@MOLECULE 7b55.A 1137 1095 119 0 0 BIOPOLYMER USER_CHARGES @ATOM 1 O -12.5812 26.5169 25.3675 O.3 1 HOH901 0.0000 2 H1 -11.6212 26.5169 25.3675 H 1 HOH901 0.0000 3 H2 -12.8714 27.1639 26.0145 H 1 HOH901 0.0000 4 O -23.3794 9.8740 27.5532 O.3 2 HOH902 0.0000 5 H1 -22.4194 9.8740 27.5532 H 2 HOH902 0.0000 6 H2 -23.6697 10.5211 28.2002 H 2 HOH902 0.0000 7 O -11.5541 23.1319 21.3478 O.3 3 HOH903 0.0000 8 H1 -10.5941 23.1319 21.3478 H 3 HOH903 0.0000 9 H2 -11.8444 23.7789 21.9948 H 3 HOH903 0.0000 10 O -10.9622 16.1891 17.3388 O.3 4 HOH904 0.0000 11 H1 -10.0022 16.1891 17.3388 H 4 HOH904 0.0000 12 H2 -11.2524 16.8361 17.9858 H 4 HOH904 0.0000 13 O -20.2515 15.2532 24.8965 O.3 5 HOH905 0.0000 14 H1 -19.2915 15.2532 24.8965 H 5 HOH905 0.0000 15 H2 -20.5418 15.9003 25.5436 H 5 HOH905 0.0000 16 O -10.3481 -0.0721 29.0874 O.3 6 HOH906 0.0000 17 H1 -9.3881 -0.0721 29.0874 H 6 HOH906 0.0000 18 H2 -10.6384 0.5750 29.7344 H 6 HOH906 0.0000 19 O -2.0891 11.9078 16.3602 O.3 7 HOH907 0.0000 20 H1 -1.1291 11.9078 16.3602 H 7 HOH907 0.0000 21 H2 -2.3794 12.5549 17.0072 H 7 HOH907 0.0000 22 O -6.8830 17.2993 35.7877 O.3 8 HOH908 0.0000 23 H1 -5.9230 17.2993 35.7877 H 8 HOH908 0.0000 24 H2 -7.1732 17.9463 36.4348 H 8 HOH908 0.0000 25 O -11.7905 22.8921 27.5549 O.3 9 HOH909 0.0000 26 H1 -10.8305 22.8921 27.5549 H 9 HOH909 0.0000 27 H2 -12.0808 23.5392 28.2019 H 9 HOH909 0.0000 28 O -5.8544 -0.3899 36.6594 O.3 10 HOH910 0.0000 29 H1 -4.8944 -0.3899 36.6594 H 10 HOH910 0.0000 30 H2 -6.1447 0.2572 37.3064 H 10 HOH910 0.0000 31 O -9.4788 21.0595 30.4082 O.3 11 HOH911 0.0000 32 H1 -8.5188 21.0595 30.4082 H 11 HOH911 0.0000 33 H2 -9.7691 21.7066 31.0552 H 11 HOH911 0.0000 34 O -1.1697 13.2856 27.6327 O.3 12 HOH912 0.0000 35 H1 -0.2097 13.2856 27.6327 H 12 HOH912 0.0000 36 H2 -1.4600 13.9327 28.2797 H 12 HOH912 0.0000 37 O -8.7068 18.3147 18.9556 O.3 13 HOH913 0.0000 38 H1 -7.7468 18.3147 18.9556 H 13 HOH913 0.0000 39 H2 -8.9971 18.9617 19.6027 H 13 HOH913 0.0000 40 O 0.5671 7.0280 34.5009 O.3 14 HOH914 0.0000 41 H1 1.5271 7.0280 34.5009 H 14 HOH914 0.0000 42 H2 0.2768 7.6751 35.1479 H 14 HOH914 0.0000 43 O -9.8817 21.7564 19.7621 O.3 15 HOH915 0.0000 44 H1 -8.9217 21.7564 19.7621 H 15 HOH915 0.0000 45 H2 -10.1719 22.4035 20.4091 H 15 HOH915 0.0000 46 O -19.7495 15.6621 29.7514 O.3 16 HOH916 0.0000 47 H1 -18.7895 15.6621 29.7514 H 16 HOH916 0.0000 48 H2 -20.0398 16.3091 30.3985 H 16 HOH916 0.0000 49 O -5.9112 5.9172 35.1321 O.3 17 HOH917 0.0000 50 H1 -4.9512 5.9172 35.1321 H 17 HOH917 0.0000 51 H2 -6.2015 6.5643 35.7792 H 17 HOH917 0.0000 52 O -4.7102 23.9909 23.5997 O.3 18 HOH918 0.0000 53 H1 -3.7502 23.9909 23.5997 H 18 HOH918 0.0000 54 H2 -5.0005 24.6380 24.2467 H 18 HOH918 0.0000 55 O -5.0321 -0.8710 15.2400 O.3 19 HOH919 0.0000 56 H1 -4.0721 -0.8710 15.2400 H 19 HOH919 0.0000 57 H2 -5.3223 -0.2240 15.8871 H 19 HOH919 0.0000 58 O 2.5045 16.0740 32.6300 O.3 20 HOH920 -0.8340 59 H1 2.1569 15.4306 33.2476 H 20 HOH920 0.4170 60 H2 3.3450 15.7100 32.3520 H 20 HOH920 0.4170 61 O 5.1792 15.8444 25.1406 O.3 21 HOH921 0.0000 62 H1 6.1392 15.8444 25.1406 H 21 HOH921 0.0000 63 H2 4.8889 16.4914 25.7876 H 21 HOH921 0.0000 64 O 1.8090 13.0071 25.8359 O.3 22 HOH922 0.0000 65 H1 2.7690 13.0071 25.8359 H 22 HOH922 0.0000 66 H2 1.5187 13.6542 26.4829 H 22 HOH922 0.0000 67 O 2.0014 10.2106 22.2091 O.3 23 HOH923 0.0000 68 H1 2.9614 10.2106 22.2091 H 23 HOH923 0.0000 69 H2 1.7111 10.8576 22.8561 H 23 HOH923 0.0000 70 O -18.2062 17.6315 31.2307 O.3 24 HOH924 0.0000 71 H1 -17.2462 17.6315 31.2307 H 24 HOH924 0.0000 72 H2 -18.4965 18.2785 31.8778 H 24 HOH924 0.0000 73 O 6.7385 24.2508 26.3764 O.3 25 HOH925 0.0000 74 H1 7.6985 24.2508 26.3764 H 25 HOH925 0.0000 75 H2 6.4483 24.8979 27.0234 H 25 HOH925 0.0000 76 O -2.0606 9.1878 17.4616 O.3 26 HOH926 0.0000 77 H1 -1.1006 9.1878 17.4616 H 26 HOH926 0.0000 78 H2 -2.3508 9.8349 18.1086 H 26 HOH926 0.0000 79 O -0.6796 1.6340 36.9494 O.3 27 HOH927 0.0000 80 H1 0.2804 1.6340 36.9494 H 27 HOH927 0.0000 81 H2 -0.9699 2.2810 37.5964 H 27 HOH927 0.0000 82 O -10.4835 4.3258 36.4216 O.3 28 HOH928 0.0000 83 H1 -9.5235 4.3258 36.4216 H 28 HOH928 0.0000 84 H2 -10.7738 4.9728 37.0686 H 28 HOH928 0.0000 85 O -5.8662 26.9538 27.3583 O.3 29 HOH929 -0.8340 86 H1 -6.6180 26.6495 26.8500 H 29 HOH929 0.4170 87 H2 -5.8610 26.3963 28.1364 H 29 HOH929 0.4170 88 O -4.6920 25.0259 34.2333 O.3 30 HOH930 -0.8340 89 H1 -4.1433 24.3604 34.6484 H 30 HOH930 0.4170 90 H2 -5.3267 25.2683 34.9076 H 30 HOH930 0.4170 91 O -6.4838 13.7421 14.3079 O.3 31 HOH931 0.0000 92 H1 -5.5238 13.7421 14.3079 H 31 HOH931 0.0000 93 H2 -6.7741 14.3892 14.9550 H 31 HOH931 0.0000 94 O 1.7993 11.1625 16.9585 O.3 32 HOH932 0.0000 95 H1 2.7593 11.1625 16.9585 H 32 HOH932 0.0000 96 H2 1.5091 11.8095 17.6055 H 32 HOH932 0.0000 97 O 0.6537 5.5581 21.5530 O.3 33 HOH933 0.0000 98 H1 1.6137 5.5581 21.5530 H 33 HOH933 0.0000 99 H2 0.3634 6.2051 22.2000 H 33 HOH933 0.0000 100 O -17.8269 8.3306 38.3370 O.3 34 HOH934 0.0000 101 H1 -16.8669 8.3306 38.3370 H 34 HOH934 0.0000 102 H2 -18.1172 8.9776 38.9841 H 34 HOH934 0.0000 103 O -5.1847 21.3352 33.5942 O.3 35 HOH935 0.0000 104 H1 -4.2247 21.3352 33.5942 H 35 HOH935 0.0000 105 H2 -5.4750 21.9823 34.2412 H 35 HOH935 0.0000 106 O 1.4173 2.8173 36.0092 O.3 36 HOH936 0.0000 107 H1 2.3773 2.8173 36.0092 H 36 HOH936 0.0000 108 H2 1.1270 3.4644 36.6563 H 36 HOH936 0.0000 109 O -4.7009 1.7397 38.3881 O.3 37 HOH937 0.0000 110 H1 -3.7409 1.7397 38.3881 H 37 HOH937 0.0000 111 H2 -4.9912 2.3867 39.0351 H 37 HOH937 0.0000 112 O 3.9274 13.6650 24.1697 O.3 38 HOH938 0.0000 113 H1 4.8874 13.6650 24.1697 H 38 HOH938 0.0000 114 H2 3.6372 14.3121 24.8167 H 38 HOH938 0.0000 115 O -17.5636 10.1616 36.5804 O.3 39 HOH939 0.0000 116 H1 -16.6036 10.1616 36.5804 H 39 HOH939 0.0000 117 H2 -17.8539 10.8087 37.2274 H 39 HOH939 0.0000 118 O 1.8405 4.6256 35.7139 O.3 40 HOH940 0.0000 119 H1 2.8005 4.6256 35.7139 H 40 HOH940 0.0000 120 H2 1.5502 5.2727 36.3610 H 40 HOH940 0.0000 121 O -5.8411 3.9842 36.9058 O.3 41 HOH941 0.0000 122 H1 -4.8811 3.9842 36.9058 H 41 HOH941 0.0000 123 H2 -6.1314 4.6312 37.5529 H 41 HOH941 0.0000 124 O 0.2361 8.3801 20.7747 O.3 42 HOH942 0.0000 125 H1 1.1961 8.3801 20.7747 H 42 HOH942 0.0000 126 H2 -0.0542 9.0271 21.4218 H 42 HOH942 0.0000 127 O 5.3993 25.7896 26.3859 O.3 43 HOH943 0.0000 128 H1 6.3593 25.7896 26.3859 H 43 HOH943 0.0000 129 H2 5.1090 26.4367 27.0329 H 43 HOH943 0.0000 130 O 1.3257 10.3618 24.5397 O.3 44 HOH944 0.0000 131 H1 2.2857 10.3618 24.5397 H 44 HOH944 0.0000 132 H2 1.0354 11.0088 25.1867 H 44 HOH944 0.0000 133 O -20.2109 16.6697 27.2590 O.3 45 HOH945 0.0000 134 H1 -19.2509 16.6697 27.2590 H 45 HOH945 0.0000 135 H2 -20.5012 17.3168 27.9061 H 45 HOH945 0.0000 136 O 4.3878 9.5306 21.4515 O.3 46 HOH946 0.0000 137 H1 5.3478 9.5306 21.4515 H 46 HOH946 0.0000 138 H2 4.0975 10.1777 22.0985 H 46 HOH946 0.0000 139 O -3.7872 13.1016 14.2405 O.3 47 HOH947 0.0000 140 H1 -2.8272 13.1016 14.2405 H 47 HOH947 0.0000 141 H2 -4.0775 13.7487 14.8875 H 47 HOH947 0.0000 142 O -6.2585 20.3758 35.1909 O.3 48 HOH948 0.0000 143 H1 -5.2985 20.3758 35.1909 H 48 HOH948 0.0000 144 H2 -6.5488 21.0228 35.8380 H 48 HOH948 0.0000 145 O -8.7571 6.4389 35.8965 O.3 49 HOH949 0.0000 146 H1 -7.7971 6.4389 35.8965 H 49 HOH949 0.0000 147 H2 -9.0474 7.0860 36.5435 H 49 HOH949 0.0000 148 O -2.0562 7.3702 15.3911 O.3 50 HOH950 0.0000 149 H1 -1.0962 7.3702 15.3911 H 50 HOH950 0.0000 150 H2 -2.3465 8.0172 16.0381 H 50 HOH950 0.0000 151 O -2.6773 22.0185 17.6087 O.3 51 HOH951 0.0000 152 H1 -1.7173 22.0185 17.6087 H 51 HOH951 0.0000 153 H2 -2.9676 22.6656 18.2557 H 51 HOH951 0.0000 154 O 1.7129 5.0978 19.2427 O.3 52 HOH952 0.0000 155 H1 2.6729 5.0978 19.2427 H 52 HOH952 0.0000 156 H2 1.4226 5.7449 19.8897 H 52 HOH952 0.0000 157 O 0.3053 8.7463 18.2870 O.3 53 HOH953 0.0000 158 H1 1.2653 8.7463 18.2870 H 53 HOH953 0.0000 159 H2 0.0150 9.3933 18.9340 H 53 HOH953 0.0000 160 O 2.4352 5.5043 24.0152 O.3 54 HOH954 0.0000 161 H1 3.3952 5.5043 24.0152 H 54 HOH954 0.0000 162 H2 2.1449 6.1513 24.6622 H 54 HOH954 0.0000 163 N -4.8617 -2.2449 24.1117 N.4 55 THR827 1.0000 BACKBONE 164 H1 -5.6437 -1.9805 24.6936 H 55 THR827 0.0000 BACKBONE 165 H2 -4.9055 -3.2353 23.9184 H 55 THR827 0.0000 BACKBONE 166 H3 -4.8991 -1.7305 23.2433 H 55 THR827 0.0000 BACKBONE 167 CA -3.6144 -1.9392 24.8048 C.3 55 THR827 0.0000 BACKBONE 168 HA -3.6031 -2.5297 25.7210 H 55 THR827 0.0000 BACKBONE 169 C -3.5387 -0.4533 25.1637 C.2 55 THR827 0.0000 BACKBONE 170 O -4.2998 0.3653 24.6316 O.2 55 THR827 0.0000 BACKBONE 171 CB -2.3827 -2.3276 23.9508 C.3 55 THR827 0.0000 172 HB -2.4563 -3.3863 23.7020 H 55 THR827 0.0000 173 OG1 -1.1779 -2.0865 24.6925 O.3 55 THR827 0.0000 174 HG1 -1.1444 -1.1486 24.8948 H 55 THR827 0.0000 175 CG2 -2.3488 -1.5148 22.6708 C.3 55 THR827 0.0000 176 HG21 -2.2753 -0.4551 22.9153 H 55 THR827 0.0000 177 HG22 -3.2614 -1.6940 22.1023 H 55 THR827 0.0000 178 HG23 -1.4855 -1.8110 22.0751 H 55 THR827 0.0000 179 N -2.6212 -0.1077 26.0735 N.am 56 ALA828 0.0000 BACKBONE 180 H -2.0594 -0.8195 26.5184 H 56 ALA828 0.0000 BACKBONE 181 CA -2.4301 1.2972 26.4250 C.3 56 ALA828 0.0000 BACKBONE 182 HA -3.3911 1.7006 26.7443 H 56 ALA828 0.0000 BACKBONE 183 C -1.9600 2.1061 25.2228 C.2 56 ALA828 0.0000 BACKBONE 184 O -2.3673 3.2585 25.0428 O.2 56 ALA828 0.0000 BACKBONE 185 CB -1.4350 1.4236 27.5777 C.3 56 ALA828 0.0000 186 HB1 -0.4693 1.0228 27.2695 H 56 ALA828 0.0000 187 HB2 -1.8027 0.8644 28.4380 H 56 ALA828 0.0000 188 HB3 -1.3232 2.4737 27.8477 H 56 ALA828 0.0000 189 N -1.1145 1.5109 24.3767 N.am 57 GLU829 0.0000 BACKBONE 190 H -0.8152 0.5636 24.5588 H 57 GLU829 0.0000 BACKBONE 191 CA -0.6152 2.2065 23.1922 C.3 57 GLU829 0.0000 BACKBONE 192 HA -0.0718 3.0914 23.5235 H 57 GLU829 0.0000 BACKBONE 193 C -1.7577 2.6696 22.2976 C.2 57 GLU829 0.0000 BACKBONE 194 O -1.7797 3.8219 21.8484 O.2 57 GLU829 0.0000 BACKBONE 195 CB 0.3376 1.2923 22.4087 C.3 57 GLU829 0.0000 196 HB1 -0.2017 0.4057 22.0754 H 57 GLU829 0.0000 197 HB2 1.1654 0.9937 23.0519 H 57 GLU829 0.0000 198 HB3 0.7256 1.8287 21.5427 H 57 GLU829 0.0000 199 N -2.7137 1.7783 22.0181 N.am 58 GLN830 0.0000 BACKBONE 200 H -2.6675 0.8529 22.4201 H 58 GLN830 0.0000 BACKBONE 201 CA -3.8248 2.1292 21.1367 C.3 58 GLN830 0.0000 BACKBONE 202 HA -3.4056 2.5267 20.2124 H 58 GLN830 0.0000 BACKBONE 203 C -4.7048 3.2042 21.7572 C.2 58 GLN830 0.0000 BACKBONE 204 O -5.1813 4.1106 21.0601 O.2 58 GLN830 0.0000 BACKBONE 205 CB -4.6593 0.8891 20.8169 C.3 58 GLN830 0.0000 206 HB2 -5.5713 1.2127 20.3152 H 58 GLN830 0.0000 207 HB3 -4.9156 0.3998 21.7565 H 58 GLN830 0.0000 208 CG -3.9656 -0.1238 19.9299 C.3 58 GLN830 0.0000 209 HG2 -4.2339 -1.1252 20.2664 H 58 GLN830 0.0000 210 HG3 -2.8879 0.0129 20.0193 H 58 GLN830 0.0000 211 CD -4.3535 0.0196 18.4772 C.2 58 GLN830 