USER MOD reduce.3.24.130724 H: found=0, std=0, add=906, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 897 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 223 TYR OH : rot -139:sc= 1.91 USER MOD Set 1.2: B 130 SER OG : rot -143:sc= 1.35 USER MOD Set 2.1: B 122 CYS SG : rot -2:sc= 1.01 USER MOD Set 2.2: B 125 CYS SG : rot -46:sc= 0.44 USER MOD Set 2.3: B 144 CYS SG : rot -88:sc= 0.699! USER MOD Set 2.4: B 146 GLN : amide:sc=-0.00249! K(o=2.1!,f=3.2) USER MOD Set 3.1: B 94 CYS SG : rot 123:sc= 2.2! USER MOD Set 3.2: B 97 CYS SG : rot -52:sc= 0.477 USER MOD Set 3.3: B 116 HIS : no HD1:sc= 0.431 K(o=-0.72,f=-2.5) USER MOD Set 3.4: B 119 CYS SG : rot 139:sc= -3.83! USER MOD Set 4.1: A 232 HIS : no HD1:sc= -2.39 K(o=-2.4,f=-0.56) USER MOD Set 4.2: A 238 ASN : amide:sc=-0.00229 K(o=-2.4,f=-3.3) USER MOD Set 5.1: A 231 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 235 ASN : amide:sc=0.000326 K(o=-0.95,f=-1.5) USER MOD Set 5.3: A 237 GLN : amide:sc= -0.951 K(o=-0.95,f=-5.8!) USER MOD Set 6.1: A 204 CYS SG : rot 139:sc= 2.2 USER MOD Set 6.2: A 207 CYS SG : rot -44:sc= 0.786! USER MOD Set 6.3: A 225 CYS SG : rot -13:sc= 1.5! USER MOD Set 6.4: A 228 CYS SG : rot 75:sc= -2.33! USER MOD Single : A 206 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 210 THR OG1 : rot 85:sc= 1.3 USER MOD Single : A 212 THR OG1 : rot -109:sc= -0.281 USER MOD Single : A 220 THR OG1 : rot -66:sc= 0.551 USER MOD Single : A 222 HIS : no HD1:sc= -0.17 K(o=-0.17,f=-0.68) USER MOD Single : A 226 ASN : amide:sc= 0.91 K(o=0.91,f=-4.5!) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 MET CE :methyl 155:sc= -0.239 (180deg=-0.928) USER MOD Single : B 96 SER OG : rot -169:sc= -0.2 USER MOD Single : B 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 104 TYR OH : rot 180:sc= 0 USER MOD Single : B 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 107 THR OG1 : rot 162:sc= 0.28 USER MOD Single : B 108 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 113 LYS NZ :NH3+ -156:sc= 0.464 (180deg=0.271) USER MOD Single : B 115 TYR OH : rot -140:sc= -0.681 USER MOD Single : B 121 LYS NZ :NH3+ -169:sc= 1.25 (180deg=1.15) USER MOD Single : B 126 GLN : amide:sc= 0.995 K(o=1,f=0) USER MOD Single : B 127 LYS NZ :NH3+ -179:sc= 0.696 (180deg=0.695) USER MOD Single : B 128 HIS : no HD1:sc= -0.385 K(o=-0.39,f=-1.3) USER MOD Single : B 135 TYR OH : rot 180:sc= 0 USER MOD Single : B 139 ASN : amide:sc=-0.00535 K(o=-0.0054,f=-1) USER MOD Single : B 140 SER OG : rot 180:sc= 0.0873 USER MOD Single : B 149 TYR OH : rot 180:sc= 0 USER MOD Single : B 152 THR OG1 : rot -93:sc= 1.23 USER MOD Single : B 153 LYS NZ :NH3+ -178:sc= 1.31 (180deg=1.29) USER MOD Single : B 155 ASN : amide:sc= 1.34 K(o=1.3,f=0) USER MOD Single : B 158 SER OG : rot 83:sc= 0.167 USER MOD Single : B 161 SER OG : rot 180:sc= 0.0885 USER MOD Single : B 164 SER OG : rot 180:sc= 0.0596 USER MOD Single : B 169 MET CE :methyl -168:sc= -0.0545 (180deg=-0.354) USER MOD Single : B 175 THR OG1 : rot 130:sc= 1.36 USER MOD ----------------------------------------------------------------- ATOM 18 N ALA A 201 9.066 -5.059 5.606 1.00 0.91 N ATOM 19 CA ALA A 201 8.206 -4.690 4.489 1.00 0.87 C ATOM 20 C ALA A 201 9.055 -4.173 3.337 1.00 0.64 C ATOM 21 O ALA A 201 8.887 -4.576 2.187 1.00 0.87 O ATOM 22 CB ALA A 201 7.196 -3.638 4.921 1.00 1.00 C ATOM 0 HA ALA A 201 7.658 -5.571 4.157 1.00 0.87 H new ATOM 0 HB1 ALA A 201 6.562 -3.374 4.075 1.00 1.00 H new ATOM 0 HB2 ALA A 201 6.579 -4.035 5.727 1.00 1.00 H new ATOM 0 HB3 ALA A 201 7.723 -2.750 5.271 1.00 1.00 H new ATOM 28 N ARG A 202 9.984 -3.293 3.672 1.00 0.69 N ATOM 29 CA ARG A 202 10.891 -2.707 2.701 1.00 0.48 C ATOM 30 C ARG A 202 12.146 -2.252 3.431 1.00 0.42 C ATOM 31 O ARG A 202 12.138 -2.150 4.657 1.00 0.60 O ATOM 32 CB ARG A 202 10.228 -1.530 1.981 1.00 0.65 C ATOM 33 CG ARG A 202 10.646 -1.386 0.527 1.00 0.67 C ATOM 34 CD ARG A 202 9.729 -2.165 -0.402 1.00 0.94 C ATOM 35 NE ARG A 202 10.143 -3.561 -0.557 1.00 0.69 N ATOM 36 CZ ARG A 202 9.524 -4.437 -1.350 1.00 0.89 C ATOM 37 NH1 ARG A 202 8.446 -4.071 -2.032 1.00 1.57 N ATOM 38 NH2 ARG A 202 9.983 -5.681 -1.452 1.00 0.83 N ATOM 0 H ARG A 202 10.130 -2.965 4.627 1.00 0.69 H new ATOM 0 HA ARG A 202 11.151 -3.448 1.945 1.00 0.48 H new ATOM 0 HB2 ARG A 202 9.146 -1.651 2.028 1.00 0.65 H new ATOM 0 HB3 ARG A 202 10.469 -0.609 2.512 1.00 0.65 H new ATOM 0 HG2 ARG A 202 10.636 -0.332 0.248 1.00 0.67 H new ATOM 0 HG3 ARG A 202 11.670 -1.738 0.406 1.00 0.67 H new ATOM 0 HD2 ARG A 202 8.711 -2.132 -0.014 1.00 0.94 H new ATOM 0 HD3 ARG A 202 9.713 -1.683 -1.380 1.00 0.94 H new ATOM 0 HE ARG A 202 10.953 -3.883 -0.027 1.00 0.69 H new ATOM 0 HH11 ARG A 202 8.090 -3.119 -1.950 1.00 1.57 H new ATOM 0 HH12 ARG A 202 7.974 -4.742 -2.638 1.00 1.57 H new ATOM 0 HH21 ARG A 202 10.808 -5.965 -0.924 1.00 0.83 H new ATOM 0 HH22 ARG A 202 9.510 -6.351 -2.058 1.00 0.83 H new ATOM 52 N GLU A 203 13.217 -1.996 2.700 1.00 0.32 N ATOM 53 CA GLU A 203 14.461 -1.564 3.319 1.00 0.38 C ATOM 54 C GLU A 203 15.015 -0.320 2.641 1.00 0.26 C ATOM 55 O GLU A 203 14.699 -0.036 1.485 1.00 0.31 O ATOM 56 CB GLU A 203 15.506 -2.687 3.293 1.00 0.62 C ATOM 57 CG GLU A 203 15.158 -3.850 2.378 1.00 0.81 C ATOM 58 CD GLU A 203 15.285 -3.504 0.912 1.00 1.24 C ATOM 59 OE1 GLU A 203 16.417 -3.547 0.382 1.00 1.92 O ATOM 60 OE2 GLU A 203 14.253 -3.195 0.280 1.00 1.36 O ATOM 0 H GLU A 203 13.252 -2.079 1.684 1.00 0.32 H new ATOM 0 HA GLU A 203 14.238 -1.317 4.357 1.00 0.38 H new ATOM 0 HB2 GLU A 203 16.463 -2.269 2.980 1.00 0.62 H new ATOM 0 HB3 GLU A 203 15.639 -3.066 4.306 1.00 0.62 H new ATOM 0 HG2 GLU A 203 15.811 -4.692 2.605 1.00 0.81 H new ATOM 0 HG3 GLU A 203 14.138 -4.174 2.583 1.00 0.81 H new ATOM 67 N CYS A 204 15.838 0.413 3.383 1.00 0.33 N ATOM 68 CA CYS A 204 16.466 1.627 2.895 1.00 0.26 C ATOM 69 C CYS A 204 17.723 1.268 2.112 1.00 0.33 C ATOM 70 O CYS A 204 18.205 0.132 2.173 1.00 0.51 O ATOM 71 CB CYS A 204 16.809 2.536 4.092 1.00 0.30 C ATOM 72 SG CYS A 204 17.694 4.087 3.698 1.00 0.34 S ATOM 0 H CYS A 204 16.087 0.177 4.344 1.00 0.33 H new ATOM 0 HA CYS A 204 15.785 2.161 2.232 1.00 0.26 H new ATOM 0 HB2 CYS A 204 15.882 2.791 4.606 1.00 0.30 H new ATOM 0 HB3 CYS A 204 17.415 1.964 4.794 1.00 0.30 H new ATOM 0 HG CYS A 204 17.208 5.058 4.414 1.00 0.34 H new ATOM 77 N VAL A 205 18.245 2.227 1.375 1.00 0.39 N ATOM 78 CA VAL A 205 19.451 2.013 0.596 1.00 0.50 C ATOM 79 C VAL A 205 20.672 2.456 1.391 1.00 0.52 C ATOM 80 O VAL A 205 21.806 2.368 0.914 1.00 0.62 O ATOM 81 CB VAL A 205 19.418 2.768 -0.751 1.00 0.63 C ATOM 82 CG1 VAL A 205 18.395 2.147 -1.685 1.00 0.71 C ATOM 83 CG2 VAL A 205 19.123 4.246 -0.541 1.00 0.68 C ATOM 0 H VAL A 205 17.853 3.165 1.298 1.00 0.39 H new ATOM 0 HA VAL A 205 19.509 0.946 0.381 1.00 0.50 H new ATOM 0 HB VAL A 205 20.403 2.683 -1.210 1.00 0.63 H new ATOM 0 HG11 VAL A 205 18.386 2.692 -2.629 1.00 0.71 H new ATOM 0 HG12 VAL A 205 18.657 1.105 -1.870 1.00 0.71 H new ATOM 0 HG13 VAL A 205 17.407 2.197 -1.228 1.00 0.71 H new ATOM 0 HG21 VAL A 205 19.105 4.754 -1.505 1.00 0.68 H new ATOM 0 HG22 VAL A 205 18.154 4.358 -0.054 1.00 0.68 H new ATOM 0 HG23 VAL A 205 19.898 4.686 0.087 1.00 0.68 H new ATOM 93 N ASN A 206 20.435 2.935 2.606 1.00 0.49 N ATOM 94 CA ASN A 206 21.521 3.391 3.461 1.00 0.54 C ATOM 95 C ASN A 206 21.414 2.810 4.867 1.00 0.54 C ATOM 96 O ASN A 206 22.423 2.423 5.457 1.00 0.65 O ATOM 97 CB ASN A 206 21.543 4.918 3.523 1.00 0.55 C ATOM 98 CG ASN A 206 22.924 5.477 3.807 1.00 0.98 C ATOM 99 OD1 ASN A 206 23.742 4.852 4.483 1.00 1.36 O ATOM 100 ND2 ASN A 206 23.195 6.661 3.283 1.00 1.48 N ATOM 0 H ASN A 206 19.506 3.017 3.019 1.00 0.49 H new ATOM 0 HA ASN A 206 22.455 3.036 3.024 1.00 0.54 H new ATOM 0 HB2 ASN A 206 21.181 5.320 2.577 1.00 0.55 H new ATOM 0 HB3 ASN A 206 20.854 5.255 4.297 1.00 0.55 H new ATOM 0 HD21 ASN A 206 24.109 7.088 3.433 1.00 1.48 H new ATOM 0 HD22 ASN A 206 22.490 7.147 2.729 1.00 1.48 H new ATOM 107 N CYS A 207 20.204 2.731 5.415 1.00 0.47 N ATOM 108 CA CYS A 207 20.048 2.194 6.756 1.00 0.52 C ATOM 109 C CYS A 207 19.178 0.932 6.762 1.00 0.52 C ATOM 110 O CYS A 207 19.693 -0.185 6.700 1.00 0.70 O ATOM 111 CB CYS A 207 19.500 3.272 7.713 1.00 0.52 C ATOM 112 SG CYS A 207 17.796 3.838 7.384 1.00 0.46 S ATOM 0 H CYS A 207 19.339 3.025 4.961 1.00 0.47 H new ATOM 0 HA CYS A 207 21.033 1.898 7.117 1.00 0.52 H new ATOM 0 HB2 CYS A 207 19.543 2.883 8.730 1.00 0.52 H new ATOM 0 HB3 CYS A 207 20.163 4.136 7.674 1.00 0.52 H new ATOM 0 HG CYS A 207 17.642 4.031 6.108 1.00 0.46 H new ATOM 117 N GLY A 208 17.871 1.121 