USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 923 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 83 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.1) USER MOD Set 1.2: A 87 LYS NZ :NH3+ 153:sc= -0.821 (180deg=-2.02) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -178:sc= 0 (180deg=-0.0103) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot -141:sc= -0.46 USER MOD Single : A 25 ASN : amide:sc= -0.226 K(o=-0.23,f=-1.7!) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot -27:sc= 0.292 USER MOD Single : A 29 ASN : amide:sc= -0.489 K(o=-0.49,f=-3.8!) USER MOD Single : A 33 GLN : amide:sc= -0.206 X(o=-0.21,f=-0.49) USER MOD Single : A 34 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 35 THR OG1 : rot -24:sc= 0.548 USER MOD Single : A 36 GLN : amide:sc= -0.184 X(o=-0.18,f=-0.49) USER MOD Single : A 38 GLN : amide:sc= -0.0107 K(o=-0.011,f=-1.6!) USER MOD Single : A 46 MET CE :methyl -159:sc= -0.0372 (180deg=-0.462) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 LYS NZ :NH3+ 134:sc= -0.0905 (180deg=-0.734) USER MOD Single : A 58 GLN : amide:sc= -0.137 X(o=-0.14,f=-0.44) USER MOD Single : A 59 LYS NZ :NH3+ 161:sc= -0.0414 (180deg=-0.511) USER MOD Single : A 61 SER OG : rot 180:sc= -0.0143 USER MOD Single : A 71 GLN : amide:sc= -0.0227 K(o=-0.023,f=-1.7!) USER MOD Single : A 75 SER OG : rot -24:sc= 0.381 USER MOD Single : A 76 GLN : amide:sc= -0.0141 K(o=-0.014,f=-1.5!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.00328 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -1.3 K(o=-1.3,f=0) USER MOD Single : A 94 LYS NZ :NH3+ -137:sc= 0.646 (180deg=-0.751) USER MOD Single : A 95 MET CE :methyl -156:sc= -0.0893 (180deg=-0.711) USER MOD Single : A 96 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 103 CYS SG : rot 82:sc= 0.0353 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot -23:sc= 0.46 USER MOD Single : A 116 THR OG1 : rot -67:sc= 1.16 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 26.991-121.880 17.621 1.00 0.00 N ATOM 2 CA MET A 1 25.762-122.534 17.088 1.00 0.00 C ATOM 3 C MET A 1 25.646-122.249 15.594 1.00 0.00 C ATOM 4 O MET A 1 25.437-123.161 14.794 1.00 0.00 O ATOM 5 CB MET A 1 24.537-121.984 17.822 1.00 0.00 C ATOM 6 CG MET A 1 23.282-122.710 17.335 1.00 0.00 C ATOM 7 SD MET A 1 21.843-122.108 18.254 1.00 0.00 S ATOM 8 CE MET A 1 21.875-123.351 19.570 1.00 0.00 C ATOM 0 H1 MET A 1 27.091-122.101 18.632 1.00 0.00 H new ATOM 0 H2 MET A 1 27.823-122.232 17.106 1.00 0.00 H new ATOM 0 H3 MET A 1 26.918-120.850 17.497 1.00 0.00 H new ATOM 0 HA MET A 1 25.819-123.611 17.244 1.00 0.00 H new ATOM 0 HB2 MET A 1 24.654-122.118 18.897 1.00 0.00 H new ATOM 0 HB3 MET A 1 24.443-120.913 17.643 1.00 0.00 H new ATOM 0 HG2 MET A 1 23.142-122.541 16.267 1.00 0.00 H new ATOM 0 HG3 MET A 1 23.393-123.785 17.475 1.00 0.00 H new ATOM 0 HE1 MET A 1 21.056-123.166 20.265 1.00 0.00 H new ATOM 0 HE2 MET A 1 21.765-124.344 19.135 1.00 0.00 H new ATOM 0 HE3 MET A 1 22.824-123.292 20.104 1.00 0.00 H new ATOM 18 N SER A 2 25.778-120.980 15.227 1.00 0.00 N ATOM 19 CA SER A 2 25.684-120.588 13.825 1.00 0.00 C ATOM 20 C SER A 2 24.389-121.108 13.210 1.00 0.00 C ATOM 21 O SER A 2 24.364-122.182 12.610 1.00 0.00 O ATOM 22 CB SER A 2 26.879-121.140 13.047 1.00 0.00 C ATOM 23 OG SER A 2 28.063-120.955 13.810 1.00 0.00 O ATOM 0 H SER A 2 25.949-120.210 15.874 1.00 0.00 H new ATOM 0 HA SER A 2 25.688-119.499 13.770 1.00 0.00 H new ATOM 0 HB2 SER A 2 26.731-122.199 12.835 1.00 0.00 H new ATOM 0 HB3 SER A 2 26.968-120.632 12.087 1.00 0.00 H new ATOM 0 HG SER A 2 28.830-121.310 13.314 1.00 0.00 H new ATOM 29 N ALA A 3 23.317-120.337 13.360 1.00 0.00 N ATOM 30 CA ALA A 3 22.022-120.729 12.813 1.00 0.00 C ATOM 31 C ALA A 3 21.140-119.503 12.596 1.00 0.00 C ATOM 32 O ALA A 3 21.275-118.499 13.294 1.00 0.00 O ATOM 33 CB ALA A 3 21.325-121.700 13.769 1.00 0.00 C ATOM 0 H ALA A 3 23.318-119.443 13.852 1.00 0.00 H new ATOM 0 HA ALA A 3 22.186-121.219 11.853 1.00 0.00 H new ATOM 0 HB1 ALA A 3 20.359-121.988 13.354 1.00 0.00 H new ATOM 0 HB2 ALA A 3 21.943-122.588 13.900 1.00 0.00 H new ATOM 0 HB3 ALA A 3 21.176-121.216 14.734 1.00 0.00 H new ATOM 39 N THR A 4 20.237-119.596 11.625 1.00 0.00 N ATOM 40 CA THR A 4 19.334-118.491 11.322 1.00 0.00 C ATOM 41 C THR A 4 18.147-118.496 12.278 1.00 0.00 C ATOM 42 O THR A 4 17.921-119.471 12.996 1.00 0.00 O ATOM 43 CB THR A 4 18.832-118.606 9.883 1.00 0.00 C ATOM 44 OG1 THR A 4 18.073-119.799 9.740 1.00 0.00 O ATOM 45 CG2 THR A 4 20.024-118.639 8.925 1.00 0.00 C ATOM 0 H THR A 4 20.111-120.420 11.037 1.00 0.00 H new ATOM 0 HA THR A 4 19.880-117.555 11.441 1.00 0.00 H new ATOM 0 HB THR A 4 18.204-117.746 9.648 1.00 0.00 H new ATOM 0 HG1 THR A 4 17.749-119.872 8.818 1.00 0.00 H new ATOM 0 HG21 THR A 4 19.664-118.721 7.899 1.00 0.00 H new ATOM 0 HG22 THR A 4 20.604-117.722 9.034 1.00 0.00 H new ATOM 0 HG23 THR A 4 20.654-119.497 9.158 1.00 0.00 H new ATOM 53 N ALA A 5 17.389-117.404 12.282 1.00 0.00 N ATOM 54 CA ALA A 5 16.224-117.292 13.153 1.00 0.00 C ATOM 55 C ALA A 5 15.212-116.317 12.562 1.00 0.00 C ATOM 56 O ALA A 5 15.574-115.390 11.839 1.00 0.00 O ATOM 57 CB ALA A 5 16.653-116.810 14.541 1.00 0.00 C ATOM 0 H ALA A 5 17.559-116.588 11.695 1.00 0.00 H new ATOM 0 HA ALA A 5 15.760-118.274 13.240 1.00 0.00 H new ATOM 0 HB1 ALA A 5 15.777-116.729 15.185 1.00 0.00 H new ATOM 0 HB2 ALA A 5 17.356-117.523 14.972 1.00 0.00 H new ATOM 0 HB3 ALA A 5 17.132-115.835 14.456 1.00 0.00 H new ATOM 63 N ALA A 6 13.937-116.534 12.878 1.00 0.00 N ATOM 64 CA ALA A 6 12.875-115.669 12.374 1.00 0.00 C ATOM 65 C ALA A 6 12.722-114.444 13.267 1.00 0.00 C ATOM 66 O ALA A 6 13.252-114.400 14.377 1.00 0.00 O ATOM 67 CB ALA A 6 11.552-116.437 12.332 1.00 0.00 C ATOM 0 H ALA A 6 13.617-117.296 13.476 1.00 0.00 H new ATOM 0 HA ALA A 6 13.139-115.345 11.367 1.00 0.00 H new ATOM 0 HB1 ALA A 6 10.764-115.785 11.955 1.00 0.00 H new ATOM 0 HB2 ALA A 6 11.653-117.301 11.675 1.00 0.00 H new ATOM 0 HB3 ALA A 6 11.295-116.773 13.336 1.00 0.00 H new ATOM 73 N THR A 7 11.992-113.446 12.775 1.00 0.00 N ATOM 74 CA THR A 7 11.771-112.217 13.533 1.00 0.00 C ATOM 75 C THR A 7 10.386-111.655 13.235 1.00 0.00 C ATOM 76 O THR A 7 9.810-111.920 12.180 1.00 0.00 O ATOM 77 CB THR A 7 12.837-111.181 13.168 1.00 0.00 C ATOM 78 OG1 THR A 7 12.538-109.950 13.810 1.00 0.00 O ATOM 79 CG2 THR A 7 12.857-110.977 11.653 1.00 0.00 C ATOM 0 H THR A 7 11.545-113.464 11.858 1.00 0.00 H new ATOM 0 HA THR A 7 11.839-112.445 14.597 1.00 0.00 H new ATOM 0 HB THR A 7 13.814-111.535 13.497 1.00 0.00 H new ATOM 0 HG1 THR A 7 12.738-109.207 13.203 1.00 0.00 H new ATOM 0 HG21 THR A 7 13.617-110.239 11.395 1.00 0.00 H new ATOM 0 HG22 THR A 7 13.088-111.922 11.162 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.881-110.624 11.320 1.00 0.00 H new ATOM 87 N VAL A 8 9.855-110.876 14.174 1.00 0.00 N ATOM 88 CA VAL A 8 8.532-110.277 14.008 1.00 0.00 C ATOM 89 C VAL A 8 8.491-108.898 14.655 1.00 0.00 C ATOM 90 O VAL A 8 7.872-108.711 15.702 1.00 0.00 O ATOM 91 CB VAL A 8 7.473-111.175 14.646 1.00 0.00 C ATOM 92 CG1 VAL A 8 6.083-110.688 14.233 1.00 0.00 C ATOM 93 CG2 VAL A 8 7.674-112.612 14.158 1.00 0.00 C ATOM 0 H VAL A 8 10.317-110.645 15.054 1.00 0.00 H new ATOM 0 HA VAL A 8 8.326-110.174 12.943 1.00 0.00 H new ATOM 0 HB VAL A 8 7.564-111.140 15.732 1.00 0.00 H new ATOM 0 HG11 VAL A 8 5.324-111.326 14.686 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.942-109.661 14.570 1.00 0.00 H new ATOM 0 HG13 VAL A 8 5.991-110.729 13.148 1.00 0.00 H new ATOM 0 HG21 VAL A 8 6.921-113.258 14.610 1.00 0.00 H new ATOM 0 HG22 VAL A 8 7.576-112.645 13.073 1.00 0.00 H new ATOM 0 HG23 VAL A 8 8.668-112.958 14.444 1.00 0.00 H new ATOM 103 N PRO A 9 9.142-107.936 14.055 1.00 0.00 N ATOM 104 CA PRO A 9 9.184-106.554 14.592 1.00 0.00 C ATOM 105 C PRO A 9 7.901-105.772 14.290 1.00 0.00 C ATOM 106 O PRO A 9 7.108-106.176 13.437 1.00 0.00 O ATOM 107 CB PRO A 9 10.400-105.932 13.882 1.00 0.00 C ATOM 108 CG PRO A 9 10.532-106.677 12.587 1.00 0.00 C ATOM 109 CD PRO A 9 9.910-108.069 12.804 1.00 0.00 C ATOM 0 HA PRO A 9 9.264-106.535 15.679 1.00 0.00 H new ATOM 0 HB2 PRO A 9 10.250-104.866 13.708 1.00 0.00 H new ATOM 0 HB3 PRO A 9 11.301-106.033 14.486 1.00 0.00 H new ATOM 0 HG2 PRO A 9 10.021-106.147 11.783 1.00 0.00 H new ATOM 0 HG3 PRO A 9 11.579-106.763 12.297 1.00 0.00 H new ATOM 0 HD2 PRO A 9 9.266-108.351 11.971 1.00 0.00 H new ATOM 0 HD3 PRO A 9 10.677-108.838 12.889 1.00 0.00 H new ATOM 117 N PRO A 10 7.695-104.659 14.954 1.00 0.00 N ATOM 118 CA PRO A 10 6.491-103.802 14.726 1.00 0.00 C ATOM 119 C PRO A 10 6.285-103.481 13.242 1.00 0.00 C ATOM 120 O PRO A 10 7.240-103.208 12.516 1.00 0.00 O ATOM 121 CB PRO A 10 6.797-102.522 15.525 1.00 0.00 C ATOM 122 CG PRO A 10 7.774-102.932 16.581 1.00 0.00 C ATOM 123 CD PRO A 10 8.576-104.102 16.005 1.00 0.00 C ATOM 0 HA PRO A 10 5.572-104.297 15.040 1.00 0.00 H new ATOM 0 HB2 PRO A 10 7.217-101.749 14.881 1.00 0.00 H new ATOM 0 HB3 PRO A 10 5.890-102.110 15.968 1.00 0.00 H new ATOM 0 HG2 PRO A 10 8.432-102.103 16.843 1.00 0.00 H new ATOM 0 HG3 PRO A 10 7.257-103.229 17.493 1.00 0.00 H new ATOM 0 HD2 PRO A 10 9.528-103.768 15.592 1.00 0.00 H new ATOM 0 HD3 PRO A 10 8.803-104.845 16.770 1.00 0.00 H new ATOM 131 N ALA A 11 5.029-103.513 12.809 1.00 0.00 N ATOM 132 CA ALA A 11 4.702-103.223 11.420 1.00 0.00 C ATOM 133 C ALA A 11 5.033-101.771 11.086 1.00 0.00 C ATOM 134 O ALA A 11 6.029-101.226 11.560 1.00 0.00 O ATOM 135 CB ALA A 11 3.215-103.483 11.166 1.00 0.00 C ATOM 0 H ALA A 11 4.226-103.736 13.397 1.00 0.00 H new ATOM 0 HA ALA A 11 5.297-103.876 10.781 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.980-103.263 10.125 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.987-104.528 11.377 1.00 0.00 H new ATOM 0 HB3 ALA A 11 2.618-102.843 11.816 1.00 0.00 H new ATOM 141 N ALA A 12 4.190-101.152 10.266 1.00 0.00 N ATOM 142 CA ALA A 12 4.401 -99.763 9.874 1.00 0.00 C ATOM 143 C ALA A 12 3.097 -99.146 9.379 1.00 0.00 C ATOM 144 O ALA A 12 2.917 -98.925 8.181 1.00 0.00 O ATOM 145 CB ALA A 12 5.456 -99.686 8.770 1.00 0.00 C ATOM 0 H ALA A 12 3.360-101.586 9.862 1.00 0.00 H new ATOM 0 HA ALA A 12 4.748 -99.206 10.745 1.00 0.00 H new ATOM 0 HB1 ALA A 12 5.607 -98.645 8.483 1.00 0.00 H new ATOM 0 HB2 ALA A 12 6.395-100.102 9.135 1.00 0.00 H new ATOM 0 HB3 ALA A 12 5.119-100.256 7.904 1.00 0.00 H new ATOM 151 N PRO A 13 2.193 -98.862 10.279 1.00 0.00 N ATOM 152 CA PRO A 13 0.873 -98.251 9.939 1.00 0.00 C ATOM 153 C PRO A 13 1.031 -96.905 9.233 1.00 0.00 C ATOM 154 O PRO A 13 1.946 -96.136 9.535 1.00 0.00 O ATOM 155 CB PRO A 13 0.176 -98.085 11.307 1.00 0.00 C ATOM 156 CG PRO A 13 0.886 -99.030 12.227 1.00 0.00 C ATOM 157 CD PRO A 13 2.326 -99.099 11.724 1.00 0.00 C ATOM 0 HA PRO A 13 0.302 -98.868 9.245 1.00 0.00 H new ATOM 0 HB2 PRO A 13 0.250 -97.058 11.664 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -0.885 -98.324 11.240 1.00 0.00 H new ATOM 0 HG2 PRO A 13 0.848 -98.675 13.257 1.00 0.00 H new ATOM 0 HG3 PRO A 13 0.419-100.015 12.212 1.00 0.00 H new ATOM 0 HD2 PRO A 13 2.954 -98.345 12.199 1.00 0.00 H new ATOM 0 HD3 PRO A 13 2.779-100.068 11.932 1.00 0.00 H new ATOM 165 N ALA A 14 0.134 -96.626 8.293 1.00 0.00 N ATOM 166 CA ALA A 14 0.177 -95.370 7.551 1.00 0.00 C ATOM 167 C ALA A 14 -0.540 -94.271 8.327 1.00 0.00 C ATOM 168 O ALA A 14 -0.931 -93.251 7.759 1.00 0.00 O ATOM 169 CB ALA A 14 -0.487 -95.548 6.184 1.00 0.00 C ATOM 0 H ALA A 14 -0.629 -97.249 8.027 1.00 0.00 H new ATOM 0 HA ALA A 14 1.220 -95.084 7.412 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -0.451 -94.606 5.637 1.00 0.00 H new ATOM 0 HB2 ALA A 14 0.042 -96.316 5.620 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -1.526 -95.849 6.320 1.00 0.00 H new ATOM 175 N GLY A 15 -0.710 -94.485 9.628 1.00 0.00 N ATOM 176 CA GLY A 15 -1.380 -93.503 10.472 1.00 0.00 C ATOM 177 C GLY A 15 -0.589 -92.200 10.518 1.00 0.00 C ATOM 178 O GLY A 15 0.489 -92.136 11.111 1.00 0.00 O ATOM 0 H GLY A 15 -0.396 -95.323 10.117 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -2.383 -93.312 10.090 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.494 -93.901 11.481 1.00 0.00 H new ATOM 182 N GLU A 16 -1.129 -91.159 9.881 1.00 0.00 N ATOM 183 CA GLU A 16 -0.473 -89.849 9.845 1.00 0.00 C ATOM 184 C GLU A 16 -1.373 -88.786 10.460 1.00 0.00 C ATOM 185 O GLU A 16 -2.585 -88.777 10.239 1.00 0.00 O ATOM 186 CB GLU A 16 -0.150 -89.470 8.397 1.00 0.00 C ATOM 187 CG GLU A 16 0.928 -90.411 7.854 1.00 0.00 C ATOM 188 CD GLU A 16 1.197 -90.102 6.386 1.00 0.00 C ATOM 189 OE1 GLU A 16 0.573 -89.192 5.869 1.00 0.00 O ATOM 190 OE2 GLU A 16 2.026 -90.781 5.801 1.00 0.00 O ATOM 0 H GLU A 16 -2.018 -91.197 9.383 1.00 0.00 H new ATOM 0 HA GLU A 16 0.450 -89.907 10.422 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -1.048 -89.536 7.783 1.00 0.00 H new ATOM 0 HB3 GLU A 16 0.195 -88.437 8.348 1.00 0.00 H new ATOM 0 HG2 GLU A 16 1.845 -90.299 8.432 1.00 0.00 H new ATOM 0 HG3 GLU A 16 0.607 -91.447 7.963 1.00 0.00 H new ATOM 197 N GLY A 17 -0.772 -87.889 11.233 1.00 0.00 N ATOM 198 CA GLY A 17 -1.523 -86.822 11.881 1.00 0.00 C ATOM 199 C GLY A 17 -1.792 -85.682 10.906 1.00 0.00 C ATOM 200 O GLY A 17 -1.546 -85.809 9.708 1.00 0.00 O ATOM 0 H GLY A 17 0.230 -87.880 11.426 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -2.467 -87.214 12.260 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -0.966 -86.448 12.740 1.00 0.00 H new ATOM 204 N GLY A 18 -2.296 -84.569 11.427 1.00 0.00 N ATOM 205 CA GLY A 18 -2.595 -83.410 10.589 1.00 0.00 C ATOM 206 C GLY A 18 -2.589 -82.131 11.419 1.00 0.00 C ATOM 207 O GLY A 18 -3.643 -81.562 11.706 1.00 0.00 O ATOM 0 H GLY A 18 -2.505 -84.443 