0.0000 212 OE1 -5.3685 0.6369 18.1567 O.2 58 GLN830 0.0000 213 NE2 -3.5476 -0.5486 17.5862 N.am 58 GLN830 0.0000 214 HE21 -3.7582 -0.4830 16.6006 H 58 GLN830 0.0000 215 HE22 -2.7244 -1.0459 17.8947 H 58 GLN830 0.0000 216 N -4.9341 3.1177 23.0692 N.am 59 VAL831 0.0000 BACKBONE 217 H -4.5137 2.3706 23.6032 H 59 VAL831 0.0000 BACKBONE 218 CA -5.7874 4.0941 23.7377 C.3 59 VAL831 0.0000 BACKBONE 219 HA -6.7310 4.1676 23.1971 H 59 VAL831 0.0000 BACKBONE 220 C -5.1368 5.4696 23.7196 C.2 59 VAL831 0.0000 BACKBONE 221 O -5.7878 6.4751 23.4082 O.2 59 VAL831 0.0000 BACKBONE 222 CB -6.1040 3.6367 25.1719 C.3 59 VAL831 0.0000 223 HB -5.1713 3.3891 25.6786 H 59 VAL831 0.0000 224 CG1 -6.7830 4.7551 25.9441 C.3 59 VAL831 0.0000 225 HG11 -7.7198 5.0187 25.4533 H 59 VAL831 0.0000 226 HG12 -6.1291 5.6268 25.9713 H 59 VAL831 0.0000 227 HG13 -6.9871 4.4221 26.9617 H 59 VAL831 0.0000 228 CG2 -6.9846 2.3913 25.1404 C.3 59 VAL831 0.0000 229 HG21 -7.9228 2.6224 24.6361 H 59 VAL831 0.0000 230 HG22 -7.1907 2.0663 26.1602 H 59 VAL831 0.0000 231 HG23 -6.4693 1.5955 24.6026 H 59 VAL831 0.0000 232 N -3.8455 5.5352 24.0622 N.am 60 ILE832 0.0000 BACKBONE 233 H -3.3609 4.6927 24.3368 H 60 ILE832 0.0000 BACKBONE 234 CA -3.1231 6.8085 24.0458 C.3 60 ILE832 0.0000 BACKBONE 235 HA -3.6141 7.5054 24.7251 H 60 ILE832 0.0000 BACKBONE 236 C -3.1516 7.4156 22.6497 C.2 60 ILE832 0.0000 BACKBONE 237 O -3.3963 8.6172 22.4716 O.2 60 ILE832 0.0000 BACKBONE 238 CB -1.6757 6.5996 24.5299 C.3 60 ILE832 0.0000 239 HB -1.2270 5.8064 23.9319 H 60 ILE832 0.0000 240 CG1 -1.6527 6.1426 25.9889 C.3 60 ILE832 0.0000 241 HG12 -2.3138 5.2817 26.0878 H 60 ILE832 0.0000 242 HG13 -2.0240 6.9589 26.6085 H 60 ILE832 0.0000 243 CG2 -0.8301 7.8570 24.3095 C.3 60 ILE832 0.0000 244 HG21 -1.2445 8.6801 24.8916 H 60 ILE832 0.0000 245 HG22 -0.8384 8.1197 23.2517 H 60 ILE832 0.0000 246 HG23 0.1946 7.6662 24.6285 H 60 ILE832 0.0000 247 CD1 -0.2789 5.7478 26.4960 C.3 60 ILE832 0.0000 248 HD11 0.1115 4.9311 25.8889 H 60 ILE832 0.0000 249 HD12 -0.3539 5.4250 27.5344 H 60 ILE832 0.0000 250 HD13 0.3928 6.6036 26.4291 H 60 ILE832 0.0000 251 N -2.8715 6.5910 21.6393 N.am 61 ALA833 0.0000 BACKBONE 252 H -2.6661 5.6206 21.8296 H 61 ALA833 0.0000 BACKBONE 253 CA -2.8585 7.0720 20.2670 C.3 61 ALA833 0.0000 BACKBONE 254 HA -2.1631 7.9092 20.2067 H 61 ALA833 0.0000 BACKBONE 255 C -4.2287 7.5765 19.8469 C.2 61 ALA833 0.0000 BACKBONE 256 O -4.3227 8.5433 19.0819 O.2 61 ALA833 0.0000 BACKBONE 257 CB -2.3833 5.9578 19.3222 C.3 61 ALA833 0.0000 258 HB1 -3.0739 5.1162 19.3767 H 61 ALA833 0.0000 259 HB2 -1.3870 5.6301 19.6191 H 61 ALA833 0.0000 260 HB3 -2.3518 6.3365 18.3006 H 61 ALA833 0.0000 261 N -5.2964 6.9431 20.3406 N.am 62 SER834 0.0000 BACKBONE 262 H -5.1716 6.1530 20.9572 H 62 SER834 0.0000 BACKBONE 263 CA -6.6420 7.3876 19.9931 C.3 62 SER834 0.0000 BACKBONE 264 HA -6.6818 7.5485 18.9157 H 62 SER834 0.0000 BACKBONE 265 C -6.9777 8.7095 20.6666 C.2 62 SER834 0.0000 BACKBONE 266 O -7.5581 9.6019 20.0401 O.2 62 SER834 0.0000 BACKBONE 267 CB -7.6603 6.3147 20.3692 C.3 62 SER834 0.0000 268 HB2 -8.6651 6.6931 20.1814 H 62 SER834 0.0000 269 HB3 -7.5541 6.0752 21.4272 H 62 SER834 0.0000 270 OG -7.4537 5.1381 19.6014 O.3 62 SER834 0.0000 271 HG -7.5523 5.3743 18.6761 H 62 SER834 0.0000 272 N -6.6256 8.8535 21.9466 N.am 63 PHE835 0.0000 BACKBONE 273 H -6.2465 8.0701 22.4591 H 63 PHE835 0.0000 BACKBONE 274 CA -6.7900 10.1428 22.6003 C.3 63 PHE835 0.0000 BACKBONE 275 HA -7.8494 10.3984 22.5785 H 63 PHE835 0.0000 BACKBONE 276 C -6.0028 11.2163 21.8696 C.2 63 PHE835 0.0000 BACKBONE 277 O -6.4844 12.3345 21.6906 O.2 63 PHE835 0.0000 BACKBONE 278 CB -6.3196 10.0704 24.0469 C.3 63 PHE835 0.0000 279 HB2 -6.0255 11.0720 24.3605 H 63 PHE835 0.0000 280 HB3 -5.4556 9.4073 24.0918 H 63 PHE835 0.0000 281 CG -7.3478 9.5638 25.0045 C.ar 63 PHE835 0.0000 282 CD1 -8.5703 10.2054 25.1317 C.ar 63 PHE835 0.0000 283 HD1 -8.7890 11.0665 24.5176 H 63 PHE835 0.0000 284 CD2 -7.0675 8.4873 25.8265 C.ar 63 PHE835 0.0000 285 HD2 -6.1084 7.9959 25.7542 H 63 PHE835 0.0000 286 CE1 -9.5117 9.7535 26.0371 C.ar 63 PHE835 0.0000 287 HE1 -10.4712 10.2439 26.1094 H 63 PHE835 0.0000 288 CE2 -8.0001 8.0336 26.7387 C.ar 63 PHE835 0.0000 289 HE2 -7.7778 7.1822 27.3648 H 63 PHE835 0.0000 290 CZ -9.2252 8.6783 26.8461 C.ar 63 PHE835 0.0000 291 HZ -9.9540 8.3353 27.5655 H 63 PHE835 0.0000 292 N -4.7795 10.8848 21.4518 N.am 64 ARG836 0.0000 BACKBONE 293 H -4.4282 9.9532 21.6216 H 64 ARG836 0.0000 BACKBONE 294 CA -3.9474 11.8521 20.7546 C.3 64 ARG836 0.0000 BACKBONE 295 HA -3.8313 12.7297 21.3905 H 64 ARG836 0.0000 BACKBONE 296 C -4.6059 12.2945 19.4602 C.2 64 ARG836 0.0000 BACKBONE 297 O -4.5476 13.4760 19.1008 O.2 64 ARG836 0.0000 BACKBONE 298 CB -2.5649 11.2635 20.4842 C.3 64 ARG836 0.0000 299 HB2 -2.6799 10.3764 19.8613 H 64 ARG836 0.0000 300 HB3 -2.1136 10.9831 21.4359 H 64 ARG836 0.0000 301 CG -1.6354 12.2397 19.7737 C.3 64 ARG836 0.0000 302 HG2 -1.9507 13.2576 20.0033 H 64 ARG836 0.0000 303 HG3 -1.7029 12.0723 18.6987 H 64 ARG836 0.0000 304 CD -0.1917 12.0628 20.2087 C.3 64 ARG836 0.0000 305 HD2 0.2301 11.1933 19.7045 H 64 ARG836 0.0000 306 HD3 -0.1591 11.9086 21.2872 H 64 ARG836 0.0000 307 NE 0.5964 13.2428 19.8691 N.pl3 64 ARG836 0.0000 308 HE 0.3033 13.7928 19.0743 H 64 ARG836 0.0000 309 CZ 1.6733 13.6417 20.5356 C.cat 64 ARG836 1.0000 310 NH1 2.3174 14.7417 20.1637 N.pl3 64 ARG836 0.0000 311 HH11 3.1295 15.0500 20.6790 H 64 ARG836 0.0000 312 HH12 1.9952 15.2701 19.3655 H 64 ARG836 0.0000 313 NH2 2.0974 12.9502 21.5826 N.pl3 64 ARG836 0.0000 314 HH21 2.9096 13.2598 22.0969 H 64 ARG836 0.0000 315 HH22 1.6086 12.1133 21.8668 H 64 ARG836 0.0000 316 N -5.2436 11.3590 18.7537 N.am 65 ILE837 0.0000 BACKBONE 317 H -5.2240 10.3985 19.0655 H 65 ILE837 0.0000 BACKBONE 318 CA -5.9689 11.7070 17.5362 C.3 65 ILE837 0.0000 BACKBONE 319 HA -5.2809 12.1946 16.8455 H 65 ILE837 0.0000 BACKBONE 320 C -7.0894 12.6933 17.8409 C.2 65 ILE837 0.0000 BACKBONE 321 O -7.2575 13.7018 17.1477 O.2 65 ILE837 0.0000 BACKBONE 322 CB -6.5040 10.4411 16.8538 C.3 65 ILE837 0.0000 323 HB -6.9176 9.7728 17.6091 H 65 ILE837 0.0000 324 CG1 -5.3597 9.7203 16.1428 C.3 65 ILE837 0.0000 325 HG12 -4.4644 9.7947 16.7601 H 65 ILE837 0.0000 326 HG13 -5.1821 10.2093 15.1849 H 65 ILE837 0.0000 327 CG2 -7.6270 10.7856 15.8891 C.3 65 ILE837 0.0000 328 HG21 -7.2495 11.4553 15.1164 H 65 ILE837 0.0000 329 HG22 -8.4348 11.2762 16.4322 H 65 ILE837 0.0000 330 HG23 -8.0019 9.8724 15.4270 H 65 ILE837 0.0000 331 CD1 -5.6501 8.2733 15.8942 C.3 65 ILE837 0.0000 332 HD11 -5.8301 7.7704 16.8444 H 65 ILE837 0.0000 333 HD12 -4.7980 7.8122 15.3948 H 65 ILE837 0.0000 334 HD13 -6.5338 8.1834 15.2624 H 65 ILE837 0.0000 335 N -7.8931 12.4085 18.8663 N.am 66 LEU838 0.0000 BACKBONE 336 H -7.7571 11.5677 19.4092 H 66 LEU838 0.0000 BACKBONE 337 CA -8.9727 13.3359 19.1885 C.3 66 LEU838 0.0000 BACKBONE 338 HA -9.5108 13.5369 18.2621 H 66 LEU838 0.0000 BACKBONE 339 C -8.4497 14.6666 19.7107 C.2 66 LEU838 0.0000 BACKBONE 340 O -9.1594 15.6738 19.6274 O.2 66 LEU838 0.0000 BACKBONE 341 CB -9.9307 12.7115 20.1996 C.3 66 LEU838 0.0000 342 HB2 -10.7102 13.4433 20.4120 H 66 LEU838 0.0000 343 HB3 -9.3653 12.5086 21.1091 H 66 LEU838 0.0000 344 CG -10.6189 11.4082 19.7795 C.3 66 LEU838 0.0000 345 HG -9.8840 10.6038 19.7473 H 66 LEU838 0.0000 346 CD1 -11.6888 11.0748 20.8024 C.3 66 LEU838 0.0000 347 HD11 -12.4238 11.8791 20.8347 H 66 LEU838 0.0000 348 HD12 -11.2299 10.9623 21.7847 H 66 LEU838 0.0000 349 HD13 -12.1814 10.1436 20.5226 H 66 LEU838 0.0000 350 CD2 -11.2091 11.5172 18.3687 C.3 66 LEU838 0.0000 351 HD21 -11.9542 12.3125 18.3470 H 66 LEU838 0.0000 352 HD22 -11.6788 10.5717 18.0973 H 66 LEU838 0.0000 353 HD23 -10.4140 11.7448 17.6588 H 66 LEU838 0.0000 354 N -7.2283 14.6981 20.2388 N.am 67 ALA839 0.0000 BACKBONE 355 H -6.7363 13.8282 20.3848 H 67 ALA839 0.0000 BACKBONE 356 CA -6.5788 15.9467 20.6127 C.3 67 ALA839 0.0000 BACKBONE 357 HA -7.3685 16.6203 20.9454 H 67 ALA839 0.0000 BACKBONE 358 C -5.8738 16.6351 19.4508 C.2 67 ALA839 0.0000 BACKBONE 359 O -5.0631 17.5267 19.6969 O.2 67 ALA839 0.0000 BACKBONE 360 CB -5.5762 15.6894 21.7378 C.3 67 ALA839 0.0000 361 HB1 -4.7972 15.0146 21.3831 H 67 ALA839 0.0000 362 HB2 -6.0901 15.2371 22.5861 H 67 ALA839 0.0000 363 HB3 -5.1265 16.6331 22.0466 H 67 ALA839 0.0000 364 N -6.1434 16.2382 18.2034 N.am 68 SER840 0.0000 BACKBONE 365 H -6.8090 15.4921 18.0611 H 68 SER840 0.0000 BACKBONE 366 CA -5.5044 16.8505 17.0356 C.3 68 SER840 0.0000 BACKBONE 367 HA -5.8308 16.2935 16.1573 H 68 SER840 0.0000 BACKBONE 368 C -3.9797 16.7494 17.1080 C.2 68 SER840 0.0000 BACKBONE 369 O -3.2590 17.6626 16.6946 O.2 68 SER840 0.0000 BACKBONE 370 CB -5.9433 18.3106 16.8731 C.3 68 SER840 0.0000 371 HB2 -5.3936 18.7622 16.0473 H 68 SER840 0.0000 372 HB3 -5.7295 18.8554 17.7927 H 68 SER840 0.0000 373 OG -7.3330 18.3762 16.6022 O.3 68 SER840 0.0000 374 HG -7.4936 17.8902 15.7900 H 68 SER840 0.0000 375 N -3.4879 15.6352 17.6528 N.am 69 ASP841 0.0000 BACKBONE 376 H -4.1538 14.9727 18.0239 H 69 ASP841 0.0000 BACKBONE 377 CA -2.0728 15.2870 17.7611 C.3 69 ASP841 0.0000 BACKBONE 378 HA -2.0550 14.2515 18.1011 H 69 ASP841 0.0000 BACKBONE 379 C -1.3247 16.1140 18.7992 C.2 69 ASP841 0.0000 BACKBONE 380 O -0.0857 16.0860 18.8219 O.2 69 ASP841 0.0000 BACKBONE 381 CB -1.3614 15.3833 16.4018 C.3 69 ASP841 0.0000 382 HB2 -1.0880 16.4236 16.2249 H 69 ASP841 0.0000 383 HB3 -2.0495 15.0513 15.6244 H 69 ASP841 0.0000 384 CG -0.1030 14.5317 16.3329 C.2 69 ASP841 0.0000 385 OD1 -0.1154 13.4021 16.8765 O.co2 69 ASP841 -0.5000 386 OD2 0.8910 14.9900 15.7236 O.co2 69 ASP841 -0.5000 387 N -2.0287 16.8519 19.6625 N.am 70 LYS842 0.0000 BACKBONE 388 H -3.0251 16.9591 19.5369 H 70 LYS842 0.0000 BACKBONE 389 CA -1.3670 17.5002 20.7802 C.3 70 LYS842 0.0000 BACKBONE 390 HA -0.4800 18.0079 20.4013 H 70 LYS842 0.0000 BACKBONE 391 C -0.9632 16.4536 21.8181 C.2 70 LYS842 0.0000 BACKBONE 392 O -1.6027 15.4075 21.9310 O.2 70 LYS842 0.0000 BACKBONE 393 CB -2.2774 18.5430 21.4335 C.3 70 LYS842 0.0000 394 HB2 -1.7778 18.9286 22.3222 H 70 LYS842 0.0000 395 HB3 -3.2082 18.0552 21.7228 H 70 LYS842 0.0000 396 CG -2.6126 19.7206 20.5175 C.3 70 LYS842 0.0000 397 HG2 -3.2859 19.3787 19.7315 H 70 LYS842 0.0000 398 HG3 -1.6921 20.0954 20.0698 H 70 LYS842 0.0000 399 CD -3.2849 20.8506 21.2908 C.3 70 LYS842 0.0000 400 HD2 -3.4703 21.6823 20.6111 H 70 LYS842 0.0000 401 HD3 -2.6195 21.1762 22.0904 H 70 LYS842 0.0000 402 CE -4.6096 20.4064 21.9008 C.3 70 LYS842 0.0000 403 HE2 -5.0046 21.2183 22.5114 H 70 LYS842 0.0000 404 HE3 -4.4317 19.5332 22.5284 H 70 LYS842 0.0000 405 NZ -5.6168 20.0536 20.8631 N.4 70 LYS842 1.0000 406 HZ1 -5.7896 20.8563 20.2750 H 70 LYS842 0.0000 407 HZ2 -6.4774 19.7727 21.3110 H 70 LYS842 0.0000 408 HZ3 -5.2667 19.2923 20.2992 H 70 LYS842 