6.844 1.00 0.50 N ATOM 118 CA GLY A 208 16.945 0.009 6.854 1.00 0.52 C ATOM 119 C GLY A 208 15.775 0.247 7.791 1.00 0.57 C ATOM 120 O GLY A 208 15.234 -0.697 8.368 1.00 0.68 O ATOM 0 H GLY A 208 17.430 2.039 6.905 1.00 0.50 H new ATOM 0 HA2 GLY A 208 16.571 -0.160 5.844 1.00 0.52 H new ATOM 0 HA3 GLY A 208 17.471 -0.897 7.155 1.00 0.52 H new ATOM 124 N ALA A 209 15.385 1.509 7.946 1.00 0.56 N ATOM 125 CA ALA A 209 14.277 1.863 8.822 1.00 0.65 C ATOM 126 C ALA A 209 12.934 1.541 8.172 1.00 0.55 C ATOM 127 O ALA A 209 12.427 2.311 7.361 1.00 0.54 O ATOM 128 CB ALA A 209 14.345 3.336 9.190 1.00 0.78 C ATOM 0 H ALA A 209 15.821 2.302 7.476 1.00 0.56 H new ATOM 0 HA ALA A 209 14.363 1.267 9.731 1.00 0.65 H new ATOM 0 HB1 ALA A 209 13.511 3.586 9.845 1.00 0.78 H new ATOM 0 HB2 ALA A 209 15.284 3.539 9.705 1.00 0.78 H new ATOM 0 HB3 ALA A 209 14.289 3.940 8.284 1.00 0.78 H new ATOM 134 N THR A 210 12.360 0.403 8.541 1.00 0.54 N ATOM 135 CA THR A 210 11.082 -0.021 7.989 1.00 0.50 C ATOM 136 C THR A 210 9.921 0.656 8.729 1.00 0.52 C ATOM 137 O THR A 210 8.791 0.704 8.230 1.00 0.55 O ATOM 138 CB THR A 210 10.945 -1.570 8.037 1.00 0.60 C ATOM 139 OG1 THR A 210 10.512 -2.072 6.764 1.00 1.12 O ATOM 140 CG2 THR A 210 9.977 -2.037 9.121 1.00 0.91 C ATOM 0 H THR A 210 12.761 -0.243 9.221 1.00 0.54 H new ATOM 0 HA THR A 210 11.043 0.287 6.944 1.00 0.50 H new ATOM 0 HB THR A 210 11.932 -1.966 8.279 1.00 0.60 H new ATOM 0 HG1 THR A 210 11.289 -2.196 6.180 1.00 1.12 H new ATOM 0 HG21 THR A 210 9.918 -3.125 9.112 1.00 0.91 H new ATOM 0 HG22 THR A 210 10.332 -1.701 10.095 1.00 0.91 H new ATOM 0 HG23 THR A 210 8.989 -1.618 8.931 1.00 0.91 H new ATOM 148 N ALA A 211 10.225 1.221 9.896 1.00 0.56 N ATOM 149 CA ALA A 211 9.220 1.888 10.720 1.00 0.61 C ATOM 150 C ALA A 211 8.923 3.303 10.227 1.00 0.55 C ATOM 151 O ALA A 211 8.155 4.036 10.853 1.00 0.59 O ATOM 152 CB ALA A 211 9.667 1.918 12.175 1.00 0.68 C ATOM 0 H ALA A 211 11.164 1.230 10.293 1.00 0.56 H new ATOM 0 HA ALA A 211 8.297 1.314 10.639 1.00 0.61 H new ATOM 0 HB1 ALA A 211 8.909 2.418 12.778 1.00 0.68 H new ATOM 0 HB2 ALA A 211 9.803 0.898 12.535 1.00 0.68 H new ATOM 0 HB3 ALA A 211 10.610 2.460 12.255 1.00 0.68 H new ATOM 158 N THR A 212 9.537 3.687 9.113 1.00 0.48 N ATOM 159 CA THR A 212 9.315 5.006 8.537 1.00 0.44 C ATOM 160 C THR A 212 7.843 5.156 8.146 1.00 0.49 C ATOM 161 O THR A 212 7.231 4.209 7.645 1.00 0.50 O ATOM 162 CB THR A 212 10.232 5.257 7.310 1.00 0.38 C ATOM 163 OG1 THR A 212 10.062 6.594 6.822 1.00 0.40 O ATOM 164 CG2 THR A 212 9.947 4.270 6.187 1.00 0.41 C ATOM 0 H THR A 212 10.192 3.103 8.592 1.00 0.48 H new ATOM 0 HA THR A 212 9.568 5.753 9.289 1.00 0.44 H new ATOM 0 HB THR A 212 11.261 5.116 7.640 1.00 0.38 H new ATOM 0 HG1 THR A 212 9.595 6.571 5.961 1.00 0.40 H new ATOM 0 HG21 THR A 212 10.608 4.476 5.345 1.00 0.41 H new ATOM 0 HG22 THR A 212 10.119 3.254 6.543 1.00 0.41 H new ATOM 0 HG23 THR A 212 8.910 4.372 5.868 1.00 0.41 H new ATOM 172 N PRO A 213 7.248 6.334 8.400 1.00 0.55 N ATOM 173 CA PRO A 213 5.836 6.596 8.091 1.00 0.64 C ATOM 174 C PRO A 213 5.525 6.436 6.608 1.00 0.65 C ATOM 175 O PRO A 213 4.471 5.920 6.232 1.00 0.79 O ATOM 176 CB PRO A 213 5.629 8.051 8.533 1.00 0.70 C ATOM 177 CG PRO A 213 6.997 8.633 8.619 1.00 0.65 C ATOM 178 CD PRO A 213 7.901 7.502 9.010 1.00 0.58 C ATOM 0 HA PRO A 213 5.176 5.890 8.595 1.00 0.64 H new ATOM 0 HB2 PRO A 213 5.014 8.596 7.817 1.00 0.70 H new ATOM 0 HB3 PRO A 213 5.119 8.101 9.495 1.00 0.70 H new ATOM 0 HG2 PRO A 213 7.299 9.063 7.664 1.00 0.65 H new ATOM 0 HG3 PRO A 213 7.034 9.436 9.356 1.00 0.65 H new ATOM 0 HD2 PRO A 213 8.913 7.644 8.630 1.00 0.58 H new ATOM 0 HD3 PRO A 213 7.978 7.402 10.093 1.00 0.58 H new ATOM 186 N LEU A 214 6.451 6.863 5.769 1.00 0.56 N ATOM 187 CA LEU A 214 6.274 6.775 4.329 1.00 0.59 C ATOM 188 C LEU A 214 7.621 6.613 3.649 1.00 0.45 C ATOM 189 O LEU A 214 8.589 7.274 4.016 1.00 0.46 O ATOM 190 CB LEU A 214 5.556 8.023 3.804 1.00 0.76 C ATOM 191 CG LEU A 214 5.106 7.953 2.341 1.00 0.86 C ATOM 192 CD1 LEU A 214 4.167 6.776 2.119 1.00 0.98 C ATOM 193 CD2 LEU A 214 4.433 9.251 1.935 1.00 1.09 C ATOM 0 H LEU A 214 7.337 7.276 6.060 1.00 0.56 H new ATOM 0 HA LEU A 214 5.660 5.903 4.102 1.00 0.59 H new ATOM 0 HB2 LEU A 214 4.681 8.208 4.427 1.00 0.76 H new ATOM 0 HB3 LEU A 214 6.219 8.880 3.922 1.00 0.76 H new ATOM 0 HG LEU A 214 5.988 7.806 1.718 1.00 0.86 H new ATOM 0 HD11 LEU A 214 3.861 6.747 1.073 1.00 0.98 H new ATOM 0 HD12 LEU A 214 4.680 5.848 2.373 1.00 0.98 H new ATOM 0 HD13 LEU A 214 3.287 6.889 2.752 1.00 0.98 H new ATOM 0 HD21 LEU A 214 4.118 9.187 0.893 1.00 1.09 H new ATOM 0 HD22 LEU A 214 3.562 9.422 2.567 1.00 1.09 H new ATOM 0 HD23 LEU A 214 5.135 10.077 2.052 1.00 1.09 H new ATOM 205 N TRP A 215 7.674 5.734 2.662 1.00 0.46 N ATOM 206 CA TRP A 215 8.907 5.473 1.937 1.00 0.36 C ATOM 207 C TRP A 215 9.168 6.534 0.880 1.00 0.42 C ATOM 208 O TRP A 215 8.280 6.879 0.098 1.00 0.50 O ATOM 209 CB TRP A 215 8.854 4.093 1.287 1.00 0.32 C ATOM 210 CG TRP A 215 9.045 2.978 2.265 1.00 0.33 C ATOM 211 CD1 TRP A 215 8.084 2.154 2.775 1.00 0.40 C ATOM 212 CD2 TRP A 215 10.280 2.571 2.858 1.00 0.34 C ATOM 213 NE1 TRP A 215 8.650 1.257 3.649 1.00 0.45 N ATOM 214 CE2 TRP A 215 9.997 1.495 3.717 1.00 0.41 C ATOM 215 CE3 TRP A 215 11.601 3.014 2.742 1.00 0.34 C ATOM 216 CZ2 TRP A 215 10.985 0.855 4.455 1.00 0.47 C ATOM 217 CZ3 TRP A 215 12.580 2.377 3.478 1.00 0.40 C ATOM 218 CH2 TRP A 215 12.268 1.308 4.325 1.00 0.45 C ATOM 0 H TRP A 215 6.874 5.187 2.343 1.00 0.46 H new ATOM 0 HA TRP A 215 9.727 5.504 2.655 1.00 0.36 H new ATOM 0 HB2 TRP A 215 7.893 3.970 0.787 1.00 0.32 H new ATOM 0 HB3 TRP A 215 9.624 4.030 0.518 1.00 0.32 H new ATOM 0 HD1 TRP A 215 7.034 2.200 2.528 1.00 0.40 H new ATOM 0 HE1 TRP A 215 8.149 0.532 4.163 1.00 0.45 H new ATOM 0 HE3 TRP A 215 11.851 3.838 2.090 1.00 0.34 H new ATOM 0 HZ2 TRP A 215 10.748 0.029 5.108 1.00 0.47 H new ATOM 0 HZ3 TRP A 215 13.604 2.710 3.399 1.00 0.40 H new ATOM 0 HH2 TRP A 215 13.057 0.831 4.888 1.00 0.45 H new ATOM 229 N ARG A 216 10.389 7.046 0.866 1.00 0.42 N ATOM 230 CA ARG A 216 10.786 8.060 -0.094 1.00 0.53 C ATOM 231 C ARG A 216 11.407 7.394 -1.310 1.00 0.51 C ATOM 232 O ARG A 216 12.620 7.210 -1.375 1.00 0.56 O ATOM 233 CB ARG A 216 11.781 9.048 0.529 1.00 0.60 C ATOM 234 CG ARG A 216 11.136 10.135 1.385 1.00 0.71 C ATOM 235 CD ARG A 216 10.516 9.567 2.654 1.00 0.66 C ATOM 236 NE ARG A 216 10.091 10.616 3.585 1.00 0.83 N ATOM 237 CZ ARG A 216 8.836 11.055 3.695 1.00 0.67 C ATOM 238 NH1 ARG A 216 7.889 10.584 2.892 1.00 0.92 N ATOM 239 NH2 ARG A 216 8.534 11.976 4.605 1.00 0.83 N ATOM 0 H ARG A 216 11.126 6.772 1.515 1.00 0.42 H new ATOM 0 HA ARG A 216 9.899 8.618 -0.396 1.00 0.53 H new ATOM 0 HB2 ARG A 216 12.491 8.493 1.142 1.00 0.60 H new ATOM 0 HB3 ARG A 216 12.352 9.522 -0.269 1.00 0.60 H new ATOM 0 HG2 ARG A 216 11.886 10.881 1.650 1.00 0.71 H new ATOM 0 HG3 ARG A 216 10.369 10.647 0.804 1.00 0.71 H new ATOM 0 HD2 ARG A 216 9.658 8.949 2.391 1.00 0.66 H new ATOM 0 HD3 ARG A 216 11.238 8.917 3.148 1.00 0.66 H new ATOM 0 HE ARG A 216 10.799 11.037 4.187 1.00 0.83 H new ATOM 0 HH11 ARG A 216 8.120 9.884 2.187 1.00 0.92 H new ATOM 0 HH12 ARG A 216 6.931 10.923 2.980 1.00 0.92 H new ATOM 0 HH21 ARG A 216 9.261 12.346 5.217 1.00 0.83 H new ATOM 0 HH22 ARG A 216 7.575 12.313 4.691 1.00 0.83 H new ATOM 253 N ARG A 217 10.571 7.005 -2.257 1.00 0.57 N ATOM 254 CA ARG A 217 11.051 6.352 -3.464 1.00 0.57 C ATOM 255 C ARG A 217 11.051 7.327 -4.633 1.00 0.68 C ATOM 256 O ARG A 217 10.052 8.007 -4.890 1.00 0.78 O ATOM 257 CB ARG A 217 10.189 5.130 -3.800 1.00 0.56 C ATOM 258 CG ARG A 217 10.718 4.321 -4.976 1.00 0.62 C ATOM 259 CD ARG A 217 9.606 3.923 -5.934 1.00 0.66 C ATOM 260 NE ARG A 217 8.928 2.693 -5.516 1.00 0.55 N ATOM 261 CZ ARG A 217 8.853 1.590 -6.264 1.00 0.67 C ATOM 262 NH1 ARG A 217 9.409 1.552 -7.470 1.00 0.88 N ATOM 263 NH2 ARG A 217 8.224 0.520 -5.805 1.00 0.81 N ATOM 0 H ARG A 217 9.559 7.129 -2.215 1.00 0.57 H new ATOM 0 HA ARG A 217 12.073 6.017 -3.284 1.00 0.57 H new ATOM 0 HB2 ARG A 217 10.129 4.485 -2.923 1.00 0.56 H new ATOM 0 HB3 ARG A 217 9.175 5.461 -4.023 1.00 0.56 H new ATOM 0 HG2 ARG A 217 11.467 4.905 -5.511 1.00 0.62 H new ATOM 0 HG3 ARG A 217 11.217 3.425 -4.606 1.00 0.62 H new ATOM 0 HD2 ARG A 217 8.879 4.732 -6.000 1.00 0.66 H new ATOM 0 HD3 ARG A 217 10.021 3.786 -6.932 1.00 0.66 H new ATOM 0 HE ARG A 217 8.486 2.679 -4.597 1.00 0.55 H new ATOM 0 HH11 ARG A 217 9.899 2.370 -7.832 1.00 0.88 H new ATOM 0 HH12 ARG A 217 9.346 0.704 -8.034 1.00 0.88 H new