12.417 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -1.859 -83.334 9.789 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -3.569 -83.538 10.116 1.00 0.00 H new ATOM 211 N PRO A 19 -1.429 -81.676 11.809 1.00 0.00 N ATOM 212 CA PRO A 19 -1.284 -80.438 12.628 1.00 0.00 C ATOM 213 C PRO A 19 -1.991 -79.238 11.987 1.00 0.00 C ATOM 214 O PRO A 19 -2.195 -79.205 10.772 1.00 0.00 O ATOM 215 CB PRO A 19 0.240 -80.216 12.696 1.00 0.00 C ATOM 216 CG PRO A 19 0.849 -81.558 12.430 1.00 0.00 C ATOM 217 CD PRO A 19 -0.127 -82.296 11.511 1.00 0.00 C ATOM 0 HA PRO A 19 -1.742 -80.541 13.612 1.00 0.00 H new ATOM 0 HB2 PRO A 19 0.564 -79.484 11.956 1.00 0.00 H new ATOM 0 HB3 PRO A 19 0.539 -79.836 13.673 1.00 0.00 H new ATOM 0 HG2 PRO A 19 1.826 -81.455 11.958 1.00 0.00 H new ATOM 0 HG3 PRO A 19 1.000 -82.108 13.359 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.143 -82.175 10.462 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -0.138 -83.366 11.716 1.00 0.00 H new ATOM 225 N PRO A 20 -2.355 -78.257 12.776 1.00 0.00 N ATOM 226 CA PRO A 20 -3.038 -77.028 12.272 1.00 0.00 C ATOM 227 C PRO A 20 -2.118 -76.187 11.385 1.00 0.00 C ATOM 228 O PRO A 20 -0.909 -76.130 11.610 1.00 0.00 O ATOM 229 CB PRO A 20 -3.429 -76.275 13.558 1.00 0.00 C ATOM 230 CG PRO A 20 -2.472 -76.762 14.601 1.00 0.00 C ATOM 231 CD PRO A 20 -2.152 -78.212 14.234 1.00 0.00 C ATOM 0 HA PRO A 20 -3.896 -77.258 11.640 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -3.350 -75.196 13.423 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -4.461 -76.486 13.840 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -1.567 -76.154 14.615 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -2.914 -76.699 15.596 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -1.130 -78.477 14.504 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -2.810 -78.910 14.751 1.00 0.00 H new ATOM 239 N ALA A 21 -2.701 -75.536 10.385 1.00 0.00 N ATOM 240 CA ALA A 21 -1.933 -74.698 9.475 1.00 0.00 C ATOM 241 C ALA A 21 -2.833 -74.160 8.364 1.00 0.00 C ATOM 242 O ALA A 21 -2.735 -74.581 7.212 1.00 0.00 O ATOM 243 CB ALA A 21 -0.773 -75.501 8.869 1.00 0.00 C ATOM 0 H ALA A 21 -3.701 -75.573 10.185 1.00 0.00 H new ATOM 0 HA ALA A 21 -1.526 -73.856 10.035 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -0.205 -74.865 8.190 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -0.119 -75.855 9.667 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -1.169 -76.355 8.320 1.00 0.00 H new ATOM 249 N PRO A 22 -3.707 -73.247 8.694 1.00 0.00 N ATOM 250 CA PRO A 22 -4.649 -72.641 7.708 1.00 0.00 C ATOM 251 C PRO A 22 -3.914 -72.018 6.515 1.00 0.00 C ATOM 252 O PRO A 22 -2.741 -71.664 6.618 1.00 0.00 O ATOM 253 CB PRO A 22 -5.402 -71.571 8.524 1.00 0.00 C ATOM 254 CG PRO A 22 -5.246 -71.984 9.953 1.00 0.00 C ATOM 255 CD PRO A 22 -3.895 -72.693 10.044 1.00 0.00 C ATOM 0 HA PRO A 22 -5.315 -73.383 7.267 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -4.984 -70.579 8.353 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -6.453 -71.527 8.240 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -5.277 -71.118 10.615 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -6.056 -72.647 10.258 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -3.096 -72.001 10.309 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -3.903 -73.476 10.802 1.00 0.00 H new ATOM 263 N PRO A 23 -4.585 -71.874 5.400 1.00 0.00 N ATOM 264 CA PRO A 23 -3.983 -71.273 4.176 1.00 0.00 C ATOM 265 C PRO A 23 -3.682 -69.781 4.357 1.00 0.00 C ATOM 266 O PRO A 23 -4.224 -69.132 5.253 1.00 0.00 O ATOM 267 CB PRO A 23 -5.054 -71.501 3.090 1.00 0.00 C ATOM 268 CG PRO A 23 -6.342 -71.646 3.836 1.00 0.00 C ATOM 269 CD PRO A 23 -5.985 -72.275 5.184 1.00 0.00 C ATOM 0 HA PRO A 23 -3.022 -71.723 3.926 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -5.094 -70.663 2.394 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -4.836 -72.393 2.503 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -6.824 -70.678 3.973 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -7.042 -72.275 3.286 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -6.633 -71.909 5.980 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -6.091 -73.360 5.160 1.00 0.00 H new ATOM 277 N PRO A 24 -2.844 -69.235 3.516 1.00 0.00 N ATOM 278 CA PRO A 24 -2.471 -67.788 3.566 1.00 0.00 C ATOM 279 C PRO A 24 -3.674 -66.879 3.304 1.00 0.00 C ATOM 280 O PRO A 24 -3.697 -65.726 3.731 1.00 0.00 O ATOM 281 CB PRO A 24 -1.405 -67.647 2.457 1.00 0.00 C ATOM 282 CG PRO A 24 -1.641 -68.805 1.539 1.00 0.00 C ATOM 283 CD PRO A 24 -2.153 -69.936 2.422 1.00 0.00 C ATOM 0 HA PRO A 24 -2.104 -67.487 4.547 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -1.508 -66.699 1.930 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -0.398 -67.673 2.873 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -2.368 -68.551 0.768 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -0.722 -69.093 1.028 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -2.829 -70.595 1.878 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -1.337 -70.555 2.795 1.00 0.00 H new ATOM 291 N ASN A 25 -4.672 -67.410 2.605 1.00 0.00 N ATOM 292 CA ASN A 25 -5.869 -66.638 2.298 1.00 0.00 C ATOM 293 C ASN A 25 -5.511 -65.370 1.523 1.00 0.00 C ATOM 294 O ASN A 25 -5.907 -64.269 1.901 1.00 0.00 O ATOM 295 CB ASN A 25 -6.592 -66.261 3.590 1.00 0.00 C ATOM 296 CG ASN A 25 -7.997 -65.763 3.270 1.00 0.00 C ATOM 297 OD1 ASN A 25 -8.624 -66.237 2.322 1.00 0.00 O ATOM 298 ND2 ASN A 25 -8.533 -64.832 4.010 1.00 0.00 N ATOM 0 H ASN A 25 -4.676 -68.364 2.243 1.00 0.00 H new ATOM 0 HA ASN A 25 -6.524 -67.252 1.680 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -6.645 -67.124 4.253 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -6.034 -65.488 4.117 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -9.473 -64.495 3.804 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -8.012 -64.441 4.795 1.00 0.00 H new ATOM 305 N LEU A 26 -4.761 -65.537 0.437 1.00 0.00 N ATOM 306 CA LEU A 26 -4.358 -64.401 -0.386 1.00 0.00 C ATOM 307 C LEU A 26 -5.578 -63.723 -0.996 1.00 0.00 C ATOM 308 O LEU A 26 -5.649 -62.495 -1.063 1.00 0.00 O ATOM 309 CB LEU A 26 -3.423 -64.874 -1.502 1.00 0.00 C ATOM 310 CG LEU A 26 -2.256 -65.664 -0.898 1.00 0.00 C ATOM 311 CD1 LEU A 26 -1.390 -66.232 -2.026 1.00 0.00 C ATOM 312 CD2 LEU A 26 -1.401 -64.744 -0.008 1.00 0.00 C ATOM 0 H LEU A 26 -4.422 -66.441 0.108 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.836 -63.683 0.247 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.971 -65.498 -2.208 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -3.045 -64.018 -2.060 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.651 -66.479 -0.291 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.559 -66.794 -1.599 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.992 -66.892 -2.650 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.001 -65.414 -2.633 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.575 -65.314 0.417 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.006 -63.923 -0.607 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.016 -64.342 0.797 1.00 0.00 H new ATOM 324 N THR A 27 -6.535 -64.527 -1.441 1.00 0.00 N ATOM 325 CA THR A 27 -7.747 -63.991 -2.045 1.00 0.00 C ATOM 326 C THR A 27 -7.407 -63.116 -3.248 1.00 0.00 C ATOM 327 O THR A 27 -6.295 -62.600 -3.358 1.00 0.00 O ATOM 328 CB THR A 27 -8.520 -63.164 -1.013 1.00 0.00 C ATOM 329 OG1 THR A 27 -8.566 -63.870 0.219 1.00 0.00 O ATOM 330 CG2 THR A 27 -9.945 -62.913 -1.515 1.00 0.00 C ATOM 0 H THR A 27 -6.496 -65.545 -1.396 1.00 0.00 H new ATOM 0 HA THR A 27 -8.363 -64.825 -2.381 1.00 0.00 H new ATOM 0 HB THR A 27 -8.018 -62.208 -0.866 1.00 0.00 H new ATOM 0 HG1 THR A 27 -9.059 -63.341 0.881 1.00 0.00 H new ATOM 0 HG21 THR A 27 -10.492 -62.324 -0.778 1.00 0.00 H new ATOM 0 HG22 THR A 27 -9.908 -62.369 -2.459 1.00 0.00 H new ATOM 0 HG23 THR A 27 -10.451 -63.867 -1.666 1.00 0.00 H new ATOM 338 N SER A 28 -8.372 -62.957 -4.147 1.00 0.00 N ATOM 339 CA SER A 28 -8.170 -62.146 -5.341 1.00 0.00 C ATOM 340 C SER A 28 -8.198 -60.662 -4.992 1.00 0.00 C ATOM 341 O SER A 28 -7.972 -59.810 -5.851 1.00 0.00 O ATOM 342 CB SER A 28 -9.253 -62.452 -6.375 1.00 0.00 C ATOM 343 OG SER A 28 -8.904 -61.849 -7.613 1.00 0.00 O ATOM 0 H SER A 28 -9.298 -63.377 -4.072 1.00 0.00 H new ATOM 0 HA SER A 28 -7.194 -62.390 -5.760 1.00 0.00 H new ATOM 0 HB2 SER A 28 -9.359 -63.530 -6.499 1.00 0.00 H new ATOM 0 HB3 SER A 28 -10.216 -62.074 -6.032 1.00 0.00 H new ATOM 0 HG SER A 28 -8.345 -61.061 -7.447 1.00 0.00 H new ATOM 349 N ASN A 29 -8.478 -60.361 -3.728 1.00 0.00 N ATOM 350 CA ASN A 29 -8.533 -58.976 -3.274 1.00 0.00 C ATOM 351 C ASN A 29 -9.597 -58.202 -4.045 1.00 0.00 C ATOM 352 O ASN A 29 -9.290 -57.503 -5.012 1.00 0.00 O ATOM 353 CB ASN A 29 -7.173 -58.305 -3.468 1.00 0.00 C ATOM 354 CG ASN A 29 -7.139 -56.971 -2.732 1.00 0.00 C ATOM 355 OD1 ASN A 29 -8.188 -56.416 -2.403 1.00 0.00 O ATOM 356 ND2 ASN A 29 -5.991 -56.419 -2.454 1.00 0.00 N ATOM 0 H ASN A 29 -8.669 -61.053 -3.004 1.00 0.00 H new ATOM 0 HA ASN A 29 -8.791 -58.972 -2.215 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -6.381 -58.955 -3.096 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -6.984 -58.148 -4.530 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -5.960 -55.526 -1.963 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -5.124 -56.881 -2.728 1.00 0.00 H new ATOM 363 N ARG A 30 -10.848 -58.333 -3.615 1.00 0.00 N ATOM 364 CA ARG A 30 -11.949 -57.645 -4.277 1.00 0.00 C ATOM 365 C ARG A 30 -11.822 -56.138 -4.082 1.00 0.00 C ATOM 366 O ARG A 30 -11.393 -55.669 -3.026 1.00 0.00 O ATOM 367 CB ARG A 30 -13.290 -58.134 -3.701 1.00 0.00 C ATOM 368 CG ARG A 30 -13.714 -59.438 -4.383 1.00 0.00 C ATOM 369 CD ARG A 30 -12.677 -60.526 -4.103 1.00 0.00 C ATOM 370 NE ARG A 30 -13.161 -61.815 -4.574 1.00 0.00 N ATOM 371 CZ ARG A 30 -13.091 -62.149 -5.857 1.00 0.00 C ATOM 372 NH1 ARG A 30 -12.581 -61.315 -6.723 1.00 0.00 N ATOM 373 NH2 ARG A 30 -13.529 -63.312 -6.251 1.00 0.00 N ATOM 0 H ARG A 30 -11.123 -58.905 -2.817 1.00 0.00 H new ATOM 0 HA ARG A 30 -11.913 -57.866 -5.344 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -13.197 -58.291 -2.626 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -14.056 -57.373 -3.847 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -14.692 -59.751 -4.016 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -13.812 -59.283 -5.457 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -11.738 -60.279 -4.598 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -12.471 -60.575 -3.034 1.00 0.00 H new ATOM 0 HE ARG A 30 -13.561 -62.474 -3.906 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -12.236 -60.406 -6.414 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -12.528 -61.572 -7.709 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -13.925 -63.964 -5.574 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -13.476 -63.570 -7.236 1.00 0.00 H new ATOM 387 N ARG A 31 -12.197 -55.382 -5.112 1.00 0.00 N ATOM 388 CA ARG A 31 -12.126 -53.927 -5.057 1.00 0.00 C ATOM 389 C ARG A 31 -13.461 -53.342 -4.602 1.00 0.00 C ATOM 390 O ARG A 31 -13.626 -52.124 -4.542 1.00 0.00 O ATOM 391 CB ARG A 31 -11.763 -53.369 -6.435 1.00 0.00 C ATOM 392 CG ARG A 31 -10.353 -53.826 -6.813 1.00 0.00 C ATOM 393 CD ARG A 31 -9.978 -53.247 -8.178 1.00 0.00 C ATOM 394 NE ARG A 31 -10.841 -53.799 -9.216 1.00 0.00 N ATOM 395 CZ ARG A 31 -10.581 -54.977 -9.775 1.00 0.00 C ATOM 396 NH1 ARG A 31 -9.539 -55.663 -9.395 1.00 0.00 N ATOM 397 NH2 ARG A 31 -11.370 -55.448 -10.702 1.00 0.00 N ATOM 0 H ARG A 31 -12.552 -55.754 -5.993 1.00 0.00 H new ATOM 0 HA ARG A 31 -11.356 -53.646 -4.338 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -12.481 -53.713 -7.180 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -11.813 -52.280 -6.423 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -9.638 -53.498 -6.058 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -10.308 -54.915 -6.843 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -10.071 -52.161 -8.158 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -8.936 -53.474 -8.403 1.00 0.00 H new ATOM 0 HE ARG A 31 -11.660 -53.271 -9.519 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -8.924 -55.296 -8.669 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -9.339 -56.567 -9.824 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -12.186 -54.912 -10.998 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -11.170 -56.352 -11.131 1.00 0.00 H new ATOM 411 N LEU A 32 -14.410 -54.218 -4.285 1.00 0.00 N ATOM 412 CA LEU A 32 -15.725 -53.776 -3.838 1.00 0.00 C ATOM 413 C LEU A 32 -15.614 -53.002 -2.530 1.00 0.00 C ATOM 414 O LEU A 32 -16.284 -51.987 -2.339 1.00 0.00 O ATOM 415 CB LEU A 32 -16.642 -54.985 -3.640 1.00 0.00 C ATOM 416 CG LEU A 32 -16.639 -55.845 -4.908 1.00 0.00 C ATOM 417 CD1 LEU A 32 -17.486 -57.099 -4.673 1.00 0.00 C ATOM 418 CD2 LEU A 32 -17.216 -55.046 -6.089 1.00 0.00 C ATOM 0 H LEU A 32 -14.294 -55.230 -4.329 1.00 0.00 H new ATOM 0 HA LEU A 32 -16.146 -53.121 -4.601 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -16.304 -55.575 -2.788 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.656 -54.653 -3.416 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.614 -56.133 -5.143 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -17.485 -57.713 -5.574 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -17.068 -57.671 -3.844 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -18.509 -56.808 -4.433 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -17.210 -55.666 -6.985 