0.0000 409 N 0.0844 16.7257 22.6067 N.am 71 PRO843 0.0000 BACKBONE 410 CA 0.4929 15.7695 23.6513 C.3 71 PRO843 0.0000 BACKBONE 411 HA 0.4552 14.7412 23.2917 H 71 PRO843 0.0000 BACKBONE 412 C -0.4215 15.7635 24.8620 C.2 71 PRO843 0.0000 BACKBONE 413 O -0.1966 14.9696 25.7838 O.2 71 PRO843 0.0000 BACKBONE 414 CB 1.8966 16.2575 24.0311 C.3 71 PRO843 0.0000 415 HB2 2.6533 15.8020 23.3923 H 71 PRO843 0.0000 416 HB3 2.1182 16.0322 25.0742 H 71 PRO843 0.0000 417 CG 1.8259 17.7525 23.8040 C.3 71 PRO843 0.0000 418 HG2 2.8213 18.1685 23.6482 H 71 PRO843 0.0000 419 HG3 1.3521 18.2511 24.6496 H 71 PRO843 0.0000 420 CD 0.9807 17.8925 22.5524 C.3 71 PRO843 0.0000 421 HD2 0.4111 18.8217 22.5695 H 71 PRO843 0.0000 422 HD3 1.6027 17.8641 21.6577 H 71 PRO843 0.0000 423 N -1.4160 16.6431 24.8858 N.am 72 TYR844 -0.7301 BACKBONE 424 H -1.4694 17.3086 24.1279 H 72 TYR844 0.3700 BACKBONE 425 CA -2.4342 16.7201 25.9215 C.3 72 TYR844 0.3611 BACKBONE 426 HA -2.4071 15.8123 26.5243 H 72 TYR844 0.0000 BACKBONE 427 C -3.7792 16.8887 25.2292 C.2 72 TYR844 0.5690 BACKBONE 428 O -3.8464 17.1912 24.0319 O.2 72 TYR844 -0.5700 BACKBONE 429 CB -2.1917 17.8985 26.8631 C.3 72 TYR844 0.1435 430 HB2 -1.2232 17.7711 27.3467 H 72 TYR844 0.0000 431 HB3 -2.9763 17.9138 27.6196 H 72 TYR844 0.0000 432 CG -2.2000 19.2225 26.1177 C.ar 72 TYR844 -0.1435 433 CD1 -3.3912 19.9078 25.8885 C.ar 72 TYR844 -0.1500 434 HD1 -4.3187 19.4966 26.2586 H 72 TYR844 0.1500 435 CD2 -1.0213 19.7667 25.6190 C.ar 72 TYR844 -0.1500 436 HD2 -0.0882 19.2441 25.7692 H 72 TYR844 0.1500 437 CE1 -3.4081 21.1045 25.1961 C.ar 72 TYR844 -0.1500 438 HE1 -4.3417 21.6209 25.0291 H 72 TYR844 0.1500 439 CE2 -1.0275 20.9785 24.9274 C.ar 72 TYR844 -0.1500 440 HE2 -0.1039 21.3990 24.5579 H 72 TYR844 0.1500 441 CZ -2.2258 21.6371 24.7187 C.ar 72 TYR844 0.0825 442 OH -2.2522 22.8253 24.0284 O.3 72 TYR844 -0.5325 443 HH -1.7336 23.5328 24.4186 H 72 TYR844 0.4500 444 N -4.8591 16.7236 25.9959 N.am 73 ILE845 0.0000 BACKBONE 445 H -4.7411 16.4297 26.9550 H 73 ILE845 0.0000 BACKBONE 446 CA -6.2042 16.9562 25.4853 C.3 73 ILE845 0.0000 BACKBONE 447 HA -6.1255 17.3481 24.4713 H 73 ILE845 0.0000 BACKBONE 448 C -6.8843 17.9543 26.4077 C.2 73 ILE845 0.0000 BACKBONE 449 O -6.5055 18.1131 27.5742 O.2 73 ILE845 0.0000 BACKBONE 450 CB -7.0451 15.6630 25.3590 C.3 73 ILE845 0.0000 451 HB -6.4236 14.8705 24.9423 H 73 ILE845 0.0000 452 CG1 -8.2178 15.8850 24.3863 C.3 73 ILE845 0.0000 453 HG12 -7.8568 16.4860 23.5516 H 73 ILE845 0.0000 454 HG13 -8.9989 16.4305 24.9158 H 73 ILE845 0.0000 455 CG2 -7.5125 15.1760 26.7480 C.3 73 ILE845 0.0000 456 HG21 -8.1410 15.9387 27.2079 H 73 ILE845 0.0000 457 HG22 -6.6436 14.9918 27.3798 H 73 ILE845 0.0000 458 HG23 -8.0829 14.2538 26.6368 H 73 ILE845 0.0000 459 CD1 -8.8245 14.6210 23.8268 C.3 73 ILE845 0.0000 460 HD11 -8.0605 14.0573 23.2915 H 73 ILE845 0.0000 461 HD12 -9.6328 14.8781 23.1422 H 73 ILE845 0.0000 462 HD13 -9.2184 14.0150 24.6428 H 73 ILE845 0.0000 463 N -7.8635 18.6677 25.8687 N.am 74 LEU846 0.0000 BACKBONE 464 H -8.0827 18.5344 24.8918 H 74 LEU846 0.0000 BACKBONE 465 CA -8.6342 19.6367 26.6357 C.3 74 LEU846 0.0000 BACKBONE 466 HA -8.0972 19.8385 27.5626 H 74 LEU846 0.0000 BACKBONE 467 C -10.0131 19.0696 26.9509 C.2 74 LEU846 0.0000 BACKBONE 468 O -10.5509 18.2534 26.2022 O.2 74 LEU846 0.0000 BACKBONE 469 CB -8.7886 20.9496 25.8665 C.3 74 LEU846 0.0000 470 HB2 -9.4572 21.5871 26.4449 H 74 LEU846 0.0000 471 HB3 -9.2519 20.7113 24.9090 H 74 LEU846 0.0000 472 CG -7.5293 21.7620 25.5715 C.3 74 LEU846 0.0000 473 HG -6.8057 21.1110 25.0809 H 74 LEU846 0.0000 474 CD1 -7.8684 22.9192 24.6445 C.3 74 LEU846 0.0000 475 HD11 -8.5921 23.5738 25.1302 H 74 LEU846 0.0000 476 HD12 -8.2937 22.5308 23.7191 H 74 LEU846 0.0000 477 HD13 -6.9626 23.4823 24.4198 H 74 LEU846 0.0000 478 CD2 -6.8980 22.2735 26.8477 C.3 74 LEU846 0.0000 479 HD21 -7.5997 22.9296 27.3626 H 74 LEU846 0.0000 480 HD22 -5.9911 22.8283 26.6074 H 74 LEU846 0.0000 481 HD23 -6.6483 21.4309 27.4926 H 74 LEU846 0.0000 482 N -10.5961 19.5362 28.0631 N.am 75 ALA847 0.0000 BACKBONE 483 H -10.1170 20.2140 28.6387 H 75 ALA847 0.0000 BACKBONE 484 CA -11.9256 19.0639 28.4429 C.3 75 ALA847 0.0000 BACKBONE 485 HA -11.8575 17.9913 28.6247 H 75 ALA847 0.0000 BACKBONE 486 C -12.9393 19.2856 27.3257 C.2 75 ALA847 0.0000 BACKBONE 487 O -13.7882 18.4297 27.0709 O.2 75 ALA847 0.0000 BACKBONE 488 CB -12.3892 19.7617 29.7179 C.3 75 ALA847 0.0000 489 HB1 -12.4585 20.8349 29.5400 H 75 ALA847 0.0000 490 HB2 -11.6731 19.5714 30.5173 H 75 ALA847 0.0000 491 HB3 -13.3673 19.3775 30.0073 H 75 ALA847 0.0000 492 N -12.8830 20.4426 26.6597 N.am 76 GLU848 0.0000 BACKBONE 493 H -12.1711 21.1237 26.8820 H 76 GLU848 0.0000 BACKBONE 494 CA -13.8593 20.7149 25.6074 C.3 76 GLU848 0.0000 BACKBONE 495 HA -14.8503 20.5406 26.0265 H 76 GLU848 0.0000 BACKBONE 496 C -13.6911 19.7785 24.4170 C.2 76 GLU848 0.0000 BACKBONE 497 O -14.6598 19.5123 23.6976 O.2 76 GLU848 0.0000 BACKBONE 498 CB -13.7450 22.1628 25.1506 C.3 76 GLU848 0.0000 499 HB2 -13.6727 22.8035 26.0294 H 76 GLU848 0.0000 500 HB3 -14.6385 22.4235 24.5834 H 76 GLU848 0.0000 501 CG -12.5397 22.3908 24.2856 C.3 76 GLU848 0.0000 502 HG2 -12.8047 22.1698 23.2517 H 76 GLU848 0.0000 503 HG3 -11.7452 21.7181 24.6088 H 76 GLU848 0.0000 504 CD -12.0362 23.8011 24.3618 C.2 76 GLU848 0.0000 505 OE1 -12.1367 24.4016 25.4563 O.co2 76 GLU848 -0.5000 506 OE2 -11.5455 24.3160 23.3283 O.co2 76 GLU848 -0.5000 507 N -12.4756 19.2723 24.1844 N.am 77 GLU849 0.0000 BACKBONE 508 H -11.6926 19.5542 24.7567 H 77 GLU849 0.0000 BACKBONE 509 CA -12.2822 18.3155 23.1066 C.3 77 GLU849 0.0000 BACKBONE 510 HA -12.8032 18.6682 22.2165 H 77 GLU849 0.0000 BACKBONE 511 C -12.8824 16.9652 23.4701 C.2 77 GLU849 0.0000 BACKBONE 512 O -13.4834 16.2970 22.6220 O.2 77 GLU849 0.0000 BACKBONE 513 CB -10.7937 18.2048 22.7722 C.3 77 GLU849 0.0000 514 HB2 -10.6562 17.4044 22.0452 H 77 GLU849 0.0000 515 HB3 -10.2463 17.9655 23.6839 H 77 GLU849 0.0000 516 CG -10.2313 19.5061 22.1860 C.3 77 GLU849 0.0000 517 HG2 -10.5372 20.3335 22.8263 H 77 GLU849 0.0000 518 HG3 -10.6495 19.6445 21.1890 H 77 GLU849 0.0000 519 CD -8.7185 19.5164 22.0778 C.2 77 GLU849 0.0000 520 OE1 -8.0470 18.9883 22.9850 O.co2 77 GLU849 -0.5000 521 OE2 -8.1932 20.0527 21.0774 O.co2 77 GLU849 -0.5000 522 N -12.7520 16.5543 24.7321 N.am 78 LEU850 0.0000 BACKBONE 523 H -12.1964 17.0869 25.3861 H 78 LEU850 0.0000 BACKBONE 524 CA -13.4179 15.3303 25.1600 C.3 78 LEU850 0.0000 BACKBONE 525 HA -13.1036 14.5142 24.5094 H 78 LEU850 0.0000 BACKBONE 526 C -14.9321 15.4643 25.0304 C.2 78 LEU850 0.0000 BACKBONE 527 O -15.6070 14.5314 24.5700 O.2 78 LEU850 0.0000 BACKBONE 528 CB -13.0101 14.9817 26.5959 C.3 78 LEU850 0.0000 529 HB2 -13.6409 14.1568 26.9273 H 78 LEU850 0.0000 530 HB3 -13.2021 15.8576 27.2156 H 78 LEU850 0.0000 531 CG -11.5437 14.5658 26.8169 C.3 78 LEU850 0.0000 532 HG -10.9303 15.2433 26.2229 H 78 LEU850 0.0000 533 CD1 -11.1294 14.7066 28.2718 C.3 78 LEU850 0.0000 534 HD11 -11.7304 14.0371 28.8871 H 78 LEU850 0.0000 535 HD12 -11.2849 15.7356 28.5959 H 78 LEU850 0.0000 536 HD13 -10.0757 14.4481 28.3761 H 78 LEU850 0.0000 537 CD2 -11.3002 13.1321 26.3420 C.3 78 LEU850 0.0000 538 HD21 -11.9096 12.4460 26.9303 H 78 LEU850 0.0000 539 HD22 -10.2468 12.8816 26.4679 H 78 LEU850 0.0000 540 HD23 -11.5706 13.0471 25.2895 H 78 LEU850 0.0000 541 N -15.4756 16.6347 25.3964 N.am 79 ARG851 0.0000 BACKBONE 542 H -14.8764 17.3736 25.7357 H 79 ARG851 0.0000 BACKBONE 543 CA -16.9177 16.8630 25.3144 C.3 79 ARG851 0.0000 BACKBONE 544 HA -17.4105 16.0376 25.8283 H 79 ARG851 0.0000 BACKBONE 545 C -17.4031 16.8700 23.8699 C.2 79 ARG851 0.0000 BACKBONE 546 O -18.4907 16.3595 23.5737 O.2 79 ARG851 0.0000 BACKBONE 547 CB -17.2946 18.1743 26.0064 C.3 79 ARG851 0.0000 548 HB2 -18.3698 18.3170 25.8976 H 79 ARG851 0.0000 549 HB3 -16.7678 18.9853 25.5037 H 79 ARG851 0.0000 550 CG -16.9565 18.2401 27.4932 C.3 79 ARG851 0.0000 551 HG2 -15.8727 18.2165 27.6064 H 79 ARG851 0.0000 552 HG3 -17.3925 17.3730 27.9893 H 79 ARG851 0.0000 553 CD -17.4920 19.5083 28.1615 C.3 79 ARG851 0.0000 554 HD2 -18.5816 19.4886 28.1400 H 79 ARG851 0.0000 555 HD3 -17.1334 20.3784 27.6116 H 79 ARG851 0.0000 556 NE -17.0439 19.6038 29.5501 N.pl3 79 ARG851 0.0000 557 HE -17.4149 18.9285 30.2032 H 79 ARG851 0.0000 558 CZ -16.1895 20.5043 30.0255 C.cat 79 ARG851 1.0000 559 NH1 -15.6814 21.4491 29.2406 N.pl3 79 ARG851 0.0000 560 HH11 -15.0420 22.1320 29.6213 H 79 ARG851 0.0000 561 HH12 -15.9348 21.4841 28.2635 H 79 ARG851 0.0000 562 NH2 -15.8507 20.4679 31.3037 N.pl3 79 ARG851 0.0000 563 HH21 -15.2106 21.1546 31.6763 H 79 ARG851 0.0000 564 HH22 -16.2322 19.7534 31.9070 H 79 ARG851 0.0000 565 N -16.6173 17.4448 22.9536 N.am 80 ARG852 0.0000 BACKBONE 566 H -15.7501 17.8810 23.2323 H 80 ARG852 0.0000 BACKBONE 567 CA -17.0160 17.4402 21.5485 C.3 80 ARG852 0.0000 BACKBONE 568 HA -18.0401 17.8093 21.4932 H 80 ARG852 0.0000 BACKBONE 569 C -16.9972 16.0308 20.9652 C.2 80 ARG852 0.0000 BACKBONE 570 O -17.9193 15.6435 20.2351 O.2 80 ARG852 0.0000 BACKBONE 571 CB -16.1082 18.3657 20.7335 C.3 80 ARG852 0.0000 572 HB2 -15.0704 18.1352 20.9744 H 80 ARG852 0.0000 573 HB3 -16.3249 19.3974 21.0103 H 80 ARG852 0.0000 574 CG -16.3031 18.2147 19.2310 C.3 80 ARG852 0.0000 575 HG2 -17.3400 18.4493 18.9904 H 80 ARG852 0.0000 576 HG3 -16.0910 17.1816 18.9558 H 80 ARG852 0.0000 577 CD -15.3982 19.1284 18.4167 C.3 80 ARG852 0.0000 578 HD2 -15.4877 20.1421 18.8074 H 80 ARG852 0.0000 579 HD3 -15.7298 19.1085 17.3786 H 80 ARG852 0.0000 580 NE -13.9904 18.7358 18.4622 N.pl3 80 ARG852 0.0000 581 HE -13.7295 17.8625 18.0270 H 80 ARG852 0.0000 582 CZ -13.0301 19.4544 19.0399 C.cat 80 ARG852 1.0000 583 NH1 -11.7759 19.0181 19.0194 N.pl3 80 ARG852 0.0000 584 HH11 -11.0444 19.5632 19.4528 H 80 ARG852 0.0000 585 HH12 -11.5536 18.1411 18.5704 H 80 ARG852 0.0000 586 NH2 -13.3175 20.6092 19.6321 N.pl3 80 ARG852 0.0000 587 HH21 -12.5832 21.1515 20.0644 H 80 ARG852 0.0000 588 HH22 -14.2700 20.9444 19.6497 H 80 ARG852 0.0000 589 N -15.9701 15.2426 21.2921 N.am 81 GLU853 0.0000 BACKBONE 590 H -15.3703 15.5108 22.0592 H 81 GLU853 0.0000 BACKBONE 591 CA -15.6896 14.0043 20.5720 C.3 81 GLU853 0.0000 BACKBONE 592 HA -16.1462 14.1259 19.5897 H 81 GLU853 0.0000 BACKBONE 593 C -16.3122 12.7637 21.1956 C.2 81 GLU853 0.0000 BACKBONE 594 O -16.4784 11.7573 20.4970 O.2 81 GLU853 0.0000 BACKBONE 595 CB -14.1726 13.7953 20.4631 C.3 81 GLU853 0.0000 596 HB2 -13.9959 12.8662 19.9212 H 81 GLU853 0.0000 597 HB3 -13.7684 13.7100 21.4718 H 81 GLU853 0.0000 598 CG -13.4284 14.9090 19.7478 C.3 81 GLU853 0.0000 599 HG2 -12.3577 14.7366 19.8574 H 81 GLU853 0.0000 600 HG3 -13.6932 15.8580 20.2141 H 81 GLU853 0.0000 601 CD -13.7552 14.9908 18.2671 C.2 81 GLU853 0.0000 602 OE1 -14.4006 14.0589 17.7431 O.co2 81 GLU853 -0.5000 603 OE2 -13.3700 15.9965 17.6307 O.co2 81 GLU853 -0.5000 604 N -16.6547 12.8057 22.4773 N.am 82 LEU854 0.0000 BACKBONE 605 H -16.5838 13.6850 22.9692 H 82 LEU854 0.0000 BACKBONE 606 CA -17.1278 11.6367 23.2020 C.3 82 LEU854 0.0000 BACKBONE 607 HA -17.1576 10.8016 22.5022 H 82 LEU854 0.0000 BACKBONE 608 C -18.5265 11.8831 23.7581 C.2 82 LEU854 0.0000 BACKBONE 609 O -18.9009 13.0344 24.0090 O.2 82 LEU854 0.0000 BACKBONE 610 CB -16.1782 11.2890 24.3588 C.3 82 LEU854 0.0000 611 HB2 -16.5863 10.4174 24.8704 H 82 LEU854 0.0000 612 HB3 -16.1652 12.1383 25.0419 H 82 LEU854 0.0000 613 CG -14.7297 10.9716 23.9869 C.3 82 LEU854 0.0000 614 HG -14.3153 11.8334 23.4639 H 82 LEU854 0.0000 615 CD1 -13.8925 10.7323 25.2383 C.3 82 LEU854 0.0000 616 HD11 -14.2873 9.8733 25.7808 H 82 LEU854 0.0000 617 HD12 -13.9328 11.6150 25.8766 H 82 LEU854 0.0000 618 HD13 -12.8589 10.5377 24.9522 H 82 LEU854 0.0000 619 CD2 -14.6596 9.7724 23.0399 C.3 82 LEU854 0.0000 620 HD21 -15.0683 8.8926 23.5369 H 82 LEU854 0.0000 621 HD22 -13.6211 9.5856 22.7664 H 82 LEU854 0.0000 622 HD23 -15.2394 9.9844 22.1416 H 82 LEU854 0.0000 623 N -19.3220 10.8266 23.9526 N.am 83 PRO855 0.0000 BACKBONE 624 CA -20.6083 10.9788 24.6492 C.3 83 PRO855 0.0000 BACKBONE 625 HA -21.3192 11.6096 24.1154 H 83 PRO855 0.0000 BACKBONE 626 C -20.4015 11.6322 25.9959 C.2 83 PRO855 0.0000 BACKBONE 627 O -19.3460 11.4399 26.6240 O.2 83 PRO855 0.0000 BACKBONE 628 CB -21.1011 9.5311 24.8046 C.3 83 PRO855 0.0000 629 HB2 -22.1833 9.4796 24.6845 H 83 PRO855 0.0000 630 HB3 -20.8248 9.1350 25.7818 H 83 PRO855 0.0000 631 CG -20.4234 8.7808 23.7300 C.3 83 PRO855 0.0000 632 HG2 -21.0115 8.8243 22.8133 H 83 PRO855 0.0000 633 HG3 -20.2884 7.7405 24.0260 H 83 PRO855 0.0000 634 CD -19.0857 9.4376 23.5193 C.3 83 PRO855 0.0000 635 HD2 -18.3167 8.9632 24.1290 H 83 PRO855 0.0000 636 HD3 -18.7923 9.3997 22.4703 H 83 PRO855 0.0000 637 N -21.3760 12.4151 26.4744 N.am 84 PRO856 0.0000 BACKBONE 638 CA -21.1518 13.2180 27.6933 C.3 84 PRO856 0.0000 BACKBONE 639 HA -20.3592 13.9508 27.5415 H 84 PRO856 0.0000 BACKBONE 640 C -20.6312 12.4412 28.8951 C.2 84 PRO856 0.0000 BACKBONE 641 O -19.7137 12.9189 29.5719 O.2 84 PRO856 0.0000 BACKBONE 642 CB -22.5366 13.8251 27.9581 C.3 84 PRO856 0.0000 643 HB2 -22.4465 14.8143 28.4071 H 84 PRO856 0.0000 644 HB3 -23.1231 13.1809 28.6131 H 84 PRO856 0.0000 645 CG -23.1590 13.9120 26.6031 C.3 84 PRO856 0.0000 646 HG2 -22.8368 14.8210 26.0952 H 84 PRO856 0.0000 647 HG3 -24.2460 13.9068 26.6839 H 84 PRO856 0.0000 648 CD -22.6844 12.6983 25.8547 C.3 84 PRO856 0.0000 649 HD2 -23.3705 11.8621 25.9894 H 84 PRO856 0.0000 650 HD3 -22.5759 12.9116 24.7913 H 84 PRO856 0.0000 651 N -21.1870 11.2656 29.1956 N.am 85 ASP857 0.0000 BACKBONE 652 H -21.9021 10.8633 28.6068 H 85 ASP857 0.0000 BACKBONE 653 CA -20.7315 10.5784 30.3995 C.3 85 ASP857 0.0000 BACKBONE 654 HA -20.7056 11.3043 31.2123 H 85 ASP857 0.0000 BACKBONE 655 C -19.3152 10.0402 30.2311 C.2 85 ASP857 0.0000 BACKBONE 656 O -18.5453 10.0129 31.2013 O.2 85 ASP857 0.0000 BACKBONE 657 CB -21.7096 9.4659 30.7892 C.3 85 ASP857 0.0000 658 HB2 -22.6863 9.9125 30.9755 H 85 ASP857 0.0000 659 HB3 -21.3480 8.9898 31.7006 H 85 ASP857 0.0000 660 CG -21.8610 8.4070 29.7212 C.2 85 ASP857 0.0000 661 OD1 -21.7028 8.7238 28.5172 O.co2 85 ASP857 -0.5000 662 OD2 -22.1464 7.2456 30.0939 O.co2 85 ASP857 -0.5000 663 N -18.9486 9.6350 29.0129 N.am 86 GLN858 0.0000 BACKBONE 664 H -19.6315 9.6083 28.2692 H 86 GLN858 0.0000 BACKBONE 665 CA -17.5710 9.2297 28.7428 C.3 86 GLN858 0.0000 BACKBONE 666 HA -17.2810 8.4956 29.4945 H 86 GLN858 0.0000 BACKBONE 667 C -16.6206 10.4136 28.8474 C.2 86 GLN858 0.0000 BACKBONE 668 O -15.5207 10.2906 29.4011 O.2 86 GLN858 0.0000 BACKBONE 669 CB -17.4693 8.5917 27.3604 C.3 86 GLN858 0.0000 670 HB2 -16.4175 8.3959 27.1521 H 86 GLN858 0.0000 671 HB3 -17.8589 9.2997 26.6290 H 86 GLN858 0.0000 672 CG -18.2364 7.2820 27.2114 C.3 86 GLN858 0.0000 673 HG2 -19.2995 7.4837 27.3428 H 86 GLN858 0.0000 674 HG3 -17.8996 6.5909 27.9840 H 86 GLN858 0.0000 675 CD -18.0297 6.6325 25.8559 C.2 86 GLN858 0.0000 676 OE1 -18.8375 5.8063 25.4248 O.2 86 GLN858 0.0000 677 NE2 -16.9381 6.9940 25.1776 N.am 86 GLN858 0.0000 678 HE21 -16.7474 6.5865 24.2733 H 86 GLN858 0.0000 679 HE22 -16.3030 7.6749 25.5688 H 86 GLN858 0.0000 680 N -17.0325 11.5686 28.3203 N.am 87 ALA859 0.0000 BACKBONE 681 H -17.9133 11.6071 27.8276 H 87 ALA859 0.0000 BACKBONE 682 CA -16.2233 12.7765 28.4485 C.3 87 ALA859 0.0000 BACKBONE 683 HA -15.2594 12.5938 27.9734 H 87 ALA859 0.0000 BACKBONE 684 C -15.9685 13.1135 29.9122 C.2 87 ALA859 0.0000 BACKBONE 685 O -14.8251 13.3503 30.3215 O.2 87 ALA859 0.0000 BACKBONE 686 CB -16.9124 13.9467 27.7450 C.3 87 ALA859 0.0000 687 HB1 -17.8777 14.1356 28.2148 H 87 ALA859 0.0000 688 HB2 -17.0619 13.7015 26.6935 H 87 ALA859 0.0000 689 HB3 -16.2888 14.8371 27.8253 H 87 ALA859 0.0000 690 N -17.0320 13.1490 30.7210 N.am 88 GLN860 0.0000 BACKBONE 691 H -17.9429 12.8992 30.3633 H 88 GLN860 0.0000 BACKBONE 692 CA -16.8859 13.5456 32.1147 C.3 88 GLN860 0.0000 BACKBONE 693 HA -16.3415 14.4896 32.1403 H 88 GLN860 0.0000 BACKBONE 694 C -16.0729 12.5273 32.9041 C.2 88 GLN860 0.0000 BACKBONE 695 O -15.2757 12.9028 33.7711 O.2 88 GLN860 0.0000 BACKBONE 696 CB -18.2593 13.7487 32.7517 C.3 88 GLN860 0.0000 697 HB2 -18.7965 12.8006 32.7267 H 88 GLN860 0.0000 698 HB3 -18.8051 14.4910 32.1691 H 88 GLN860 0.0000 699 CG -18.1863 14.2225 34.1869 C.3 88 GLN860 0.0000 700 HG2 -17.8387 13.3974 34.8086 H 88 GLN860 0.0000 701 HG3 -19.1845 14.5223 34.5058 H 88 GLN860 0.0000 702 CD -17.2417 15.4026 34.3725 C.2 88 GLN860 0.0000 703 OE1 -17.2654 16.3725 33.6013 O.2 88 GLN860 0.0000 704 NE2 -16.4030 15.3271 35.4019 N.am 88 GLN860 0.0000 705 HE21 -15.7523 16.0788 35.5793 H 88 GLN860 0.0000 706 HE22 -16.4169 14.5180 36.0063 H 88 GLN860 0.0000 707 N -16.2567 11.2400 32.6139 N.am 89 TYR861 0.0000 BACKBONE 708 H -16.9713 10.9710 31.9529 H 89 TYR861 0.0000 BACKBONE 709 CA -15.4299 10.2159 33.2471 C.3 89 TYR861 0.0000 BACKBONE 710 HA -15.6059 10.2334 34.3227 H 89 TYR861 0.0000 BACKBONE 711 C -13.9468 10.5003 33.0203 C.2 89 TYR861 0.0000 BACKBONE 712 O -13.1440 10.4657 33.9616 O.2 89 TYR861 0.0000 BACKBONE 713 CB -15.8162 8.8373 32.7145 C.3 89 TYR861 0.0000 714 HB2 -15.6041 8.8135 31.6456 H 89 TYR861 0.0000 715 HB3 -16.8850 8.6971 32.8760 H 89 TYR861 0.0000 716 CG -15.0828 7.6826 33.3687 C.ar 89 TYR861 0.0000 717 CD1 -15.5651 7.0916 34.5325 C.ar 89 TYR861 0.0000 718 HD1 -16.4725 7.4659 34.9830 H 89 TYR861 0.0000 719 CD2 -13.9152 7.1800 32.8151 C.ar 89 TYR861 0.0000 720 HD2 -13.5256 7.6230 31.9105 H 89 TYR861 0.0000 721 CE1 -14.8965 6.0276 35.1227 C.ar 89 TYR861 0.0000 722 HE1 -15.2827 5.5762 36.0247 H 89 TYR861 0.0000 723 CE2 -13.2378 6.1214 33.3981 C.ar 89 TYR861 0.0000 724 HE2 -12.3276 5.7477 32.9529 H 89 TYR861 0.0000 725 CZ -13.7318 5.5489 34.5478 C.ar 89 TYR861 0.0000 726 OH -13.0473 4.4916 35.1138 O.3 89 TYR861 0.0000 727 HH -12.2516 4.2267 34.6466 H 89 TYR861 0.0000 728 N -13.5760 10.8442 31.7835 N.am 90 CYS862 0.0000 BACKBONE 729 H -14.2687 10.8894 31.0498 H 90 CYS862 0.0000 BACKBONE 730 CA -12.1810 11.1557 31.4785 C.3 90 CYS862 0.0000 BACKBONE 731 HA -11.5694 10.3553 31.8949 H 90 CYS862 0.0000 BACKBONE 732 C -11.7430 12.4649 32.1182 C.2 90 CYS862 0.0000 BACKBONE 733 O -10.6397 12.5495 32.6727 O.2 90 CYS862 0.0000 BACKBONE 734 CB -11.9709 11.2251 29.9652 C.3 90 CYS862 0.0000 735 HB2 -10.9569 11.5760 29.7737 H 90 CYS862 0.0000 736 HB3 -12.6857 11.9357 29.5502 H 90 CYS862 0.0000 737 SG -12.1899 9.6628 29.1441 S.3 90 CYS862 0.0000 738 HG -11.3223 8.7748 29.6378 H 90 CYS862 0.0000 739 N -12.5791 13.5046 32.0345 N.am 91 ILE863 0.0000 BACKBONE 740 H -13.4746 13.3935 31.5808 H 91 ILE863 0.0000 BACKBONE 741 CA -12.2059 14.7981 32.5944 C.3 91 ILE863 0.0000 BACKBONE 742 HA -11.2859 15.1410 32.1209 H 91 ILE863 0.0000 BACKBONE 743 C -11.9336 14.6737 34.0850 C.2 91 ILE863 0.0000 BACKBONE 744 O -10.9940 15.2812 34.6134 O.2 91 ILE863 0.0000 BACKBONE 745 CB -13.3059 15.8376 32.3021 C.3 91 ILE863 0.0000 746 HB -14.2692 15.4316 32.6110 H 91 ILE863 0.0000 747 CG1 -13.3744 16.1219 30.7978 C.3 91 ILE863 0.0000 748 HG12 -13.3458 15.1712 30.2655 H 91 ILE863 0.0000 749 HG13 -12.5064 16.7200 30.5200 H 91 ILE863 0.0000 750 CG2 -13.0745 17.1069 33.1058 C.3 91 ILE863 0.0000 751 HG21 -12.1170 17.5453 32.8249 H 91 ILE863 0.0000 752 HG22 -13.0664 16.8673 34.1691 H 91 ILE863 0.0000 753 HG23 -13.8743 17.8183 32.8998 H 91 ILE863 0.0000 754 CD1 -14.6212 16.8663 30.3802 C.3 91 ILE863 0.0000 755 HD11 -15.5008 16.2821 30.6505 H 91 ILE863 0.0000 756 HD12 -14.6066 17.0232 29.3016 H 91 ILE863 0.0000 757 HD13 -14.6556 17.8306 30.8871 H 91 ILE863 0.0000 758 N -12.7382 13.8675 34.7795 N.am 92 LYS864 0.0000 BACKBONE 759 H -13.4670 13.3599 34.2984 H 92 LYS864 0.0000 BACKBONE 760 CA -12.5846 13.7058 36.2210 C.3 92 LYS864 0.0000 BACKBONE 761 HA -12.5572 14.7014 36.6638 H 92 LYS864 0.0000 BACKBONE 762 C -11.2746 13.0110 36.5913 C.2 92 LYS864 0.0000 BACKBONE 763 O -10.7156 13.2887 37.6592 O.2 92 LYS864 0.0000 BACKBONE 764 CB -13.7713 12.9162 36.7774 C.3 92 LYS864 0.0000 765 HB1 -13.7895 11.9231 36.3285 H 92 LYS864 0.0000 766 HB2 -14.6983 13.4387 36.5411 H 92 LYS864 0.0000 767 HB3 -13.6716 12.8243 37.8590 H 92 LYS864 0.0000 768 N -10.7602 12.1322 35.7265 N.am 93 ARG865 0.0000 BACKBONE 769 H -11.1432 12.0772 34.7935 H 93 ARG865 0.0000 BACKBONE 770 CA -9.6591 11.2503 36.0966 C.3 93 ARG865 0.0000 BACKBONE 771 HA -9.4771 11.4407 37.1543 H 93 ARG865 0.0000 BACKBONE 772 C -8.3510 11.5368 35.3704 C.2 93 ARG865 0.0000 BACKBONE 773 O -7.3392 10.8976 35.6860 O.2 93 ARG865 0.0000 BACKBONE 774 CB -10.0543 9.7848 35.8499 C.3 93 ARG865 0.0000 775 HB2 -9.1692 9.1598 35.9687 H 93 ARG865 0.0000 776 HB3 -10.4309 9.6915 34.8313 H 93 ARG865 0.0000 777 CG -11.1212 9.3007 36.8071 C.3 93 ARG865 0.0000 778 HG2 -11.8254 10.1128 36.9879 H 93 ARG865 0.0000 779 HG3 -10.6471 9.0151 37.7461 H 93 ARG865 0.0000 780 CD -11.8840 8.1033 36.2590 C.3 93 ARG865 0.0000 781 HD2 -11.1779 7.3036 36.0356 H 93 ARG865 0.0000 782 HD3 -12.4001 8.3981 35.3453 H 93 ARG865 0.0000 783 NE -12.8668 7.6158 37.2264 N.pl3 93 ARG865 0.0000 784 HE -12.6356 6.7872 37.7555 H 93 ARG865 0.0000 785 CZ -14.0438 8.1895 37.4565 C.cat 93 ARG865 1.0000 786 NH1 -14.3962 9.2895 36.7952 N.pl3 93 ARG865 0.0000 787 HH11 -15.2910 9.7220 36.9751 H 93 ARG865 0.0000 788 HH12 -13.7689 9.6916 36.1134 H 93 ARG865 0.0000 789 NH2 -14.8697 7.6608 38.3535 N.pl3 93 ARG865 0.0000 790 HH21 -15.7643 8.0937 38.5331 H 93 ARG865 0.0000 791 HH22 -14.6026 6.8261 38.8555 H 93 ARG865 0.0000 792 N -8.3332 12.4461 34.4037 N.am 94 MET866 0.0000 BACKBONE 793 H -9.1903 12.9074 34.1341 H 94 MET866 0.0000 BACKBONE 794 CA -7.0896 12.7836 33.7296 C.3 94 MET866 0.0000 BACKBONE 795 HA -6.4724 11.8871 33.6695 H 94 MET866 