ATOM 0 HH21 ARG A 217 7.796 0.538 -4.879 1.00 0.81 H new ATOM 0 HH22 ARG A 217 8.167 -0.323 -6.377 1.00 0.81 H new ATOM 277 N ASP A 218 12.174 7.398 -5.334 1.00 0.70 N ATOM 278 CA ASP A 218 12.307 8.285 -6.483 1.00 0.81 C ATOM 279 C ASP A 218 11.853 7.577 -7.761 1.00 0.84 C ATOM 280 O ASP A 218 11.310 6.470 -7.708 1.00 0.77 O ATOM 281 CB ASP A 218 13.762 8.756 -6.633 1.00 0.85 C ATOM 282 CG ASP A 218 14.597 7.803 -7.468 1.00 0.83 C ATOM 283 OD1 ASP A 218 14.790 6.654 -7.045 1.00 0.75 O ATOM 284 OD2 ASP A 218 15.039 8.195 -8.569 1.00 0.93 O ATOM 0 H ASP A 218 13.009 6.850 -5.127 1.00 0.70 H new ATOM 0 HA ASP A 218 11.671 9.155 -6.318 1.00 0.81 H new ATOM 0 HB2 ASP A 218 13.775 9.744 -7.093 1.00 0.85 H new ATOM 0 HB3 ASP A 218 14.211 8.858 -5.645 1.00 0.85 H new ATOM 289 N ARG A 219 12.090 8.219 -8.900 1.00 0.97 N ATOM 290 CA ARG A 219 11.716 7.675 -10.199 1.00 1.01 C ATOM 291 C ARG A 219 12.459 6.372 -10.509 1.00 0.97 C ATOM 292 O ARG A 219 11.844 5.395 -10.940 1.00 1.00 O ATOM 293 CB ARG A 219 12.002 8.709 -11.294 1.00 1.14 C ATOM 294 CG ARG A 219 12.088 8.118 -12.695 1.00 1.33 C ATOM 295 CD ARG A 219 12.792 9.062 -13.656 1.00 1.40 C ATOM 296 NE ARG A 219 13.284 8.367 -14.845 1.00 1.61 N ATOM 297 CZ ARG A 219 13.754 8.985 -15.929 1.00 1.54 C ATOM 298 NH1 ARG A 219 13.793 10.311 -15.978 1.00 1.43 N ATOM 299 NH2 ARG A 219 14.185 8.271 -16.964 1.00 1.91 N ATOM 0 H ARG A 219 12.546 9.130 -8.948 1.00 0.97 H new ATOM 0 HA ARG A 219 10.650 7.449 -10.170 1.00 1.01 H new ATOM 0 HB2 ARG A 219 11.219 9.467 -11.278 1.00 1.14 H new ATOM 0 HB3 ARG A 219 12.940 9.215 -11.066 1.00 1.14 H new ATOM 0 HG2 ARG A 219 12.623 7.169 -12.658 1.00 1.33 H new ATOM 0 HG3 ARG A 219 11.085 7.904 -13.063 1.00 1.33 H new ATOM 0 HD2 ARG A 219 12.104 9.852 -13.957 1.00 1.40 H new ATOM 0 HD3 ARG A 219 13.627 9.543 -13.146 1.00 1.40 H new ATOM 0 HE ARG A 219 13.267 7.347 -14.845 1.00 1.61 H new ATOM 0 HH11 ARG A 219 13.463 10.861 -15.185 1.00 1.43 H new ATOM 0 HH12 ARG A 219 14.153 10.780 -16.809 1.00 1.43 H new ATOM 0 HH21 ARG A 219 14.156 7.252 -16.928 1.00 1.91 H new ATOM 0 HH22 ARG A 219 14.545 8.742 -17.794 1.00 1.91 H new ATOM 313 N THR A 220 13.772 6.350 -10.278 1.00 0.94 N ATOM 314 CA THR A 220 14.571 5.164 -10.576 1.00 0.93 C ATOM 315 C THR A 220 14.194 3.993 -9.675 1.00 0.83 C ATOM 316 O THR A 220 14.116 2.849 -10.129 1.00 0.88 O ATOM 317 CB THR A 220 16.087 5.439 -10.469 1.00 0.97 C ATOM 318 OG1 THR A 220 16.425 5.950 -9.172 1.00 0.89 O ATOM 319 CG2 THR A 220 16.531 6.427 -11.532 1.00 1.11 C ATOM 0 H THR A 220 14.299 7.132 -9.889 1.00 0.94 H new ATOM 0 HA THR A 220 14.347 4.899 -11.609 1.00 0.93 H new ATOM 0 HB THR A 220 16.605 4.492 -10.623 1.00 0.97 H new ATOM 0 HG1 THR A 220 16.016 6.832 -9.051 1.00 0.89 H new ATOM 0 HG21 THR A 220 17.602 6.606 -11.438 1.00 1.11 H new ATOM 0 HG22 THR A 220 16.317 6.019 -12.520 1.00 1.11 H new ATOM 0 HG23 THR A 220 15.994 7.366 -11.403 1.00 1.11 H new ATOM 327 N GLY A 221 13.959 4.275 -8.403 1.00 0.78 N ATOM 328 CA GLY A 221 13.584 3.226 -7.483 1.00 0.68 C ATOM 329 C GLY A 221 14.438 3.204 -6.235 1.00 0.63 C ATOM 330 O GLY A 221 14.507 2.188 -5.543 1.00 0.62 O ATOM 0 H GLY A 221 14.021 5.207 -7.994 1.00 0.78 H new ATOM 0 HA2 GLY A 221 12.539 3.354 -7.200 1.00 0.68 H new ATOM 0 HA3 GLY A 221 13.662 2.263 -7.987 1.00 0.68 H new ATOM 334 N HIS A 222 15.092 4.317 -5.941 1.00 0.62 N ATOM 335 CA HIS A 222 15.926 4.412 -4.758 1.00 0.60 C ATOM 336 C HIS A 222 15.045 4.496 -3.524 1.00 0.52 C ATOM 337 O HIS A 222 14.467 5.543 -3.240 1.00 0.62 O ATOM 338 CB HIS A 222 16.839 5.639 -4.830 1.00 0.70 C ATOM 339 CG HIS A 222 18.291 5.305 -4.719 1.00 0.78 C ATOM 340 ND1 HIS A 222 19.148 5.924 -3.831 1.00 0.87 N ATOM 341 CD2 HIS A 222 19.044 4.414 -5.403 1.00 1.12 C ATOM 342 CE1 HIS A 222 20.361 5.422 -3.975 1.00 0.99 C ATOM 343 NE2 HIS A 222 20.323 4.506 -4.922 1.00 1.19 N ATOM 0 H HIS A 222 15.060 5.165 -6.506 1.00 0.62 H new ATOM 0 HA HIS A 222 16.554 3.523 -4.702 1.00 0.60 H new ATOM 0 HB2 HIS A 222 16.664 6.158 -5.772 1.00 0.70 H new ATOM 0 HB3 HIS A 222 16.571 6.330 -4.031 1.00 0.70 H new ATOM 0 HD2 HIS A 222 18.700 3.752 -6.184 1.00 1.12 H new ATOM 0 HE1 HIS A 222 21.236 5.713 -3.412 1.00 0.99 H new ATOM 0 HE2 HIS A 222 21.118 3.955 -5.245 1.00 1.19 H new ATOM 352 N TYR A 223 14.918 3.386 -2.816 1.00 0.39 N ATOM 353 CA TYR A 223 14.096 3.342 -1.622 1.00 0.32 C ATOM 354 C TYR A 223 14.822 3.957 -0.442 1.00 0.32 C ATOM 355 O TYR A 223 15.779 3.390 0.083 1.00 0.36 O ATOM 356 CB TYR A 223 13.673 1.908 -1.309 1.00 0.26 C ATOM 357 CG TYR A 223 12.241 1.622 -1.696 1.00 0.30 C ATOM 358 CD1 TYR A 223 11.192 2.110 -0.929 1.00 0.44 C ATOM 359 CD2 TYR A 223 11.935 0.885 -2.834 1.00 0.38 C ATOM 360 CE1 TYR A 223 9.879 1.875 -1.287 1.00 0.54 C ATOM 361 CE2 TYR A 223 10.624 0.641 -3.192 1.00 0.49 C ATOM 362 CZ TYR A 223 9.601 1.141 -2.417 1.00 0.54 C ATOM 363 OH TYR A 223 8.293 0.921 -2.779 1.00 0.69 O ATOM 0 H TYR A 223 15.374 2.504 -3.049 1.00 0.39 H new ATOM 0 HA TYR A 223 13.197 3.930 -1.809 1.00 0.32 H new ATOM 0 HB2 TYR A 223 14.332 1.217 -1.835 1.00 0.26 H new ATOM 0 HB3 TYR A 223 13.801 1.721 -0.243 1.00 0.26 H new ATOM 0 HD1 TYR A 223 11.406 2.682 -0.038 1.00 0.44 H new ATOM 0 HD2 TYR A 223 12.735 0.497 -3.448 1.00 0.38 H new ATOM 0 HE1 TYR A 223 9.074 2.266 -0.682 1.00 0.54 H new ATOM 0 HE2 TYR A 223 10.402 0.061 -4.075 1.00 0.49 H new ATOM 0 HH TYR A 223 8.192 -0.001 -3.096 1.00 0.69 H new ATOM 373 N LEU A 224 14.372 5.137 -0.056 1.00 0.31 N ATOM 374 CA LEU A 224 14.952 5.853 1.060 1.00 0.32 C ATOM 375 C LEU A 224 13.960 5.900 2.212 1.00 0.28 C ATOM 376 O LEU A 224 12.765 6.111 1.998 1.00 0.34 O ATOM 377 CB LEU A 224 15.332 7.273 0.632 1.00 0.43 C ATOM 378 CG LEU A 224 16.203 7.360 -0.624 1.00 0.60 C ATOM 379 CD1 LEU A 224 15.800 8.551 -1.480 1.00 0.78 C ATOM 380 CD2 LEU A 224 17.672 7.448 -0.247 1.00 0.61 C ATOM 0 H LEU A 224 13.597 5.623 -0.507 1.00 0.31 H new ATOM 0 HA LEU A 224 15.853 5.334 1.388 1.00 0.32 H new ATOM 0 HB2 LEU A 224 14.418 7.842 0.462 1.00 0.43 H new ATOM 0 HB3 LEU A 224 15.859 7.755 1.455 1.00 0.43 H new ATOM 0 HG LEU A 224 16.049 6.453 -1.209 1.00 0.60 H new ATOM 0 HD11 LEU A 224 16.433 8.592 -2.367 1.00 0.78 H new ATOM 0 HD12 LEU A 224 14.758 8.446 -1.782 1.00 0.78 H new ATOM 0 HD13 LEU A 224 15.920 9.469 -0.905 1.00 0.78 H new ATOM 0 HD21 LEU A 224 18.277 7.509 -1.152 1.00 0.61 H new ATOM 0 HD22 LEU A 224 17.839 8.337 0.362 1.00 0.61 H new ATOM 0 HD23 LEU A 224 17.956 6.561 0.320 1.00 0.61 H new ATOM 392 N CYS A 225 14.455 5.680 3.418 1.00 0.27 N ATOM 393 CA CYS A 225 13.628 5.703 4.615 1.00 0.34 C ATOM 394 C CYS A 225 12.921 7.046 4.764 1.00 0.41 C ATOM 395 O CYS A 225 11.720 7.178 4.523 1.00 0.48 O ATOM 396 CB CYS A 225 14.521 5.464 5.833 1.00 0.37 C ATOM 397 SG CYS A 225 15.988 6.550 5.873 1.00 0.34 S ATOM 0 H CYS A 225 15.439 5.481 3.596 1.00 0.27 H new ATOM 0 HA CYS A 225 12.870 4.923 4.536 1.00 0.34 H new ATOM 0 HB2 CYS A 225 13.937 5.620 6.740 1.00 0.37 H new ATOM 0 HB3 CYS A 225 14.847 4.424 5.838 1.00 0.37 H new ATOM 0 HG CYS A 225 16.133 7.126 4.717 1.00 0.34 H new ATOM 402 N ASN A 226 13.705 8.027 5.171 1.00 0.43 N ATOM 403 CA ASN A 226 13.246 9.385 5.382 1.00 0.54 C ATOM 404 C ASN A 226 14.446 10.260 5.722 1.00 0.53 C ATOM 405 O ASN A 226 14.584 11.377 5.223 1.00 0.65 O ATOM 406 CB ASN A 226 12.209 9.443 6.516 1.00 0.66 C ATOM 407 CG ASN A 226 11.647 10.837 6.717 1.00 0.81 C ATOM 408 OD1 ASN A 226 11.510 11.609 5.767 1.00 0.86 O ATOM 409 ND2 ASN A 226 11.295 11.165 7.951 1.00 0.94 N ATOM 0 H ASN A 226 14.698 7.898 5.368 1.00 0.43 H new ATOM 0 HA ASN A 226 12.766 9.748 4.473 1.00 0.54 H new ATOM 0 HB2 ASN A 226 11.394 8.754 6.294 1.00 0.66 H new ATOM 0 HB3 ASN A 226 12.670 9.103 7.443 1.00 0.66 H new ATOM 0 HD21 ASN A 226 10.895 12.084 8.140 1.00 0.94 H new ATOM 0 HD22 ASN A 226 11.424 10.498 8.712 1.00 0.94 H new ATOM 416 N ALA A 227 15.336 9.717 6.546 1.00 0.45 N ATOM 417 CA ALA A 227 16.533 10.430 6.968 1.00 0.45 C ATOM 418 C ALA A 227 17.605 10.408 5.882 1.00 0.42 C ATOM 419 O ALA A 227 18.154 11.449 5.522 1.00 0.45 O ATOM 420 CB ALA A 227 17.073 9.834 8.256 1.00 0.47 C ATOM 0 H ALA A 227 15.248 8.779 6.936 1.00 0.45 H new ATOM 0 HA ALA A 227 16.259 11.470 7.146 1.00 0.45 H new ATOM 0 HB1 ALA A 227 17.968 10.376 8.561 1.00 0.47 H new ATOM 0 HB2 ALA A 227 16.318 9.912 9.038 1.00 0.47 H new ATOM 0 HB3 ALA A 227 17.321 8.785 8.095 1.00 0.47 H new ATOM 426 N CYS A 228 17.903 9.221 5.354 1.00 0.38 N ATOM 427 CA CYS A 228 18.909 9.098 4.305 1.00 0.39 C ATOM 428 C CYS A 228 18.375 9.665 2.989 1.00 0.44 C ATOM 429 O CYS A 228 19.122 9.854 