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -18.239 -54.748 -5.861 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -16.608 -54.157 -6.258 1.00 0.00 H new ATOM 430 N GLN A 33 -14.767 -53.487 -1.631 1.00 0.00 N ATOM 431 CA GLN A 33 -14.578 -52.829 -0.344 1.00 0.00 C ATOM 432 C GLN A 33 -14.027 -51.421 -0.539 1.00 0.00 C ATOM 433 O GLN A 33 -14.442 -50.482 0.138 1.00 0.00 O ATOM 434 CB GLN A 33 -13.611 -53.645 0.518 1.00 0.00 C ATOM 435 CG GLN A 33 -14.243 -54.996 0.867 1.00 0.00 C ATOM 436 CD GLN A 33 -15.442 -54.790 1.788 1.00 0.00 C ATOM 437 OE1 GLN A 33 -15.346 -54.065 2.779 1.00 0.00 O ATOM 438 NE2 GLN A 33 -16.570 -55.389 1.522 1.00 0.00 N ATOM 0 H GLN A 33 -14.204 -54.327 -1.767 1.00 0.00 H new ATOM 0 HA GLN A 33 -15.544 -52.761 0.157 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -12.674 -53.799 -0.016 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -13.372 -53.098 1.430 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -14.557 -55.506 -0.044 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -13.507 -55.636 1.353 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -16.648 -55.989 0.701 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -17.374 -55.257 2.135 1.00 0.00 H new ATOM 447 N GLN A 34 -13.087 -51.284 -1.466 1.00 0.00 N ATOM 448 CA GLN A 34 -12.485 -49.987 -1.738 1.00 0.00 C ATOM 449 C GLN A 34 -13.516 -49.007 -2.289 1.00 0.00 C ATOM 450 O GLN A 34 -13.522 -47.827 -1.929 1.00 0.00 O ATOM 451 CB GLN A 34 -11.348 -50.142 -2.752 1.00 0.00 C ATOM 452 CG GLN A 34 -10.182 -50.892 -2.107 1.00 0.00 C ATOM 453 CD GLN A 34 -9.072 -51.113 -3.129 1.00 0.00 C ATOM 454 OE1 GLN A 34 -9.284 -51.776 -4.146 1.00 0.00 O ATOM 455 NE2 GLN A 34 -7.893 -50.596 -2.919 1.00 0.00 N ATOM 0 H GLN A 34 -12.728 -52.049 -2.037 1.00 0.00 H new ATOM 0 HA GLN A 34 -12.095 -49.594 -0.799 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -11.701 -50.684 -3.629 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -11.017 -49.162 -3.095 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -9.799 -50.324 -1.259 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -10.526 -51.851 -1.719 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -7.719 -50.048 -2.077 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -7.145 -50.740 -3.597 1.00 0.00 H new ATOM 464 N THR A 35 -14.385 -49.508 -3.167 1.00 0.00 N ATOM 465 CA THR A 35 -15.417 -48.685 -3.784 1.00 0.00 C ATOM 466 C THR A 35 -14.840 -47.338 -4.215 1.00 0.00 C ATOM 467 O THR A 35 -13.629 -47.115 -4.153 1.00 0.00 O ATOM 468 CB THR A 35 -16.555 -48.468 -2.790 1.00 0.00 C ATOM 469 OG1 THR A 35 -16.913 -49.711 -2.207 1.00 0.00 O ATOM 470 CG2 THR A 35 -17.795 -47.844 -3.465 1.00 0.00 C ATOM 0 H THR A 35 -14.392 -50.483 -3.466 1.00 0.00 H new ATOM 0 HA THR A 35 -15.797 -49.197 -4.668 1.00 0.00 H new ATOM 0 HB THR A 35 -16.205 -47.775 -2.025 1.00 0.00 H new ATOM 0 HG1 THR A 35 -16.651 -50.441 -2.806 1.00 0.00 H new ATOM 0 HG21 THR A 35 -18.582 -47.706 -2.724 1.00 0.00 H new ATOM 0 HG22 THR A 35 -17.528 -46.879 -3.895 1.00 0.00 H new ATOM 0 HG23 THR A 35 -18.152 -48.506 -4.254 1.00 0.00 H new ATOM 478 N GLN A 36 -15.716 -46.443 -4.650 1.00 0.00 N ATOM 479 CA GLN A 36 -15.294 -45.116 -5.093 1.00 0.00 C ATOM 480 C GLN A 36 -15.111 -44.185 -3.899 1.00 0.00 C ATOM 481 O GLN A 36 -14.565 -43.090 -4.033 1.00 0.00 O ATOM 482 CB GLN A 36 -16.338 -44.527 -6.045 1.00 0.00 C ATOM 483 CG GLN A 36 -16.450 -45.403 -7.295 1.00 0.00 C ATOM 484 CD GLN A 36 -15.144 -45.364 -8.082 1.00 0.00 C ATOM 485 OE1 GLN A 36 -14.589 -44.290 -8.309 1.00 0.00 O ATOM 486 NE2 GLN A 36 -14.622 -46.477 -8.518 1.00 0.00 N ATOM 0 H GLN A 36 -16.721 -46.608 -4.707 1.00 0.00 H new ATOM 0 HA GLN A 36 -14.341 -45.214 -5.613 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -17.305 -44.464 -5.546 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -16.057 -43.512 -6.325 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -16.681 -46.429 -7.010 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -17.271 -45.054 -7.921 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -15.085 -47.366 -8.328 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -13.751 -46.458 -9.049 1.00 0.00 H new ATOM 495 N ALA A 37 -15.571 -44.626 -2.734 1.00 0.00 N ATOM 496 CA ALA A 37 -15.453 -43.821 -1.526 1.00 0.00 C ATOM 497 C ALA A 37 -14.001 -43.428 -1.288 1.00 0.00 C ATOM 498 O ALA A 37 -13.718 -42.410 -0.657 1.00 0.00 O ATOM 499 CB ALA A 37 -15.972 -44.609 -0.320 1.00 0.00 C ATOM 0 H ALA A 37 -16.026 -45.529 -2.601 1.00 0.00 H new ATOM 0 HA ALA A 37 -16.049 -42.917 -1.654 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -15.880 -44.000 0.579 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -17.019 -44.868 -0.478 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -15.387 -45.521 -0.202 1.00 0.00 H new ATOM 505 N GLN A 38 -13.082 -44.242 -1.797 1.00 0.00 N ATOM 506 CA GLN A 38 -11.659 -43.968 -1.631 1.00 0.00 C ATOM 507 C GLN A 38 -11.292 -42.640 -2.287 1.00 0.00 C ATOM 508 O GLN A 38 -10.528 -41.852 -1.730 1.00 0.00 O ATOM 509 CB GLN A 38 -10.836 -45.092 -2.263 1.00 0.00 C ATOM 510 CG GLN A 38 -9.355 -44.885 -1.942 1.00 0.00 C ATOM 511 CD GLN A 38 -8.542 -46.074 -2.444 1.00 0.00 C ATOM 512 OE1 GLN A 38 -9.095 -47.145 -2.692 1.00 0.00 O ATOM 513 NE2 GLN A 38 -7.253 -45.949 -2.607 1.00 0.00 N ATOM 0 H GLN A 38 -13.294 -45.090 -2.323 1.00 0.00 H new ATOM 0 HA GLN A 38 -11.439 -43.910 -0.565 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -11.169 -46.058 -1.884 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -10.986 -45.104 -3.342 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -8.998 -43.967 -2.408 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -9.220 -44.770 -0.867 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -6.797 -45.060 -2.401 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -6.702 -46.740 -2.941 1.00 0.00 H new ATOM 522 N VAL A 39 -11.843 -42.398 -3.473 1.00 0.00 N ATOM 523 CA VAL A 39 -11.566 -41.159 -4.193 1.00 0.00 C ATOM 524 C VAL A 39 -12.084 -39.958 -3.408 1.00 0.00 C ATOM 525 O VAL A 39 -11.393 -38.949 -3.268 1.00 0.00 O ATOM 526 CB VAL A 39 -12.230 -41.198 -5.571 1.00 0.00 C ATOM 527 CG1 VAL A 39 -12.026 -39.855 -6.279 1.00 0.00 C ATOM 528 CG2 VAL A 39 -11.603 -42.314 -6.409 1.00 0.00 C ATOM 0 H VAL A 39 -12.478 -43.037 -3.952 1.00 0.00 H new ATOM 0 HA VAL A 39 -10.487 -41.061 -4.313 1.00 0.00 H new ATOM 0 HB VAL A 39 -13.297 -41.387 -5.452 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.500 -39.885 -7.260 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -12.473 -39.059 -5.684 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.959 -39.664 -6.397 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -12.076 -42.342 -7.391 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.536 -42.126 -6.526 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.750 -43.271 -5.908 1.00 0.00 H new ATOM 538 N ASP A 40 -13.305 -40.075 -2.898 1.00 0.00 N ATOM 539 CA ASP A 40 -13.911 -38.994 -2.127 1.00 0.00 C ATOM 540 C ASP A 40 -13.136 -38.755 -0.836 1.00 0.00 C ATOM 541 O ASP A 40 -13.009 -37.621 -0.376 1.00 0.00 O ATOM 542 CB ASP A 40 -15.365 -39.336 -1.797 1.00 0.00 C ATOM 543 CG ASP A 40 -16.103 -38.084 -1.335 1.00 0.00 C ATOM 544 OD1 ASP A 40 -15.880 -37.038 -1.923 1.00 0.00 O ATOM 545 OD2 ASP A 40 -16.882 -38.189 -0.401 1.00 0.00 O ATOM 0 H ASP A 40 -13.892 -40.902 -3.003 1.00 0.00 H new ATOM 0 HA ASP A 40 -13.881 -38.085 -2.728 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -15.857 -39.755 -2.675 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -15.400 -40.097 -1.018 1.00 0.00 H new ATOM 550 N GLU A 41 -12.622 -39.833 -0.253 1.00 0.00 N ATOM 551 CA GLU A 41 -11.865 -39.731 0.990 1.00 0.00 C ATOM 552 C GLU A 41 -10.676 -38.794 0.813 1.00 0.00 C ATOM 553 O GLU A 41 -10.290 -38.084 1.742 1.00 0.00 O ATOM 554 CB GLU A 41 -11.369 -41.116 1.414 1.00 0.00 C ATOM 555 CG GLU A 41 -10.686 -41.020 2.781 1.00 0.00 C ATOM 556 CD GLU A 41 -10.233 -42.402 3.236 1.00 0.00 C ATOM 557 OE1 GLU A 41 -10.673 -43.374 2.644 1.00 0.00 O ATOM 558 OE2 GLU A 41 -9.449 -42.468 4.169 1.00 0.00 O ATOM 0 H GLU A 41 -12.715 -40.781 -0.618 1.00 0.00 H new ATOM 0 HA GLU A 41 -12.520 -39.329 1.763 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.205 -41.814 1.462 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -10.670 -41.506 0.674 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -9.829 -40.349 2.722 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -11.374 -40.595 3.512 1.00 0.00 H new ATOM 565 N VAL A 42 -10.100 -38.794 -0.382 1.00 0.00 N ATOM 566 CA VAL A 42 -8.955 -37.939 -0.670 1.00 0.00 C ATOM 567 C VAL A 42 -9.347 -36.470 -0.571 1.00 0.00 C ATOM 568 O VAL A 42 -8.613 -35.656 -0.010 1.00 0.00 O ATOM 569 CB VAL A 42 -8.415 -38.236 -2.071 1.00 0.00 C ATOM 570 CG1 VAL A 42 -7.279 -37.265 -2.403 1.00 0.00 C ATOM 571 CG2 VAL A 42 -7.889 -39.673 -2.121 1.00 0.00 C ATOM 0 H VAL A 42 -10.405 -39.373 -1.164 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.178 -38.146 0.066 1.00 0.00 H new ATOM 0 HB VAL A 42 -9.217 -38.115 -2.799 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.897 -37.479 -3.401 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -7.654 -36.242 -2.370 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -6.476 -37.381 -1.675 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -7.504 -39.885 -3.119 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.089 -39.793 -1.390 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.699 -40.365 -1.890 1.00 0.00 H new ATOM 581 N VAL A 43 -10.508 -36.135 -1.120 1.00 0.00 N ATOM 582 CA VAL A 43 -10.986 -34.759 -1.091 1.00 0.00 C ATOM 583 C VAL A 43 -11.144 -34.283 0.350 1.00 0.00 C ATOM 584 O VAL A 43 -10.759 -33.164 0.689 1.00 0.00 O ATOM 585 CB VAL A 43 -12.328 -34.655 -1.819 1.00 0.00 C ATOM 586 CG1 VAL A 43 -12.876 -33.232 -1.687 1.00 0.00 C ATOM 587 CG2 VAL A 43 -12.133 -34.991 -3.299 1.00 0.00 C ATOM 0 H VAL A 43 -11.132 -36.792 -1.588 1.00 0.00 H new ATOM 0 HA VAL A 43 -10.255 -34.126 -1.594 1.00 0.00 H new ATOM 0 HB VAL A 43 -13.035 -35.357 -1.376 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -13.832 -33.161 -2.206 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -13.017 -32.993 -0.633 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -12.170 -32.528 -2.128 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -13.089 -34.917 -3.818 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -11.425 -34.290 -3.741 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -11.746 -36.006 -3.394 1.00 0.00 H new ATOM 597 N ASP A 44 -11.710 -35.140 1.191 1.00 0.00 N ATOM 598 CA ASP A 44 -11.910 -34.795 2.592 1.00 0.00 C ATOM 599 C ASP A 44 -10.571 -34.528 3.273 1.00 0.00 C ATOM 600 O ASP A 44 -10.442 -33.588 4.057 1.00 0.00 O ATOM 601 CB ASP A 44 -12.630 -35.937 3.312 1.00 0.00 C ATOM 602 CG ASP A 44 -14.089 -35.998 2.874 1.00 0.00 C ATOM 603 OD1 ASP A 44 -14.563 -35.018 2.321 1.00 0.00 O ATOM 604 OD2 ASP A 44 -14.710 -37.024 3.093 1.00 0.00 O ATOM 0 H ASP A 44 -12.036 -36.071 0.930 1.00 0.00 H new ATOM 0 HA ASP A 44 -12.518 -33.892 2.642 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -12.137 -36.884 3.092 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -12.572 -35.791 4.391 1.00 0.00 H new ATOM 609 N ILE A 45 -9.574 -35.359 2.971 1.00 0.00 N ATOM 610 CA ILE A 45 -8.255 -35.191 3.570 1.00 0.00 C ATOM 611 C ILE A 45 -7.635 -33.863 3.138 1.00 0.00 C ATOM 612 O ILE A 45 -7.063 -33.139 3.953 1.00 0.00 O ATOM 613 CB ILE A 45 -7.344 -36.349 3.148 1.00 0.00 C ATOM 614 CG1 ILE A 45 -7.847 -37.646 3.787 1.00 0.00 C ATOM 615 CG2 ILE A 45 -5.909 -36.075 3.611 1.00 0.00 C ATOM 616 CD1 ILE A 45 -7.123 -38.838 3.159 1.00 0.00 C ATOM 0 H ILE A 45 -9.654 -36.144 2.324 1.00 0.00 H new ATOM 0 HA ILE A 45 -8.362 -35.189 4.655 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.359 -36.444 2.062 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -7.672 -37.626 4.863 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.923 -37.742 3.641 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -5.265 -36.901 3.309 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -5.551 -35.151 3.158 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -5.889 -35.978 4.696 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -7.481 -39.762 3.614 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -7.321 -38.861 2.087 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -6.050 -38.742 3.328 1.00 0.00 H new ATOM 628 N MET A 46 -7.751 -33.557 1.853 1.00 0.00 N ATOM 629 CA MET A 46 -7.198 -32.319 1.319 1.00 0.00 C ATOM 630 C MET A 46 -7.921 -31.111 1.902 1.00 0.00 C ATOM 631 O MET A 46 -7.306 -30.084 2.186 1.00 0.00 O ATOM 632 CB MET A 46 -7.326 -32.310 -0.206 1.00 0.00 C ATOM 633 CG MET A 46 -6.451 -33.418 -0.802 1.00 0.00 C ATOM 634 SD MET A 46 -4.698 -33.032 -0.528 1.00 0.00 S ATOM 635 CE MET A 46 -4.511 -31.716 -1.766 1.00 0.00 C ATOM 0 H MET A 46 -8.220 -34.145 1.164 1.00 0.00 H new ATOM 0 HA MET A 46 -6.146 -32.262 1.597 1.00 0.00 H new ATOM 0 HB2 MET A 46 -8.366 -32.460 -0.495 1.00 0.00 H new ATOM 0 HB3 MET A 46 -7.022 -31.341 -0.601 1.00 0.00 H new ATOM 0 HG2 MET A 46 -6.698 -34.375 -0.343 1.00 0.00 H new ATOM 0 HG3 MET A 46 -6.649 -33.516 -1.869 1.00 0.00 H new ATOM 0 HE1 MET A 46 -3.457 -31.603 -2.020 1.00 0.00 H new ATOM 0 HE2 MET A 46 -5.075 -31.976 -2.662 1.00 0.00 H new ATOM 0 HE3 MET A 46 -4.889 -30.778 -1.360 1.00 0.00 H new ATOM 645 N ARG A 47 -9.231 -31.240 2.075 1.00 0.00 N ATOM 646 CA ARG A 47 -10.029 -30.150 2.620 1.00 0.00 C ATOM 647 C ARG A 47 -9.547 -29.787 4.021 1.00 0.00 C ATOM 648 O ARG A 47 -9.435 -28.609 4.362 1.00 0.00 O ATOM 649 CB ARG A 47 -11.504 -30.559 2.669 