0.0000 BACKBONE 796 C -6.3468 13.8469 34.5213 C.2 94 MET866 0.0000 BACKBONE 797 O -6.9194 14.9148 34.7950 O.2 94 MET866 0.0000 BACKBONE 798 CB -7.3540 13.2653 32.3175 C.3 94 MET866 0.0000 799 HB2 -6.4627 13.7706 31.9456 H 94 MET866 0.0000 800 HB3 -8.1882 13.9667 32.3357 H 94 MET866 0.0000 801 CG -7.6938 12.1290 31.3856 C.3 94 MET866 0.0000 802 HG2 -8.6238 11.6621 31.7100 H 94 MET866 0.0000 803 HG3 -6.8907 11.3924 31.4070 H 94 MET866 0.0000 804 SD -7.8906 12.7447 29.7113 S.3 94 MET866 0.0000 805 CE -8.2026 11.2194 28.8311 C.3 94 MET866 0.0000 806 HE1 -8.3468 11.4339 27.7722 H 94 MET866 0.0000 807 HE2 -9.0990 10.7458 29.2313 H 94 MET866 0.0000 808 HE3 -7.3520 10.5488 28.9535 H 94 MET866 0.0000 809 N -5.1039 13.6027 34.9233 N.am 95 PRO867 -0.6602 BACKBONE 810 CA -4.3579 14.6198 35.6648 C.3 95 PRO867 0.3611 BACKBONE 811 HA -4.9543 15.1102 36.4341 H 95 PRO867 0.0000 BACKBONE 812 C -3.8927 15.7334 34.7438 C.2 95 PRO867 0.5690 BACKBONE 813 O -3.8371 15.5840 33.5188 O.2 95 PRO867 -0.5700 BACKBONE 814 CB -3.1717 13.8416 36.2415 C.3 95 PRO867 0.0000 815 HB2 -3.4074 13.4586 37.2344 H 95 PRO867 0.0000 816 HB3 -2.2856 14.4740 36.2970 H 95 PRO867 0.0000 817 CG -2.9616 12.7212 35.2793 C.3 95 PRO867 0.0000 818 HG2 -2.5326 11.8608 35.7929 H 95 PRO867 0.0000 819 HG3 -2.2940 13.0356 34.4771 H 95 PRO867 0.0000 820 CD -4.3201 12.3681 34.7178 C.3 95 PRO867 0.3001 821 HD2 -4.2523 12.1205 33.6584 H 95 PRO867 0.0000 822 HD3 -4.7608 11.5310 35.2591 H 95 PRO867 0.0000 823 N -3.5697 16.8712 35.3624 N.am 96 ALA868 -0.7301 BACKBONE 824 H -3.6864 16.9432 36.3630 H 96 ALA868 0.3700 BACKBONE 825 CA -3.0517 18.0103 34.6177 C.3 96 ALA868 0.3611 BACKBONE 826 HA -3.8058 18.3239 33.8957 H 96 ALA868 0.0000 BACKBONE 827 C -1.7877 17.6219 33.8607 C.2 96 ALA868 0.5690 BACKBONE 828 O -0.8868 16.9793 34.4122 O.2 96 ALA868 -0.5700 BACKBONE 829 CB -2.7630 19.1748 35.5656 C.3 96 ALA868 0.0000 830 HB1 -2.0095 18.8729 36.2931 H 96 ALA868 0.0000 831 HB2 -3.6787 19.4553 36.0861 H 96 ALA868 0.0000 832 HB3 -2.3949 20.0264 34.9934 H 96 ALA868 0.0000 833 N -1.7361 17.9878 32.5837 N.am 97 TYR869 -0.7301 BACKBONE 834 H -2.5594 18.3760 32.1459 H 97 TYR869 0.3700 BACKBONE 835 CA -0.5168 17.8396 31.8051 C.3 97 TYR869 0.3611 BACKBONE 836 HA -0.0092 16.9190 32.0928 H 97 TYR869 0.0000 BACKBONE 837 C 0.4010 19.0246 32.0847 C.2 97 TYR869 0.5690 BACKBONE 838 O -0.0211 20.1814 31.9961 O.2 97 TYR869 -0.5700 BACKBONE 839 CB -0.8455 17.7483 30.3165 C.3 97 TYR869 0.1435 840 HB2 -1.4121 18.6369 30.0382 H 97 TYR869 0.0000 841 HB3 -1.4590 16.8616 30.1574 H 97 TYR869 0.0000 842 CG 0.3612 17.6556 29.4113 C.ar 97 TYR869 -0.1435 843 CD1 1.0142 16.4458 29.2161 C.ar 97 TYR869 -0.1500 844 HD1 0.6584 15.5613 29.7235 H 97 TYR869 0.1500 845 CD2 0.8367 18.7743 28.7436 C.ar 97 TYR869 -0.1500 846 HD2 0.3382 19.7227 28.8791 H 97 TYR869 0.1500 847 CE1 2.1146 16.3565 28.3809 C.ar 97 TYR869 -0.1500 848 HE1 2.6135 15.4096 28.2371 H 97 TYR869 0.1500 849 CE2 1.9330 18.7008 27.9101 C.ar 97 TYR869 -0.1500 850 HE2 2.2902 19.5838 27.4010 H 97 TYR869 0.1500 851 CZ 2.5697 17.4900 27.7320 C.ar 97 TYR869 0.0825 852 OH 3.6631 17.4164 26.9020 O.3 97 TYR869 -0.5325 853 HH 3.9157 18.2455 26.4893 H 97 TYR869 0.4500 854 N 1.6490 18.7345 32.4496 N.am 98 SER870 -0.7301 BACKBONE 855 H 1.9160 17.7656 32.5492 H 98 SER870 0.3700 BACKBONE 856 CA 2.6421 19.7698 32.7099 C.3 98 SER870 0.3611 BACKBONE 857 HA 2.1920 20.7219 32.4287 H 98 SER870 0.0000 BACKBONE 858 C 3.8983 19.5874 31.8674 C.2 98 SER870 0.5690 BACKBONE 859 O 4.8982 20.2734 32.1071 O.2 98 SER870 -0.5700 BACKBONE 860 CB 3.0090 19.8000 34.1970 C.3 98 SER870 0.2800 861 HB2 2.1125 20.0018 34.7831 H 98 SER870 0.0000 862 HB3 3.7411 20.5890 34.3693 H 98 SER870 0.0000 863 OG 3.5592 18.5583 34.6005 O.3 98 SER870 -0.6800 864 HG 2.8976 17.8816 34.4394 H 98 SER870 0.4000 865 N 3.8736 18.6879 30.8898 N.am 99 GLY871 -0.7301 BACKBONE 866 H 3.0295 18.1553 30.7346 H 99 GLY871 0.3700 BACKBONE 867 CA 5.0160 18.4502 30.0447 C.3 99 GLY871 0.3611 BACKBONE 868 HA2 4.8838 17.4912 29.5438 H 99 GLY871 0.0000 BACKBONE 869 HA3 5.9084 18.4138 30.6695 H 99 GLY871 0.0000 BACKBONE 870 C 5.2075 19.5225 28.9916 C.2 99 GLY871 0.5690 BACKBONE 871 O 4.6297 20.6134 29.0599 O.2 99 GLY871 -0.5700 BACKBONE 872 N 6.0358 19.2233 27.9928 N.am 100 PRO872 -0.6602 BACKBONE 873 CA 6.3395 20.2111 26.9465 C.3 100 PRO872 0.3611 BACKBONE 874 HA 6.7818 21.1213 27.3514 H 100 PRO872 0.0000 BACKBONE 875 C 5.0935 20.6997 26.2195 C.2 100 PRO872 0.5690 BACKBONE 876 O 4.2585 19.9094 25.7686 O.2 100 PRO872 -0.5700 BACKBONE 877 CB 7.2757 19.4428 26.0064 C.3 100 PRO872 0.0000 878 HB2 8.0294 20.1079 25.5848 H 100 PRO872 0.0000 879 HB3 6.7122 18.9744 25.1994 H 100 PRO872 0.0000 880 CG 7.9107 18.4095 26.8753 C.3 100 PRO872 0.0000 881 HG2 8.7729 18.8270 27.3953 H 100 PRO872 0.0000 882 HG3 8.2256 17.5526 26.2798 H 100 PRO872 0.0000 883 CD 6.8502 18.0031 27.8599 C.3 100 PRO872 0.3001 884 HD2 6.2551 17.1750 27.4750 H 100 PRO872 0.0000 885 HD3 7.2909 17.7203 28.8158 H 100 PRO872 0.0000 886 N 4.9760 22.0216 26.1037 N.am 101 GLY873 -0.7301 BACKBONE 887 H 5.6754 22.6189 26.5211 H 101 GLY873 0.3700 BACKBONE 888 CA 3.8651 22.6201 25.3909 C.3 101 GLY873 0.3611 BACKBONE 889 HA2 3.6919 22.0370 24.4864 H 101 GLY873 0.0000 BACKBONE 890 HA3 4.1482 23.6370 25.1189 H 101 GLY873 0.0000 BACKBONE 891 C 2.5667 22.6871 26.1582 C.2 101 GLY873 0.5690 BACKBONE 892 O 1.5119 22.8837 25.5481 O.2 101 GLY873 -0.5700 BACKBONE 893 N 2.6085 22.5412 27.4797 N.am 102 SER874 -0.7301 BACKBONE 894 H 3.5019 22.4226 27.9358 H 102 SER874 0.3700 BACKBONE 895 CA 1.3940 22.5488 28.2828 C.3 102 SER874 0.3611 BACKBONE 896 HA 0.6932 21.8426 27.8376 H 102 SER874 0.0000 BACKBONE 897 C 0.7463 23.9304 28.2862 C.2 102 SER874 0.5690 BACKBONE 898 O 1.4225 24.9601 28.2200 O.2 102 SER874 -0.5700 BACKBONE 899 CB 1.7014 22.1133 29.7157 C.3 102 SER874 0.2800 900 HB2 1.9934 21.0631 29.7140 H 102 SER874 0.0000 901 HB3 0.8074 22.2407 30.3262 H 102 SER874 0.0000 902 OG 2.7543 22.8862 30.2687 O.3 102 SER874 -0.6800 903 HG 3.5290 22.7588 29.7163 H 102 SER874 0.4000 904 N -0.5807 23.9394 28.3587 N.am 103 VAL875 -0.7301 BACKBONE 905 H -1.0698 23.0557 28.3603 H 103 VAL875 0.3700 BACKBONE 906 CA -1.3649 25.1722 28.4363 C.3 103 VAL875 0.3611 BACKBONE 907 HA -0.7222 26.0437 28.5610 H 103 VAL875 0.0000 BACKBONE 908 C -2.2933 24.9995 29.6335 C.2 103 VAL875 0.5690 BACKBONE 909 O -2.3886 23.8843 30.1687 O.2 103 VAL875 -0.5700 BACKBONE 910 CB -2.1467 25.4309 27.1359 C.3 103 VAL875 0.0000 911 HB -2.7039 26.3609 27.2483 H 103 VAL875 0.0000 912 CG1 -1.1990 25.5978 25.9535 C.3 103 VAL875 0.0000 913 HG11 -0.6257 24.6811 25.8151 H 103 VAL875 0.0000 914 HG12 -0.5180 26.4264 26.1478 H 103 VAL875 0.0000 915 HG13 -1.7756 25.8053 25.0521 H 103 VAL875 0.0000 916 CG2 -3.1376 24.3017 26.8833 C.3 103 VAL875 0.0000 917 HG21 -2.5965 23.3624 26.7684 H 103 VAL875 0.0000 918 HG22 -3.7015 24.5097 25.9740 H 103 VAL875 0.0000 919 HG23 -3.8237 24.2248 27.7268 H 103 VAL875 0.0000 920 N -2.9774 26.0413 30.1059 N.am 104 PRO876 -0.6602 BACKBONE 921 CA -3.9125 25.8447 31.2221 C.3 104 PRO876 0.3611 BACKBONE 922 HA -3.4786 25.2986 32.0597 H 104 PRO876 0.0000 BACKBONE 923 C -5.1084 25.0192 30.7795 C.2 104 PRO876 0.5690 BACKBONE 924 O -5.6762 25.2450 29.7073 O.2 104 PRO876 -0.5700 BACKBONE 925 CB -4.3176 27.2752 31.6073 C.3 104 PRO876 0.0000 926 HB2 -3.7002 27.6440 32.4264 H 104 PRO876 0.0000 927 HB3 -5.3675 27.3141 31.8978 H 104 PRO876 0.0000 928 CG -4.0853 28.0628 30.3830 C.3 104 PRO876 0.0000 929 HG2 -3.9168 29.1110 30.6299 H 104 PRO876 0.0000 930 HG3 -4.9382 27.9809 29.7091 H 104 PRO876 0.0000 931 CD -2.8608 27.4684 29.7543 C.3 104 PRO876 0.3001 932 HD2 -2.8662 27.6088 28.6734 H 104 PRO876 0.0000 933 HD3 -1.9533 27.9036 30.1727 H 104 PRO876 0.0000 934 N -5.4765 24.0408 31.6077 N.am 105 GLY877 0.0000 BACKBONE 935 H -5.0216 23.9613 32.5059 H 105 GLY877 0.0000 BACKBONE 936 CA -6.5091 23.0899 31.2562 C.3 105 GLY877 0.0000 BACKBONE 937 HA2 -7.2395 23.5998 30.6279 H 105 GLY877 0.0000 BACKBONE 938 HA3 -6.9904 22.7571 32.1758 H 105 GLY877 0.0000 BACKBONE 939 C -6.0203 21.8645 30.5104 C.2 105 GLY877 0.0000 BACKBONE 940 O -6.8306 20.9734 30.2108 O.2 105 GLY877 0.0000 BACKBONE 941 N -4.7302 21.7953 30.1916 N.am 106 ALA878 -0.7301 BACKBONE 942 H -4.1160 22.5614 30.4283 H 106 ALA878 0.3700 BACKBONE 943 CA -4.1924 20.6259 29.5043 C.3 106 ALA878 0.3611 BACKBONE 944 HA -4.7517 20.4680 28.5822 H 106 ALA878 0.0000 BACKBONE 945 C -4.3393 19.3879 30.3839 C.2 106 ALA878 0.5690 BACKBONE 946 O -3.9244 19.3886 31.5495 O.2 106 ALA878 -0.5700 BACKBONE 947 CB -2.7215 20.8559 29.1553 C.3 106 ALA878 0.0000 948 HB1 -2.1516 21.0153 30.0706 H 106 ALA878 0.0000 949 HB2 -2.6330 21.7334 28.5147 H 106 ALA878 0.0000 950 HB3 -2.3316 19.9830 28.6317 H 106 ALA878 0.0000 951 N -4.9284 18.3346 29.8261 N.am 107 LEU879 0.0000 BACKBONE 952 H -5.2410 18.4012 28.8680 H 107 LEU879 0.0000 BACKBONE 953 CA -5.1386 17.0873 30.5498 C.3 107 LEU879 0.0000 BACKBONE 954 HA -4.8960 17.2508 31.5998 H 107 LEU879 0.0000 BACKBONE 955 C -4.2234 16.0032 29.9984 C.2 107 LEU879 0.0000 BACKBONE 956 O -4.0358 15.8879 28.7805 O.2 107 LEU879 0.0000 BACKBONE 957 CB -6.6021 16.6498 30.4654 C.3 107 LEU879 0.0000 958 HB2 -6.7255 15.7567 31.0781 H 107 LEU879 0.0000 959 HB3 -6.8257 16.4108 29.4257 H 107 LEU879 0.0000 960 CG -7.6174 17.7044 30.9444 C.3 107 LEU879 0.0000 961 HG -7.4749 18.6142 30.3614 H 107 LEU879 0.0000 962 CD1 -9.0397 17.2060 30.7128 C.3 107 LEU879 0.0000 963 HD11 -9.2035 16.2947 31.2880 H 107 LEU879 0.0000 964 HD12 -9.1834 16.9972 29.6527 H 107 LEU879 0.0000 965 HD13 -9.7488 17.9697 31.0321 H 107 LEU879 0.0000 966 CD2 -7.3846 18.0656 32.4109 C.3 107 LEU879 0.0000 967 HD21 -7.5184 17.1781 33.0294 H 107 LEU879 0.0000 968 HD22 -8.0989 18.8310 32.7143 H 107 LEU879 0.0000 969 HD23 -6.3705 18.4455 32.5350 H 107 LEU879 0.0000 970 N -3.6749 15.1955 30.9107 N.am 108 ASP880 0.0000 BACKBONE 971 H -3.9699 15.2841 31.8726 H 108 ASP880 0.0000 BACKBONE 972 CA -2.6632 14.1855 30.5784 C.3 108 ASP880 0.0000 BACKBONE 973 HA -2.1124 14.4873 29.6876 H 108 ASP880 0.0000 BACKBONE 974 C -3.3474 12.8540 30.2747 C.2 108 ASP880 0.0000 BACKBONE 975 O -3.4547 11.9544 31.1156 O.2 108 ASP880 0.0000 BACKBONE 976 CB -1.6623 14.0636 31.7228 C.3 108 ASP880 0.0000 977 HB2 -2.0969 13.4333 32.4987 H 108 ASP880 0.0000 978 HB3 -1.4733 15.0584 32.1264 H 108 ASP880 0.0000 979 CG -0.3407 13.4578 31.2919 C.2 108 ASP880 0.0000 980 OD1 -0.3061 12.7498 30.2641 O.co2 108 ASP880 -0.5000 981 OD2 0.6657 13.6895 32.0002 O.co2 108 ASP880 -0.5000 982 N -3.7934 12.7138 29.0255 N.am 109 TYR881 0.0000 BACKBONE 983 H -3.6875 13.4655 28.3593 H 109 TYR881 0.0000 BACKBONE 984 CA -4.4348 11.4664 28.6306 C.3 109 TYR881 0.0000 BACKBONE 985 HA -5.2250 11.2497 29.3494 H 109 TYR881 0.0000 BACKBONE 986 C -3.4495 10.3040 28.6659 C.2 109 TYR881 0.0000 