2.031 1.00 0.51 O ATOM 430 CB CYS A 228 19.331 7.640 4.116 1.00 0.39 C ATOM 431 SG CYS A 228 19.525 6.694 5.663 1.00 0.39 S ATOM 0 H CYS A 228 17.467 8.342 5.633 1.00 0.38 H new ATOM 0 HA CYS A 228 19.785 9.670 4.609 1.00 0.39 H new ATOM 0 HB2 CYS A 228 18.591 7.140 3.491 1.00 0.39 H new ATOM 0 HB3 CYS A 228 20.275 7.617 3.572 1.00 0.39 H new ATOM 0 HG CYS A 228 18.353 6.399 6.141 1.00 0.39 H new ATOM 436 N GLY A 229 17.076 9.944 2.960 1.00 0.44 N ATOM 437 CA GLY A 229 16.457 10.501 1.770 1.00 0.51 C ATOM 438 C GLY A 229 16.952 11.902 1.474 1.00 0.61 C ATOM 439 O GLY A 229 16.991 12.329 0.319 1.00 0.68 O ATOM 0 H GLY A 229 16.438 9.794 3.742 1.00 0.44 H new ATOM 0 HA2 GLY A 229 16.666 9.855 0.917 1.00 0.51 H new ATOM 0 HA3 GLY A 229 15.375 10.519 1.899 1.00 0.51 H new ATOM 443 N LEU A 230 17.360 12.605 2.524 1.00 0.64 N ATOM 444 CA LEU A 230 17.865 13.967 2.395 1.00 0.76 C ATOM 445 C LEU A 230 19.214 13.971 1.682 1.00 0.73 C ATOM 446 O LEU A 230 19.628 14.978 1.109 1.00 0.81 O ATOM 447 CB LEU A 230 17.993 14.612 3.777 1.00 0.83 C ATOM 448 CG LEU A 230 16.714 14.601 4.616 1.00 0.99 C ATOM 449 CD1 LEU A 230 17.015 15.013 6.046 1.00 1.11 C ATOM 450 CD2 LEU A 230 15.671 15.526 4.004 1.00 1.21 C ATOM 0 H LEU A 230 17.351 12.251 3.481 1.00 0.64 H new ATOM 0 HA LEU A 230 17.159 14.546 1.800 1.00 0.76 H new ATOM 0 HB2 LEU A 230 18.777 14.096 4.331 1.00 0.83 H new ATOM 0 HB3 LEU A 230 18.318 15.645 3.651 1.00 0.83 H new ATOM 0 HG LEU A 230 16.314 13.587 4.626 1.00 0.99 H new ATOM 0 HD11 LEU A 230 16.095 15.000 6.630 1.00 1.11 H new ATOM 0 HD12 LEU A 230 17.731 14.317 6.482 1.00 1.11 H new ATOM 0 HD13 LEU A 230 17.436 16.019 6.054 1.00 1.11 H new ATOM 0 HD21 LEU A 230 14.767 15.507 4.612 1.00 1.21 H new ATOM 0 HD22 LEU A 230 16.063 16.542 3.967 1.00 1.21 H new ATOM 0 HD23 LEU A 230 15.436 15.191 2.994 1.00 1.21 H new ATOM 462 N TYR A 231 19.884 12.826 1.704 1.00 0.67 N ATOM 463 CA TYR A 231 21.183 12.668 1.059 1.00 0.71 C ATOM 464 C TYR A 231 21.033 12.768 -0.458 1.00 0.75 C ATOM 465 O TYR A 231 21.942 13.211 -1.162 1.00 0.86 O ATOM 466 CB TYR A 231 21.774 11.312 1.452 1.00 0.69 C ATOM 467 CG TYR A 231 23.223 11.110 1.069 1.00 0.79 C ATOM 468 CD1 TYR A 231 24.249 11.679 1.813 1.00 0.85 C ATOM 469 CD2 TYR A 231 23.562 10.328 -0.026 1.00 0.90 C ATOM 470 CE1 TYR A 231 25.573 11.471 1.474 1.00 0.98 C ATOM 471 CE2 TYR A 231 24.881 10.120 -0.371 1.00 1.03 C ATOM 472 CZ TYR A 231 25.881 10.693 0.381 1.00 1.06 C ATOM 473 OH TYR A 231 27.197 10.483 0.041 1.00 1.21 O ATOM 0 H TYR A 231 19.545 11.983 2.167 1.00 0.67 H new ATOM 0 HA TYR A 231 21.854 13.462 1.387 1.00 0.71 H new ATOM 0 HB2 TYR A 231 21.679 11.190 2.531 1.00 0.69 H new ATOM 0 HB3 TYR A 231 21.179 10.525 0.989 1.00 0.69 H new ATOM 0 HD1 TYR A 231 24.009 12.293 2.669 1.00 0.85 H new ATOM 0 HD2 TYR A 231 22.780 9.875 -0.618 1.00 0.90 H new ATOM 0 HE1 TYR A 231 26.361 11.916 2.063 1.00 0.98 H new ATOM 0 HE2 TYR A 231 25.128 9.510 -1.227 1.00 1.03 H new ATOM 0 HH TYR A 231 27.242 9.911 -0.754 1.00 1.21 H new ATOM 483 N HIS A 232 19.853 12.397 -0.942 1.00 0.72 N ATOM 484 CA HIS A 232 19.555 12.416 -2.370 1.00 0.80 C ATOM 485 C HIS A 232 18.903 13.739 -2.787 1.00 0.86 C ATOM 486 O HIS A 232 18.301 13.831 -3.858 1.00 1.03 O ATOM 487 CB HIS A 232 18.623 11.243 -2.708 1.00 0.82 C ATOM 488 CG HIS A 232 18.724 10.760 -4.125 1.00 0.88 C ATOM 489 ND1 HIS A 232 17.973 11.280 -5.160 1.00 1.19 N ATOM 490 CD2 HIS A 232 19.487 9.788 -4.676 1.00 0.88 C ATOM 491 CE1 HIS A 232 18.270 10.646 -6.279 1.00 1.24 C ATOM 492 NE2 HIS A 232 19.188 9.736 -6.014 1.00 1.03 N ATOM 0 H HIS A 232 19.080 12.076 -0.360 1.00 0.72 H new ATOM 0 HA HIS A 232 20.491 12.318 -2.920 1.00 0.80 H new ATOM 0 HB2 HIS A 232 18.845 10.413 -2.037 1.00 0.82 H new ATOM 0 HB3 HIS A 232 17.594 11.544 -2.512 1.00 0.82 H new ATOM 0 HD2 HIS A 232 20.201 9.166 -4.157 1.00 0.88 H new ATOM 0 HE1 HIS A 232 17.835 10.840 -7.248 1.00 1.24 H new ATOM 0 HE2 HIS A 232 19.606 9.099 -6.692 1.00 1.03 H new ATOM 501 N LYS A 233 19.017 14.763 -1.942 1.00 0.83 N ATOM 502 CA LYS A 233 18.422 16.064 -2.247 1.00 0.88 C ATOM 503 C LYS A 233 19.247 17.217 -1.676 1.00 0.91 C ATOM 504 O LYS A 233 19.678 18.109 -2.407 1.00 1.00 O ATOM 505 CB LYS A 233 16.994 16.134 -1.695 1.00 0.89 C ATOM 506 CG LYS A 233 15.915 16.054 -2.763 1.00 1.01 C ATOM 507 CD LYS A 233 15.873 17.319 -3.606 1.00 1.16 C ATOM 508 CE LYS A 233 14.640 17.355 -4.491 1.00 1.36 C ATOM 509 NZ LYS A 233 14.498 18.656 -5.196 1.00 1.52 N ATOM 0 H LYS A 233 19.510 14.719 -1.050 1.00 0.83 H new ATOM 0 HA LYS A 233 18.405 16.167 -3.332 1.00 0.88 H new ATOM 0 HB2 LYS A 233 16.849 15.320 -0.985 1.00 0.89 H new ATOM 0 HB3 LYS A 233 16.875 17.065 -1.141 1.00 0.89 H new ATOM 0 HG2 LYS A 233 16.100 15.193 -3.405 1.00 1.01 H new ATOM 0 HG3 LYS A 233 14.945 15.897 -2.291 1.00 1.01 H new ATOM 0 HD2 LYS A 233 15.880 18.193 -2.954 1.00 1.16 H new ATOM 0 HD3 LYS A 233 16.769 17.375 -4.225 1.00 1.16 H new ATOM 0 HE2 LYS A 233 14.696 16.550 -5.224 1.00 1.36 H new ATOM 0 HE3 LYS A 233 13.753 17.173 -3.884 1.00 1.36 H new ATOM 0 HZ1 LYS A 233 13.644 18.638 -5.789 1.00 1.52 H new ATOM 0 HZ2 LYS A 233 14.418 19.422 -4.498 1.00 1.52 H new ATOM 0 HZ3 LYS A 233 15.332 18.819 -5.795 1.00 1.52 H new ATOM 523 N MET A 234 19.470 17.187 -0.369 1.00 0.86 N ATOM 524 CA MET A 234 20.222 18.237 0.313 1.00 0.89 C ATOM 525 C MET A 234 21.688 18.228 -0.102 1.00 0.90 C ATOM 526 O MET A 234 22.247 19.257 -0.485 1.00 0.98 O ATOM 527 CB MET A 234 20.121 18.059 1.830 1.00 0.88 C ATOM 528 CG MET A 234 20.299 19.349 2.610 1.00 1.05 C ATOM 529 SD MET A 234 18.809 20.365 2.606 1.00 1.24 S ATOM 530 CE MET A 234 17.682 19.327 3.538 1.00 1.28 C ATOM 0 H MET A 234 19.139 16.443 0.245 1.00 0.86 H new ATOM 0 HA MET A 234 19.788 19.195 0.026 1.00 0.89 H new ATOM 0 HB2 MET A 234 19.149 17.630 2.072 1.00 0.88 H new ATOM 0 HB3 MET A 234 20.876 17.342 2.154 1.00 0.88 H new ATOM 0 HG2 MET A 234 20.572 19.114 3.639 1.00 1.05 H new ATOM 0 HG3 MET A 234 21.125 19.918 2.183 1.00 1.05 H new ATOM 0 HE1 MET A 234 16.913 19.947 3.999 1.00 1.28 H new ATOM 0 HE2 MET A 234 17.214 18.606 2.868 1.00 1.28 H new ATOM 0 HE3 MET A 234 18.233 18.797 4.314 1.00 1.28 H new ATOM 540 N ASN A 235 22.300 17.058 -0.035 1.00 0.84 N ATOM 541 CA ASN A 235 23.708 16.909 -0.389 1.00 0.88 C ATOM 542 C ASN A 235 23.887 16.790 -1.896 1.00 0.93 C ATOM 543 O ASN A 235 24.995 16.952 -2.410 1.00 0.98 O ATOM 544 CB ASN A 235 24.314 15.683 0.301 1.00 0.84 C ATOM 545 CG ASN A 235 24.694 15.947 1.746 1.00 0.95 C ATOM 546 OD1 ASN A 235 24.009 16.678 2.461 1.00 1.15 O ATOM 547 ND2 ASN A 235 25.791 15.351 2.185 1.00 1.06 N ATOM 0 H ASN A 235 21.846 16.194 0.261 1.00 0.84 H new ATOM 0 HA ASN A 235 24.228 17.804 -0.047 1.00 0.88 H new ATOM 0 HB2 ASN A 235 23.600 14.861 0.263 1.00 0.84 H new ATOM 0 HB3 ASN A 235 25.199 15.363 -0.249 1.00 0.84 H new ATOM 0 HD21 ASN A 235 26.096 15.490 3.148 1.00 1.06 H new ATOM 0 HD22 ASN A 235 26.331 14.752 1.560 1.00 1.06 H new ATOM 554 N GLY A 236 22.792 16.513 -2.597 1.00 0.97 N ATOM 555 CA GLY A 236 22.848 16.369 -4.041 1.00 1.05 C ATOM 556 C GLY A 236 23.705 15.190 -4.456 1.00 1.03 C ATOM 557 O GLY A 236 24.602 15.324 -5.293 1.00 1.16 O ATOM 0 H GLY A 236 21.865 16.385 -2.190 1.00 0.97 H new ATOM 0 HA2 GLY A 236 21.839 16.241 -4.433 1.00 1.05 H new ATOM 0 HA3 GLY A 236 23.248 17.282 -4.482 1.00 1.05 H new ATOM 561 N GLN A 237 23.447 14.041 -3.850 1.00 0.95 N ATOM 562 CA GLN A 237 24.196 12.830 -4.148 1.00 0.94 C ATOM 563 C GLN A 237 23.237 11.660 -4.338 1.00 0.85 C ATOM 564 O GLN A 237 22.021 11.830 -4.238 1.00 0.82 O ATOM 565 CB GLN A 237 25.195 12.533 -3.024 1.00 0.91 C ATOM 566 CG GLN A 237 26.301 13.572 -2.912 1.00 1.05 C ATOM 567 CD GLN A 237 27.167 13.385 -1.686 1.00 0.97 C ATOM 568 OE1 GLN A 237 26.890 13.939 -0.621 1.00 0.89 O ATOM 569 NE2 GLN A 237 28.228 12.611 -1.829 1.00 1.11 N ATOM 0 H GLN A 237 22.720 13.922 -3.145 1.00 0.95 H new ATOM 0 HA GLN A 237 24.755 12.976 -5.072 1.00 0.94 H new ATOM 0 HB2 GLN A 237 24.659 12.479 -2.076 1.00 0.91 H new ATOM 0 HB3 GLN A 237 25.642 11.553 -3.194 1.00 0.91 H new ATOM 0 HG2 GLN A 237 26.927 13.525 -3.803 1.00 1.05 H new ATOM 0 HG3 GLN A 237 25.856 14.567 -2.887 1.00 1.05 H new ATOM 0 HE21 GLN A 237 28.421 12.171 -2.729 1.00 1.11 H new ATOM 0 HE22 GLN A 237 28.854 12.453 -1.040 1.00 1.11 H new ATOM 578 N ASN A 238 23.777 10.484 -4.616 1.00 0.89 N ATOM 579 CA ASN A 238 22.951 9.301 -4.820 1.00 0.81 C ATOM 580 C ASN A 238 22.812 8.513 -3.524 1.00 0.84 C ATOM 581 O ASN A 238 23.844 8.040 -3.005 1.00 1.01 O ATOM 582 CB ASN A 238 23.534 8.402 -5.910 1.00 0.94 C