1.00 0.00 C ATOM 650 CG ARG A 47 -12.349 -29.374 3.144 1.00 0.00 C ATOM 651 CD ARG A 47 -13.825 -29.772 3.164 1.00 0.00 C ATOM 652 NE ARG A 47 -14.058 -30.792 4.179 1.00 0.00 N ATOM 653 CZ ARG A 47 -15.261 -31.329 4.348 1.00 0.00 C ATOM 654 NH1 ARG A 47 -16.259 -30.943 3.602 1.00 0.00 N ATOM 655 NH2 ARG A 47 -15.445 -32.242 5.261 1.00 0.00 N ATOM 0 H ARG A 47 -9.760 -32.082 1.848 1.00 0.00 H new ATOM 0 HA ARG A 47 -9.918 -29.279 1.974 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -11.835 -30.883 1.682 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -11.635 -31.406 3.343 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -12.032 -29.064 4.140 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -12.201 -28.520 2.482 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -14.442 -28.897 3.369 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -14.121 -30.149 2.185 1.00 0.00 H new ATOM 0 HE ARG A 47 -13.285 -31.098 4.769 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -16.116 -30.228 2.888 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -17.183 -31.356 3.732 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -14.665 -32.544 5.845 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -16.369 -32.654 5.391 1.00 0.00 H new ATOM 669 N VAL A 48 -9.270 -30.803 4.829 1.00 0.00 N ATOM 670 CA VAL A 48 -8.808 -30.579 6.192 1.00 0.00 C ATOM 671 C VAL A 48 -7.477 -29.834 6.188 1.00 0.00 C ATOM 672 O VAL A 48 -7.273 -28.906 6.971 1.00 0.00 O ATOM 673 CB VAL A 48 -8.648 -31.918 6.919 1.00 0.00 C ATOM 674 CG1 VAL A 48 -8.018 -31.689 8.296 1.00 0.00 C ATOM 675 CG2 VAL A 48 -10.021 -32.574 7.095 1.00 0.00 C ATOM 0 H VAL A 48 -9.357 -31.785 4.566 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.549 -29.973 6.713 1.00 0.00 H new ATOM 0 HB VAL A 48 -8.003 -32.569 6.329 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -7.907 -32.644 8.809 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -7.039 -31.225 8.176 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -8.660 -31.034 8.885 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -9.906 -33.526 7.612 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -10.665 -31.918 7.681 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -10.471 -32.745 6.117 1.00 0.00 H new ATOM 685 N ASN A 49 -6.574 -30.249 5.309 1.00 0.00 N ATOM 686 CA ASN A 49 -5.267 -29.614 5.221 1.00 0.00 C ATOM 687 C ASN A 49 -5.423 -28.131 4.901 1.00 0.00 C ATOM 688 O ASN A 49 -4.716 -27.291 5.453 1.00 0.00 O ATOM 689 CB ASN A 49 -4.433 -30.291 4.131 1.00 0.00 C ATOM 690 CG ASN A 49 -3.084 -29.592 3.996 1.00 0.00 C ATOM 691 OD1 ASN A 49 -2.862 -28.849 3.041 1.00 0.00 O ATOM 692 ND2 ASN A 49 -2.166 -29.788 4.902 1.00 0.00 N ATOM 0 H ASN A 49 -6.721 -31.016 4.653 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.760 -29.718 6.180 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -4.284 -31.343 4.376 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -4.966 -30.258 3.181 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -1.261 -29.325 4.820 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -2.353 -30.405 5.693 1.00 0.00 H new ATOM 699 N VAL A 50 -6.355 -27.820 4.010 1.00 0.00 N ATOM 700 CA VAL A 50 -6.601 -26.435 3.629 1.00 0.00 C ATOM 701 C VAL A 50 -7.154 -25.642 4.803 1.00 0.00 C ATOM 702 O VAL A 50 -6.770 -24.497 5.031 1.00 0.00 O ATOM 703 CB VAL A 50 -7.576 -26.372 2.448 1.00 0.00 C ATOM 704 CG1 VAL A 50 -7.931 -24.912 2.152 1.00 0.00 C ATOM 705 CG2 VAL A 50 -6.916 -26.994 1.216 1.00 0.00 C ATOM 0 H VAL A 50 -6.950 -28.503 3.540 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.652 -25.992 3.329 1.00 0.00 H new ATOM 0 HB VAL A 50 -8.484 -26.921 2.696 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -8.624 -24.869 1.312 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -8.397 -24.466 3.030 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -7.024 -24.360 1.903 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -7.606 -26.952 0.373 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -6.009 -26.441 0.971 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -6.662 -28.033 1.425 1.00 0.00 H new ATOM 715 N ASP A 51 -8.065 -26.260 5.533 1.00 0.00 N ATOM 716 CA ASP A 51 -8.693 -25.609 6.681 1.00 0.00 C ATOM 717 C ASP A 51 -7.644 -25.190 7.708 1.00 0.00 C ATOM 718 O ASP A 51 -7.948 -24.480 8.666 1.00 0.00 O ATOM 719 CB ASP A 51 -9.698 -26.556 7.341 1.00 0.00 C ATOM 720 CG ASP A 51 -10.922 -26.724 6.446 1.00 0.00 C ATOM 721 OD1 ASP A 51 -11.056 -25.954 5.509 1.00 0.00 O ATOM 722 OD2 ASP A 51 -11.706 -27.622 6.709 1.00 0.00 O ATOM 0 H ASP A 51 -8.390 -27.211 5.356 1.00 0.00 H new ATOM 0 HA ASP A 51 -9.211 -24.720 6.322 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -9.233 -27.525 7.521 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -9.998 -26.162 8.312 1.00 0.00 H new ATOM 727 N LYS A 52 -6.414 -25.635 7.499 1.00 0.00 N ATOM 728 CA LYS A 52 -5.323 -25.308 8.404 1.00 0.00 C ATOM 729 C LYS A 52 -5.077 -23.807 8.416 1.00 0.00 C ATOM 730 O LYS A 52 -4.653 -23.245 9.426 1.00 0.00 O ATOM 731 CB LYS A 52 -4.050 -26.037 7.964 1.00 0.00 C ATOM 732 CG LYS A 52 -4.260 -27.560 8.025 1.00 0.00 C ATOM 733 CD LYS A 52 -4.084 -28.067 9.463 1.00 0.00 C ATOM 734 CE LYS A 52 -4.218 -29.590 9.483 1.00 0.00 C ATOM 735 NZ LYS A 52 -3.126 -30.191 8.669 1.00 0.00 N ATOM 0 H LYS A 52 -6.147 -26.224 6.710 1.00 0.00 H new ATOM 0 HA LYS A 52 -5.594 -25.627 9.410 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -3.785 -25.740 6.949 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -3.218 -25.751 8.608 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -5.257 -27.811 7.664 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -3.548 -28.058 7.367 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -3.108 -27.771 9.848 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -4.833 -27.616 10.114 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -4.168 -29.958 10.508 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -5.189 -29.886 9.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -2.699 -30.982 9.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -3.515 -30.540 7.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -2.400 -29.471 8.476 1.00 0.00 H new ATOM 749 N VAL A 53 -5.338 -23.161 7.289 1.00 0.00 N ATOM 750 CA VAL A 53 -5.129 -21.727 7.190 1.00 0.00 C ATOM 751 C VAL A 53 -5.988 -20.990 8.209 1.00 0.00 C ATOM 752 O VAL A 53 -5.604 -19.938 8.719 1.00 0.00 O ATOM 753 CB VAL A 53 -5.485 -21.242 5.783 1.00 0.00 C ATOM 754 CG1 VAL A 53 -6.986 -21.435 5.536 1.00 0.00 C ATOM 755 CG2 VAL A 53 -5.132 -19.757 5.647 1.00 0.00 C ATOM 0 H VAL A 53 -5.691 -23.602 6.440 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.079 -21.519 7.394 1.00 0.00 H new ATOM 0 HB VAL A 53 -4.920 -21.818 5.050 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.237 -21.089 4.533 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.237 -22.492 5.629 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.552 -20.862 6.270 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -5.386 -19.413 4.644 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.694 -19.181 6.382 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -4.064 -19.620 5.818 1.00 0.00 H new ATOM 765 N LEU A 54 -7.156 -21.550 8.498 1.00 0.00 N ATOM 766 CA LEU A 54 -8.070 -20.940 9.454 1.00 0.00 C ATOM 767 C LEU A 54 -7.446 -20.879 10.841 1.00 0.00 C ATOM 768 O LEU A 54 -7.614 -19.898 11.568 1.00 0.00 O ATOM 769 CB LEU A 54 -9.381 -21.730 9.517 1.00 0.00 C ATOM 770 CG LEU A 54 -10.494 -20.860 10.139 1.00 0.00 C ATOM 771 CD1 LEU A 54 -11.183 -20.020 9.055 1.00 0.00 C ATOM 772 CD2 LEU A 54 -11.537 -21.758 10.817 1.00 0.00 C ATOM 0 H LEU A 54 -7.491 -22.421 8.086 1.00 0.00 H new ATOM 0 HA LEU A 54 -8.276 -19.924 9.118 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -9.673 -22.046 8.516 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -9.242 -22.634 10.109 1.00 0.00 H new ATOM 0 HG LEU A 54 -10.044 -20.195 10.876 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -11.966 -19.412 9.509 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -10.450 -19.370 8.577 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -11.624 -20.680 8.308 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -12.320 -21.139 11.255 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -11.975 -22.429 10.078 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -11.058 -22.345 11.601 1.00 0.00 H new ATOM 784 N GLU A 55 -6.735 -21.938 11.203 1.00 0.00 N ATOM 785 CA GLU A 55 -6.092 -22.010 12.515 1.00 0.00 C ATOM 786 C GLU A 55 -5.493 -20.659 12.895 1.00 0.00 C ATOM 787 O GLU A 55 -6.129 -19.860 13.584 1.00 0.00 O ATOM 788 CB GLU A 55 -4.987 -23.070 12.495 1.00 0.00 C ATOM 789 CG GLU A 55 -5.600 -24.451 12.251 1.00 0.00 C ATOM 790 CD GLU A 55 -6.469 -24.856 13.436 1.00 0.00 C ATOM 791 OE1 GLU A 55 -6.272 -24.301 14.505 1.00 0.00 O ATOM 792 OE2 GLU A 55 -7.321 -25.711 13.259 1.00 0.00 O ATOM 0 H GLU A 55 -6.587 -22.757 10.613 1.00 0.00 H new ATOM 0 HA GLU A 55 -6.846 -22.281 13.254 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -4.263 -22.840 11.713 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -4.447 -23.064 13.442 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.198 -24.436 11.340 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -4.810 -25.187 12.101 1.00 0.00 H new ATOM 799 N ARG A 56 -4.275 -20.408 12.436 1.00 0.00 N ATOM 800 CA ARG A 56 -3.606 -19.149 12.733 1.00 0.00 C ATOM 801 C ARG A 56 -4.236 -18.007 11.942 1.00 0.00 C ATOM 802 O ARG A 56 -5.200 -17.387 12.394 1.00 0.00 O ATOM 803 CB ARG A 56 -2.119 -19.261 12.383 1.00 0.00 C ATOM 804 CG ARG A 56 -1.471 -20.399 13.180 1.00 0.00 C ATOM 805 CD ARG A 56 -1.266 -19.979 14.638 1.00 0.00 C ATOM 806 NE ARG A 56 -0.431 -20.954 15.330 1.00 0.00 N ATOM 807 CZ ARG A 56 -0.542 -21.148 16.642 1.00 0.00 C ATOM 808 NH1 ARG A 56 -1.414 -20.464 17.332 1.00 0.00 N ATOM 809 NH2 ARG A 56 0.223 -22.018 17.237 1.00 0.00 N ATOM 0 H ARG A 56 -3.733 -21.053 11.861 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.716 -18.938 13.797 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -2.002 -19.443 11.315 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -1.614 -18.320 12.603 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -2.101 -21.287 13.136 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -0.513 -20.665 12.733 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -0.799 -18.995 14.678 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -2.230 -19.895 15.139 1.00 0.00 H new ATOM 0 HE ARG A 56 0.250 -21.497 14.799 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -2.011 -19.781 16.866 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -1.499 -20.613 18.337 1.00 0.00 H new ATOM 0 HH21 ARG A 56 0.906 -22.550 16.698 1.00 0.00 H new ATOM 0 HH22 ARG A 56 0.139 -22.168 18.242 1.00 0.00 H new ATOM 823 N ASP A 57 -3.687 -17.729 10.764 1.00 0.00 N ATOM 824 CA ASP A 57 -4.201 -16.655 9.923 1.00 0.00 C ATOM 825 C ASP A 57 -3.876 -16.926 8.460 1.00 0.00 C ATOM 826 O ASP A 57 -3.209 -17.909 8.132 1.00 0.00 O ATOM 827 CB ASP A 57 -3.583 -15.322 10.350 1.00 0.00 C ATOM 828 CG ASP A 57 -4.059 -14.952 11.751 1.00 0.00 C ATOM 829 OD1 ASP A 57 -5.251 -15.055 11.998 1.00 0.00 O ATOM 830 OD2 ASP A 57 -3.227 -14.568 12.556 1.00 0.00 O ATOM 0 H ASP A 57 -2.890 -18.230 10.372 1.00 0.00 H new ATOM 0 HA ASP A 57 -5.284 -16.606 10.040 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -2.496 -15.394 10.334 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -3.861 -14.540 9.644 1.00 0.00 H new ATOM 835 N GLN A 58 -4.357 -16.053 7.583 1.00 0.00 N ATOM 836 CA GLN A 58 -4.119 -16.207 6.157 1.00 0.00 C ATOM 837 C GLN A 58 -2.626 -16.327 5.871 1.00 0.00 C ATOM 838 O GLN A 58 -1.794 -15.907 6.674 1.00 0.00 O ATOM 839 CB GLN A 58 -4.688 -15.003 5.403 1.00 0.00 C ATOM 840 CG GLN A 58 -6.196 -14.907 5.648 1.00 0.00 C ATOM 841 CD GLN A 58 -6.902 -16.120 5.052 1.00 0.00 C ATOM 842 OE1 GLN A 58 -6.634 -16.497 3.912 1.00 0.00 O ATOM 843 NE2 GLN A 58 -7.798 -16.753 5.758 1.00 0.00 N ATOM 0 H GLN A 58 -4.912 -15.235 7.835 1.00 0.00 H new ATOM 0 HA GLN A 58 -4.615 -17.117 5.821 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -4.197 -14.088 5.735 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -4.489 -15.102 4.336 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -6.396 -14.850 6.718 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -6.587 -13.993 5.201 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -8.018 -16.438 6.703 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -8.278 -17.563 5.365 1.00 0.00 H new ATOM 852 N LYS A 59 -2.296 -16.905 4.721 1.00 0.00 N ATOM 853 CA LYS A 59 -0.900 -17.077 4.339 1.00 0.00 C ATOM 854 C LYS A 59 -0.213 -15.723 4.186 1.00 0.00 C ATOM 855 O LYS A 59 0.935 -15.548 4.600 1.00 0.00 O ATOM 856 CB LYS A 59 -0.809 -17.849 3.021 1.00 0.00 C ATOM 857 CG LYS A 59 -1.266 -19.291 3.241 1.00 0.00 C ATOM 858 CD LYS A 59 -1.170 -20.067 1.924 1.00 0.00 C ATOM 859 CE LYS A 59 -1.575 -21.524 2.160 1.00 0.00 C ATOM 860 NZ LYS A 59 -2.992 -21.579 2.614 1.00 0.00 N ATOM 0 H LYS A 59 -2.970 -17.260 4.043 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.396 -17.640 5.125 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -1.431 -17.371 2.264 1.00 0.00 H new ATOM 0 HB3 LYS A 59 0.215 -17.834 2.649 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -0.647 -19.767 4.001 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -2.292 -19.306 3.610 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -1.820 -19.615 1.175 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -0.153 -20.019 1.535 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -1.454 -22.099 1.242 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -0.925 -21.977 2.