BACKBONE 987 O -3.8503 9.1584 28.9124 O.2 109 TYR881 0.0000 BACKBONE 988 CB -5.0711 11.6060 27.2407 C.3 109 TYR881 0.0000 989 HB2 -5.8425 12.3737 27.3012 H 109 TYR881 0.0000 990 HB3 -5.5289 10.6505 26.9846 H 109 TYR881 0.0000 991 CG -4.1225 11.9852 26.1164 C.ar 109 TYR881 0.0000 992 CD1 -3.3192 11.0282 25.5041 C.ar 109 TYR881 0.0000 993 HD1 -3.3695 10.0019 25.8365 H 109 TYR881 0.0000 994 CD2 -4.0483 13.2990 25.6563 C.ar 109 TYR881 0.0000 995 HD2 -4.6688 14.0573 26.1107 H 109 TYR881 0.0000 996 CE1 -2.4559 11.3691 24.4753 C.ar 109 TYR881 0.0000 997 HE1 -1.8331 10.6156 24.0162 H 109 TYR881 0.0000 998 CE2 -3.1893 13.6477 24.6230 C.ar 109 TYR881 0.0000 999 HE2 -3.1411 14.6696 24.2770 H 109 TYR881 0.0000 1000 CZ -2.3970 12.6780 24.0410 C.ar 109 TYR881 0.0000 1001 OH -1.5375 13.0126 23.0161 O.3 109 TYR881 0.0000 1002 HH -1.5477 13.9389 22.7641 H 109 TYR881 0.0000 1003 N -2.1582 10.5746 28.4473 N.am 110 ALA882 0.0000 BACKBONE 1004 H -1.8547 11.5260 28.2963 H 110 ALA882 0.0000 BACKBONE 1005 CA -1.1911 9.4798 28.4291 C.3 110 ALA882 0.0000 BACKBONE 1006 HA -1.5957 8.6807 27.8079 H 110 ALA882 0.0000 BACKBONE 1007 C -0.9743 8.9222 29.8268 C.2 110 ALA882 0.0000 BACKBONE 1008 O -0.9585 7.6971 30.0148 O.2 110 ALA882 0.0000 BACKBONE 1009 CB 0.1315 9.9397 27.8171 C.3 110 ALA882 0.0000 1010 HB1 0.5539 10.7403 28.4244 H 110 ALA882 0.0000 1011 HB2 -0.0438 10.3050 26.8053 H 110 ALA882 0.0000 1012 HB3 0.8280 9.1018 27.7853 H 110 ALA882 0.0000 1013 N -0.8221 9.8042 30.8160 N.am 111 ALA883 0.0000 BACKBONE 1014 H -0.7839 10.7902 30.6004 H 111 ALA883 0.0000 BACKBONE 1015 CA -0.7096 9.3675 32.2078 C.3 111 ALA883 0.0000 BACKBONE 1016 HA 0.1587 8.7136 32.2881 H 111 ALA883 0.0000 BACKBONE 1017 C -1.9377 8.5767 32.6363 C.2 111 ALA883 0.0000 BACKBONE 1018 O -1.8196 7.5220 33.2774 O.2 111 ALA883 0.0000 BACKBONE 1019 CB -0.5129 10.5759 33.1260 C.3 111 ALA883 0.0000 1020 HB1 -1.3782 11.2344 33.0504 H 111 ALA883 0.0000 1021 HB2 0.3837 11.1183 32.8257 H 111 ALA883 0.0000 1022 HB3 -0.4039 10.2359 34.1558 H 111 ALA883 0.0000 1023 N -3.1262 9.0715 32.2834 N.am 112 PHE884 0.0000 BACKBONE 1024 H -3.1629 9.9488 31.7844 H 112 PHE884 0.0000 BACKBONE 1025 CA -4.3755 8.3820 32.5973 C.3 112 PHE884 0.0000 BACKBONE 1026 HA -4.4509 8.2447 33.6760 H 112 PHE884 0.0000 BACKBONE 1027 C -4.4140 6.9906 31.9756 C.2 112 PHE884 0.0000 BACKBONE 1028 O -4.7217 5.9971 32.6519 O.2 112 PHE884 0.0000 BACKBONE 1029 CB -5.5471 9.2420 32.1077 C.3 112 PHE884 0.0000 1030 HB2 -5.2797 9.6626 31.1383 H 112 PHE884 0.0000 1031 HB3 -5.7006 10.0490 32.8241 H 112 PHE884 0.0000 1032 CG -6.8406 8.4967 31.9556 C.ar 112 PHE884 0.0000 1033 CD1 -7.6744 8.3090 33.0468 C.ar 112 PHE884 0.0000 1034 HD1 -7.3841 8.6918 34.0140 H 112 PHE884 0.0000 1035 CD2 -7.2427 8.0132 30.7148 C.ar 112 PHE884 0.0000 1036 HD2 -6.6113 8.1680 29.8524 H 112 PHE884 0.0000 1037 CE1 -8.8737 7.6364 32.9084 C.ar 112 PHE884 0.0000 1038 HE1 -9.5111 7.4902 33.7680 H 112 PHE884 0.0000 1039 CE2 -8.4387 7.3379 30.5714 C.ar 112 PHE884 0.0000 1040 HE2 -8.7356 6.9564 29.6056 H 112 PHE884 0.0000 1041 CZ -9.2582 7.1527 31.6801 C.ar 112 PHE884 0.0000 1042 HZ -10.1968 6.6288 31.5760 H 112 PHE884 0.0000 1043 N -4.0872 6.9001 30.6841 N.am 113 SER885 0.0000 BACKBONE 1044 H -3.7806 7.7224 30.1843 H 113 SER885 0.0000 BACKBONE 1045 CA -4.1710 5.6188 29.9918 C.3 113 SER885 0.0000 BACKBONE 1046 HA -5.1522 5.1870 30.1884 H 113 SER885 0.0000 BACKBONE 1047 C -3.1301 4.6324 30.5116 C.2 113 SER885 0.0000 BACKBONE 1048 O -3.4424 3.4581 30.7402 O.2 113 SER885 0.0000 BACKBONE 1049 CB -4.0118 5.8321 28.4915 C.3 113 SER885 0.0000 1050 HB2 -4.1233 4.8742 27.9834 H 113 SER885 0.0000 1051 HB3 -3.0183 6.2346 28.2939 H 113 SER885 0.0000 1052 OG -4.9837 6.7358 27.9910 O.3 113 SER885 0.0000 1053 HG -5.8489 6.3628 28.1751 H 113 SER885 0.0000 1054 N -1.8888 5.0857 30.7107 N.am 114 SER886 0.0000 BACKBONE 1055 H -1.6690 6.0532 30.5217 H 114 SER886 0.0000 BACKBONE 1056 CA -0.8479 4.1826 31.2019 C.3 114 SER886 0.0000 BACKBONE 1057 HA -0.7877 3.3373 30.5163 H 114 SER886 0.0000 BACKBONE 1058 C -1.1895 3.6441 32.5836 C.2 114 SER886 0.0000 BACKBONE 1059 O -1.0207 2.4474 32.8507 O.2 114 SER886 0.0000 BACKBONE 1060 CB 0.5053 4.8977 31.2332 C.3 114 SER886 0.0000 1061 HB2 1.2395 4.2535 31.7169 H 114 SER886 0.0000 1062 HB3 0.4073 5.8248 31.7980 H 114 SER886 0.0000 1063 OG 0.9437 5.1978 29.9172 O.3 114 SER886 0.0000 1064 HG 1.0223 4.3680 29.4411 H 114 SER886 0.0000 1065 N -1.6602 4.5172 33.4772 N.am 115 ALA887 0.0000 BACKBONE 1066 H -1.7655 5.4877 33.2183 H 115 ALA887 0.0000 BACKBONE 1067 CA -2.0246 4.0872 34.8236 C.3 115 ALA887 0.0000 BACKBONE 1068 HA -1.1579 3.6111 35.2820 H 115 ALA887 0.0000 BACKBONE 1069 C -3.1506 3.0679 34.7819 C.2 115 ALA887 0.0000 BACKBONE 1070 O -3.1590 2.1057 35.5570 O.2 115 ALA887 0.0000 BACKBONE 1071 CB -2.4304 5.2971 35.6629 C.3 115 ALA887 0.0000 1072 HB1 -3.2971 5.7789 35.2105 H 115 ALA887 0.0000 1073 HB2 -1.6021 6.0045 35.7048 H 115 ALA887 0.0000 1074 HB3 -2.6814 4.9714 36.6723 H 115 ALA887 0.0000 1075 N -4.0998 3.2523 33.8646 N.am 116 LEU888 0.0000 BACKBONE 1076 H -4.0213 4.0209 33.2141 H 116 LEU888 0.0000 BACKBONE 1077 CA -5.2492 2.3600 33.7877 C.3 116 LEU888 0.0000 BACKBONE 1078 HA -5.7721 2.3872 34.7436 H 116 LEU888 0.0000 BACKBONE 1079 C -4.8220 0.9187 33.5399 C.2 116 LEU888 0.0000 BACKBONE 1080 O -5.4253 -0.0167 34.0764 O.2 116 LEU888 0.0000 BACKBONE 1081 CB -6.1787 2.8318 32.6768 C.3 116 LEU888 0.0000 1082 HB2 -5.7606 2.4776 31.7346 H 116 LEU888 0.0000 1083 HB3 -6.1705 3.9217 32.6910 H 116 LEU888 0.0000 1084 CG -7.6347 2.3926 32.7159 C.3 116 LEU888 0.0000 1085 HG -7.6894 1.3040 32.7289 H 116 LEU888 0.0000 1086 CD1 -8.3106 2.9071 33.9867 C.3 116 LEU888 0.0000 1087 HD11 -8.2720 3.9963 34.0032 H 116 LEU888 0.0000 1088 HD12 -7.7914 2.5119 34.8598 H 116 LEU888 0.0000 1089 HD13 -9.3502 2.5800 34.0032 H 116 LEU888 0.0000 1090 CD2 -8.3439 2.9076 31.4734 C.3 116 LEU888 0.0000 1091 HD21 -8.2944 3.9963 31.4518 H 116 LEU888 0.0000 1092 HD22 -9.3870 2.5918 31.4932 H 116 LEU888 0.0000 1093 HD23 -7.8589 2.5041 30.5846 H 116 LEU888 0.0000 1094 N -3.7876 0.7190 32.7242 N.am 117 TYR889 0.0000 BACKBONE 1095 H -3.2746 1.5182 32.3804 H 117 TYR889 0.0000 BACKBONE 1096 CA -3.3730 -0.6156 32.3125 C.3 117 TYR889 0.0000 BACKBONE 1097 HA -4.1290 -1.3166 32.6664 H 117 TYR889 0.0000 BACKBONE 1098 C -2.0533 -1.0375 32.9460 C.2 117 TYR889 0.0000 BACKBONE 1099 O -1.4436 -2.0147 32.4833 O.2 117 TYR889 0.0000 BACKBONE 1100 CB -3.2865 -0.6878 30.7885 C.3 117 TYR889 0.0000 1101 HB2 -3.0338 -1.7084 30.5011 H 117 TYR889 0.0000 1102 HB3 -2.5022 -0.0105 30.4508 H 117 TYR889 0.0000 1103 CG -4.5812 -0.3024 30.1153 C.ar 117 TYR889 0.0000 1104 CD1 -5.7309 -1.0625 30.2931 C.ar 117 TYR889 0.0000 1105 HD1 -5.6961 -1.9431 30.9175 H 117 TYR889 0.0000 1106 CD2 -4.6574 0.8245 29.3061 C.ar 117 TYR889 0.0000 1107 HD2 -3.7760 1.4305 29.1567 H 117 TYR889 0.0000 1108 CE1 -6.9236 -0.7051 29.6789 C.ar 117 TYR889 0.0000 1109 HE1 -7.8122 -1.2997 29.8307 H 117 TYR889 0.0000 1110 CE2 -5.8420 1.1845 28.6880 C.ar 117 TYR889 0.0000 1111 HE2 -5.8842 2.0647 28.0636 H 117 TYR889 0.0000 1112 CZ -6.9668 0.4121 28.8751 C.ar 117 TYR889 0.0000 1113 OH -8.1483 0.7620 28.2669 O.3 117 TYR889 0.0000 1114 HH -8.1081 1.5562 27.7291 H 117 TYR889 0.0000 1115 N -1.6061 -0.3275 33.9761 N.am 118 GLY890 0.0000 BACKBONE 1116 H -2.1262 0.4889 34.2644 H 118 GLY890 0.0000 BACKBONE 1117 CA -0.3961 -0.6791 34.7064 C.3 118 GLY890 0.0000 BACKBONE 1118 HA2 -0.5085 -1.6970 35.0797 H 118 GLY890 0.0000 BACKBONE 1119 HA3 -0.2954 0.0072 35.5472 H 118 GLY890 0.0000 BACKBONE 1120 C 0.8757 -0.6144 33.8906 C.2 118 GLY890 0.0000 BACKBONE 1121 O 1.7686 -1.4485 34.0796 O.2 118 GLY890 0.0000 BACKBONE 1122 N 0.9781 0.3504 32.9798 N.am 119 GLU891 0.0000 BACKBONE 1123 H 0.2639 1.0623 32.9228 H 119 GLU891 0.0000 BACKBONE 1124 CA 2.1162 0.3898 32.0596 C.3 119 GLU891 0.0000 BACKBONE 1125 HA 2.5577 -0.6068 32.0594 H 119 GLU891 0.0000 BACKBONE 1126 C 3.1931 1.3924 32.5201 C.2 119 GLU891 0.0000 BACKBONE 1127 H 4.2225 1.2371 32.2325 H 119 GLU891 0.0000 BACKBONE 1128 O 2.8981 2.3634 33.2079 O.2 119 GLU891 0.0000 BACKBONE 1129 CB 1.6607 0.7373 30.6430 C.3 119 GLU891 0.0000 1130 HB2 2.5480 0.8882 30.0283 H 119 GLU891 0.0000 1131 HB3 1.0880 1.6637 30.6880 H 119 GLU891 0.0000 1132 CG 0.7863 -0.3350 29.9683 C.3 119 GLU891 0.0000 1133 HG2 0.4261 0.0633 29.0198 H 119 GLU891 0.0000 1134 HG3 -0.0620 -0.5453 30.6196 H 119 GLU891 0.0000 1135 CD 1.5177 -1.6488 29.6917 C.2 119 GLU891 0.0000 1136 OE1 0.8389 -2.6652 29.4053 O.co2 119 GLU891 -0.5000 1137 OE2 2.7685 -1.6705 29.7419 O.co2 119 GLU891 -0.5000 @BOND 1 1 2 1 2 1 3 1 3 4 5 1 4 4 6 1 5 7 8 1 6 7 9 1 7 10 11 1 8 10 12 1 9 13 14 1 10 13 15 1 11 16 17 1 12 16 18 1 13 19 20 1 14 19 21 1 15 22 23 1 16 22 24 1 17 25 26 1 18 25 27 1 19 28 29 1 20 28 30 1 21 31 32 1 22 31 33 1 23 34 35 1 24 34 36 1 25 37 38 1 26 37 39 1 27 40 41 1 28 40 42 1 29 43 44 1 30 43 45 1 31 46 47 1 32 46 48 1 33 49 50 1 34 49 51 1 35 52 53 1 36 52 54 1 37 55 56 1 38 55 57 1 39 58 59 1 40 58 60 1 41 61 62 1 42 61 63 1 43 64 65 1 44 64 66 1 45 67 68 1 46 67 69 1 47 70 71 1 48 70 72 1 49 73 74 1 50 73 75 1 51 76 77 1 52 76 78 1 53 79 80 1 54 79 81 1 55 82 83 1 56 82 84 1 57 85 86 1 58 85 87 1 59 88 89 1 60 88 90 1 61 91 92 1 62 91 93 1 63 94 95 1 64 94 96 1 65 97 98 1 66 97 99 1 67 100 101 1 68 100 102 1 69 103 104 1 70 103 105 1 71 106 107 1 72 106 108 1 73 109 110 1 74 109 111 1 75 112 113 1 76 112 114 1 77 115 116 1 78 115 117 1 79 118 119 1 80 118 120 1 81 121 122 1 82 121 123 1 83 124 125 1 84 124 126 1 85 127 128 1 86 127 129 1 87 130 131 1 88 130 132 1 89 133 134 1 90 133 135 1 91 136 137 1 92 136 138 1 93 139 140 1 94 139 141 1 95 142 143 1 96 142 144 1 97 145 146 1 98 145 147 1 99 148 149 1 100 148 150 1 101 151 152 1 102 151 153 1 103 154 155 1 104 154 156 1 105 157 158 1 106 157 159 1 107 160 161 1 108 160 162 1 109 163 164 1 BACKBONE 110 163 165 1 BACKBONE 111 163 166 1 BACKBONE 112 163 167 1 BACKBONE 113 167 168 1 BACKBONE 114 167 169 1 BACKBONE 115 167 171 1 116 169 170 2 BACKBONE 117 169 179 am BACKBONE|INTERRES 118 171 172 1 119 171 173 1 120 171 175 1 121 173 174 1 122 175 176 1 123 175 177 1 124 175 178 1 125 179 180 1 BACKBONE 126 179 181 1 BACKBONE 127 181 182 1 BACKBONE 128 181 183 1 BACKBONE 129 181 185 1 130 183 184 2 BACKBONE 131 183 189 am BACKBONE|INTERRES 132 185 186 1 133 185 187 1 134 185 188 1 135 189 190 1 BACKBONE 136 189 191 1 BACKBONE 137 191 192 1 BACKBONE 138 191 193 1 BACKBONE 139 191 195 1 140 193 194 2 BACKBONE 141 193 199 am BACKBONE|INTERRES 142 195 196 1 143 195 197 1 144 195 198 1 145 199 200 1 BACKBONE 146 199 201 1 BACKBONE 147 201 202 1 BACKBONE 148 201 203 1 BACKBONE 149 201 205 1 150 203 204 2 BACKBONE 151 203 216 am BACKBONE|INTERRES 152 205 206 1 153 205 207 1 154 205 208 1 155 208 209 1 156 208 210 1 157 208 211 1 158 211 212 2 159 211 213 am 160 213 214 1 161 213 215 1 162 216 217 1 BACKBONE 163 216 218 1 BACKBONE 164 218 219 1 BACKBONE 165 218 220 1 BACKBONE 166 218 222 1 167 220 221 2 BACKBONE 168 220 232 am BACKBONE|INTERRES 169 222 223 1 170 222 224 1 171 222 228 1 172 224 225 1 173 224 226 1 174 224 227 1 175 228 229 1 176 228 230 1 177 228 231 1 178 232 233 1 BACKBONE 179 232 234 1 BACKBONE 180 234 235 1 BACKBONE 181 234 236 1 BACKBONE 182 234 238 1 183 236 237 2 BACKBONE 184 236 251 am BACKBONE|INTERRES 185 238 239 1 186 238 240 1 187 238 243 1 188 240 241 1 189 240 242 1 190 240 247 1 191 243 244 1 192 243 245 1 193 243 246 1 194 247 248 1 195 247 249 1 196 247 250 1 197 251 252 1 BACKBONE 198 251 253 1 BACKBONE 199 253 254 1 BACKBONE 200 253 255 1 BACKBONE 201 253 257 1 202 255 256 2 BACKBONE 203 255 261 am BACKBONE|INTERRES 204 257 258 1 205 257 259 1 206 257 260 1 207 261 262 1 BACKBONE 208 261 263 1 BACKBONE 209 263 264 1 BACKBONE 210 263 265 1 BACKBONE 211 263 267 1 212 265 266 2 BACKBONE 213 265 272 am BACKBONE|INTERRES 214 267 268 1 215 267 269 1 216 267 270 1 217 270 271 1 218 272 273 1 BACKBONE 219 272 274 1 BACKBONE 220 274 275 1 BACKBONE 221 274 276 1 BACKBONE 222 274 278 1 223 276 277 2 BACKBONE 224 276 292 am BACKBONE|INTERRES 225 278 279 1 226 278 280 1 227 278 281 1 228 281 282 ar 229 281 284 ar 230 282 283 1 231 282 286 ar 232 284 285 1 233 284 288 ar 234 286 287 1 235 286 290 ar 236 288 289 1 237 288 290 ar 238 290 291 1 239 292 293 1 BACKBONE 240 292 294 1 BACKBONE 241 294 295 1 BACKBONE 242 294 296 1 BACKBONE 243 294 298 1 244 296 297 2 BACKBONE 245 296 316 am BACKBONE|INTERRES 246 298 299 1 247 298 300 1 248 298 301 1 249 301 302 1 250 301 303 1 251 301 304 1 252 304 305 1 253 304 306 1 254 304 307 1 255 307 308 1 256 307 309 ar 257 309 310 ar 258 309 313 ar 259 310 311 1 260 310 312 1 261 313 314 1 262 313 315 1 263 316 317 1 BACKBONE 264 316 318 1 BACKBONE 265 318 319 1 BACKBONE 266 318 320 1 BACKBONE 267 318 322 1 268 320 321 2 BACKBONE 269 320 335 am BACKBONE|INTERRES 270 322 323 1 271 322 324 1 272 322 327 1 273 324 325 1 274 324 326 1 275 324 331 1 276 327 328 1 277 327 329 1 278 327 330 1 279 331 332 1 280 331 333 1 281 331 334 1 282 335 336 1 BACKBONE 283 335 337 1 BACKBONE 284 337 338 1 BACKBONE 285 337 339 1 BACKBONE 286 337 341 1 287 339 340 2 BACKBONE 288 339 354 am BACKBONE|INTERRES 289 341 342 1 290 341 343 1 291 341 344 1 292 344 345 1 293 344 346 1 294 344 350 1 295 346 347 1 296 346 348 1 297 346 349 1 298 350 351 1 299 350 352 1 300 350 353 1 301 354 355 1 BACKBONE 302 354 356 1 BACKBONE 303 356 357 1 BACKBONE 304 356 358 1 BACKBONE 305 356 360 1 306 358 359 2 BACKBONE 307 358 364 am BACKBONE|INTERRES 308 360 361 1 309 360 362 1 310 360 363 1 311 364 365 1 BACKBONE 312 364 366 1 BACKBONE 313 366 367 1 BACKBONE 314 366 368 1 BACKBONE 315 366 370 1 316 368 369 2 BACKBONE 317 368 375 am BACKBONE|INTERRES 318 370 371 1 319 370 372 1 320 370 373 1 321 373 374 1 322 375 376 1 BACKBONE 323 375 377 1 BACKBONE 324 377 378 1 BACKBONE 325 377 379 1 BACKBONE 326 377 381 1 327 379 380 2 BACKBONE 328 379 387 am BACKBONE|INTERRES 329 381 382 1 330 381 383 1 331 381 384 1 332 384 385 ar 333 384 386 ar 334 387 388 1 BACKBONE 335 387 389 1 BACKBONE 336 389 390 1 BACKBONE 337 389 391 1 BACKBONE 338 389 393 1 339 391 392 2 BACKBONE 340 391 409 am BACKBONE|INTERRES 341 393 394 1 342 393 395 1 343 393 396 1 344 396 397 1 345 396 398 1 346 396 399 1 347 399 400 1 348 399 401 1 349 399 402 1 350 402 403 1 351 402 404 1 352 402 405 1 353 405 406 1 354 405 407 1 355 405 408 1 356 409 410 1 BACKBONE 357 409 420 1 358 410 411 1 BACKBONE 359 410 412 1 BACKBONE 360 410 414 1 361 412 413 2 BACKBONE 362 412 423 am BACKBONE|INTERRES 363 414 415 1 364 414 416 1 365 414 417 1 366 417 418 1 367 417 419 1 368 417 420 1 369 420 421 1 370 420 422 1 371 423 424 1 BACKBONE 372 423 425 1 BACKBONE 373 425 426 1 BACKBONE 374 425 427 1 BACKBONE 375 425 429 1 376 427 428 2 BACKBONE 377 427 444 am BACKBONE|INTERRES 378 429 430 1 379 429 431 1 380 429 432 1 381 432 433 ar 382 432 435 ar 383 433 434 1 384 433 437 ar 385 435 436 1 386 435 439 ar 387 437 438 1 388 437 441 ar 389 439 440 1 390 439 441 ar 391 441 442 1 392 442 443 1 393 444 445 1 BACKBONE 394 444 446 1 BACKBONE 395 446 447 1 BACKBONE 396 446 448 1 BACKBONE 397 446 450 1 398 448 449 2 BACKBONE 399 448 463 am BACKBONE|INTERRES 400 450 451 1 401 450 452 1 402 450 455 1 403 452 453 1 404 452 454 1 405 452 459 1 406 455 456 1 407 455 457 1 408 455 458 1 409 459 460 1 410 459 461 1 411 459 462 1 412 463 464 1 BACKBONE 413 463 465 1 BACKBONE 414 465 466 1 BACKBONE 415 465 467 1 BACKBONE 416 465 469 1 417 467 468 2 BACKBONE 418 467 482 am BACKBONE|INTERRES 419 469 470 1 420 469 471 1 421 469 472 1 422 472 473 1 423 472 474 1 424 472 478 1 425 474 475 1 426 474 476 1 427 474 477 1 428 478 479 1 429 478 480 1 430 478 481 1 431 482 483 1 BACKBONE 432 482 484 1 BACKBONE 433 484 485 1 BACKBONE 434 484 486 1 BACKBONE 435 484 488 1 436 486 487 2 BACKBONE 437 486 492 am BACKBONE|INTERRES 438 488 489 1 439 488 490 1 440 488 491 1 441 492 493 1 BACKBONE 442 492 494 1 BACKBONE 443 494 495 1 BACKBONE 444 494 496 1 BACKBONE 445 494 498 1 446 496 497 2 BACKBONE 447 496 507 am BACKBONE|INTERRES 448 498 499 1 449 498 500 1 450 498 501 1 451 501 502 1 452 501 503 1 453 501 504 1 454 504 505 ar 455 504 506 ar 456 507 508 1 BACKBONE 457 507 509 1 BACKBONE 458 509 510 1 BACKBONE 459 509 511 1 BACKBONE 460 509 513 1 461 511 512 2 BACKBONE 462 511 522 am BACKBONE|INTERRES 463 513 514 1 464 513 515 1 465 513 516 1 466 516 517 1 467 516 518 1 468 516 519 1 469 519 520 ar 470 519 521 ar 471 522 523 1 BACKBONE 472 522 524 1 BACKBONE 473 524 525 1 BACKBONE 474 524 526 1 BACKBONE 475 524 528 1 476 526 527 2 BACKBONE 477 526 541 am BACKBONE|INTERRES 478 528 529 1 479 528 530 1 480 528 531 1 481 531 532 1 482 531 533 1 483 531 537 1 484 533 534 1 485 533 535 1 486 533 536 1 487 537 538 1 488 537 539 1 489 537 540 1 490 541 542 1 BACKBONE 491 541 543 1 BACKBONE 492 543 544 1 BACKBONE 493 543 545 1 BACKBONE 494 543 547 1 495 545 546 2 BACKBONE 496 545 565 am BACKBONE|INTERRES 497 547 548 1 498 547 549 1 499 547 550 1 500 550 551 1 501 550 552 1 502 550 553 1 503 553 554 1 504 553 555 1 505 553 556 1 506 556 557 1 507 556 558 ar 508 558 559 ar 509 558 562 ar 510 559 560 1 511 559 561 1 512 562 563 1 513 562 564 1 514 565 566 1 BACKBONE 515 565 567 1 BACKBONE 516 567 568 1 BACKBONE 517 567 569 1 BACKBONE 518 567 571 1 519 569 570 2 BACKBONE 520 569 589 am BACKBONE|INTERRES 521 571 572 1 522 571 573 1 523 571 574 1 524 574 575 1 525 574 576 1 526 574 577 1 527 577 578 1 528 577 579 1 529 577 580 1 530 580 581 1 531 580 582 ar 532 582 583 ar 533 582 586 ar 534 583 584 1 535 583 585 1 536 586 587 1 537 586 588 1 538 589 590 1 BACKBONE 539 589 591 1 BACKBONE 540 591 592 1 BACKBONE 541 591 593 1 BACKBONE 542 591 595 1 543 593 594 2 BACKBONE 544 593 604 am BACKBONE|INTERRES 545 595 596 1 546 595 597 1 547 595 598 1 548 598 599 1 549 598 600 1 550 598 601 1 551 601 602 ar 552 601 603 ar 553 604 605 1 BACKBONE 554 604 606 1 BACKBONE 555 606 607 1 BACKBONE 556 606 608 1 BACKBONE 557 606 610 1 558 608 609 2 BACKBONE 559 608 623 am BACKBONE|INTERRES 560 610 611 1 561 610 612 1 562 610 613 1 563 613 614 1 564 613 615 1 565 613 619 1 566 615 616 1 567 615 617 1 568 615 618 1 569 619 620 1 570 619 621 1 571 619 622 1 572 623 624 1 BACKBONE 573 623 634 1 574 624 625 1 BACKBONE 575 624 626 1 BACKBONE 576 624 628 1 577 626 627 2 BACKBONE 578 626 637 am BACKBONE|INTERRES 579 628 629 1 580 628 630 1 581 628 631 1 582 631 632 1 583 631 633 1 584 631 634 1 585 634 635 1 586 634 636 1 587 637 638 1 BACKBONE 588 637 648 1 589 638 639 1 BACKBONE 590 638 640 1 BACKBONE 591 638 642 1 592 640 641 2 BACKBONE 593 640 651 am BACKBONE|INTERRES 594 642 643 1 595 642 644 1 596 642 645 1 597 645 646 1 598 645 647 1 599 645 648 1 600 648 649 1 601 648 650 1 602 651 652 1 BACKBONE 603 651 653 1 BACKBONE 604 653 654 1 BACKBONE 605 653 655 1 BACKBONE 606 653 657 1 607 655 656 2 BACKBONE 608 655 663 am BACKBONE|INTERRES 609 657 658 1 610 657 659 1 611 657 660 1 612 660 661 ar 613 660 662 ar 614 663 664 1 BACKBONE 615 663 665 1 BACKBONE 616 665 666 1 BACKBONE 617 665 667 1 BACKBONE 618 665 669 1 619 667 668 2 BACKBONE 620 667 680 am BACKBONE|INTERRES 621 669 670 1 622 669 671 1 623 669 672 1 624 672 673 1 625 672 674 1 626 672 675 1 627 675 676 2 628 675 677 am 629 677 678 1 630 677 679 1 631 680 681 1 BACKBONE 632 680 682 1 BACKBONE 633 682 683 1 BACKBONE 634 682 684 1 BACKBONE 635 682 686 1 636 684 685 2 BACKBONE 637 684 690 am BACKBONE|INTERRES 638 686 687 1 639 686 688 1 640 686 689 1 641 690 691 1 BACKBONE 642 690 692 1 BACKBONE 643 692 693 1 BACKBONE 644 692 694 1 BACKBONE 645 692 696 1 646 694 695 2 BACKBONE 647 694 707 am BACKBONE|INTERRES 648 696 697 1 649 696 698 1 650 696 699 1 651 699 700 1 652 699 701 1 653 699 702 1 654 702 703 2 655 702 704 am 656 704 705 1 657 704 706 1 658 707 708 1 BACKBONE 659 707 709 1 BACKBONE 660 709 710 1 BACKBONE 661 709 711 1 BACKBONE 662 709 713 1 663 711 712 2 BACKBONE 664 711 728 am BACKBONE|INTERRES 665 713 714 1 666 713 715 1 667 713 716 1 668 716 717 ar 669 716 719 ar 670 717 718 1 671 717 721 ar 672 719 720 1 673 719 723 ar 674 721 722 1 675 721 725 ar 676 723 724 1 677 723 725 ar 678 725 726 1 679 726 727 1 680 728 729 1 BACKBONE 681 728 730 1 BACKBONE 682 730 731 1 BACKBONE 683 730 732 1 BACKBONE 684 730 734 1 685 732 733 2 BACKBONE 686 732 739 am BACKBONE|INTERRES 687 734 735 1 688 734 736 1 689 734 737 1 690 737 738 1 691 739 740 1 BACKBONE 692 739 741 1 BACKBONE 693 741 742 1 BACKBONE 694 741 743 1 BACKBONE 695 741 745 1 696 743 744 2 BACKBONE 697 743 758 am BACKBONE|INTERRES 698 745 746 1 699 745 747 1 700 745 750 1 701 747 748 1 702 747 749 1 703 747 754 1 704 750 751 1 705 750 752 1 706 750 753 1 707 754 755 1 708 754 756 1 709 754 757 1 710 758 759 1 BACKBONE 711 758 760 1 BACKBONE 712 760 761 1 BACKBONE 713 760 762 1 BACKBONE 714 760 764 1 715 762 763 2 BACKBONE 716 762 768 am BACKBONE|INTERRES 717 764 765 1 718 764 766 1 719 764 767 1 720 768 769 1 BACKBONE 721 768 770 1 BACKBONE 722 770 771 1 BACKBONE 723 770 772 1 BACKBONE 724 770 774 1 725 772 773 2 BACKBONE 726 772 792 am BACKBONE|INTERRES 727 774 775 1 728 774 776 1 729 774 777 1 730 777 778 1 731 777 779 1 732 777 780 1 733 780 781 1 734 780 782 1 735 780 783 1 736 783 784 1 737 783 785 ar 738 785 786 ar 739 785 789 ar 740 786 787 1 741 786 788 1 742 789 790 1 743 789 791 1 744 792 793 1 BACKBONE 745 792 794 1 BACKBONE 746 794 795 1 BACKBONE 747 794 796 1 BACKBONE 748 794 798 1 749 796 797 2 BACKBONE 750 796 809 am BACKBONE|INTERRES 751 798 799 1 752 798 800 1 753 798 801 1 754 801 802 1 755 801 803 1 756 801 