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -3.366 -22.538 2.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -3.042 -21.338 3.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -3.558 -20.899 2.067 1.00 0.00 H new ATOM 874 N LEU A 60 -0.918 -14.768 3.586 1.00 0.00 N ATOM 875 CA LEU A 60 -0.364 -13.436 3.378 1.00 0.00 C ATOM 876 C LEU A 60 -1.486 -12.424 3.150 1.00 0.00 C ATOM 877 O LEU A 60 -1.231 -11.235 2.957 1.00 0.00 O ATOM 878 CB LEU A 60 0.589 -13.448 2.169 1.00 0.00 C ATOM 879 CG LEU A 60 0.097 -14.465 1.134 1.00 0.00 C ATOM 880 CD1 LEU A 60 -1.341 -14.127 0.717 1.00 0.00 C ATOM 881 CD2 LEU A 60 1.010 -14.416 -0.095 1.00 0.00 C ATOM 0 H LEU A 60 -1.869 -14.891 3.237 1.00 0.00 H new ATOM 0 HA LEU A 60 0.193 -13.144 4.268 1.00 0.00 H new ATOM 0 HB2 LEU A 60 0.638 -12.455 1.722 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.598 -13.703 2.492 1.00 0.00 H new ATOM 0 HG LEU A 60 0.119 -15.464 1.569 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.687 -14.853 -0.019 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.991 -14.160 1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.368 -13.128 0.282 1.00 0.00 H new ATOM 0 HD21 LEU A 60 0.664 -15.138 -0.834 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.986 -13.415 -0.526 1.00 0.00 H new ATOM 0 HD23 LEU A 60 2.031 -14.660 0.200 1.00 0.00 H new ATOM 893 N SER A 61 -2.729 -12.903 3.168 1.00 0.00 N ATOM 894 CA SER A 61 -3.882 -12.036 2.955 1.00 0.00 C ATOM 895 C SER A 61 -4.375 -11.464 4.279 1.00 0.00 C ATOM 896 O SER A 61 -5.570 -11.488 4.572 1.00 0.00 O ATOM 897 CB SER A 61 -5.005 -12.826 2.283 1.00 0.00 C ATOM 898 OG SER A 61 -4.451 -13.663 1.277 1.00 0.00 O ATOM 0 H SER A 61 -2.961 -13.883 3.327 1.00 0.00 H new ATOM 0 HA SER A 61 -3.582 -11.210 2.310 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.535 -13.427 3.022 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.734 -12.144 1.845 1.00 0.00 H new ATOM 0 HG SER A 61 -5.168 -14.173 0.845 1.00 0.00 H new ATOM 904 N GLU A 62 -3.445 -10.953 5.080 1.00 0.00 N ATOM 905 CA GLU A 62 -3.794 -10.383 6.372 1.00 0.00 C ATOM 906 C GLU A 62 -4.675 -9.150 6.197 1.00 0.00 C ATOM 907 O GLU A 62 -5.596 -8.917 6.981 1.00 0.00 O ATOM 908 CB GLU A 62 -2.525 -10.000 7.136 1.00 0.00 C ATOM 909 CG GLU A 62 -1.764 -11.269 7.527 1.00 0.00 C ATOM 910 CD GLU A 62 -0.449 -10.901 8.208 1.00 0.00 C ATOM 911 OE1 GLU A 62 -0.193 -9.717 8.353 1.00 0.00 O ATOM 912 OE2 GLU A 62 0.280 -11.807 8.574 1.00 0.00 O ATOM 0 H GLU A 62 -2.450 -10.923 4.857 1.00 0.00 H new ATOM 0 HA GLU A 62 -4.347 -11.133 6.938 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -1.895 -9.361 6.518 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -2.783 -9.428 8.027 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.373 -11.876 8.197 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.568 -11.873 6.641 1.00 0.00 H new ATOM 919 N LEU A 63 -4.387 -8.361 5.165 1.00 0.00 N ATOM 920 CA LEU A 63 -5.153 -7.151 4.890 1.00 0.00 C ATOM 921 C LEU A 63 -6.361 -7.469 4.018 1.00 0.00 C ATOM 922 O LEU A 63 -6.862 -6.608 3.295 1.00 0.00 O ATOM 923 CB LEU A 63 -4.267 -6.121 4.186 1.00 0.00 C ATOM 924 CG LEU A 63 -2.962 -5.943 4.970 1.00 0.00 C ATOM 925 CD1 LEU A 63 -2.057 -4.955 4.229 1.00 0.00 C ATOM 926 CD2 LEU A 63 -3.265 -5.407 6.379 1.00 0.00 C ATOM 0 H LEU A 63 -3.629 -8.539 4.506 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.503 -6.741 5.837 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.050 -6.448 3.169 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -4.790 -5.168 4.110 1.00 0.00 H new ATOM 0 HG LEU A 63 -2.460 -6.907 5.057 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.128 -4.826 4.784 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.835 -5.341 3.234 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -2.563 -3.994 4.141 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.332 -5.283 6.930 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.771 -4.445 6.301 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.907 -6.113 6.906 1.00 0.00 H new ATOM 938 N ASP A 64 -6.823 -8.713 4.092 1.00 0.00 N ATOM 939 CA ASP A 64 -7.975 -9.134 3.303 1.00 0.00 C ATOM 940 C ASP A 64 -9.213 -8.332 3.691 1.00 0.00 C ATOM 941 O ASP A 64 -10.021 -7.965 2.838 1.00 0.00 O ATOM 942 CB ASP A 64 -8.239 -10.623 3.527 1.00 0.00 C ATOM 943 CG ASP A 64 -8.394 -10.911 5.018 1.00 0.00 C ATOM 944 OD1 ASP A 64 -8.179 -10.005 5.804 1.00 0.00 O ATOM 945 OD2 ASP A 64 -8.721 -12.039 5.350 1.00 0.00 O ATOM 0 H ASP A 64 -6.422 -9.441 4.684 1.00 0.00 H new ATOM 0 HA ASP A 64 -7.758 -8.956 2.250 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -9.141 -10.924 2.995 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -7.417 -11.211 3.119 1.00 0.00 H new ATOM 950 N ASP A 65 -9.357 -8.067 4.984 1.00 0.00 N ATOM 951 CA ASP A 65 -10.500 -7.307 5.476 1.00 0.00 C ATOM 952 C ASP A 65 -10.437 -5.864 4.978 1.00 0.00 C ATOM 953 O ASP A 65 -11.404 -5.113 5.101 1.00 0.00 O ATOM 954 CB ASP A 65 -10.516 -7.317 7.005 1.00 0.00 C ATOM 955 CG ASP A 65 -11.836 -6.750 7.520 1.00 0.00 C ATOM 956 OD1 ASP A 65 -12.638 -6.333 6.700 1.00 0.00 O ATOM 957 OD2 ASP A 65 -12.027 -6.748 8.724 1.00 0.00 O ATOM 0 H ASP A 65 -8.702 -8.365 5.707 1.00 0.00 H new ATOM 0 HA ASP A 65 -11.411 -7.773 5.100 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -10.381 -8.335 7.371 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -9.684 -6.727 7.389 1.00 0.00 H new ATOM 962 N ARG A 66 -9.293 -5.485 4.417 1.00 0.00 N ATOM 963 CA ARG A 66 -9.118 -4.131 3.904 1.00 0.00 C ATOM 964 C ARG A 66 -9.292 -3.109 5.022 1.00 0.00 C ATOM 965 O ARG A 66 -10.275 -2.367 5.051 1.00 0.00 O ATOM 966 CB ARG A 66 -10.136 -3.856 2.795 1.00 0.00 C ATOM 967 CG ARG A 66 -9.732 -2.592 2.033 1.00 0.00 C ATOM 968 CD ARG A 66 -10.731 -2.338 0.902 1.00 0.00 C ATOM 969 NE ARG A 66 -12.040 -2.004 1.450 1.00 0.00 N ATOM 970 CZ ARG A 66 -13.092 -1.832 0.657 1.00 0.00 C ATOM 971 NH1 ARG A 66 -12.965 -1.965 -0.634 1.00 0.00 N ATOM 972 NH2 ARG A 66 -14.254 -1.530 1.171 1.00 0.00 N ATOM 0 H ARG A 66 -8.480 -6.091 4.307 1.00 0.00 H new ATOM 0 HA ARG A 66 -8.109 -4.043 3.500 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -10.185 -4.705 2.113 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -11.131 -3.733 3.223 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -9.708 -1.738 2.710 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -8.727 -2.705 1.627 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -10.376 -1.525 0.269 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -10.808 -3.223 0.270 1.00 0.00 H new ATOM 0 HE ARG A 66 -12.150 -1.901 2.459 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -12.058 -2.201 -1.036 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -13.773 -1.833 -1.242 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -14.354 -1.426 2.181 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -15.062 -1.398 0.563 1.00 0.00 H new ATOM 986 N ALA A 67 -8.334 -3.073 5.942 1.00 0.00 N ATOM 987 CA ALA A 67 -8.392 -2.137 7.058 1.00 0.00 C ATOM 988 C ALA A 67 -8.264 -0.701 6.561 1.00 0.00 C ATOM 989 O ALA A 67 -7.520 -0.423 5.620 1.00 0.00 O ATOM 990 CB ALA A 67 -7.267 -2.437 8.050 1.00 0.00 C ATOM 0 H ALA A 67 -7.513 -3.678 5.937 1.00 0.00 H new ATOM 0 HA ALA A 67 -9.355 -2.253 7.555 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -7.317 -1.733 8.881 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -7.377 -3.453 8.428 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -6.304 -2.338 7.549 1.00 0.00 H new ATOM 996 N ASP A 68 -8.997 0.207 7.195 1.00 0.00 N ATOM 997 CA ASP A 68 -8.962 1.609 6.809 1.00 0.00 C ATOM 998 C ASP A 68 -7.559 2.179 6.989 1.00 0.00 C ATOM 999 O ASP A 68 -7.065 2.915 6.136 1.00 0.00 O ATOM 1000 CB ASP A 68 -9.953 2.412 7.654 1.00 0.00 C ATOM 1001 CG ASP A 68 -11.382 2.085 7.234 1.00 0.00 C ATOM 1002 OD1 ASP A 68 -11.551 1.503 6.175 1.00 0.00 O ATOM 1003 OD2 ASP A 68 -12.287 2.418 7.980 1.00 0.00 O ATOM 0 H ASP A 68 -9.620 -0.003 7.975 1.00 0.00 H new ATOM 0 HA ASP A 68 -9.241 1.682 5.758 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -9.814 2.181 8.710 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -9.765 3.479 7.534 1.00 0.00 H new ATOM 1008 N ALA A 69 -6.923 1.832 8.105 1.00 0.00 N ATOM 1009 CA ALA A 69 -5.576 2.312 8.390 1.00 0.00 C ATOM 1010 C ALA A 69 -5.601 3.792 8.768 1.00 0.00 C ATOM 1011 O ALA A 69 -4.574 4.370 9.128 1.00 0.00 O ATOM 1012 CB ALA A 69 -4.670 2.099 7.166 1.00 0.00 C ATOM 0 H ALA A 69 -7.317 1.223 8.823 1.00 0.00 H new ATOM 0 HA ALA A 69 -5.179 1.745 9.232 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -3.666 2.461 7.389 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.628 1.037 6.925 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -5.073 2.648 6.315 1.00 0.00 H new ATOM 1018 N LEU A 70 -6.781 4.401 8.680 1.00 0.00 N ATOM 1019 CA LEU A 70 -6.930 5.816 9.010 1.00 0.00 C ATOM 1020 C LEU A 70 -7.167 5.990 10.505 1.00 0.00 C ATOM 1021 O LEU A 70 -8.305 6.133 10.953 1.00 0.00 O ATOM 1022 CB LEU A 70 -8.109 6.405 8.232 1.00 0.00 C ATOM 1023 CG LEU A 70 -7.910 6.160 6.731 1.00 0.00 C ATOM 1024 CD1 LEU A 70 -9.126 6.695 5.965 1.00 0.00 C ATOM 1025 CD2 LEU A 70 -6.634 6.872 6.242 1.00 0.00 C ATOM 0 H LEU A 70 -7.642 3.941 8.385 1.00 0.00 H new ATOM 0 HA LEU A 70 -6.014 6.338 8.735 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -9.041 5.949 8.565 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -8.190 7.474 8.429 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.806 5.090 6.553 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -8.988 6.523 4.898 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -10.025 6.179 6.303 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -9.231 7.764 6.149 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -6.503 6.691 5.175 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -6.724 7.944 6.420 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.771 6.486 6.784 1.00 0.00 H new ATOM 1037 N GLN A 71 -6.081 5.983 11.272 1.00 0.00 N ATOM 1038 CA GLN A 71 -6.174 6.144 12.713 1.00 0.00 C ATOM 1039 C GLN A 71 -4.785 6.256 13.333 1.00 0.00 C ATOM 1040 O GLN A 71 -4.500 7.195 14.075 1.00 0.00 O ATOM 1041 CB GLN A 71 -6.917 4.954 13.327 1.00 0.00 C ATOM 1042 CG GLN A 71 -7.045 5.156 14.837 1.00 0.00 C ATOM 1043 CD GLN A 71 -7.940 4.074 15.430 1.00 0.00 C ATOM 1044 OE1 GLN A 71 -8.659 3.392 14.701 1.00 0.00 O ATOM 1045 NE2 GLN A 71 -7.943 3.877 16.721 1.00 0.00 N ATOM 0 H GLN A 71 -5.131 5.868 10.918 1.00 0.00 H new ATOM 0 HA GLN A 71 -6.725 7.061 12.921 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -7.905 4.858 12.877 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -6.380 4.029 13.117 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -6.060 5.121 15.302 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -7.462 6.141 15.047 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -7.347 4.443 17.325 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -8.542 3.157 17.126 1.00 0.00 H new ATOM 1054 N ALA A 72 -3.924 5.291 13.023 1.00 0.00 N ATOM 1055 CA ALA A 72 -2.568 5.292 13.557 1.00 0.00 C ATOM 1056 C ALA A 72 -1.790 6.502 13.048 1.00 0.00 C ATOM 1057 O ALA A 72 -1.014 7.109 13.787 1.00 0.00 O ATOM 1058 CB ALA A 72 -1.843 4.009 13.144 1.00 0.00 C ATOM 0 H ALA A 72 -4.140 4.505 12.410 1.00 0.00 H new ATOM 0 HA ALA A 72 -2.628 5.344 14.644 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.830 4.018 13.547 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -2.381 3.145 13.534 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -1.800 3.949 12.056 1.00 0.00 H new ATOM 1064 N GLY A 73 -2.006 6.847 11.784 1.00 0.00 N ATOM 1065 CA GLY A 73 -1.321 7.987 11.186 1.00 0.00 C ATOM 1066 C GLY A 73 0.192 7.843 11.313 1.00 0.00 C ATOM 1067 O GLY A 73 0.803 8.399 12.225 1.00 0.00 O ATOM 0 H GLY A 73 -2.645 6.358 11.157 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.595 8.070 10.134 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -1.645 8.907 11.673 1.00 0.00 H new ATOM 1071 N ALA A 74 0.790 7.093 10.392 1.00 0.00 N ATOM 1072 CA ALA A 74 2.233 6.883 10.412 1.00 0.00 C ATOM 1073 C ALA A 74 2.653 6.175 11.695 1.00 0.00 C ATOM 1074 O ALA A 74 2.207 6.530 12.788 1.00 0.00 O ATOM 1075 CB ALA A 74 2.959 8.226 10.304 1.00 0.00 C ATOM 0 H ALA A 74 0.302 6.624 9.629 1.00 0.00 H new ATOM 0 HA ALA A 74 2.502 6.257 9.561 1.00 0.00 H new ATOM 0 HB1 ALA A 74 4.036 8.060 10.320 1.00 0.00 H new ATOM 0 HB2 ALA A 74 2.681 8.716 9.371 1.00 0.00 H new ATOM 0 HB3 ALA A 74 2.678 8.860 11.145 1.00 0.00 H new ATOM 1081 N SER A 75 3.515 5.171 11.559 1.00 0.00 N ATOM 1082 CA SER A 75 3.989 4.420 12.711 1.00 0.00 C ATOM 1083 C SER A 75 5.304 3.716 12.390 1.00 0.00 C ATOM 1084 O SER A 75 5.639 3.508 11.225 1.00 0.00 O ATOM 1085 CB SER A 75 2.946 3.387 13.127 1.00 0.00 C ATOM 1086 OG SER A 75 1.693 4.034 13.315 1.00 0.00 O ATOM 0 H SER A 75 3.897 4.862 10.665 1.00 0.00 H new ATOM 0 HA SER A 75 4.155 5.119 13.531 1.00 0.00 H new ATOM 0 HB2 SER A 75 2.858 2.614 12.364 1.00 0.00 H new ATOM 0 HB3 SER A 75 3.255 2.892 14.048 1.00 0.00 H new ATOM 0 HG SER A 75 1.841 4.981 13.518 1.00 0.00 H new ATOM 1092 N GLN A 76 6.042 3.352 13.432 1.00 0.00 N ATOM 1093 CA GLN A 76 7.320 2.668 13.259 1.00 0.00 C ATOM 1094 C GLN A 76 8.263 3.516 12.407 1.00 0.00 C ATOM 1095 O GLN A 76 9.389 3.112 12.120 1.00 0.00 O ATOM 1096 CB GLN A 76 7.095 1.308 12.587 1.00 0.00 C ATOM 1097 CG GLN A 76 8.330 0.416 12.773 1.00 0.00 C ATOM 1098 CD GLN A 76 8.048 -0.986 12.249 1.00 0.00 C ATOM 1099 OE1 GLN A 76 6.890 -1.386 12.128 1.00 0.00 O ATOM 1100 NE2 GLN A 76 9.048 -1.759 11.925 1.00 0.00 N ATOM 0 H GLN A 76 5.779 3.518 14.404 1.00 0.00 H new ATOM 0 HA GLN A 76 7.772 2.515 14.239 1.00 0.00 H new ATOM 0 HB2 GLN A 76 6.218 0.822 13.016 1.00 0.00 H new ATOM 0 HB3 GLN A 76 6.894 1.447 11.525 1.00 0.00 H new ATOM 0 HG2 GLN A 76 9.181 0.846 12.245 1.00 0.00 H new ATOM 0 HG3 GLN A 76 8.600 0.371 13.828 1.00 0.00 H new ATOM 0 HE21 GLN A 76 10.006 -1.423 12.027 1.00 0.00 H new ATOM 0 HE22 GLN A 76 8.872 -2.699 11.570 1.00 0.00 H new ATOM 1109 N PHE A 77 7.796 4.694 12.002 1.00 0.00 N ATOM 1110 CA PHE A 77 8.608 5.586 11.180 1.00 0.00 C ATOM 1111 C PHE A 77 9.066 4.878 9.909 1.00 0.00 C ATOM 1112 O PHE A 77 9.821 5.436 9.113 1.00 0.00 O ATOM 1113 CB PHE A 77 9.830 6.049 11.968 1.00 0.00 C ATOM 1114 CG PHE A 77 9.382 6.816 13.189 1.00 0.00 C ATOM 1115 CD1 PHE A 77 9.018 8.163 13.074 1.00 0.00 C ATOM 1116 CD2 PHE A 77 9.327 6.181 14.437 1.00 0.00 C ATOM 1117 CE1 PHE A 77 8.602 8.876 14.205 1.00 0.00 C ATOM 1118 CE2 PHE A 77 8.912 6.894 15.568 1.00 0.00 C ATOM 1119 CZ PHE A 77 8.548 8.241 15.451 1.00 0.00 C ATOM 0 H PHE A 77 6.867 5.051 12.227 1.00 0.00 H new ATOM 0 HA PHE A 77 8.000 6.448 10.905 1.00 0.00 H new ATOM 0 HB2 PHE A 77 10.431 5.190 12.266 1.00 0.00 H new ATOM 0 HB3 PHE A 77 10.462 6.679 11.342 1.00 0.00 H new ATOM 0 HD1 PHE A 77 9.058 8.653 12.112 1.00 0.00 H new ATOM 0 HD2 PHE A 77 9.605 5.141 14.526 1.00 0.00 H new ATOM 0 HE1 PHE A 77 8.323 9.916 14.116 1.00 0.00 H new ATOM 0 HE2 PHE A 77 8.873 6.405 16.530 1.00 0.00 H new ATOM 0 HZ PHE A 77 8.225 8.790 16.323 1.00 0.00 H new ATOM 1129 N GLU A 78 8.604 3.648 9.728 1.00 0.00 N ATOM 1130 CA GLU A 78 8.970 2.868 8.548 1.00 0.00 C ATOM 1131 C GLU A 78 8.714 3.670 7.277 1.00 0.00 C ATOM 1132 O GLU A 78 9.257 3.360 6.216 1.00 0.00 O ATOM 1133 CB GLU A 78 8.161 1.567 8.508 1.00 0.00 C ATOM 1134 CG GLU A 78 6.667 1.892 8.401 1.00 0.00 C ATOM 1135 CD GLU A 78 5.847 0.608 8.466 1.00 0.00 C ATOM 1136 OE1 GLU A 78 6.314 -0.397 7.958 1.00 0.00 O ATOM 1137 OE2 GLU A 78 4.765 0.649 9.029 1.00 0.00 O ATOM 0 H GLU A 78 7.979 3.169 10.377 1.00 0.00 H new ATOM 0 HA GLU A 78 10.032 2.631 8.607 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.473 0.959 7.658 1.00 0.00 H new ATOM 0 HB3 GLU A 78 8.352 0.981 9.407 1.00 0.00 H new ATOM 0 HG2 GLU A 78 6.374 2.562 9.209 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.466 2.414 7.466 1.00 0.00 H new ATOM 1144 N THR A 79 7.884 4.702 7.392 1.00 0.00 N ATOM 1145 CA THR A 79 7.562 5.539 6.243 1.00 0.00 C ATOM 1146 C THR A 79 8.801 6.287 5.760 1.00 0.00 C ATOM 1147 O THR A 79 9.017 6.438 4.557 1.00 0.00 O ATOM 1148 CB THR A 79 6.474 6.547 6.621 1.00 0.00 C ATOM 1149 OG1 THR A 79 6.856 7.232 7.805 1.00 0.00 O ATOM 1150 CG2 THR A 79 5.154 5.811 6.858 1.00 0.00 C ATOM 0 H THR A 79 7.426 4.977 8.261 1.00 0.00 H new ATOM 0 HA THR A 79 7.202 4.897 5.439 1.00 0.00 H new ATOM 0 HB THR A 79 6.346 7.265 5.811 1.00 0.00 H new ATOM 0 HG1 THR A 79 6.161 7.879 8.047 1.00 0.00 H new ATOM 0 HG21 THR A 79 4.380 6.530 7.127 1.00 0.00 H new ATOM 0 HG22 THR A 79 4.862 5.286 5.948 1.00 0.00 H new ATOM 0 HG23 THR A 79 5.279 5.092 7.668 1.00 0.00 H new ATOM 1158 N SER A 80 9.613 6.753 6.704 1.00 0.00 N ATOM 1159 CA SER A 80 10.827 7.483 6.359 1.00 0.00 C ATOM 1160 C SER A 80 11.767 6.606 5.537 1.00 0.00 C ATOM 1161 O SER A 80 12.358 7.061 4.558 1.00 0.00 O ATOM 1162 CB SER A 80 11.537 7.943 7.633 1.00 0.00 C ATOM 1163 OG SER A 80 10.692 8.834 8.347 1.00 0.00 O ATOM 0 H SER A 80 9.454 6.639 7.705 1.00 0.00 H new ATOM 0 HA SER A 80 10.549 8.352 5.763 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.786 7.083 8.255 1.00 0.00 H new ATOM 0 HB3 SER A 80 12.476 8.437 7.382 1.00 0.00 H new ATOM 0 HG SER A 80 11.144 9.129 9.165 1.00 0.00 H new ATOM 1169 N ALA A 81 11.899 5.348 5.943 1.00 0.00 N ATOM 1170 CA ALA A 81 12.769 4.413 5.238 1.00 0.00 C ATOM 1171 C ALA A 81 12.278 4.192 3.812 1.00 0.00 C ATOM 1172 O ALA A 81 13.059 3.854 2.921 1.00 0.00 O ATOM 1173 CB ALA A 81 12.811 3.075 5.979 1.00 0.00 C ATOM 0 H ALA A 81 11.418 4.954 6.751 1.00 0.00 H new ATOM 0 HA ALA A 81 13.772 4.839 5.202 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.463 2.384 5.445 1.00 0.00 H new ATOM 0 HB2 ALA A 81 13.194 3.230 6.988 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.806 2.657 6.033 1.00 0.00 H new ATOM 1179 N ALA A 82 10.981 4.386 3.602 1.00 0.00 N ATOM 1180 CA ALA A 82 10.398 4.203 2.280 1.00 0.00 C ATOM 1181 C ALA A 82 11.038 5.158 1.281 1.00 0.00 C ATOM 1182 O ALA A 82 11.222 4.817 0.113 1.00 0.00 O ATOM 1183 CB ALA A 82 8.888 4.455 2.333 1.00 0.00 C ATOM 0 H ALA A 82 10.318 4.668 4.324 1.00 0.00 H new ATOM 0 HA ALA A 82 10.583 3.178 1.960 1.00 0.00 H new ATOM 0 HB1 ALA A 82 8.461 4.316 1.340 1.00 0.00 H new ATOM 0 HB2 ALA A 82 8.426 3.754 3.028 1.00 0.00 H new ATOM 0 HB3 ALA A 82 8.701 5.475 2.669 1.00 0.00 H new ATOM 1189 N LYS A 83 11.370 6.355 1.745 1.00 0.00 N ATOM 1190 CA LYS A 83 11.981 7.345 0.873 1.00 0.00 C ATOM 1191 C LYS A 83 13.309 6.828 0.329 1.00 0.00 C ATOM 1192 O LYS A 83 13.580 6.926 -0.867 1.00 0.00 O ATOM 1193 CB LYS A 83 12.213 8.649 1.645 1.00 0.00 C ATOM 1194 CG LYS A 83 12.783 9.738 0.721 1.00 0.00 C ATOM 1195 CD LYS A 83 11.745 10.130 -0.340 1.00 0.00 C ATOM 1196 CE LYS A 83 12.102 11.492 -0.933 1.00 0.00 C ATOM 1197 NZ LYS A 83 13.411 11.391 -1.636 1.00 0.00 N ATOM 0 H LYS A 83 11.228 6.660 2.708 1.00 0.00 H new ATOM 0 HA LYS A 83 11.308 7.534 0.037 1.00 0.00 H new ATOM 0 HB2 LYS A 83 11.274 8.991 2.081 1.00 0.00 H new ATOM 0 HB3 LYS A 83 12.901 8.470 2.471 1.00 0.00 H new ATOM 0 HG2 LYS A 83 13.062 10.613 1.308 1.00 0.00 H new ATOM 0 HG3 LYS A 83 13.690 9.376 0.237 1.00 0.00 H new ATOM 0 HD2 LYS A 83 11.714 9.377 -1.127 1.00 0.00 H new ATOM 0 HD3 LYS A 83 10.751 10.166 0.106 1.00 0.00 H new ATOM 0 HE2 LYS A 83 11.326 11.814 -1.628 1.00 0.00 H new ATOM 0 HE3 LYS A 83 12.156 12.243 -0.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 13.549 12.230 -2.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 14.178 11.336 -0.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 13.422 10.536 -2.229 1.00 0.00 H new ATOM 1211 N LEU A 84 14.132 6.285 1.217 1.00 0.00 N ATOM 1212 CA LEU A 84 15.431 5.761 0.816 1.00 0.00 C ATOM 1213 C LEU A 84 15.260 4.584 -0.134 1.00 0.00 C ATOM 1214 O LEU A 84 15.998 4.445 -1.108 1.00 0.00 O ATOM 1215 CB LEU A 84 16.221 5.323 2.050 1.00 0.00 C ATOM 1216 CG LEU A 84 16.263 6.470 3.067 1.00 0.00 C ATOM 1217 CD1 LEU A 84 17.030 6.014 4.312 1.00 0.00 C ATOM 1218 CD2 LEU A 84 16.958 7.696 2.448 1.00 0.00 C ATOM 0 H LEU A 84 13.925 6.196 2.212 1.00 0.00 H new ATOM 0 HA LEU A 84 15.980 6.549 0.300 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.758 4.443 2.497 1.00 0.00 H new ATOM 0 HB3 LEU A 84 17.234 5.040 1.764 1.00 0.00 H new ATOM 0 HG LEU A 84 15.245 6.744 3.345 1.00 0.00 H new ATOM 0 HD11 LEU A 84 17.062 6.827 5.038 1.00 0.00 H new ATOM 0 HD12 LEU A 84 16.528 5.153 4.754 1.00 0.00 H new ATOM 0 HD13 LEU A 84 18.046 5.737 4.032 1.00 0.00 H new ATOM 0 HD21 LEU A 84 16.984 8.506 3.177 1.00 0.00 H new ATOM 0 HD22 LEU A 84 17.976 7.432 2.163 1.00 0.00 H new ATOM 0 HD23 LEU A 84 16.407 8.020 1.565 1.00 0.00 H new ATOM 1230 N LYS A 85 14.281 3.740 0.158 1.00 0.00 N ATOM 1231 CA LYS A 85 14.013 2.575 -0.676 1.00 0.00 C ATOM 1232 C LYS A 85 13.575 2.999 -2.072 1.00 0.00 C ATOM 1233 O LYS A 85 13.912 2.353 -3.063 1.00 0.00 O ATOM 1234 CB LYS A 85 12.928 1.714 -0.037 1.00 0.00 C ATOM 1235 CG LYS A 85 13.478 1.067 1.236 1.00 0.00 C ATOM 1236 CD LYS A 85 12.362 0.293 1.949 1.00 0.00 C ATOM 1237 CE LYS A 85 12.075 -1.024 1.216 1.00 0.00 C ATOM 1238 NZ LYS A 85 11.239 -1.901 2.081 1.00 0.00 N ATOM 0 H LYS A 85 13.661 3.838 0.962 1.00 0.00 H new ATOM 0 HA LYS A 85 14.933 1.996 -0.760 1.00 0.00 H new ATOM 0 HB2 LYS A 85 12.056 2.324 0.199 1.00 0.00 H new ATOM 0 HB3 LYS A 85 12.599 0.945 -0.736 1.00 0.00 H new ATOM 0 HG2 LYS A 85 14.299 0.394 0.988 1.00 0.00 H new ATOM 0 HG3 LYS A 85 13.883 1.832 1.898 1.00 0.00 H new ATOM 0 HD2 LYS A 85 12.653 0.088 2.979 1.00 0.00 H new ATOM 0 HD3 LYS A 85 11.457 0.900 1.989 1.00 0.00 H new ATOM 0 HE2 LYS A 85 11.560 -0.825 0.276 1.00 0.00 H new ATOM 0 HE3 LYS A 85 13.010 -1.525 0.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 11.044 -2.794 1.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 11.747 -2.101 2.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 10.342 -1.422 2.297 1.00 0.00 H new ATOM 1252 N ARG A 86 12.810 4.081 -2.138 1.00 0.00 N ATOM 1253 CA ARG A 86 12.316 4.581 -3.417 1.00 0.00 C ATOM 1254 C ARG A 86 13.468 4.911 -4.350 1.00 0.00 C ATOM 1255 O ARG A 86 13.360 4.749 -5.560 1.00 0.00 O ATOM 1256 CB ARG A 86 11.459 5.827 -3.198 1.00 0.00 C ATOM 1257 CG ARG A 86 10.870 6.291 -4.534 1.00 0.00 C ATOM 1258 CD ARG A 86 9.708 7.254 -4.276 1.00 0.00 C ATOM 1259 NE ARG A 86 8.556 6.518 -3.765 1.00 0.00 N ATOM 1260 CZ ARG A 86 7.430 7.140 -3.433 1.00 0.00 C ATOM 1261 NH1 ARG A 86 7.341 8.435 -3.556 1.00 0.00 N ATOM 1262 NH2 ARG A 86 6.412 6.455 -2.986 1.00 0.00 N ATOM 0 H ARG A 86 12.519 4.627 -1.327 1.00 0.00 H new ATOM 0 HA ARG A 86 11.709 3.800 -3.876 1.00 0.00 H new ATOM 0 HB2 ARG A 86 10.657 5.609 -2.492 1.00 0.00 H new ATOM 0 HB3 ARG A 86 12.062 6.622 -2.760 1.00 0.00 H new ATOM 0 HG2 ARG A 86 11.638 6.783 -5.130 1.00 0.00 H new ATOM 0 HG3 ARG A 86 10.523 5.432 -5.108 1.00 0.00 H new ATOM 0 HD2 ARG A 86 10.010 8.018 -3.559 1.00 0.00 H new ATOM 0 HD3 ARG A 86 9.441 7.770 -5.198 1.00 0.00 H new ATOM 0 HE ARG A 86 8.617 5.505 -3.661 1.00 0.00 H new ATOM 0 HH11 ARG A 86 8.136 8.970 -3.907 1.00 0.00 H new ATOM 0 HH12 ARG A 86 6.477 8.913 -3.301 1.00 0.00 H new ATOM 0 HH21 ARG A 86 6.481 5.442 -2.892 1.00 0.00 H new ATOM 0 HH22 ARG A 86 5.548 6.933 -2.731 1.00 0.00 H new ATOM 1276 N LYS A 87 14.567 5.375 -3.779 1.00 0.00 N ATOM 1277 CA LYS A 87 15.731 5.729 -4.582 1.00 0.00 C ATOM 1278 C LYS A 87 16.226 4.516 -5.363 1.00 0.00 C ATOM 1279 O LYS A 87 16.563 4.625 -6.539 1.00 0.00 O ATOM 1280 CB LYS A 87 16.851 6.246 -3.676 1.00 0.00 C ATOM 1281 CG LYS A 87 16.433 7.583 -3.063 1.00 0.00 C ATOM 1282 CD LYS A 87 17.551 8.103 -2.157 1.00 0.00 C ATOM 1283 CE LYS A 87 17.180 9.492 -1.637 1.00 0.00 C ATOM 1284 NZ LYS A 87 15.932 9.406 -0.830 1.00 0.00 N ATOM 0 H LYS A 87 14.680 5.515 -2.775 1.00 0.00 H new ATOM 0 HA LYS A 87 15.443 6.510 -5.286 1.00 0.00 H new ATOM 0 HB2 LYS A 87 17.060 5.522 -2.888 1.00 0.00 H new ATOM 0 HB3 LYS A 87 17.770 6.368 -4.249 1.00 0.00 H new ATOM 0 HG2 LYS A 87 16.223 8.306 -3.851 1.00 0.00 H new ATOM 0 HG3 LYS A 87 15.514 7.461 -2.490 1.00 0.00 H new ATOM 0 HD2 LYS A 87 17.705 7.419 -1.322 1.00 0.00 H new ATOM 0 HD3 LYS A 87 18.490 8.148 -2.709 1.00 0.00 H new ATOM 0 HE2 LYS A 87 17.991 9.892 -1.029 1.00 0.00 H new ATOM 0 HE3 LYS A 87 17.039 10.178 -2.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 15.919 10.174 -0.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 15.107 9.495 -1.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 15.898 8.489 -0.340 1.00 0.00 H new ATOM 1298 N TYR A 88 16.265 3.361 -4.710 1.00 0.00 N ATOM 1299 CA TYR A 88 16.714 2.141 -5.370 1.00 0.00 C ATOM 1300 C TYR A 88 15.642 1.616 -6.322 1.00 0.00 C ATOM 1301 O TYR A 88 15.940 1.218 -7.448 1.00 0.00 O ATOM 1302 CB TYR A 88 17.042 1.074 -4.328 1.00 0.00 C ATOM 1303 CG TYR A 88 18.233 1.518 -3.514 1.00 0.00 C ATOM 1304 CD1 TYR A 88 18.047 2.296 -2.368 1.00 0.00 C ATOM 1305 CD2 TYR A 88 19.525 1.149 -3.908 1.00 0.00 C ATOM 1306 CE1 TYR A 88 19.152 2.709 -1.614 1.00 0.00 C ATOM 1307 CE2 TYR A 88 20.631 1.561 -3.156 1.00 0.00 C ATOM 1308 CZ TYR A 88 20.444 2.340 -2.007 1.00 0.00 C ATOM 1309 OH TYR A 88 21.534 2.747 -1.265 1.00 0.00 O ATOM 0 H TYR A 88 15.994 3.243 -3.734 1.00 0.00 H new ATOM 0 HA TYR A 88 17.610 2.373 -5.946 1.00 0.00 H new ATOM 0 HB2 TYR A 88 16.183 0.910 -3.677 1.00 0.00 H new ATOM 0 HB3 TYR A 88 17.256 0.125 -4.819 1.00 0.00 H new ATOM 0 HD1 TYR A 88 17.050 2.579 -2.064 1.00 0.00 H new ATOM 0 HD2 TYR A 88 19.668 0.546 -4.793 1.00 0.00 H new ATOM 0 HE1 TYR A 88 19.008 3.312 -0.730 1.00 0.00 H new ATOM 0 HE2 TYR A 88 21.628 1.279 -3.461 1.00 0.00 H new ATOM 0 HH TYR A 88 22.355 2.404 -1.675 1.00 0.00 H new ATOM 1319 N TRP A 89 14.396 1.612 -5.856 1.00 0.00 N ATOM 1320 CA TRP A 89 13.287 1.127 -6.671 1.00 0.00 C ATOM 1321 C TRP A 89 13.055 2.033 -7.877 1.00 0.00 C ATOM 1322 O TRP A 89 12.969 1.565 -9.013 1.00 0.00 O ATOM 1323 CB TRP A 89 12.011 1.064 -5.828 1.00 0.00 C ATOM 1324 CG TRP A 89 10.867 0.621 -6.683 1.00 0.00 C ATOM 1325 CD1 TRP A 89 9.898 1.434 -7.168 1.00 0.00 C ATOM 1326 CD2 TRP A 89 10.555 -0.719 -7.162 1.00 0.00 C ATOM 1327 NE1 TRP A 89 9.014 0.678 -7.914 1.00 0.00 N ATOM 1328 CE2 TRP A 89 9.374 -0.656 -7.940 1.00 0.00 C ATOM 1329 CE3 TRP A 89 11.174 -1.971 -6.998 1.00 0.00 C ATOM 1330 CZ2 TRP A 89 8.829 -1.793 -8.537 1.00 0.00 C ATOM 1331 CZ3 TRP A 89 10.628 -3.118 -7.596 1.00 0.00 C ATOM 1332 CH2 TRP A 89 9.458 -3.029 -8.363 1.00 0.00 C ATOM 0 H TRP A 89 14.131 1.936 -4.926 1.00 0.00 H new ATOM 0 HA TRP A 89 13.541 0.130 -7.031 1.00 0.00 H new ATOM 0 HB2 TRP A 89 12.146 0.372 -4.997 1.00 0.00 H new ATOM 0 HB3 TRP A 89 11.799 2.043 -5.397 1.00 0.00 H new ATOM 0 HD1 TRP A 89 9.828 2.498 -6.999 1.00 0.00 H new ATOM 0 HE1 TRP A 89 8.195 1.058 -8.388 1.00 0.00 H new ATOM 0 HE3 TRP A 89 12.075 -2.051 -6.408 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 7.929 -1.719 -9.129 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 11.112 -4.074 -7.464 1.00 0.00 H new ATOM 0 HH2 TRP A 89 9.043 -3.915 -8.819 1.00 0.00 H new ATOM 1343 N TRP A 90 12.948 3.332 -7.621 1.00 0.00 N ATOM 1344 CA TRP A 90 12.718 4.297 -8.692 1.00 0.00 C ATOM 1345 C TRP A 90 13.861 4.252 -9.698 1.00 