804 1 757 804 805 1 758 805 806 1 759 805 807 1 760 805 808 1 761 809 810 1 BACKBONE 762 809 820 1 763 810 811 1 BACKBONE 764 810 812 1 BACKBONE 765 810 814 1 766 812 813 2 BACKBONE 767 812 823 am BACKBONE|INTERRES 768 814 815 1 769 814 816 1 770 814 817 1 771 817 818 1 772 817 819 1 773 817 820 1 774 820 821 1 775 820 822 1 776 823 824 1 BACKBONE 777 823 825 1 BACKBONE 778 825 826 1 BACKBONE 779 825 827 1 BACKBONE 780 825 829 1 781 827 828 2 BACKBONE 782 827 833 am BACKBONE|INTERRES 783 829 830 1 784 829 831 1 785 829 832 1 786 833 834 1 BACKBONE 787 833 835 1 BACKBONE 788 835 836 1 BACKBONE 789 835 837 1 BACKBONE 790 835 839 1 791 837 838 2 BACKBONE 792 837 854 am BACKBONE|INTERRES 793 839 840 1 794 839 841 1 795 839 842 1 796 842 843 ar 797 842 845 ar 798 843 844 1 799 843 847 ar 800 845 846 1 801 845 849 ar 802 847 848 1 803 847 851 ar 804 849 850 1 805 849 851 ar 806 851 852 1 807 852 853 1 808 854 855 1 BACKBONE 809 854 856 1 BACKBONE 810 856 857 1 BACKBONE 811 856 858 1 BACKBONE 812 856 860 1 813 858 859 2 BACKBONE 814 858 865 am BACKBONE|INTERRES 815 860 861 1 816 860 862 1 817 860 863 1 818 863 864 1 819 865 866 1 BACKBONE 820 865 867 1 BACKBONE 821 867 868 1 BACKBONE 822 867 869 1 BACKBONE 823 867 870 1 BACKBONE 824 870 871 2 BACKBONE 825 870 872 am BACKBONE|INTERRES 826 872 873 1 BACKBONE 827 872 883 1 828 873 874 1 BACKBONE 829 873 875 1 BACKBONE 830 873 877 1 831 875 876 2 BACKBONE 832 875 886 am BACKBONE|INTERRES 833 877 878 1 834 877 879 1 835 877 880 1 836 880 881 1 837 880 882 1 838 880 883 1 839 883 884 1 840 883 885 1 841 886 887 1 BACKBONE 842 886 888 1 BACKBONE 843 888 889 1 BACKBONE 844 888 890 1 BACKBONE 845 888 891 1 BACKBONE 846 891 892 2 BACKBONE 847 891 893 am BACKBONE|INTERRES 848 893 894 1 BACKBONE 849 893 895 1 BACKBONE 850 895 896 1 BACKBONE 851 895 897 1 BACKBONE 852 895 899 1 853 897 898 2 BACKBONE 854 897 904 am BACKBONE|INTERRES 855 899 900 1 856 899 901 1 857 899 902 1 858 902 903 1 859 904 905 1 BACKBONE 860 904 906 1 BACKBONE 861 906 907 1 BACKBONE 862 906 908 1 BACKBONE 863 906 910 1 864 908 909 2 BACKBONE 865 908 920 am BACKBONE|INTERRES 866 910 911 1 867 910 912 1 868 910 916 1 869 912 913 1 870 912 914 1 871 912 915 1 872 916 917 1 873 916 918 1 874 916 919 1 875 920 921 1 BACKBONE 876 920 931 1 877 921 922 1 BACKBONE 878 921 923 1 BACKBONE 879 921 925 1 880 923 924 2 BACKBONE 881 923 934 am BACKBONE|INTERRES 882 925 926 1 883 925 927 1 884 925 928 1 885 928 929 1 886 928 930 1 887 928 931 1 888 931 932 1 889 931 933 1 890 934 935 1 BACKBONE 891 934 936 1 BACKBONE 892 936 937 1 BACKBONE 893 936 938 1 BACKBONE 894 936 939 1 BACKBONE 895 939 940 2 BACKBONE 896 939 941 am BACKBONE|INTERRES 897 941 942 1 BACKBONE 898 941 943 1 BACKBONE 899 943 944 1 BACKBONE 900 943 945 1 BACKBONE 901 943 947 1 902 945 946 2 BACKBONE 903 945 951 am BACKBONE|INTERRES 904 947 948 1 905 947 949 1 906 947 950 1 907 951 952 1 BACKBONE 908 951 953 1 BACKBONE 909 953 954 1 BACKBONE 910 953 955 1 BACKBONE 911 953 957 1 912 955 956 2 BACKBONE 913 955 970 am BACKBONE|INTERRES 914 957 958 1 915 957 959 1 916 957 960 1 917 960 961 1 918 960 962 1 919 960 966 1 920 962 963 1 921 962 964 1 922 962 965 1 923 966 967 1 924 966 968 1 925 966 969 1 926 970 971 1 BACKBONE 927 970 972 1 BACKBONE 928 972 973 1 BACKBONE 929 972 974 1 BACKBONE 930 972 976 1 931 974 975 2 BACKBONE 932 974 982 am BACKBONE|INTERRES 933 976 977 1 934 976 978 1 935 976 979 1 936 979 980 ar 937 979 981 ar 938 982 983 1 BACKBONE 939 982 984 1 BACKBONE 940 984 985 1 BACKBONE 941 984 986 1 BACKBONE 942 984 988 1 943 986 987 2 BACKBONE 944 986 1003 am BACKBONE|INTERRES 945 988 989 1 946 988 990 1 947 988 991 1 948 991 992 ar 949 991 994 ar 950 992 993 1 951 992 996 ar 952 994 995 1 953 994 998 ar 954 996 997 1 955 996 1000 ar 956 998 999 1 957 998 1000 ar 958 1000 1001 1 959 1001 1002 1 960 1003 1004 1 BACKBONE 961 1003 1005 1 BACKBONE 962 1005 1006 1 BACKBONE 963 1005 1007 1 BACKBONE 964 1005 1009 1 965 1007 1008 2 BACKBONE 966 1007 1013 am BACKBONE|INTERRES 967 1009 1010 1 968 1009 1011 1 969 1009 1012 1 970 1013 1014 1 BACKBONE 971 1013 1015 1 BACKBONE 972 1015 1016 1 BACKBONE 973 1015 1017 1 BACKBONE 974 1015 1019 1 975 1017 1018 2 BACKBONE 976 1017 1023 am BACKBONE|INTERRES 977 1019 1020 1 978 1019 1021 1 979 1019 1022 1 980 1023 1024 1 BACKBONE 981 1023 1025 1 BACKBONE 982 1025 1026 1 BACKBONE 983 1025 1027 1 BACKBONE 984 1025 1029 1 985 1027 1028 2 BACKBONE 986 1027 1043 am BACKBONE|INTERRES 987 1029 1030 1 988 1029 1031 1 989 1029 1032 1 990 1032 1033 ar 991 1032 1035 ar 992 1033 1034 1 993 1033 1037 ar 994 1035 1036 1 995 1035 1039 ar 996 1037 1038 1 997 1037 1041 ar 998 1039 1040 1 999 1039 1041 ar 1000 1041 1042 1 1001 1043 1044 1 BACKBONE 1002 1043 1045 1 BACKBONE 1003 1045 1046 1 BACKBONE 1004 1045 1047 1 BACKBONE 1005 1045 1049 1 1006 1047 1048 2 BACKBONE 1007 1047 1054 am BACKBONE|INTERRES 1008 1049 1050 1 1009 1049 1051 1 1010 1049 1052 1 1011 1052 1053 1 1012 1054 1055 1 BACKBONE 1013 1054 1056 1 BACKBONE 1014 1056 1057 1 BACKBONE 1015 1056 1058 1 BACKBONE 1016 1056 1060 1 1017 1058 1059 2 BACKBONE 1018 1058 1065 am BACKBONE|INTERRES 1019 1060 1061 1 1020 1060 1062 1 1021 1060 1063 1 1022 1063 1064 1 1023 1065 1066 1 BACKBONE 1024 1065 1067 1 BACKBONE 1025 1067 1068 1 BACKBONE 1026 1067 1069 1 BACKBONE 1027 1067 1071 1 1028 1069 1070 2 BACKBONE 1029 1069 1075 am BACKBONE|INTERRES 1030 1071 1072 1 1031 1071 1073 1 1032 1071 1074 1 1033 1075 1076 1 BACKBONE 1034 1075 1077 1 BACKBONE 1035 1077 1078 1 BACKBONE 1036 1077 1079 1 BACKBONE 1037 1077 1081 1 1038 1079 1080 2 BACKBONE 1039 1079 1094 am BACKBONE|INTERRES 1040 1081 1082 1 1041 1081 1083 1 1042 1081 1084 1 1043 1084 1085 1 1044 1084 1086 1 1045 1084 1090 1 1046 1086 1087 1 1047 1086 1088 1 1048 1086 1089 1 1049 1090 1091 1 1050 1090 1092 1 1051 1090 1093 1 1052 1094 1095 1 BACKBONE 1053 1094 1096 1 BACKBONE 1054 1096 1097 1 BACKBONE 1055 1096 1098 1 BACKBONE 1056 1096 1100 1 1057 1098 1099 2 BACKBONE 1058 1098 1115 am BACKBONE|INTERRES 1059 1100 1101 1 1060 1100 1102 1 1061 1100 1103 1 1062 1103 1104 ar 1063 1103 1106 ar 1064 1104 1105 1 1065 1104 1108 ar 1066 1106 1107 1 1067 1106 1110 ar 1068 1108 1109 1 1069 1108 1112 ar 1070 1110 1111 1 1071 1110 1112 ar 1072 1112 1113 1 1073 1113 1114 1 1074 1115 1116 1 BACKBONE 1075 1115 1117 1 BACKBONE 1076 1117 1118 1 BACKBONE 1077 1117 1119 1 BACKBONE 1078 1117 1120 1 BACKBONE 1079 1120 1121 2 BACKBONE 1080 1120 1122 am BACKBONE|INTERRES 1081 1122 1123 1 BACKBONE 1082 1122 1124 1 BACKBONE 1083 1124 1125 1 BACKBONE 1084 1124 1126 1 BACKBONE 1085 1124 1129 1 1086 1126 1127 1 BACKBONE 1087 1126 1128 2 BACKBONE 1088 1129 1130 1 1089 1129 1131 1 1090 1129 1132 1 1091 1132 1133 1 1092 1132 1134 1 1093 1132 1135 1 1094 1135 1136 ar 1095 1135 1137 ar @SUBSTRUCTURE 1 HOH901 1 RESIDUE 4 A1 HOH 0 2 HOH902 4 RESIDUE 4 A1 HOH 0 3 HOH903 7 RESIDUE 4 A1 HOH 0 4 HOH904 10 RESIDUE 4 A1 HOH 0 5 HOH905 13 RESIDUE 4 A1 HOH 0 6 HOH906 16 RESIDUE 4 A1 HOH 0 7 HOH907 19 RESIDUE 4 A1 HOH 0 8 HOH908 22 RESIDUE 4 A1 HOH 0 9 HOH909 25 RESIDUE 4 A1 HOH 0 10 HOH910 28 RESIDUE 4 A1 HOH 0 11 HOH911 31 RESIDUE 4 A1 HOH 0 12 HOH912 34 RESIDUE 4 A1 HOH 0 13 HOH913 37 RESIDUE 4 A1 HOH 0 14 HOH914 40 RESIDUE 4 A1 HOH 0 15 HOH915 43 RESIDUE 4 A1 HOH 0 16 HOH916 46 RESIDUE 4 A1 HOH 0 17 HOH917 49 RESIDUE 4 A1 HOH 0 18 HOH918 52 RESIDUE 4 A1 HOH 0 19 HOH919 55 RESIDUE 4 A1 HOH 0 20 HOH920 58 RESIDUE 4 A1 HOH 0 21 HOH921 61 RESIDUE 4 A1 HOH 0 22 HOH922 64 RESIDUE 4 A1 HOH 0 23 HOH923 67 RESIDUE 4 A1 HOH 0 24 HOH924 70 RESIDUE 4 A1 HOH 0 25 HOH925 73 RESIDUE 4 A1 HOH 0 26 HOH926 76 RESIDUE 4 A1 HOH 0 27 HOH927 79 RESIDUE 4 A1 HOH 0 28 HOH928 82 RESIDUE 4 A1 HOH 0 29 HOH929 85 RESIDUE 4 A1 HOH 0 30 HOH930 88 RESIDUE 4 A1 HOH 0 31 HOH931 91 RESIDUE 4 A1 HOH 0 32 HOH932 94 RESIDUE 4 A1 HOH 0 33 HOH933 97 RESIDUE 4 A1 HOH 0 34 HOH934 100 RESIDUE 4 A1 HOH 0 35 HOH935 103 RESIDUE 4 A1 HOH 0 36 HOH936 106 RESIDUE 4 A1 HOH 0 37 HOH937 109 RESIDUE 4 A1 HOH 0 38 HOH938 112 RESIDUE 4 A1 HOH 0 39 HOH939 115 RESIDUE 4 A1 HOH 0 40 HOH940 118 RESIDUE 4 A1 HOH 0 41 HOH941 121 RESIDUE 4 A1 HOH 0 42 HOH942 124 RESIDUE 4 A1 HOH 0 43 HOH943 127 RESIDUE 4 A1 HOH 0 44 HOH944 130 RESIDUE 4 A1 HOH 0 45 HOH945 133 RESIDUE 4 A1 HOH 0 46 HOH946 136 RESIDUE 4 A1 HOH 0 47 HOH947 139 RESIDUE 4 A1 HOH 0 48 HOH948 142 RESIDUE 4 A1 HOH 0 49 HOH949 145 RESIDUE 4 A1 HOH 0 50 HOH950 148 RESIDUE 4 A1 HOH 0 51 HOH951 151 RESIDUE 4 A1 HOH 0 52 HOH952 154 RESIDUE 4 A1 HOH 0 53 HOH953 157 RESIDUE 4 A1 HOH 0 54 HOH954 160 RESIDUE 4 A1 HOH 0 55 THR827 167 RESIDUE 4 A2 THR 1 56 ALA828 181 RESIDUE 4 A2 ALA 2 57 GLU829 191 RESIDUE 4 A2 GLU 2 58 GLN830 201 RESIDUE 4 A2 GLN 2 59 VAL831 218 RESIDUE 4 A2 VAL 2 60 ILE832 234 RESIDUE 4 A2 ILE 2 61 ALA833 253 RESIDUE 4 A2 ALA 2 62 SER834 263 RESIDUE 4 A2 SER 2 63 PHE835 274 RESIDUE 4 A2 PHE 2 64 ARG836 294 RESIDUE 4 A2 ARG 2 65 ILE837 318 RESIDUE 4 A2 ILE 2 66 LEU838 337 RESIDUE 4 A2 LEU 2 67 ALA839 356 RESIDUE 4 A2 ALA 2 68 SER840 366 RESIDUE 4 A2 SER 2 69 ASP841 377 RESIDUE 4 A2 ASP 2 70 LYS842 389 RESIDUE 4 A2 LYS 2 71 PRO843 410 RESIDUE 4 A2 PRO 2 72 TYR844 425 RESIDUE 4 A2 TYR 2 73 ILE845 446 RESIDUE 4 A2 ILE 2 74 LEU846 465 RESIDUE 4 A2 LEU 2 75 ALA847 484 RESIDUE 4 A2 ALA 2 76 GLU848 494 RESIDUE 4 A2 GLU 2 77 GLU849 509 RESIDUE 4 A2 GLU 2 78 LEU850 524 RESIDUE 4 A2 LEU 2 79 ARG851 543 RESIDUE 4 A2 ARG 2 80 ARG852 567 RESIDUE 4 A2 ARG 2 81 GLU853 591 RESIDUE 4 A2 GLU 2 82 LEU854 606 RESIDUE 4 A2 LEU 2 83 PRO855 624 RESIDUE 4 A2 PRO 2 84 PRO856 638 RESIDUE 4 A2 PRO 2 85 ASP857 653 RESIDUE 4 A2 ASP 2 86 GLN858 665 RESIDUE 4 A2 GLN 2 87 ALA859 682 RESIDUE 4 A2 ALA 2 88 GLN860 692 RESIDUE 4 A2 GLN 2 89 TYR861 709 RESIDUE 4 A2 TYR 2 90 CYS862 730 RESIDUE 4 A2 CYS 2 91 ILE863 741 RESIDUE 4 A2 ILE 2 92 LYS864 760 RESIDUE 4 A2 LYS 2 93 ARG865 770 RESIDUE 4 A2 ARG 2 94 MET866 794 RESIDUE 4 A2 MET 2 95 PRO867 810 RESIDUE 4 A2 PRO 2 96 ALA868 825 RESIDUE 4 A2 ALA 2 97 TYR869 835 RESIDUE 4 A2 TYR 2 98 SER870 856 RESIDUE 4 A2 SER 2 99 GLY871 867 RESIDUE 4 A2 GLY 2 100 PRO872 873 RESIDUE 4 A2 PRO 2 101 GLY873 888 RESIDUE 4 A2 GLY 2 102 SER874 895 RESIDUE 4 A2 SER 2 103 VAL875 906 RESIDUE 4 A2 VAL 2 104 PRO876 921 RESIDUE 4 A2 PRO 2 105 GLY877 936 RESIDUE 4 A2 GLY 2 106 ALA878 943 RESIDUE 4 A2 ALA 2 107 LEU879 953 RESIDUE 4 A2 LEU 2 108 ASP880 972 RESIDUE 4 A2 ASP 2 109 TYR881 984 RESIDUE 4 A2 TYR 2 110 ALA882 1005 RESIDUE 4 A2 ALA 2 111 ALA883 1015 RESIDUE 4 A2 ALA 2 112 PHE884 1025 RESIDUE 4 A2 PHE 2 113 SER885 1045 RESIDUE 4 A2 SER 2 114 SER886 1056 RESIDUE 4 A2 SER 2 115 ALA887 1067 RESIDUE 4 A2 ALA 2 116 LEU888 1077 RESIDUE 4 A2 LEU 2 117 TYR889 1096 RESIDUE 4 A2 TYR 2 118 GLY890 1117 RESIDUE 4 A2 GLY 2 119 GLU891 1124 RESIDUE 4 A2 GLU 1 # MOE 2014.09 (io_trps.svl 2012.10)