0.00 C ATOM 1346 O TRP A 90 13.638 4.260 -10.908 1.00 0.00 O ATOM 1347 CB TRP A 90 12.601 5.709 -8.108 1.00 0.00 C ATOM 1348 CG TRP A 90 12.448 6.698 -9.215 1.00 0.00 C ATOM 1349 CD1 TRP A 90 13.399 7.578 -9.608 1.00 0.00 C ATOM 1350 CD2 TRP A 90 11.298 6.925 -10.079 1.00 0.00 C ATOM 1351 NE1 TRP A 90 12.905 8.330 -10.656 1.00 0.00 N ATOM 1352 CE2 TRP A 90 11.614 7.965 -10.984 1.00 0.00 C ATOM 1353 CE3 TRP A 90 10.024 6.335 -10.163 1.00 0.00 C ATOM 1354 CZ2 TRP A 90 10.697 8.406 -11.940 1.00 0.00 C ATOM 1355 CZ3 TRP A 90 9.099 6.776 -11.124 1.00 0.00 C ATOM 1356 CH2 TRP A 90 9.436 7.808 -12.011 1.00 0.00 C ATOM 0 H TRP A 90 13.016 3.740 -6.689 1.00 0.00 H new ATOM 0 HA TRP A 90 11.789 4.039 -9.200 1.00 0.00 H new ATOM 0 HB2 TRP A 90 11.745 5.765 -7.436 1.00 0.00 H new ATOM 0 HB3 TRP A 90 13.486 5.944 -7.517 1.00 0.00 H new ATOM 0 HD1 TRP A 90 14.383 7.676 -9.173 1.00 0.00 H new ATOM 0 HE1 TRP A 90 13.430 9.065 -11.130 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.755 5.538 -9.485 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 10.960 9.203 -12.619 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 8.123 6.317 -11.180 1.00 0.00 H new ATOM 0 HH2 TRP A 90 8.721 8.141 -12.749 1.00 0.00 H new ATOM 1367 N LYS A 91 15.085 4.204 -9.187 1.00 0.00 N ATOM 1368 CA LYS A 91 16.259 4.158 -10.053 1.00 0.00 C ATOM 1369 C LYS A 91 16.444 2.759 -10.627 1.00 0.00 C ATOM 1370 O LYS A 91 16.044 1.766 -10.017 1.00 0.00 O ATOM 1371 CB LYS A 91 17.509 4.558 -9.263 1.00 0.00 C ATOM 1372 CG LYS A 91 17.349 5.978 -8.695 1.00 0.00 C ATOM 1373 CD LYS A 91 17.621 7.021 -9.785 1.00 0.00 C ATOM 1374 CE LYS A 91 17.544 8.420 -9.176 1.00 0.00 C ATOM 1375 NZ LYS A 91 17.680 9.429 -10.262 1.00 0.00 N ATOM 0 H LYS A 91 15.291 4.196 -8.188 1.00 0.00 H new ATOM 0 HA LYS A 91 16.110 4.859 -10.874 1.00 0.00 H new ATOM 0 HB2 LYS A 91 17.676 3.851 -8.451 1.00 0.00 H new ATOM 0 HB3 LYS A 91 18.386 4.514 -9.909 1.00 0.00 H new ATOM 0 HG2 LYS A 91 16.341 6.108 -8.301 1.00 0.00 H new ATOM 0 HG3 LYS A 91 18.038 6.124 -7.863 1.00 0.00 H new ATOM 0 HD2 LYS A 91 18.605 6.857 -10.224 1.00 0.00 H new ATOM 0 HD3 LYS A 91 16.892 6.922 -10.590 1.00 0.00 H new ATOM 0 HE2 LYS A 91 16.595 8.552 -8.656 1.00 0.00 H new ATOM 0 HE3 LYS A 91 18.334 8.553 -8.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 17.629 10.385 -9.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 18.596 9.304 -10.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 16.911 9.304 -10.951 1.00 0.00 H new ATOM 1389 N ASN A 92 17.051 2.687 -11.809 1.00 0.00 N ATOM 1390 CA ASN A 92 17.283 1.406 -12.469 1.00 0.00 C ATOM 1391 C ASN A 92 18.636 0.838 -12.063 1.00 0.00 C ATOM 1392 O ASN A 92 19.113 -0.131 -12.648 1.00 0.00 O ATOM 1393 CB ASN A 92 17.237 1.583 -13.987 1.00 0.00 C ATOM 1394 CG ASN A 92 15.849 2.052 -14.413 1.00 0.00 C ATOM 1395 OD1 ASN A 92 15.693 2.642 -15.482 1.00 0.00 O ATOM 1396 ND2 ASN A 92 14.825 1.823 -13.636 1.00 0.00 N ATOM 0 H ASN A 92 17.390 3.497 -12.327 1.00 0.00 H new ATOM 0 HA ASN A 92 16.500 0.712 -12.163 1.00 0.00 H new ATOM 0 HB2 ASN A 92 17.988 2.309 -14.300 1.00 0.00 H new ATOM 0 HB3 ASN A 92 17.479 0.641 -14.479 1.00 0.00 H new ATOM 0 HD21 ASN A 92 13.894 2.133 -13.915 1.00 0.00 H new ATOM 0 HD22 ASN A 92 14.956 1.334 -12.751 1.00 0.00 H new ATOM 1403 N LEU A 93 19.247 1.448 -11.055 1.00 0.00 N ATOM 1404 CA LEU A 93 20.549 0.990 -10.580 1.00 0.00 C ATOM 1405 C LEU A 93 20.444 -0.432 -10.038 1.00 0.00 C ATOM 1406 O LEU A 93 21.325 -1.258 -10.266 1.00 0.00 O ATOM 1407 CB LEU A 93 21.073 1.923 -9.483 1.00 0.00 C ATOM 1408 CG LEU A 93 22.474 1.474 -9.028 1.00 0.00 C ATOM 1409 CD1 LEU A 93 23.468 1.556 -10.203 1.00 0.00 C ATOM 1410 CD2 LEU A 93 22.943 2.380 -7.882 1.00 0.00 C ATOM 0 H LEU A 93 18.868 2.252 -10.555 1.00 0.00 H new ATOM 0 HA LEU A 93 21.245 1.001 -11.419 1.00 0.00 H new ATOM 0 HB2 LEU A 93 21.114 2.947 -9.855 1.00 0.00 H new ATOM 0 HB3 LEU A 93 20.389 1.919 -8.635 1.00 0.00 H new ATOM 0 HG LEU A 93 22.429 0.441 -8.684 1.00 0.00 H new ATOM 0 HD11 LEU A 93 24.455 1.236 -9.868 1.00 0.00 H new ATOM 0 HD12 LEU A 93 23.131 0.907 -11.011 1.00 0.00 H new ATOM 0 HD13 LEU A 93 23.523 2.584 -10.562 1.00 0.00 H new ATOM 0 HD21 LEU A 93 23.935 2.068 -7.554 1.00 0.00 H new ATOM 0 HD22 LEU A 93 22.983 3.413 -8.228 1.00 0.00 H new ATOM 0 HD23 LEU A 93 22.245 2.303 -7.049 1.00 0.00 H new ATOM 1422 N LYS A 94 19.367 -0.704 -9.310 1.00 0.00 N ATOM 1423 CA LYS A 94 19.164 -2.025 -8.730 1.00 0.00 C ATOM 1424 C LYS A 94 19.405 -3.114 -9.768 1.00 0.00 C ATOM 1425 O LYS A 94 19.764 -4.241 -9.428 1.00 0.00 O ATOM 1426 CB LYS A 94 17.737 -2.137 -8.188 1.00 0.00 C ATOM 1427 CG LYS A 94 16.736 -1.910 -9.323 1.00 0.00 C ATOM 1428 CD LYS A 94 15.313 -1.979 -8.772 1.00 0.00 C ATOM 1429 CE LYS A 94 14.314 -1.837 -9.923 1.00 0.00 C ATOM 1430 NZ LYS A 94 14.533 -0.534 -10.612 1.00 0.00 N ATOM 0 H LYS A 94 18.626 -0.032 -9.109 1.00 0.00 H new ATOM 0 HA LYS A 94 19.877 -2.158 -7.916 1.00 0.00 H new ATOM 0 HB2 LYS A 94 17.582 -3.121 -7.745 1.00 0.00 H new ATOM 0 HB3 LYS A 94 17.579 -1.403 -7.398 1.00 0.00 H new ATOM 0 HG2 LYS A 94 16.911 -0.939 -9.787 1.00 0.00 H new ATOM 0 HG3 LYS A 94 16.873 -2.663 -10.099 1.00 0.00 H new ATOM 0 HD2 LYS A 94 15.157 -2.926 -8.255 1.00 0.00 H new ATOM 0 HD3 LYS A 94 15.156 -1.187 -8.040 1.00 0.00 H new ATOM 0 HE2 LYS A 94 14.436 -2.659 -10.629 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.294 -1.893 -9.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.615 -0.089 -10.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 15.095 0.092 -10.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 15.042 -0.694 -11.504 1.00 0.00 H new ATOM 1444 N MET A 95 19.207 -2.771 -11.034 1.00 0.00 N ATOM 1445 CA MET A 95 19.404 -3.729 -12.113 1.00 0.00 C ATOM 1446 C MET A 95 20.860 -4.172 -12.177 1.00 0.00 C ATOM 1447 O MET A 95 21.153 -5.351 -12.370 1.00 0.00 O ATOM 1448 CB MET A 95 19.005 -3.097 -13.447 1.00 0.00 C ATOM 1449 CG MET A 95 17.519 -2.730 -13.423 1.00 0.00 C ATOM 1450 SD MET A 95 16.516 -4.240 -13.311 1.00 0.00 S ATOM 1451 CE MET A 95 16.789 -4.852 -14.995 1.00 0.00 C ATOM 0 H MET A 95 18.912 -1.843 -11.337 1.00 0.00 H new ATOM 0 HA MET A 95 18.779 -4.601 -11.919 1.00 0.00 H new ATOM 0 HB2 MET A 95 19.606 -2.207 -13.632 1.00 0.00 H new ATOM 0 HB3 MET A 95 19.204 -3.792 -14.263 1.00 0.00 H new ATOM 0 HG2 MET A 95 17.309 -2.079 -12.574 1.00 0.00 H new ATOM 0 HG3 MET A 95 17.257 -2.174 -14.323 1.00 0.00 H new ATOM 0 HE1 MET A 95 15.965 -5.505 -15.283 1.00 0.00 H new ATOM 0 HE2 MET A 95 16.841 -4.009 -15.684 1.00 0.00 H new ATOM 0 HE3 MET A 95 17.725 -5.410 -15.032 1.00 0.00 H new ATOM 1461 N MET A 96 21.771 -3.221 -12.015 1.00 0.00 N ATOM 1462 CA MET A 96 23.192 -3.534 -12.058 1.00 0.00 C ATOM 1463 C MET A 96 23.566 -4.453 -10.903 1.00 0.00 C ATOM 1464 O MET A 96 24.346 -5.390 -11.069 1.00 0.00 O ATOM 1465 CB MET A 96 24.014 -2.242 -11.978 1.00 0.00 C ATOM 1466 CG MET A 96 25.512 -2.558 -12.094 1.00 0.00 C ATOM 1467 SD MET A 96 25.855 -3.233 -13.743 1.00 0.00 S ATOM 1468 CE MET A 96 27.224 -2.130 -14.182 1.00 0.00 C ATOM 0 H MET A 96 21.554 -2.237 -11.854 1.00 0.00 H new ATOM 0 HA MET A 96 23.409 -4.042 -12.998 1.00 0.00 H new ATOM 0 HB2 MET A 96 23.715 -1.563 -12.776 1.00 0.00 H new ATOM 0 HB3 MET A 96 23.814 -1.733 -11.035 1.00 0.00 H new ATOM 0 HG2 MET A 96 26.100 -1.655 -11.928 1.00 0.00 H new ATOM 0 HG3 MET A 96 25.805 -3.275 -11.327 1.00 0.00 H new ATOM 0 HE1 MET A 96 27.588 -2.381 -15.178 1.00 0.00 H new ATOM 0 HE2 MET A 96 26.877 -1.097 -14.172 1.00 0.00 H new ATOM 0 HE3 MET A 96 28.032 -2.248 -13.460 1.00 0.00 H new ATOM 1478 N ILE A 97 23.013 -4.174 -9.728 1.00 0.00 N ATOM 1479 CA ILE A 97 23.307 -4.979 -8.552 1.00 0.00 C ATOM 1480 C ILE A 97 22.818 -6.409 -8.750 1.00 0.00 C ATOM 1481 O ILE A 97 23.519 -7.365 -8.424 1.00 0.00 O ATOM 1482 CB ILE A 97 22.630 -4.371 -7.316 1.00 0.00 C ATOM 1483 CG1 ILE A 97 23.278 -3.019 -6.997 1.00 0.00 C ATOM 1484 CG2 ILE A 97 22.799 -5.310 -6.116 1.00 0.00 C ATOM 1485 CD1 ILE A 97 22.465 -2.292 -5.922 1.00 0.00 C ATOM 0 H ILE A 97 22.365 -3.403 -9.566 1.00 0.00 H new ATOM 0 HA ILE A 97 24.387 -4.991 -8.403 1.00 0.00 H new ATOM 0 HB ILE A 97 21.568 -4.233 -7.518 1.00 0.00 H new ATOM 0 HG12 ILE A 97 24.301 -3.169 -6.652 1.00 0.00 H new ATOM 0 HG13 ILE A 97 23.331 -2.410 -7.899 1.00 0.00 H new ATOM 0 HG21 ILE A 97 22.317 -4.873 -5.242 1.00 0.00 H new ATOM 0 HG22 ILE A 97 22.341 -6.273 -6.340 1.00 0.00 H new ATOM 0 HG23 ILE A 97 23.860 -5.452 -5.912 1.00 0.00 H new ATOM 0 HD11 ILE A 97 22.931 -1.332 -5.700 1.00 0.00 H new ATOM 0 HD12 ILE A 97 21.450 -2.128 -6.283 1.00 0.00 H new ATOM 0 HD13 ILE A 97 22.435 -2.898 -5.017 1.00 0.00 H new ATOM 1497 N ILE A 98 21.610 -6.544 -9.280 1.00 0.00 N ATOM 1498 CA ILE A 98 21.031 -7.862 -9.508 1.00 0.00 C ATOM 1499 C ILE A 98 21.860 -8.635 -10.523 1.00 0.00 C ATOM 1500 O ILE A 98 22.118 -9.824 -10.353 1.00 0.00 O ATOM 1501 CB ILE A 98 19.587 -7.725 -10.012 1.00 0.00 C ATOM 1502 CG1 ILE A 98 18.692 -7.150 -8.887 1.00 0.00 C ATOM 1503 CG2 ILE A 98 19.055 -9.097 -10.460 1.00 0.00 C ATOM 1504 CD1 ILE A 98 18.190 -8.265 -7.956 1.00 0.00 C ATOM 0 H ILE A 98 21.015 -5.764 -9.559 1.00 0.00 H new ATOM 0 HA ILE A 98 21.029 -8.408 -8.565 1.00 0.00 H new ATOM 0 HB ILE A 98 19.569 -7.045 -10.864 1.00 0.00 H new ATOM 0 HG12 ILE A 98 19.254 -6.416 -8.310 1.00 0.00 H new ATOM 0 HG13 ILE A 98 17.842 -6.628 -9.325 1.00 0.00 H new ATOM 0 HG21 ILE A 98 18.030 -8.991 -10.816 1.00 0.00 H new ATOM 0 HG22 ILE A 98 19.680 -9.485 -11.264 1.00 0.00 H new ATOM 0 HG23 ILE A 98 19.077 -9.788 -9.618 1.00 0.00 H new ATOM 0 HD11 ILE A 98 17.564 -7.833 -7.175 1.00 0.00 H new ATOM 0 HD12 ILE A 98 17.608 -8.985 -8.531 1.00 0.00 H new ATOM 0 HD13 ILE A 98 19.042 -8.769 -7.500 1.00 0.00 H new ATOM 1516 N LEU A 99 22.268 -7.952 -11.580 1.00 0.00 N ATOM 1517 CA LEU A 99 23.058 -8.593 -12.617 1.00 0.00 C ATOM 1518 C LEU A 99 24.372 -9.107 -12.043 1.00 0.00 C ATOM 1519 O LEU A 99 24.821 -10.202 -12.382 1.00 0.00 O ATOM 1520 CB LEU A 99 23.341 -7.604 -13.753 1.00 0.00 C ATOM 1521 CG LEU A 99 24.232 -8.261 -14.821 1.00 0.00 C ATOM 1522 CD1 LEU A 99 23.567 -9.543 -15.352 1.00 0.00 C ATOM 1523 CD2 LEU A 99 24.449 -7.273 -15.972 1.00 0.00 C ATOM 0 H LEU A 99 22.068 -6.965 -11.742 1.00 0.00 H new ATOM 0 HA LEU A 99 22.491 -9.437 -13.011 1.00 0.00 H new ATOM 0 HB2 LEU A 99 22.403 -7.277 -14.202 1.00 0.00 H new ATOM 0 HB3 LEU A 99 23.831 -6.715 -13.357 1.00 0.00 H new ATOM 0 HG LEU A 99 25.192 -8.525 -14.377 1.00 0.00 H new ATOM 0 HD11 LEU A 99 24.207 -9.999 -16.107 1.00 0.00 H new ATOM 0 HD12 LEU A 99 23.420 -10.244 -14.530 1.00 0.00 H new ATOM 0 HD13 LEU A 99 22.602 -9.296 -15.795 1.00 0.00 H new ATOM 0 HD21 LEU A 99 25.080 -7.733 -16.732 1.00 0.00 H new ATOM 0 HD22 LEU A 99 23.487 -7.008 -16.411 1.00 0.00 H new ATOM 0 HD23 LEU A 99 24.935 -6.374 -15.593 1.00 0.00 H new ATOM 1535 N GLY A 100 24.987 -8.307 -11.182 1.00 0.00 N ATOM 1536 CA GLY A 100 26.257 -8.689 -10.581 1.00 0.00 C ATOM 1537 C GLY A 100 26.110 -9.965 -9.762 1.00 0.00 C ATOM 1538 O GLY A 100 27.016 -10.798 -9.727 1.00 0.00 O ATOM 0 H GLY A 100 24.631 -7.398 -10.886 1.00 0.00 H new ATOM 0 HA2 GLY A 100 27.003 -8.837 -11.362 1.00 0.00 H new ATOM 0 HA3 GLY A 100 26.619 -7.883 -9.943 1.00 0.00 H new ATOM 1542 N VAL A 101 24.967 -10.113 -9.105 1.00 0.00 N ATOM 1543 CA VAL A 101 24.720 -11.293 -8.290 1.00 0.00 C ATOM 1544 C VAL A 101 24.731 -12.553 -9.153 1.00 0.00 C ATOM 1545 O VAL A 101 25.352 -13.553 -8.798 1.00 0.00 O ATOM 1546 CB VAL A 101 23.363 -11.166 -7.585 1.00 0.00 C ATOM 1547 CG1 VAL A 101 23.023 -12.476 -6.867 1.00 0.00 C ATOM 1548 CG2 VAL A 101 23.423 -10.027 -6.561 1.00 0.00 C ATOM 0 H VAL A 101 24.203 -9.437 -9.120 1.00 0.00 H new ATOM 0 HA VAL A 101 25.512 -11.370 -7.545 1.00 0.00 H new ATOM 0 HB VAL A 101 22.594 -10.953 -8.327 1.00 0.00 H new ATOM 0 HG11 VAL A 101 22.058 -12.378 -6.369 1.00 0.00 H new ATOM 0 HG12 VAL A 101 22.976 -13.287 -7.593 1.00 0.00 H new ATOM 0 HG13 VAL A 101 23.793 -12.696 -6.127 1.00 0.00 H new ATOM 0 HG21 VAL A 101 22.459 -9.937 -6.060 1.00 0.00 H new ATOM 0 HG22 VAL A 101 24.196 -10.241 -5.823 1.00 0.00 H new ATOM 0 HG23 VAL A 101 23.656 -9.092 -7.070 1.00 0.00 H new ATOM 1558 N ILE A 102 24.037 -12.499 -10.286 1.00 0.00 N ATOM 1559 CA ILE A 102 23.972 -13.650 -11.182 1.00 0.00 C ATOM 1560 C ILE A 102 25.355 -13.997 -11.713 1.00 0.00 C ATOM 1561 O ILE A 102 25.777 -15.153 -11.682 1.00 0.00 O ATOM 1562 CB ILE A 102 23.042 -13.332 -12.351 1.00 0.00 C ATOM 1563 CG1 ILE A 102 21.662 -12.937 -11.813 1.00 0.00 C ATOM 1564 CG2 ILE A 102 22.904 -14.569 -13.240 1.00 0.00 C ATOM 1565 CD1 ILE A 102 20.858 -12.272 -12.928 1.00 0.00 C ATOM 0 H ILE A 102 23.517 -11.681 -10.603 1.00 0.00 H new ATOM 0 HA ILE A 102 23.589 -14.505 -10.625 1.00 0.00 H new ATOM 0 HB ILE A 102 23.456 -12.508 -12.932 1.00 0.00 H new ATOM 0 HG12 ILE A 102 21.136 -13.818 -11.446 1.00 0.00 H new ATOM 0 HG13 ILE A 102 21.769 -12.255 -10.970 1.00 0.00 H new ATOM 0 HG21 ILE A 102 22.241 -14.345 -14.075 1.00 0.00 H new ATOM 0 HG22 ILE A 102 23.884 -14.854 -13.622 1.00 0.00 H new ATOM 0 HG23 ILE A 102 22.489 -15.391 -12.657 1.00 0.00 H new ATOM 0 HD11 ILE A 102 19.876 -11.989 -12.549 1.00 0.00 H new ATOM 0 HD12 ILE A 102 21.383 -11.382 -13.274 1.00 0.00 H new ATOM 0 HD13 ILE A 102 20.740 -12.969 -13.757 1.00 0.00 H new ATOM 1577 N CYS A 103 26.051 -12.982 -12.194 1.00 0.00 N ATOM 1578 CA CYS A 103 27.398 -13.175 -12.731 1.00 0.00 C ATOM 1579 C CYS A 103 28.343 -13.679 -11.646 1.00 0.00 C ATOM 1580 O CYS A 103 29.236 -14.483 -11.910 1.00 0.00 O ATOM 1581 CB CYS A 103 27.938 -11.865 -13.308 1.00 0.00 C ATOM 1582 SG CYS A 103 26.943 -11.396 -14.741 1.00 0.00 S ATOM 0 H CYS A 103 25.714 -12.020 -12.226 1.00 0.00 H new ATOM 0 HA CYS A 103 27.339 -13.919 -13.525 1.00 0.00 H new ATOM 0 HB2 CYS A 103 27.904 -11.079 -12.553 1.00 0.00 H new ATOM 0 HB3 CYS A 103 28.982 -11.984 -13.598 1.00 0.00 H new ATOM 0 HG CYS A 103 25.862 -10.795 -14.341 1.00 0.00 H new ATOM 1588 N ALA A 104 28.140 -13.197 -10.424 1.00 0.00 N ATOM 1589 CA ALA A 104 28.980 -13.602 -9.306 1.00 0.00 C ATOM 1590 C ALA A 104 28.883 -15.108 -9.082 1.00 0.00 C ATOM 1591 O ALA A 104 29.868 -15.757 -8.735 1.00 0.00 O ATOM 1592 CB ALA A 104 28.547 -12.868 -8.035 1.00 0.00 C ATOM 0 H ALA A 104 27.406 -12.530 -10.185 1.00 0.00 H new ATOM 0 HA ALA A 104 30.013 -13.346 -9.540 1.00 0.00 H new ATOM 0 HB1 ALA A 104 29.180 -13.176 -7.203 1.00 0.00 H new ATOM 0 HB2 ALA A 104 28.643 -11.793 -8.185 1.00 0.00 H new ATOM 0 HB3 ALA A 104 27.509 -13.111 -7.810 1.00 0.00 H new ATOM 1598 N ILE A 105 27.688 -15.653 -9.282 1.00 0.00 N ATOM 1599 CA ILE A 105 27.470 -17.087 -9.098 1.00 0.00 C ATOM 1600 C ILE A 105 28.299 -17.889 -10.097 1.00 0.00 C ATOM 1601 O ILE A 105 28.893 -18.911 -9.749 1.00 0.00 O ATOM 1602 CB ILE A 105 25.984 -17.421 -9.268 1.00 0.00 C ATOM 1603 CG1 ILE A 105 25.192 -16.802 -8.114 1.00 0.00 C ATOM 1604 CG2 ILE A 105 25.793 -18.942 -9.254 1.00 0.00 C ATOM 1605 CD1 ILE A 105 23.693 -16.898 -8.411 1.00 0.00 C ATOM 0 H ILE A 105 26.860 -15.130 -9.569 1.00 0.00 H new ATOM 0 HA ILE A 105 27.784 -17.355 -8.089 1.00 0.00 H new ATOM 0 HB ILE A 105 25.628 -17.020 -10.217 1.00 0.00 H new ATOM 0 HG12 ILE A 105 25.422 -17.319 -7.183 1.00 0.00 H new ATOM 0 HG13 ILE A 105 25.480 -15.760 -7.979 1.00 0.00 H new ATOM 0 HG21 ILE A 105 24.736 -19.177 -9.375 1.00 0.00 H new ATOM 0 HG22 ILE A 105 26.360 -19.387 -10.072 1.00 0.00 H new ATOM 0 HG23 ILE A 105 26.148 -19.345 -8.305 1.00 0.00 H new ATOM 0 HD11 ILE A 105 23.130 -16.457 -7.588 1.00 0.00 H new ATOM 0 HD12 ILE A 105 23.470 -16.361 -9.333 1.00 0.00 H new ATOM 0 HD13 ILE A 105 23.411 -17.945 -8.524 1.00 0.00 H new ATOM 1617 N ILE A 106 28.325 -17.424 -11.339 1.00 0.00 N ATOM 1618 CA ILE A 106 29.068 -18.106 -12.390 1.00 0.00 C ATOM 1619 C ILE A 106 30.540 -18.193 -12.016 1.00 0.00 C ATOM 1620 O ILE A 106 31.196 -19.201 -12.270 1.00 0.00 O ATOM 1621 CB ILE A 106 28.918 -17.357 -13.715 1.00 0.00 C ATOM 1622 CG1 ILE A 106 27.428 -17.107 -13.996 1.00 0.00 C ATOM 1623 CG2 ILE A 106 29.522 -18.189 -14.849 1.00 0.00 C ATOM 1624 CD1 ILE A 106 26.636 -18.419 -13.922 1.00 0.00 C ATOM 0 H ILE A 106 27.841 -16.579 -11.643 1.00 0.00 H new ATOM 0 HA ILE A 106 28.666 -19.113 -12.503 1.00 0.00 H new ATOM 0 HB ILE A 106 29.441 -16.403 -13.652 1.00 0.00 H new ATOM 0 HG12 ILE A 106 27.031 -16.395 -13.273 1.00 0.00 H new ATOM 0 HG13 ILE A 106 27.309 -16.659 -14.983 1.00 0.00 H new ATOM 0 HG21 ILE A 106 29.413 -17.652 -15.792 1.00 0.00 H new ATOM 0 HG22 ILE A 106 30.580 -18.362 -14.650 1.00 0.00 H new ATOM 0 HG23 ILE A 106 29.004 -19.146 -14.914 1.00 0.00 H new ATOM 0 HD11 ILE A 106 25.583 -18.220 -14.124 1.00 0.00 H new ATOM 0 HD12 ILE A 106 27.022 -19.119 -14.663 1.00 0.00 H new ATOM 0 HD13 ILE A 106 26.739 -18.851 -12.926 1.00 0.00 H new ATOM 1636 N LEU A 107 31.058 -17.133 -11.417 1.00 0.00 N ATOM 1637 CA LEU A 107 32.459 -17.113 -11.029 1.00 0.00 C ATOM 1638 C LEU A 107 32.767 -18.270 -10.082 1.00 0.00 C ATOM 1639 O LEU A 107 33.800 -18.926 -10.208 1.00 0.00 O ATOM 1640 CB LEU A 107 32.792 -15.784 -10.337 1.00 0.00 C ATOM 1641 CG LEU A 107 34.268 -15.762 -9.903 1.00 0.00 C ATOM 1642 CD1 LEU A 107 35.182 -15.962 -11.125 1.00 0.00 C ATOM 1643 CD2 LEU A 107 34.576 -14.417 -9.234 1.00 0.00 C ATOM 0 H LEU A 107 30.538 -16.285 -11.191 1.00 0.00 H new ATOM 0 HA LEU A 107 33.068 -17.218 -11.927 1.00 0.00 H new ATOM 0 HB2 LEU A 107 32.593 -14.954 -11.015 1.00 0.00 H new ATOM 0 HB3 LEU A 107 32.148 -15.648 -9.468 1.00 0.00 H new ATOM 0 HG LEU A 107 34.450 -16.572 -9.196 1.00 0.00 H new ATOM 0 HD11 LEU A 107 36.224 -15.945 -10.806 1.00 0.00 H new ATOM 0 HD12 LEU A 107 34.961 -16.922 -11.591 1.00 0.00 H new ATOM 0 HD13 LEU A 107 35.009 -15.161 -11.844 1.00 0.00 H new ATOM 0 HD21 LEU A 107 35.621 -14.396 -8.924 1.00 0.00 H new ATOM 0 HD22 LEU A 107 34.390 -13.608 -9.941 1.00 0.00 H new ATOM 0 HD23 LEU A 107 33.936 -14.290 -8.361 1.00 0.00 H new ATOM 1655 N ILE A 108 31.870 -18.514 -9.134 1.00 0.00 N ATOM 1656 CA ILE A 108 32.071 -19.589 -8.170 1.00 0.00 C ATOM 1657 C ILE A 108 32.092 -20.940 -8.877 1.00 0.00 C ATOM 1658 O ILE A 108 32.935 -21.790 -8.588 1.00 0.00 O ATOM 1659 CB ILE A 108 30.950 -19.573 -7.130 1.00 0.00 C ATOM 1660 CG1 ILE A 108 30.829 -18.165 -6.530 1.00 0.00 C ATOM 1661 CG2 ILE A 108 31.252 -20.582 -6.021 1.00 0.00 C ATOM 1662 CD1 ILE A 108 32.177 -17.694 -5.964 1.00 0.00 C ATOM 0 H ILE A 108 31.005 -17.988 -9.012 1.00 0.00 H new ATOM 0 HA ILE A 108 33.029 -19.435 -7.673 1.00 0.00 H new ATOM 0 HB ILE A 108 30.010 -19.845 -7.611 1.00 0.00 H new ATOM 0 HG12 ILE A 108 30.487 -17.467 -7.295 1.00 0.00 H new ATOM 0 HG13 ILE A 108 30.078 -18.165 -5.740 1.00 0.00 H new ATOM 0 HG21 ILE A 108 30.449 -20.564 -5.284 1.00 0.00 H new ATOM 0 HG22 ILE A 108 31.329 -21.581 -6.449 1.00 0.00 H new ATOM 0 HG23 ILE A 108 32.193 -20.321 -5.538 1.00 0.00 H new ATOM 0 HD11 ILE A 108 32.066 -16.694 -5.545 1.00 0.00 H new ATOM 0 HD12 ILE A 108 32.504 -18.381 -5.183 1.00 0.00 H new ATOM 0 HD13 ILE A 108 32.919 -17.672 -6.762 1.00 0.00 H new ATOM 1674 N ILE A 109 31.163 -21.131 -9.803 1.00 0.00 N ATOM 1675 CA ILE A 109 31.087 -22.386 -10.540 1.00 0.00 C ATOM 1676 C ILE A 109 32.352 -22.591 -11.370 1.00 0.00 C ATOM 1677 O ILE A 109 32.906 -23.690 -11.413 1.00 0.00 O ATOM 1678 CB ILE A 109 29.864 -22.375 -11.460 1.00 0.00 C ATOM 1679 CG1 ILE A 109 28.592 -22.385 -10.610 1.00 0.00 C ATOM 1680 CG2 ILE A 109 29.883 -23.616 -12.358 1.00 0.00 C ATOM 1681 CD1 ILE A 109 27.382 -22.094 -11.498 1.00 0.00 C ATOM 0 H ILE A 109 30.457 -20.441 -10.061 1.00 0.00 H new ATOM 0 HA ILE A 109 30.996 -23.205 -9.827 1.00 0.00 H new ATOM 0 HB ILE A 109 29.886 -21.479 -12.080 1.00 0.00 H new ATOM 0 HG12 ILE A 109 28.475 -23.353 -10.124 1.00 0.00 H new ATOM 0 HG13 ILE A 109 28.664 -21.638 -9.820 1.00 0.00 H new ATOM 0 HG21 ILE A 109 29.011 -23.605 -13.012 1.00 0.00 H new ATOM 0 HG22 ILE A 109 30.790 -23.614 -12.963 1.00 0.00 H new ATOM 0 HG23 ILE A 109 29.862 -24.513 -11.739 1.00 0.00 H new ATOM 0 HD11 ILE A 109 26.476 -22.101 -10.892 1.00 0.00 H new ATOM 0 HD12 ILE A 109 27.499 -21.115 -11.964 1.00 0.00 H new ATOM 0 HD13 ILE A 109 27.307 -22.858 -12.272 1.00 0.00 H new ATOM 1693 N ILE A 110 32.801 -21.531 -12.030 1.00 0.00 N ATOM 1694 CA ILE A 110 33.997 -21.612 -12.856 1.00 0.00 C ATOM 1695 C ILE A 110 35.213 -21.944 -11.999 1.00 0.00 C ATOM 1696 O ILE A 110 36.044 -22.771 -12.376 1.00 0.00 O ATOM 1697 CB ILE A 110 34.222 -20.282 -13.584 1.00 0.00 C ATOM 1698 CG1 ILE A 110 33.106 -20.069 -14.609 1.00 0.00 C ATOM 1699 CG2 ILE A 110 35.573 -20.306 -14.306 1.00 0.00 C ATOM 1700 CD1 ILE A 110 33.155 -18.631 -15.127 1.00 0.00 C ATOM 0 H ILE A 110 32.359 -20.612 -12.010 1.00 0.00 H new ATOM 0 HA ILE A 110 33.859 -22.405 -13.591 1.00 0.00 H new ATOM 0 HB ILE A 110 34.216 -19.470 -12.857 1.00 0.00 H new ATOM 0 HG12 ILE A 110 33.220 -20.769 -15.437 1.00 0.00 H new ATOM 0 HG13 ILE A 110 32.136 -20.270 -14.153 1.00 0.00 H new ATOM 0 HG21 ILE A 110 35.727 -19.358 -14.821 1.00 0.00 H new ATOM 0 HG22 ILE A 110 36.371 -20.458 -13.579 1.00 0.00 H new ATOM 0 HG23 ILE A 110 35.583 -21.119 -15.032 1.00 0.00 H new ATOM 0 HD11 ILE A 110 32.360 -18.480 -15.857 1.00 0.00 H new ATOM 0 HD12 ILE A 110 33.020 -17.940 -14.295 1.00 0.00 H new ATOM 0 HD13 ILE A 110 34.120 -18.447 -15.599 1.00 0.00 H new ATOM 1712 N ILE A 111 35.314 -21.292 -10.848 1.00 0.00 N ATOM 1713 CA ILE A 111 36.443 -21.523 -9.955 1.00 0.00 C ATOM 1714 C ILE A 111 36.437 -22.962 -9.448 1.00 0.00 C ATOM 1715 O ILE A 111 37.477 -23.621 -9.411 1.00 0.00 O ATOM 1716 CB ILE A 111 36.372 -20.552 -8.764 1.00 0.00 C ATOM 1717 CG1 ILE A 111 36.618 -19.102 -9.248 1.00 0.00 C ATOM 1718 CG2 ILE A 111 37.418 -20.942 -7.707 1.00 0.00 C ATOM 1719 CD1 ILE A 111 38.122 -18.794 -9.324 1.00 0.00 C ATOM 0 H ILE A 111 34.637 -20.607 -10.513 1.00 0.00 H new ATOM 0 HA ILE A 111 37.366 -21.351 -10.508 1.00 0.00 H new ATOM 0 HB ILE A 111 35.380 -20.610 -8.317 1.00 0.00 H new ATOM 0 HG12 ILE A 111 36.164 -18.960 -10.229 1.00 0.00 H new ATOM 0 HG13 ILE A 111 36.134 -18.401 -8.568 1.00 0.00 H new ATOM 0 HG21 ILE A 111 37.362 -20.250 -6.867 1.00 0.00 H new ATOM 0 HG22 ILE A 111 37.221 -21.955 -7.357 1.00 0.00 H new ATOM 0 HG23 ILE A 111 38.414 -20.898 -8.147 1.00 0.00 H new ATOM 0 HD11 ILE A 111 38.267 -17.769 -9.667 1.00 0.00 H new ATOM 0 HD12 ILE A 111 38.568 -18.913 -8.337 1.00 0.00 H new ATOM 0 HD13 ILE A 111 38.599 -19.481 -10.023 1.00 0.00 H new ATOM 1731 N VAL A 112 35.264 -23.442 -9.059 1.00 0.00 N ATOM 1732 CA VAL A 112 35.138 -24.797 -8.559 1.00 0.00 C ATOM 1733 C VAL A 112 35.400 -25.799 -9.675 1.00 0.00 C ATOM 1734 O VAL A 112 36.085 -26.802 -9.477 1.00 0.00 O ATOM 1735 CB VAL A 112 33.738 -25.012 -7.978 1.00 0.00 C ATOM 1736 CG1 VAL A 112 33.555 -26.485 -7.603 1.00 0.00 C ATOM 1737 CG2 VAL A 112 33.569 -24.145 -6.727 1.00 0.00 C ATOM 0 H VAL A 112 34.392 -22.913 -9.081 1.00 0.00 H new ATOM 0 HA VAL A 112 35.877 -24.950 -7.772 1.00 0.00 H new ATOM 0 HB VAL A 112 32.992 -24.733 -8.722 1.00 0.00 H new ATOM 0 HG11 VAL A 112 32.557 -26.634 -7.190 1.00 0.00 H new ATOM 0 HG12 VAL A 112 33.676 -27.104 -8.492 1.00 0.00 H new ATOM 0 HG13 VAL A 112 34.301 -26.767 -6.860 1.00 0.00 H new ATOM 0 HG21 VAL A 112 32.573 -24.296 -6.311 1.00 0.00 H new ATOM 0 HG22 VAL A 112 34.318 -24.425 -5.986 1.00 0.00 H new ATOM 0 HG23 VAL A 112 33.696 -23.095 -6.992 1.00 0.00 H new ATOM 1747 N TYR A 113 34.842 -25.521 -10.846 1.00 0.00 N ATOM 1748 CA TYR A 113 35.009 -26.410 -11.984 1.00 0.00 C ATOM 1749 C TYR A 113 36.481 -26.563 -12.337 1.00 0.00 C ATOM 1750 O TYR A 113 36.962 -27.669 -12.586 1.00 0.00 O ATOM 1751 CB TYR A 113 34.236 -25.873 -13.193 1.00 0.00 C ATOM 1752 CG TYR A 113 34.489 -26.756 -14.394 1.00 0.00 C ATOM 1753 CD1 TYR A 113 33.828 -27.985 -14.512 1.00 0.00 C ATOM 1754 CD2 TYR A 113 35.388 -26.348 -15.387 1.00 0.00 C ATOM 1755 CE1 TYR A 113 34.065 -28.804 -15.624 1.00 0.00 C ATOM 1756 CE2 TYR A 113 35.624 -27.165 -16.498 1.00 0.00 C ATOM 1757 CZ TYR A 113 34.963 -28.394 -16.616 1.00 0.00 C ATOM 1758 OH TYR A 113 35.197 -29.200 -17.711 1.00 0.00 O ATOM 0 H TYR A 113 34.275 -24.694 -11.030 1.00 0.00 H new ATOM 0 HA TYR A 113 34.613 -27.389 -11.713 1.00 0.00 H new ATOM 0 HB2 TYR A 113 33.169 -25.843 -12.970 1.00 0.00 H new ATOM 0 HB3 TYR A 113 34.546 -24.851 -13.410 1.00 0.00 H new ATOM 0 HD1 TYR A 113 33.136 -28.302 -13.746 1.00 0.00 H new ATOM 0 HD2 TYR A 113 35.900 -25.401 -15.295 1.00 0.00 H new ATOM 0 HE1 TYR A 113 33.555 -29.751 -15.716 1.00 0.00 H new ATOM 0 HE2 TYR A 113 36.316 -26.848 -17.264 1.00 0.00 H new ATOM 0 HH TYR A 113 35.846 -28.766 -18.304 1.00 0.00 H new ATOM 1768 N PHE A 114 37.187 -25.446 -12.357 1.00 0.00 N ATOM 1769 CA PHE A 114 38.606 -25.455 -12.683 1.00 0.00 C ATOM 1770 C PHE A 114 39.381 -26.302 -11.686 1.00 0.00 C ATOM 1771 O PHE A 114 40.232 -27.109 -12.064 1.00 0.00 O ATOM 1772 CB PHE A 114 39.157 -24.027 -12.679 1.00 0.00 C ATOM 1773 CG PHE A 114 40.632 -24.054 -13.008 1.00 0.00 C ATOM 1774 CD1 PHE A 114 41.051 -24.141 -14.342 1.00 0.00 C ATOM 1775 CD2 PHE A 114 41.580 -23.993 -11.979 1.00 0.00 C ATOM 1776 CE1 PHE A 114 42.419 -24.166 -14.645 1.00 0.00 C ATOM 1777 CE2 PHE A 114 42.945 -24.018 -12.283 1.00 0.00 C ATOM 1778 CZ PHE A 114 43.366 -24.105 -13.615 1.00 0.00 C ATOM 0 H PHE A 114 36.804 -24.523 -12.152 1.00 0.00 H new ATOM 0 HA PHE A 114 38.724 -25.886 -13.677 1.00 0.00 H new ATOM 0 HB2 PHE A 114 38.622 -23.418 -13.408 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.000 -23.568 -11.703 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.320 -24.189 -15.136 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.257 -23.927 -10.951 1.00 0.00 H new ATOM 0 HE1 PHE A 114 42.743 -24.232 -15.673 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.675 -23.970 -11.489 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.420 -24.125 -13.848 1.00 0.00 H new ATOM 1788 N SER A 115 39.081 -26.108 -10.412 1.00 0.00 N ATOM 1789 CA SER A 115 39.754 -26.850 -9.355 1.00 0.00 C ATOM 1790 C SER A 115 39.166 -28.247 -9.215 1.00 0.00 C ATOM 1791 O SER A 115 39.706 -29.079 -8.488 1.00 0.00 O ATOM 1792 CB SER A 115 39.626 -26.118 -8.021 1.00 0.00 C ATOM 1793 OG SER A 115 38.267 -26.142 -7.600 1.00 0.00 O ATOM 0 H SER A 115 38.378 -25.445 -10.084 1.00 0.00 H new ATOM 0 HA SER A 115 40.807 -26.930 -9.626 1.00 0.00 H new ATOM 0 HB2 SER A 115 40.259 -26.592 -7.271 1.00 0.00 H new ATOM 0 HB3 SER A 115 39.969 -25.088 -8.124 1.00 0.00 H new ATOM 0 HG SER A 115 37.685 -26.268 -8.379 1.00 0.00 H new ATOM 1799 N THR A 116 38.057 -28.493 -9.917 1.00 0.00 N ATOM 1800 CA THR A 116 37.384 -29.796 -9.875 1.00 0.00 C ATOM 1801 C THR A 116 37.525 -30.458 -8.504 1.00 0.00 C ATOM 1802 O THR A 116 37.399 -29.755 -7.515 1.00 0.00 O ATOM 1803 CB THR A 116 37.961 -30.716 -10.958 1.00 0.00 C ATOM 1804 OG1 THR A 116 37.393 -32.011 -10.824 1.00 0.00 O ATOM 1805 CG2 THR A 116 39.481 -30.808 -10.810 1.00 0.00 C ATOM 1806 OXT THR A 116 37.775 -31.650 -8.468 1.00 0.00 O ATOM 0 H THR A 116 37.605 -27.807 -10.522 1.00 0.00 H new ATOM 0 HA THR A 116 36.323 -29.630 -10.060 1.00 0.00 H new ATOM 0 HB THR A 116 37.723 -30.309 -11.941 1.00 0.00 H new ATOM 0 HG1 THR A 116 37.702 -32.419 -9.988 1.00 0.00 H new ATOM 0 HG21 THR A 116 39.883 -31.463 -11.583 1.00 0.00 H new ATOM 0 HG22 THR A 116 39.917 -29.815 -10.914 1.00 0.00 H new ATOM 0 HG23 THR A 116 39.727 -31.212 -9.828 1.00 0.00 H new TER 1814 THR A 116