ATOM 583 CG ASN A 238 22.586 7.277 -6.287 1.00 0.98 C ATOM 584 OD1 ASN A 238 21.364 7.450 -6.287 1.00 0.96 O ATOM 585 ND2 ASN A 238 23.137 6.117 -6.609 1.00 1.32 N ATOM 586 OXT ASN A 238 21.672 8.372 -3.030 1.00 0.85 O ATOM 0 H ASN A 238 24.780 10.322 -4.706 1.00 0.89 H new ATOM 0 HA ASN A 238 21.965 9.639 -5.139 1.00 0.81 H new ATOM 0 HB2 ASN A 238 23.756 9.001 -6.794 1.00 0.94 H new ATOM 0 HB3 ASN A 238 24.478 7.980 -5.566 1.00 0.94 H new ATOM 0 HD21 ASN A 238 22.547 5.327 -6.869 1.00 1.32 H new ATOM 0 HD22 ASN A 238 24.152 6.014 -6.597 1.00 1.32 H new ATOM 723 N ASP B 91 -15.960 4.930 -3.312 1.00 1.09 N ATOM 724 CA ASP B 91 -16.931 3.843 -3.410 1.00 1.11 C ATOM 725 C ASP B 91 -18.194 4.189 -2.638 1.00 1.14 C ATOM 726 O ASP B 91 -19.252 4.415 -3.224 1.00 1.30 O ATOM 727 CB ASP B 91 -16.349 2.528 -2.879 1.00 1.03 C ATOM 728 CG ASP B 91 -17.361 1.391 -2.910 1.00 1.07 C ATOM 729 OD1 ASP B 91 -18.155 1.266 -1.951 1.00 1.15 O ATOM 730 OD2 ASP B 91 -17.369 0.623 -3.892 1.00 1.42 O ATOM 0 HA ASP B 91 -17.175 3.713 -4.464 1.00 1.11 H new ATOM 0 HB2 ASP B 91 -15.479 2.252 -3.474 1.00 1.03 H new ATOM 0 HB3 ASP B 91 -16.002 2.674 -1.856 1.00 1.03 H new ATOM 735 N GLY B 92 -18.073 4.227 -1.319 1.00 1.04 N ATOM 736 CA GLY B 92 -19.206 4.543 -0.475 1.00 1.07 C ATOM 737 C GLY B 92 -19.073 3.902 0.889 1.00 1.09 C ATOM 738 O GLY B 92 -19.147 4.582 1.913 1.00 1.16 O ATOM 0 H GLY B 92 -17.205 4.043 -0.816 1.00 1.04 H new ATOM 0 HA2 GLY B 92 -19.289 5.624 -0.364 1.00 1.07 H new ATOM 0 HA3 GLY B 92 -20.124 4.200 -0.952 1.00 1.07 H new ATOM 742 N LEU B 93 -18.850 2.599 0.902 1.00 1.06 N ATOM 743 CA LEU B 93 -18.696 1.864 2.148 1.00 1.09 C ATOM 744 C LEU B 93 -17.391 1.082 2.137 1.00 1.04 C ATOM 745 O LEU B 93 -16.848 0.787 1.072 1.00 1.02 O ATOM 746 CB LEU B 93 -19.878 0.920 2.375 1.00 1.17 C ATOM 747 CG LEU B 93 -21.175 1.597 2.826 1.00 1.28 C ATOM 748 CD1 LEU B 93 -22.349 0.641 2.684 1.00 1.27 C ATOM 749 CD2 LEU B 93 -21.054 2.082 4.264 1.00 1.80 C ATOM 0 H LEU B 93 -18.771 2.026 0.062 1.00 1.06 H new ATOM 0 HA LEU B 93 -18.672 2.582 2.968 1.00 1.09 H new ATOM 0 HB2 LEU B 93 -20.073 0.378 1.450 1.00 1.17 H new ATOM 0 HB3 LEU B 93 -19.593 0.181 3.124 1.00 1.17 H new ATOM 0 HG LEU B 93 -21.353 2.462 2.186 1.00 1.28 H new ATOM 0 HD11 LEU B 93 -23.264 1.137 3.009 1.00 1.27 H new ATOM 0 HD12 LEU B 93 -22.450 0.341 1.641 1.00 1.27 H new ATOM 0 HD13 LEU B 93 -22.176 -0.241 3.300 1.00 1.27 H new ATOM 0 HD21 LEU B 93 -21.986 2.560 4.566 1.00 1.80 H new ATOM 0 HD22 LEU B 93 -20.853 1.234 4.918 1.00 1.80 H new ATOM 0 HD23 LEU B 93 -20.237 2.800 4.338 1.00 1.80 H new ATOM 761 N CYS B 94 -16.894 0.752 3.322 1.00 1.04 N ATOM 762 CA CYS B 94 -15.647 0.014 3.465 1.00 1.00 C ATOM 763 C CYS B 94 -15.839 -1.465 3.139 1.00 1.01 C ATOM 764 O CYS B 94 -16.876 -1.893 2.626 1.00 1.09 O ATOM 765 CB CYS B 94 -15.137 0.165 4.904 1.00 1.04 C ATOM 766 SG CYS B 94 -13.410 -0.353 5.205 1.00 0.96 S ATOM 0 H CYS B 94 -17.342 0.987 4.207 1.00 1.04 H new ATOM 0 HA CYS B 94 -14.919 0.421 2.763 1.00 1.00 H new ATOM 0 HB2 CYS B 94 -15.237 1.211 5.195 1.00 1.04 H new ATOM 0 HB3 CYS B 94 -15.788 -0.413 5.561 1.00 1.04 H new ATOM 0 HG CYS B 94 -12.738 0.644 5.699 1.00 0.96 H new ATOM 771 N ALA B 95 -14.816 -2.228 3.451 1.00 0.99 N ATOM 772 CA ALA B 95 -14.816 -3.657 3.238 1.00 1.00 C ATOM 773 C ALA B 95 -14.257 -4.339 4.474 1.00 1.01 C ATOM 774 O ALA B 95 -14.562 -5.497 4.758 1.00 1.05 O ATOM 775 CB ALA B 95 -14.000 -4.012 2.010 1.00 1.00 C ATOM 0 H ALA B 95 -13.954 -1.871 3.863 1.00 0.99 H new ATOM 0 HA ALA B 95 -15.836 -4.001 3.067 1.00 1.00 H new ATOM 0 HB1 ALA B 95 -14.011 -5.092 1.865 1.00 1.00 H new ATOM 0 HB2 ALA B 95 -14.429 -3.524 1.135 1.00 1.00 H new ATOM 0 HB3 ALA B 95 -12.972 -3.675 2.146 1.00 1.00 H new ATOM 781 N SER B 96 -13.437 -3.597 5.210 1.00 1.00 N ATOM 782 CA SER B 96 -12.839 -4.102 6.430 1.00 1.01 C ATOM 783 C SER B 96 -13.686 -3.693 7.628 1.00 1.07 C ATOM 784 O SER B 96 -13.777 -4.422 8.615 1.00 1.13 O ATOM 785 CB SER B 96 -11.412 -3.571 6.587 1.00 0.97 C ATOM 786 OG SER B 96 -10.694 -3.643 5.365 1.00 1.17 O ATOM 0 H SER B 96 -13.173 -2.640 4.977 1.00 1.00 H new ATOM 0 HA SER B 96 -12.798 -5.190 6.376 1.00 1.01 H new ATOM 0 HB2 SER B 96 -11.443 -2.537 6.932 1.00 0.97 H new ATOM 0 HB3 SER B 96 -10.890 -4.147 7.351 1.00 0.97 H new ATOM 0 HG SER B 96 -9.745 -3.464 5.532 1.00 1.17 H new ATOM 792 N CYS B 97 -14.317 -2.530 7.534 1.00 1.10 N ATOM 793 CA CYS B 97 -15.157 -2.046 8.610 1.00 1.17 C ATOM 794 C CYS B 97 -16.516 -1.619 8.059 1.00 1.22 C ATOM 795 O CYS B 97 -16.782 -1.775 6.865 1.00 1.26 O ATOM 796 CB CYS B 97 -14.461 -0.900 9.365 1.00 1.16 C ATOM 797 SG CYS B 97 -14.534 0.730 8.551 1.00 1.15 S ATOM 0 H CYS B 97 -14.261 -1.910 6.726 1.00 1.10 H new ATOM 0 HA CYS B 97 -15.323 -2.851 9.325 1.00 1.17 H new ATOM 0 HB2 CYS B 97 -14.910 -0.814 10.354 1.00 1.16 H new ATOM 0 HB3 CYS B 97 -13.415 -1.167 9.512 1.00 1.16 H new ATOM 0 HG CYS B 97 -14.127 0.620 7.321 1.00 1.15 H new ATOM 802 N ASP B 98 -17.375 -1.090 8.915 1.00 1.26 N ATOM 803 CA ASP B 98 -18.706 -0.667 8.487 1.00 1.33 C ATOM 804 C ASP B 98 -18.901 0.827 8.702 1.00 1.34 C ATOM 805 O ASP B 98 -19.871 1.257 9.331 1.00 1.45 O ATOM 806 CB ASP B 98 -19.796 -1.445 9.231 1.00 1.41 C ATOM 807 CG ASP B 98 -20.182 -2.730 8.525 1.00 1.68 C ATOM 808 OD1 ASP B 98 -20.698 -2.667 7.388 1.00 1.97 O ATOM 809 OD2 ASP B 98 -19.971 -3.818 9.103 1.00 1.86 O ATOM 0 H ASP B 98 -17.180 -0.942 9.905 1.00 1.26 H new ATOM 0 HA ASP B 98 -18.789 -0.880 7.421 1.00 1.33 H new ATOM 0 HB2 ASP B 98 -19.448 -1.678 10.237 1.00 1.41 H new ATOM 0 HB3 ASP B 98 -20.679 -0.814 9.337 1.00 1.41 H new ATOM 814 N LYS B 99 -17.961 1.617 8.206 1.00 1.28 N ATOM 815 CA LYS B 99 -18.044 3.066 8.327 1.00 1.29 C ATOM 816 C LYS B 99 -18.119 3.707 6.945 1.00 1.27 C ATOM 817 O LYS B 99 -17.409 3.294 6.024 1.00 1.25 O ATOM 818 CB LYS B 99 -16.839 3.620 9.089 1.00 1.28 C ATOM 819 CG LYS B 99 -16.694 3.060 10.496 1.00 1.33 C ATOM 820 CD LYS B 99 -17.856 3.467 11.391 1.00 1.41 C ATOM 821 CE LYS B 99 -17.713 2.870 12.783 1.00 1.60 C ATOM 822 NZ LYS B 99 -18.889 3.171 13.639 1.00 1.72 N ATOM 0 H LYS B 99 -17.132 1.280 7.716 1.00 1.28 H new ATOM 0 HA LYS B 99 -18.949 3.308 8.885 1.00 1.29 H new ATOM 0 HB2 LYS B 99 -15.932 3.401 8.525 1.00 1.28 H new ATOM 0 HB3 LYS B 99 -16.924 4.705 9.147 1.00 1.28 H new ATOM 0 HG2 LYS B 99 -16.635 1.973 10.450 1.00 1.33 H new ATOM 0 HG3 LYS B 99 -15.759 3.412 10.932 1.00 1.33 H new ATOM 0 HD2 LYS B 99 -17.901 4.554 11.461 1.00 1.41 H new ATOM 0 HD3 LYS B 99 -18.795 3.137 10.946 1.00 1.41 H new ATOM 0 HE2 LYS B 99 -17.589 1.790 12.704 1.00 1.60 H new ATOM 0 HE3 LYS B 99 -16.811 3.261 13.255 1.00 1.60 H new ATOM 0 HZ1 LYS B 99 -18.752 2.747 14.579 1.00 1.72 H new ATOM 0 HZ2 LYS B 99 -18.993 4.201 13.736 1.00 1.72 H new ATOM 0 HZ3 LYS B 99 -19.746 2.776 13.202 1.00 1.72 H new ATOM 836 N ARG B 100 -18.980 4.706 6.803 1.00 1.33 N ATOM 837 CA ARG B 100 -19.147 5.405 5.533 1.00 1.32 C ATOM 838 C ARG B 100 -17.850 6.076 5.100 1.00 1.27 C ATOM 839 O ARG B 100 -17.186 6.746 5.896 1.00 1.34 O ATOM 840 CB ARG B 100 -20.256 6.449 5.646 1.00 1.40 C ATOM 841 CG ARG B 100 -21.647 5.883 5.438 1.00 1.46 C ATOM 842 CD ARG B 100 -22.713 6.953 5.610 1.00 1.51 C ATOM 843 NE ARG B 100 -22.845 7.377 7.001 1.00 1.58 N ATOM 844 CZ ARG B 100 -23.862 7.033 7.792 1.00 1.68 C ATOM 845 NH1 ARG B 100 -24.864 6.296 7.320 1.00 1.80 N ATOM 846 NH2 ARG B 100 -23.886 7.445 9.053 1.00 1.80 N ATOM 0 H ARG B 100 -19.576 5.053 7.554 1.00 1.33 H new ATOM 0 HA ARG B 100 -19.421 4.668 4.779 1.00 1.32 H new ATOM 0 HB2 ARG B 100 -20.206 6.915 6.630 1.00 1.40 H new ATOM 0 HB3 ARG B 100 -20.079 7.235 4.912 1.00 1.40 H new ATOM 0 HG2 ARG B 100 -21.720 5.452 4.440 1.00 1.46 H new ATOM 0 HG3 ARG B 100 -21.823 5.075 6.148 1.00 1.46 H new ATOM 0 HD2 ARG B 100 -22.464 7.815 4.991 1.00 1.51 H new ATOM 0 HD3 ARG B 100 -23.670 6.571 5.255 1.00 1.51 H new ATOM 0 HE ARG B 100 -22.115 7.973 7.391 1.00 1.58 H new ATOM 0 HH11 ARG B 100 -24.858 5.990 6.347 1.00 1.80 H new ATOM 0 HH12 ARG B 100 -25.638 6.037 7.931 1.00 1.80 H new ATOM 0 HH21 ARG B 100 -23.128 8.023 9.415 1.00 1.80 H new ATOM 0 HH22 ARG B 100 -24.663 7.183 9.660 1.00 1.80 H new ATOM 860 N ILE B 101 -17.490 5.891 3.838 1.00 1.19 N ATOM 861 CA ILE B 101 -16.274 6.477 3.293 1.00 1.15 C ATOM 862 C ILE B 101 -16.456 7.972 3.064 1.00 1.19 C ATOM 863 O ILE B 101 -17.415 8.404 2.423 1.00 1.27 O ATOM 864 CB ILE B 101 -15.863 5.792 1.971 1.00 1.12 C ATOM 865 CG1 ILE B 101 -15.500 4.329 2.228 1.00 1.07 C ATOM 866 CG2 ILE B 101 -14.697 6.527 1.320 1.00 1.11 C ATOM 867 CD1 ILE B 101 -15.120 3.571 0.976 1.00 1.09 C ATOM 0 H ILE B 101 -18.026 5.337 3.170 1.00 1.19 H new ATOM 0 HA ILE B 101 -15.479 6.321 4.022 1.00 1.15 H new ATOM 0 HB ILE B 101 -16.709 5.828 1.285 1.00 1.12 H new ATOM 0 HG12 ILE B 101 -14.670 4.288 2.934 1.00 1.07 H new ATOM 0 HG13 ILE B 101 -16.346 3.831 2.701 1.00 1.07 H new ATOM 0 HG21 ILE B 101 -14.425 6.027 0.391 1.00 1.11 H new ATOM 0 HG22 ILE B 101 -14.989 7.555 1.107 1.00 1.11 H new ATOM 0 HG23 ILE B 101 -13.842 6.525 1.997 1.00 1.11 H new ATOM 0 HD11 ILE B 101 -14.875 2.541 1.235 1.00 1.09 H new ATOM 0 HD12 ILE B 101 -15.956 3.581 0.277 1.00 1.09 H new ATOM 0 HD13 ILE B 101 -14.254 4.044 0.513 1.00 1.09 H new ATOM 879 N ARG B 102 -15.548 8.758 3.622 1.00 1.17 N ATOM 880 CA ARG B 102 -15.592 10.205 3.479 1.00 1.21 C ATOM 881 C ARG B 102 -14.351 10.686 2.746 1.00 1.13 C ATOM 882 O ARG B 102 -13.527 9.874 2.322 1.00 1.04 O ATOM 883 CB ARG B 102 -15.692 10.879 4.854 1.00 1.34 C ATOM 884 CG ARG B 102 -16.966 10.540 5.619 1.00 1.47 C ATOM 885 CD ARG B 102 -18.190 11.205 5.003 1.00 1.51 C ATOM 886 NE ARG B 102 -18.510 10.666 3.681 1.00 1.39 N ATOM 887 CZ ARG B 102 -19.131 11.353 2.725 1.00 1.58 C ATOM 888 NH1 ARG B 102 -19.540 12.593 2.952 1.00 1.94 N ATOM 889 NH2 ARG B 102 -19.352 10.791 1.546 1.00 1.57 N ATOM 0 H ARG B 102 -14.767 8.415 4.181 1.00 1.17 H new ATOM 0 HA ARG B 102 -16.475 10.475 2.901 1.00 1.21 H new ATOM 0 HB2 ARG B 102 -14.831 10.586 5.454 1.00 1.34 H new ATOM 0 HB3 ARG B 102 -15.636 11.960 4.723 1.00 1.34 H new ATOM 0 HG2 ARG B 102 -17.107 9.459 5.630 1.00 1.47 H new ATOM 0 HG3 ARG B 102 -16.863 10.859 6.656 1.00 1.47 H new ATOM 0 HD2 ARG B 102 -19.046 11.070 5.665 1.00 1.51 H new ATOM 0 HD3 ARG B 102 -18.016 12.278 4.923 1.00 1.51 H new ATOM 0 HE ARG B 102 -18.240 9.703 3.479 1.00 1.39 H new ATOM 0 HH11 ARG B 102 -19.379 13.024 3.862 1.00 1.94 H new ATOM 0 HH12 ARG B 102 -20.015 13.116 2.217 1.00 1.94 H new ATOM 0 HH21 ARG B 102 -19.046 9.833 1.372 1.00 1.57 H new ATOM 0 HH22 ARG B 102 -19.828 11.316 0.812 1.00 1.57 H new ATOM 903 N ALA B 103 -14.198 12.001 2.633 1.00 1.20 N ATOM 904 CA ALA B 103 -13.050 12.590 1.944 1.00 1.16 C ATOM 905 C ALA B 103 -11.798 12.546 2.817 1.00 1.16 C ATOM 906 O ALA B 103 -10.952 13.438 2.764 1.00 1.39 O ATOM 907 CB ALA B 103 -13.364 14.021 1.535 1.00 1.30 C ATOM 0 H ALA B 103 -14.856 12.683 3.010 1.00 1.20 H new ATOM 0 HA ALA B 103 -12.852 12.001 1.049 1.00 1.16 H new ATOM 0 HB1 ALA B 103 -12.503 14.450 1.023 1.00 1.30 H new ATOM 0 HB2 ALA B 103 -14.225 14.028 0.866 1.00 1.30 H new ATOM 0 HB3 ALA B 103 -13.590 14.612 2.423 1.00 1.30 H new ATOM 913 N TYR B 104 -11.686 11.495 3.612 1.00 1.18 N ATOM 914 CA TYR B 104 -10.552 11.314 4.499 1.00 1.15 C ATOM 915 C TYR B 104 -10.013 9.893 4.363 1.00 1.13 C ATOM 916 O TYR B 104 -9.295 9.403 5.230 1.00 1.30 O ATOM 917 CB TYR B 104 -10.969 11.606 5.948 1.00 1.20 C ATOM 918 CG TYR B 104 -9.806 11.769 6.909 1.00 1.28 C ATOM 919 CD1 TYR B 104 -8.822 12.724 6.684 1.00 1.33 C ATOM 920 CD2 TYR B 104 -9.692 10.963 8.037 1.00 1.39 C ATOM 921 CE1 TYR B 104 -7.759 12.874 7.554 1.00 1.47 C ATOM 922 CE2 TYR B 104 -8.630 11.107 8.912 1.00 1.52 C ATOM 923 CZ TYR B 104 -7.667 12.064 8.666 1.00 1.56 C ATOM 924 OH TYR B 104 -6.607 12.211 9.535 1.00 1.74 O ATOM 0 H TYR B 104 -12.377 10.746 3.660 1.00 1.18 H new ATOM 0 HA TYR B 104 -9.761 12.011 4.224 1.00 1.15 H new ATOM 0 HB2 TYR B 104 -11.570 12.515 5.965 1.00 1.20 H new ATOM 0 HB3 TYR B 104 -11.607 10.796 6.301 1.00 1.20 H new ATOM 0 HD1 TYR B 104 -8.889 13.360 5.814 1.00 1.33 H new ATOM 0 HD2 TYR B 104 -10.444 10.213 8.233 1.00 1.39 H new ATOM 0 HE1 TYR B 104 -7.004 13.622 7.364 1.00 1.47 H new ATOM 0 HE2 TYR B 104 -8.555 10.473 9.783 1.00 1.52 H new ATOM 0 HH TYR B 104 -6.692 11.565 10.267 1.00 1.74 H new ATOM 934 N GLU B 105 -10.380 9.226 3.273 1.00 1.03 N ATOM 935 CA GLU B 105 -9.916 7.866 3.035 1.00 1.02 C ATOM 936 C GLU B 105 -8.430 7.876 2.698 1.00 0.98 C ATOM 937 O GLU B 105 -7.631 7.257 3.404 1.00 1.01 O ATOM 938 CB GLU B 105 -10.726 7.185 1.925 1.00 1.10 C ATOM 939 CG GLU B 105 -11.061 8.086 0.747 1.00 1.16 C ATOM 940 CD GLU B 105 -10.702 7.453 -0.582 1.00 1.13 C ATOM 941 OE1 GLU B 105 -9.505 7.470 -0.941 1.00 1.45 O ATOM 942 OE2 GLU B 105 -11.612 6.934 -1.263 1.00 1.42 O ATOM 0 H GLU B 105 -10.991 9.601 2.548 1.00 1.03 H new ATOM 0 HA GLU B 105 -10.066 7.287 3.946 1.00 1.02 H new ATOM 0 HB2 GLU B 105 -10.166 6.324 1.560 1.00 1.10 H new ATOM 0 HB3 GLU B 105 -11.654 6.805 2.351 1.00 1.10 H new ATOM 0 HG2 GLU B 105 -12.126 8.317 0.761 1.00 1.16 H new ATOM 0 HG3 GLU B 105 -10.528 9.031 0.852 1.00 1.16 H new ATOM 949 N MET B 106 -8.071 8.601 1.631 1.00 0.96 N ATOM 950 CA MET B 106 -6.678 8.726 1.195 1.00 0.95 C ATOM 951 C MET B 106 -6.040 7.354 1.028 1.00 0.90 C ATOM 952 O MET B 106 -4.899 7.124 1.434 1.00 0.94 O ATOM 953 CB MET B 106 -5.878 9.567 2.196 1.00 1.03 C ATOM 954 CG MET B 106 -6.404 10.986 2.358 1.00 1.06 C ATOM 955 SD MET B 106 -5.449 11.956 3.541 1.00 1.16 S ATOM 956 CE MET B 106 -6.315 13.525 3.466 1.00 1.21 C ATOM 0 H MET B 106 -8.735 9.114 1.050 1.00 0.96 H new ATOM 0 HA MET B 106 -6.667 9.229 0.228 1.00 0.95 H new ATOM 0 HB2 MET B 106 -5.891 9.071 3.166 1.00 1.03 H new ATOM 0 HB3 MET B 106 -4.838 9.609 1.873 1.00 1.03 H new ATOM 0 HG2 MET B 106 -6.390 11.486 1.390 1.00 1.06 H new ATOM 0 HG3 MET B 106 -7.444 10.948 2.682 1.00 1.06 H new ATOM 0 HE1 MET B 106 -5.842 14.234 4.145 1.00 1.21 H new ATOM 0 HE2 MET B 106 -6.275 13.914 2.449 1.00 1.21 H new ATOM 0 HE3 MET B 106 -7.355 13.381 3.758 1.00 1.21 H new ATOM 966 N THR B 107 -6.780 6.453 0.412 1.00 0.86 N ATOM 967 CA THR B 107 -6.314 5.098 0.213 1.00 0.84 C ATOM 968 C THR B 107 -5.840 4.885 -1.222 1.00 0.76 C ATOM 969 O THR B 107 -6.044 5.736 -2.088 1.00 0.77 O ATOM 970 CB THR B 107 -7.429 4.090 0.562 1.00 0.90 C ATOM 971 OG1 THR B 107 -6.876 2.793 0.809 1.00 0.97 O ATOM 972 CG2 THR B 107 -8.469 4.002 -0.547 1.00 0.88 C ATOM 0 H THR B 107 -7.711 6.638 0.039 1.00 0.86 H new ATOM 0 HA THR B 107 -5.467 4.932 0.878 1.00 0.84 H new ATOM 0 HB THR B 107 -7.921 4.449 1.466 1.00 0.90 H new ATOM 0 HG1 THR B 107 -7.525 2.249 1.303 1.00 0.97 H new ATOM 0 HG21 THR B 107 -9.239 3.283 -0.267 1.00 0.88 H new ATOM 0 HG22 THR B 107 -8.924 4.981 -0.698 1.00 0.88 H new ATOM 0 HG23 THR B 107 -7.989 3.679 -1.471 1.00 0.88 H new ATOM 980 N MET B 108 -5.182 3.759 -1.456 1.00 0.76 N ATOM 981 CA MET B 108 -4.685 3.417 -2.780 1.00 0.71 C ATOM 982 C MET B 108 -5.835 2.925 -3.647 1.00 0.69 C ATOM 983 O MET B 108 -6.807 2.373 -3.133 1.00 0.76 O ATOM 984 CB MET B 108 -3.601 2.341 -2.685 1.00 0.64 C ATOM 985 CG MET B 108 -2.257 2.855 -2.187 1.00 0.84 C ATOM 986 SD MET B 108 -2.239 3.201 -0.415 1.00 1.33 S ATOM 987 CE MET B 108 -0.488 3.462 -0.140 1.00 1.26 C ATOM 0 H MET B 108 -4.979 3.062 -0.740 1.00 0.76 H new ATOM 0 HA MET B 108 -4.248 4.307 -3.233 1.00 0.71 H new ATOM 0 HB2 MET B 108 -3.946 1.551 -2.018 1.00 0.64 H new ATOM 0 HB3 MET B 108 -3.464 1.891 -3.668 1.00 0.64 H new ATOM 0 HG2 MET B 108 -1.487 2.118 -2.414 1.00 0.84 H new ATOM 0 HG3 MET B 108 -1.999 3.764 -2.731 1.00 0.84 H new ATOM 0 HE1 MET B 108 -0.315 3.687 0.912 1.00 1.26 H new ATOM 0 HE2 MET B 108 0.062 2.561 -0.414 1.00 1.26 H new ATOM 0 HE3 MET B 108 -0.144 4.297 -0.751 1.00 1.26 H new ATOM 997 N ARG B 109 -5.736 3.128 -4.952 1.00 0.72 N ATOM 998 CA ARG B 109 -6.788 2.694 -5.860 1.00 0.74 C ATOM 999 C ARG B 109 -6.889 1.169 -5.883 1.00 0.64 C ATOM 1000 O ARG B 109 -6.047 0.487 -6.466 1.00 0.63 O ATOM 1001 CB ARG B 109 -6.541 3.232 -7.272 1.00 0.85 C ATOM 1002 CG ARG B 109 -7.679 2.955 -8.245 1.00 1.01 C ATOM 1003 CD ARG B 109 -8.951 3.685 -7.840 1.00 1.28 C ATOM 1004 NE ARG B 109 -10.057 3.418 -8.761 1.00 1.29 N ATOM 1005 CZ ARG B 109 -10.870 4.358 -9.246 1.00 1.27 C ATOM 1006 NH1 ARG B 109 -10.743 5.622 -8.860 1.00 1.53 N ATOM 1007 NH2 ARG B 109 -11.831 4.026 -10.097 1.00 1.45 N ATOM 0 H ARG B 109 -4.945 3.587 -5.404 1.00 0.72 H new ATOM 0 HA ARG B 109 -7.734 3.097 -5.497 1.00 0.74 H new ATOM 0 HB2 ARG B 109 -6.377 4.308 -7.217 1.00 0.85 H new ATOM 0 HB3 ARG B 109 -5.625 2.790 -7.664 1.00 0.85 H new ATOM 0 HG2 ARG B 109 -7.385 3.264 -9.248 1.00 1.01 H new ATOM 0 HG3 ARG B 109 -7.871 1.883 -8.286 1.00 1.01 H new ATOM 0 HD2 ARG B 109 -9.237 3.382 -6.833 1.00 1.28 H new ATOM 0 HD3 ARG B 109 -8.758 4.757 -7.807 1.00 1.28 H new ATOM 0 HE ARG B 109 -10.216 2.453 -9.050 1.00 1.29 H new ATOM 0 HH11 ARG B 109 -10.020 5.880 -8.188 1.00 1.53 H new ATOM 0 HH12 ARG B 109 -11.368 6.335 -9.235 1.00 1.53 H new ATOM 0 HH21 ARG B 109 -11.948 3.053 -10.380 1.00 1.45 H new ATOM 0 HH22 ARG B 109 -12.453 4.744 -10.469 1.00 1.45 H new ATOM 1021 N VAL B 110 -7.920 0.650 -5.229 1.00 0.67 N ATOM 1022 CA VAL B 110 -8.155 -0.785 -5.164 1.00 0.68 C ATOM 1023 C VAL B 110 -9.019 -1.225 -6.348 1.00 0.74 C ATOM 1024 O VAL B 110 -9.532 -0.384 -7.085 1.00 1.09 O ATOM 1025 CB VAL B 110 -8.847 -1.169 -3.830 1.00 0.79 C ATOM 1026 CG1 VAL B 110 -8.759 -2.665 -3.570 1.00 1.10 C ATOM 1027 CG2 VAL B 110 -8.244 -0.400 -2.663 1.00 0.98 C ATOM 0 H VAL B 110 -8.613 1.209 -4.731 1.00 0.67 H new ATOM 0 HA VAL B 110 -7.193 -1.296 -5.211 1.00 0.68 H new ATOM 0 HB VAL B 110 -9.899 -0.899 -3.921 1.00 0.79 H new ATOM 0 HG11 VAL B 110 -9.254 -2.900 -2.628 1.00 1.10 H new ATOM 0 HG12 VAL B 110 -9.248 -3.205 -4.381 1.00 1.10 H new ATOM 0 HG13 VAL B 110 -7.712 -2.964 -3.515 1.00 1.10 H new ATOM 0 HG21 VAL B 110 -8.747 -0.687 -1.739 1.00 0.98 H new ATOM 0 HG22 VAL B 110 -7.182 -0.631 -2.585 1.00 0.98 H new ATOM 0 HG23 VAL B 110 -8.371 0.670 -2.828 1.00 0.98 H new ATOM 1037 N LYS B 111 -9.159 -2.540 -6.530 1.00 0.60 N ATOM 1038 CA LYS B 111 -9.957 -3.112 -7.615 1.00 0.65 C ATOM 1039 C LYS B 111 -11.369 -2.526 -7.648 1.00 0.70 C ATOM 1040 O LYS B 111 -11.841 -2.078 -8.694 1.00 0.75 O ATOM 1041 CB LYS B 111 -10.043 -4.633 -7.455 1.00 0.66 C ATOM 1042 CG LYS B 111 -8.699 -5.338 -7.533 1.00 0.66 C ATOM 1043 CD LYS B 111 -8.843 -6.844 -7.345 1.00 0.74 C ATOM 1044 CE LYS B 111 -9.390 -7.523 -8.594 1.00 0.84 C ATOM 1045 NZ LYS B 111 -9.705 -8.955 -8.351 1.00 0.92 N ATOM 0 H LYS B 111 -8.722 -3.238 -5.928 1.00 0.60 H new ATOM 0 HA LYS B 111 -9.462 -2.863 -8.554 1.00 0.65 H new ATOM 0 HB2 LYS B 111 -10.507 -4.862 -6.496 1.00 0.66 H new ATOM 0 HB3 LYS B 111 -10.698 -5.033 -8.229 1.00 0.66 H new ATOM 0 HG2 LYS B 111 -8.236 -5.134 -8.499 1.00 0.66 H new ATOM 0 HG3 LYS B 111 -8.033 -4.938 -6.769 1.00 0.66 H new ATOM 0 HD2 LYS B 111 -7.873 -7.273 -7.094 1.00 0.74 H new ATOM 0 HD3 LYS B 111 -9.507 -7.043 -6.504 1.00 0.74 H new ATOM 0 HE2 LYS B 111 -10.290 -7.004 -8.925 1.00 0.84 H new ATOM 0 HE3 LYS B 111 -8.661 -7.443 -9.400 1.00 0.84 H new ATOM 0 HZ1 LYS B 111 -10.075 -9.382 -9.224 1.00 0.92 H new ATOM 0 HZ2 LYS B 111 -8.841 -9.456 -8.059 1.00 0.92 H new ATOM 0 HZ3 LYS B 111 -10.420 -9.031 -7.599 1.00 0.92 H new ATOM 1059 N ASP B 112 -12.034 -2.544 -6.503 1.00 0.77 N ATOM 1060 CA ASP B 112 -13.388 -2.015 -6.395 1.00 0.85 C ATOM 1061 C ASP B 112 -13.613 -1.420 -5.014 1.00 0.82 C ATOM 1062 O ASP B 112 -13.672 -0.202 -4.853 1.00 0.86 O ATOM 1063 CB ASP B 112 -14.418 -3.119 -6.671 1.00 0.95 C ATOM 1064 CG ASP B 112 -15.838 -2.699 -6.336 1.00 1.11 C ATOM 1065 OD1 ASP B 112 -16.416 -1.870 -7.072 1.00 1.31 O ATOM 1066 OD2 ASP B 112 -16.390 -3.205 -5.339 1.00 1.24 O ATOM 0 H ASP B 112 -11.658 -2.920 -5.632 1.00 0.77 H new ATOM 0 HA ASP B 112 -13.513 -1.229 -7.140 1.00 0.85 H new ATOM 0 HB2 ASP B 112 -14.367 -3.402 -7.722 1.00 0.95 H new ATOM 0 HB3 ASP B 112 -14.159 -4.004 -6.089 1.00 0.95 H new ATOM 1071 N LYS B 113 -13.722 -2.292 -4.021 1.00 0.80 N ATOM 1072 CA LYS B 113 -13.933 -1.869 -2.648 1.00 0.81 C ATOM 1073 C LYS B 113 -12.667 -1.238 -2.076 1.00 0.75 C ATOM 1074 O LYS B 113 -11.648 -1.907 -1.895 1.00 0.75 O ATOM 1075 CB LYS B 113 -14.381 -3.057 -1.787 1.00 0.88 C ATOM 1076 CG LYS B 113 -13.484 -4.288 -1.885 1.00 0.86 C ATOM 1077 CD LYS B 113 -14.117 -5.479 -1.185 1.00 1.01 C ATOM 1078 CE LYS B 113 -13.115 -6.600 -0.956 1.00 1.08 C ATOM 1079 NZ LYS B 113 -13.739 -7.774 -0.285 1.00 1.42 N ATOM 0 H LYS B 113 -13.667 -3.303 -4.145 1.00 0.80 H new ATOM 0 HA LYS B 113 -14.721 -1.116 -2.637 1.00 0.81 H new ATOM 0 HB2 LYS B 113 -14.425 -2.738 -0.746 1.00 0.88 H new ATOM 0 HB3 LYS B 113 -15.393 -3.338 -2.077 1.00 0.88 H new ATOM 0 HG2 LYS B 113 -13.305 -4.530 -2.933 1.00 0.86 H new ATOM 0 HG3 LYS B 113 -12.514 -4.072 -1.438 1.00 0.86 H new ATOM 0 HD2 LYS B 113 -14.530 -5.160 -0.228 1.00 1.01 H new ATOM 0 HD3 LYS B 113 -14.949 -5.852 -1.783 1.00 1.01 H new ATOM 0 HE2 LYS B 113 -12.693 -6.910 -1.912 1.00 1.08 H new ATOM 0 HE3 LYS B 113 -12.290 -6.230 -0.348 1.00 1.08 H new ATOM 0 HZ1 LYS B 113 -13.006 -8.321 0.211 1.00 1.42 H new ATOM 0 HZ2 LYS B 113 -14.449 -7.445 0.400 1.00 1.42 H new ATOM 0 HZ3 LYS B 113 -14.199 -8.377 -0.997 1.00 1.42 H new ATOM 1093 N VAL B 114 -12.732 0.057 -1.815 1.00 0.77 N ATOM 1094 CA VAL B 114 -11.597 0.782 -1.269 1.00 0.74 C ATOM 1095 C VAL B 114 -11.628 0.758 0.255 1.00 0.77 C ATOM 1096 O VAL B 114 -12.630 1.111 0.876 1.00 0.93 O ATOM 1097 CB VAL B 114 -11.551 2.243 -1.774 1.00 0.76 C ATOM 1098 CG1 VAL B 114 -10.961 2.302 -3.174 1.00 0.75 C ATOM 1099 CG2 VAL B 114 -12.935 2.872 -1.749 1.00 0.80 C ATOM 0 H VAL B 114 -13.561 0.629 -1.973 1.00 0.77 H new ATOM 0 HA VAL B 114 -10.695 0.279 -1.617 1.00 0.74 H new ATOM 0 HB VAL B 114 -10.910 2.815 -1.103 1.00 0.76 H new ATOM 0 HG11 VAL B 114 -10.936 3.337 -3.515 1.00 0.75 H new ATOM 0 HG12 VAL B 114 -9.948 1.900 -3.159 1.00 0.75 H new ATOM 0 HG13 VAL B 114 -11.576 1.711 -3.853 1.00 0.75 H new ATOM 0 HG21 VAL B 114 -12.874 3.899 -2.109 1.00 0.80 H new ATOM 0 HG22 VAL B 114 -13.606 2.301 -2.391 1.00 0.80 H new ATOM 0 HG23 VAL B 114 -13.319 2.867 -0.729 1.00 0.80 H new ATOM 1109 N TYR B 115 -10.530 0.316 0.848 1.00 0.71 N ATOM 1110 CA TYR B 115 -10.425 0.236 2.296 1.00 0.75 C ATOM 1111 C TYR B 115 -9.953 1.568 2.871 1.00 0.79 C ATOM 1112 O TYR B 115 -9.454 2.424 2.145 1.00 0.94 O ATOM 1113 CB TYR B 115 -9.446 -0.873 2.706 1.00 0.73 C ATOM 1114 CG TYR B 115 -9.610 -2.167 1.933 1.00 0.70 C ATOM 1115 CD1 TYR B 115 -10.509 -3.139 2.352 1.00 0.92 C ATOM 1116 CD2 TYR B 115 -8.863 -2.418 0.788 1.00 0.69 C ATOM 1117 CE1 TYR B 115 -10.658 -4.321 1.653 1.00 0.95 C ATOM 1118 CE2 TYR B 115 -9.010 -3.597 0.083 1.00 0.74 C ATOM 1119 CZ TYR B 115 -9.907 -4.544 0.519 1.00 0.79 C ATOM 1120 OH TYR B 115 -10.061 -5.718 -0.182 1.00 0.90 O ATOM 0 H TYR B 115 -9.697 0.007 0.347 1.00 0.71 H new ATOM 0 HA TYR B 115 -11.413 0.004 2.693 1.00 0.75 H new ATOM 0 HB2 TYR B 115 -8.427 -0.510 2.572 1.00 0.73 H new ATOM 0 HB3 TYR B 115 -9.573 -1.080 3.769 1.00 0.73 H new ATOM 0 HD1 TYR B 115 -11.101 -2.968 3.239 1.00 0.92 H new ATOM 0 HD2 TYR B 115 -8.155 -1.678 0.443 1.00 0.69 H new ATOM 0 HE1 TYR B 115 -11.360 -5.067 1.994 1.00 0.95 H new ATOM 0 HE2 TYR B 115 -8.423 -3.774 -0.806 1.00 0.74 H new ATOM 0 HH TYR B 115 -9.185 -6.036 -0.484 1.00 0.90 H new ATOM 1130 N HIS B 116 -10.106 1.737 4.175 1.00 0.77 N ATOM 1131 CA HIS B 116 -9.675 2.964 4.839 1.00 0.81 C ATOM 1132 C HIS B 116 -8.162 2.959 5.009 1.00 0.80 C ATOM 1133 O HIS B 116 -7.529 1.919 4.850 1.00 0.83 O ATOM 1134 CB HIS B 116 -10.349 3.107 6.203 1.00 0.90 C ATOM 1135 CG HIS B 116 -11.760 3.599 6.123 1.00 0.98 C ATOM 1136 ND1 HIS B 116 -12.855 2.818 6.424 1.00 1.03 N ATOM 1137 CD2 HIS B 116 -12.256 4.814 5.777 1.00 1.02 C ATOM 1138 CE1 HIS B 116 -13.958 3.526 6.264 1.00 1.09 C ATOM 1139 NE2 HIS B 116 -13.624 4.743 5.871 1.00 1.09 N ATOM 0 H HIS B 116 -10.524 1.044 4.796 1.00 0.77 H new ATOM 0 HA HIS B 116 -9.966 3.811 4.218 1.00 0.81 H new ATOM 0 HB2 HIS B 116 -10.337 2.141 6.708 1.00 0.90 H new ATOM 0 HB3 HIS B 116 -9.767 3.795 6.817 1.00 0.90 H new ATOM 0 HD2 HIS B 116 -11.680 5.679 5.482 1.00 1.02 H new ATOM 0 HE1 HIS B 116 -14.965 3.170 6.427 1.00 1.09 H new ATOM 0 HE2 HIS B 116 -14.274 5.503 5.671 1.00 1.09 H new ATOM 1147 N LEU B 117 -7.590 4.114 5.344 1.00 0.84 N ATOM 1148 CA LEU B 117 -6.142 4.229 5.532 1.00 0.84 C ATOM 1149 C LEU B 117 -5.636 3.273 6.612 1.00 0.87 C ATOM 1150 O LEU B 117 -4.541 2.723 6.500 1.00 0.87 O ATOM 1151 CB LEU B 117 -5.748 5.677 5.868 1.00 0.90 C ATOM 1152 CG LEU B 117 -6.484 6.317 7.052 1.00 0.97 C ATOM 1153 CD1 LEU B 117 -5.632 6.269 8.312 1.00 1.09 C ATOM 1154 CD2 LEU B 117 -6.866 7.754 6.732 1.00 1.22 C ATOM 0 H LEU B 117 -8.104 4.983 5.491 1.00 0.84 H new ATOM 0 HA LEU B 117 -5.668 3.948 4.591 1.00 0.84 H new ATOM 0 HB2 LEU B 117 -4.678 5.703 6.074 1.00 0.90 H new ATOM 0 HB3 LEU B 117 -5.917 6.293 4.985 1.00 0.90 H new ATOM 0 HG LEU B 117 -7.394 5.744 7.230 1.00 0.97 H new ATOM 0 HD11 LEU B 117 -6.176 6.729 9.137 1.00 1.09 H new ATOM 0 HD12 LEU B 117 -5.407 5.232 8.560 1.00 1.09 H new ATOM 0 HD13 LEU B 117 -4.702 6.812 8.143 1.00 1.09 H new ATOM 0 HD21 LEU B 117 -7.387 8.190 7.584 1.00 1.22 H new ATOM 0 HD22 LEU B 117 -5.966 8.332 6.522 1.00 1.22 H new ATOM 0 HD23 LEU B 117 -7.519 7.771 5.860 1.00 1.22 H new ATOM 1166 N GLU B 118 -6.436 3.068 7.654 1.00 0.92 N ATOM 1167 CA GLU B 118 -6.049 2.167 8.733 1.00 0.98 C ATOM 1168 C GLU B 118 -6.643 0.778 8.510 1.00 0.93 C ATOM 1169 O GLU B 118 -6.257 -0.186 9.167 1.00 1.00 O ATOM 1170 CB GLU B 118 -6.473 2.724 10.094 1.00 1.12 C ATOM 1171 CG GLU B 118 -7.967 2.941 10.243 1.00 1.22 C ATOM 1172 CD GLU B 118 -8.507 2.344 11.524 1.00 1.24 C ATOM 1173 OE1 GLU B 118 -7.843 2.478 12.571 1.00 1.77 O ATOM 1174 OE2 GLU B 118 -9.594 1.732 11.492 1.00 1.55 O ATOM 0 H GLU B 118 -7.348 3.509 7.773 1.00 0.92 H new ATOM 0 HA GLU B 118 -4.962 2.083 8.729 1.00 0.98 H new ATOM 0 HB2 GLU B 118 -6.138 2.040 10.874 1.00 1.12 H new ATOM 0 HB3 GLU B 118 -5.962 3.672 10.260 1.00 1.12 H new ATOM 0 HG2 GLU B 118 -8.181 4.010 10.224 1.00 1.22 H new ATOM 0 HG3 GLU B 118 -8.483 2.498 9.392 1.00 1.22 H new ATOM 1181 N CYS B 119 -7.582 0.683 7.572 1.00 0.87 N ATOM 1182 CA CYS B 119 -8.219 -0.588 7.243 1.00 0.85 C ATOM 1183 C CYS B 119 -7.370 -1.338 6.222 1.00 0.77 C ATOM 1184 O CYS B 119 -7.628 -2.500 5.904 1.00 0.82 O ATOM 1185 CB CYS B 119 -9.639 -0.350 6.705 1.00 0.87 C ATOM 1186 SG CYS B 119 -10.797 0.303 7.955 1.00 0.99 S ATOM 0 H CYS B 119 -7.919 1.475 7.025 1.00 0.87 H new ATOM 0 HA CYS B 119 -8.298 -1.195 8.145 1.00 0.85 H new ATOM 0 HB2 CYS B 119 -9.589 0.348 5.869 1.00 0.87 H new ATOM 0 HB3 CYS B 119 -10.032 -1.288 6.314 1.00 0.87 H new ATOM 0 HG CYS B 119 -11.548 1.217 7.415 1.00 0.99 H new ATOM 1191 N PHE B 120 -6.351 -0.653 5.725 1.00 0.70 N ATOM 1192 CA PHE B 120 -5.441 -1.221 4.748 1.00 0.63 C ATOM 1193 C PHE B 120 -4.173 -1.722 5.433 1.00 0.66 C ATOM 1194 O PHE B 120 -3.133 -1.062 5.416 1.00 0.72 O ATOM 1195 CB PHE B 120 -5.088 -0.180 3.682 1.00 0.62 C ATOM 1196 CG PHE B 120 -4.787 -0.767 2.330 1.00 0.54 C ATOM 1197 CD1 PHE B 120 -3.572 -1.386 2.076 1.00 0.62 C ATOM 1198 CD2 PHE B 120 -5.719 -0.689 1.310 1.00 0.53 C ATOM 1199 CE1 PHE B 120 -3.300 -1.921 0.831 1.00 0.60 C ATOM 1200 CE2 PHE B 120 -5.450 -1.220 0.063 1.00 0.50 C ATOM 1201 CZ PHE B 120 -4.238 -1.836 -0.178 1.00 0.47 C ATOM 0 H PHE B 120 -6.134 0.308 5.988 1.00 0.70 H new ATOM 0 HA PHE B 120 -5.934 -2.064 4.264 1.00 0.63 H new ATOM 0 HB2 PHE B 120 -5.916 0.522 3.586 1.00 0.62 H new ATOM 0 HB3 PHE B 120 -4.223 0.392 4.019 1.00 0.62 H new ATOM 0 HD1 PHE B 120 -2.831 -1.451 2.859 1.00 0.62 H new ATOM 0 HD2 PHE B 120 -6.668 -0.207 1.491 1.00 0.53 H new ATOM 0 HE1 PHE B 120 -2.353 -2.406 0.647 1.00 0.60 H new ATOM 0 HE2 PHE B 120 -6.188 -1.153 -0.723 1.00 0.50 H new ATOM 0 HZ PHE B 120 -4.025 -2.250 -1.153 1.00 0.47 H new ATOM 1211 N LYS B 121 -4.276 -2.874 6.072 1.00 0.67 N ATOM 1212 CA LYS B 121 -3.135 -3.474 6.744 1.00 0.71 C ATOM 1213 C LYS B 121 -3.007 -4.935 6.340 1.00 0.62 C ATOM 1214 O LYS B 121 -4.016 -5.615 6.136 1.00 0.63 O ATOM 1215 CB LYS B 121 -3.239 -3.348 8.268 1.00 0.89 C ATOM 1216 CG LYS B 121 -4.659 -3.230 8.807 1.00 1.03 C ATOM 1217 CD LYS B 121 -4.721 -3.637 10.271 1.00 1.38 C ATOM 1218 CE LYS B 121 -6.031 -3.218 10.920 1.00 1.59 C ATOM 1219 NZ LYS B 121 -6.037 -1.781 11.304 1.00 2.28 N ATOM 0 H LYS B 121 -5.139 -3.414 6.140 1.00 0.67 H new ATOM 0 HA LYS B 121 -2.241 -2.933 6.434 1.00 0.71 H new ATOM 0 HB2 LYS B 121 -2.764 -4.217 8.723 1.00 0.89 H new ATOM 0 HB3 LYS B 121 -2.672 -2.473 8.585 1.00 0.89 H new ATOM 0 HG2 LYS B 121 -5.010 -2.204 8.696 1.00 1.03 H new ATOM 0 HG3 LYS B 121 -5.328 -3.861 8.222 1.00 1.03 H new ATOM 0 HD2 LYS B 121 -4.604 -4.718 10.353 1.00 1.38 H new ATOM 0 HD3 LYS B 121 -3.888 -3.185 10.809 1.00 1.38 H new ATOM 0 HE2 LYS B 121 -6.853 -3.411 10.231 1.00 1.59 H new ATOM 0 HE3 LYS B 121 -6.207 -3.829 11.805 1.00 1.59 H new ATOM 0 HZ1 LYS B 121 -6.864 -1.585 11.904 1.00 2.28 H new ATOM 0 HZ2 LYS B 121 -5.168 -1.558 11.830 1.00 2.28 H new ATOM 0 HZ3 LYS B 121 -6.084 -1.193 10.447 1.00 2.28 H new ATOM 1233 N CYS B 122 -1.770 -5.397 6.204 1.00 0.57 N ATOM 1234 CA CYS B 122 -1.500 -6.775 5.818 1.00 0.51 C ATOM 1235 C CYS B 122 -2.131 -7.750 6.804 1.00 0.59 C ATOM 1236 O CYS B 122 -2.159 -7.508 8.011 1.00 0.69 O ATOM 1237 CB CYS B 122 0.010 -7.007 5.742 1.00 0.45 C ATOM 1238 SG CYS B 122 0.505 -8.650 5.131 1.00 0.40 S ATOM 0 H CYS B 122 -0.934 -4.833 6.357 1.00 0.57 H new ATOM 0 HA CYS B 122 -1.941 -6.951 4.837 1.00 0.51 H new ATOM 0 HB2 CYS B 122 0.447 -6.248 5.094 1.00 0.45 H new ATOM 0 HB3 CYS B 122 0.435 -6.862 6.735 1.00 0.45 H new ATOM 0 HG CYS B 122 -0.556 -9.366 4.903 1.00 0.40 H new ATOM 1243 N ALA B 123 -2.616 -8.859 6.282 1.00 0.59 N ATOM 1244 CA ALA B 123 -3.253 -9.876 7.099 1.00 0.67 C ATOM 1245 C ALA B 123 -2.223 -10.737 7.819 1.00 0.67 C ATOM 1246 O ALA B 123 -2.568 -11.524 8.701 1.00 0.77 O ATOM 1247 CB ALA B 123 -4.157 -10.744 6.237 1.00 0.70 C ATOM 0 H ALA B 123 -2.581 -9.081 5.287 1.00 0.59 H new ATOM 0 HA ALA B 123 -3.854 -9.374 7.857 1.00 0.67 H new ATOM 0 HB1 ALA B 123 -4.631 -11.504 6.858 1.00 0.70 H new ATOM 0 HB2 ALA B 123 -4.924 -10.123 5.774 1.00 0.70 H new ATOM 0 HB3 ALA B 123 -3.564 -11.227 5.460 1.00 0.70 H new ATOM 1253 N ALA B 124 -0.954 -10.581 7.460 1.00 0.57 N ATOM 1254 CA ALA B 124 0.094 -11.373 8.086 1.00 0.57 C ATOM 1255 C ALA B 124 1.021 -10.533 8.965 1.00 0.56 C ATOM 1256 O ALA B 124 1.077 -10.734 10.178 1.00 0.66 O ATOM 1257 CB ALA B 124 0.886 -12.120 7.032 1.00 0.52 C ATOM 0 H ALA B 124 -0.631 -9.924 6.750 1.00 0.57 H new ATOM 0 HA ALA B 124 -0.395 -12.091 8.744 1.00 0.57 H new ATOM 0 HB1 ALA B 124 1.667 -12.709 7.513 1.00 0.52 H new ATOM 0 HB2 ALA B 124 0.221 -12.783 6.479 1.00 0.52 H new ATOM 0 HB3 ALA B 124 1.341 -11.406 6.345 1.00 0.52 H new ATOM 1263 N CYS B 125 1.742 -9.590 8.369 1.00 0.50 N ATOM 1264 CA CYS B 125 2.674 -8.772 9.135 1.00 0.51 C ATOM 1265 C CYS B 125 2.026 -7.494 9.672 1.00 0.55 C ATOM 1266 O CYS B 125 2.557 -6.866 10.597 1.00 0.60 O ATOM 1267 CB CYS B 125 3.913 -8.443 8.293 1.00 0.44 C ATOM 1268 SG CYS B 125 3.611 -7.346 6.869 1.00 0.39 S ATOM 0 H CYS B 125 1.701 -9.375 7.373 1.00 0.50 H new ATOM 0 HA CYS B 125 2.980 -9.357 10.002 1.00 0.51 H new ATOM 0 HB2 CYS B 125 4.659 -7.978 8.938 1.00 0.44 H new ATOM 0 HB3 CYS B 125 4.344 -9.376 7.929 1.00 0.44 H new ATOM 0 HG CYS B 125 2.552 -7.746 6.230 1.00 0.39 H new ATOM 1273 N GLN B 126 0.895 -7.116 9.081 1.00 0.56 N ATOM 1274 CA GLN B 126 0.147 -5.915 9.480 1.00 0.61 C ATOM 1275 C GLN B 126 0.983 -4.646 9.323 1.00 0.60 C ATOM 1276 O GLN B 126 0.712 -3.633 9.971 1.00 0.69 O ATOM 1277 CB GLN B 126 -0.345 -6.017 10.929 1.00 0.72 C ATOM 1278 CG GLN B 126 -1.722 -6.640 11.073 1.00 0.84 C ATOM 1279 CD GLN B 126 -1.662 -8.117 11.407 1.00 0.77 C ATOM 1280 OE1 GLN B 126 -1.553 -8.499 12.574 1.00 0.93 O ATOM 1281 NE2 GLN B 126 -1.754 -8.953 10.391 1.00 0.93 N ATOM 0 H GLN B 126 0.467 -7.630 8.311 1.00 0.56 H new ATOM 0 HA GLN B 126 -0.713 -5.853 8.813 1.00 0.61 H new ATOM 0 HB2 GLN B 126 0.370 -6.605 11.504 1.00 0.72 H new ATOM 0 HB3 GLN B 126 -0.362 -5.019 11.367 1.00 0.72 H new ATOM 0 HG2 GLN B 126 -2.273 -6.117 11.854 1.00 0.84 H new ATOM 0 HG3 GLN B 126 -2.277 -6.503 10.145 1.00 0.84 H new ATOM 0 HE21 GLN B 126 -1.843 -8.593 9.441 1.00 0.93 H new ATOM 0 HE22 GLN B 126 -1.736 -9.959 10.556 1.00 0.93 H new ATOM 1290 N LYS B 127 1.996 -4.693 8.470 1.00 0.52 N ATOM 1291 CA LYS B 127 2.849 -3.533 8.254 1.00 0.54 C ATOM 1292 C LYS B 127 2.204 -2.573 7.262 1.00 0.51 C ATOM 1293 O LYS B 127 1.253 -2.932 6.564 1.00 0.52 O ATOM 1294 CB LYS B 127 4.226 -3.966 7.746 1.00 0.52 C ATOM 1295 CG LYS B 127 4.984 -4.844 8.728 1.00 0.54 C ATOM 1296 CD LYS B 127 5.543 -4.040 9.891 1.00 1.07 C ATOM 1297 CE LYS B 127 5.962 -4.944 11.038 1.00 1.09 C ATOM 1298 NZ LYS B 127 4.788 -5.498 11.764 1.00 1.12 N ATOM 0 H LYS B 127 2.246 -5.515 7.920 1.00 0.52 H new ATOM 0 HA LYS B 127 2.974 -3.019 9.207 1.00 0.54 H new ATOM 0 HB2 LYS B 127 4.105 -4.505 6.807 1.00 0.52 H new ATOM 0 HB3 LYS B 127 4.821 -3.078 7.530 1.00 0.52 H new ATOM 0 HG2 LYS B 127 4.320 -5.620 9.109 1.00 0.54 H new ATOM 0 HG3 LYS B 127 5.800 -5.348 8.210 1.00 0.54 H new ATOM 0 HD2 LYS B 127 6.400 -3.457 9.554 1.00 1.07 H new ATOM 0 HD3 LYS B 127 4.792 -3.331 10.240 1.00 1.07 H new ATOM 0 HE2 LYS B 127 6.570 -5.762 10.652 1.00 1.09 H new ATOM 0 HE3 LYS B 127 6.587 -4.383 11.733 1.00 1.09 H new ATOM 0 HZ1 LYS B 127 5.116 -6.096 12.549 1.00 1.12 H new ATOM 0 HZ2 LYS B 127 4.212 -4.718 12.140 1.00 1.12 H new ATOM 0 HZ3 LYS B 127 4.214 -6.069 11.111 1.00 1.12 H new ATOM 1312 N HIS B 128 2.708 -1.347 7.217 1.00 0.51 N ATOM 1313 CA HIS B 128 2.186 -0.351 6.297 1.00 0.50 C ATOM 1314 C HIS B 128 2.750 -0.598 4.904 1.00 0.47 C ATOM 1315 O HIS B 128 3.937 -0.887 4.745 1.00 0.47 O ATOM 1316 CB HIS B 128 2.494 1.076 6.788 1.00 0.55 C ATOM 1317 CG HIS B 128 3.893 1.556 6.519 1.00 0.54 C ATOM 1318 ND1 HIS B 128 4.198 2.452 5.520 1.00 0.59 N ATOM 1319 CD2 HIS B 128 5.069 1.272 7.133 1.00 0.58 C ATOM 1320 CE1 HIS B 128 5.493 2.691 5.526 1.00 0.57 C ATOM 1321 NE2 HIS B 128 6.050 1.993 6.498 1.00 0.57 N ATOM 0 H HIS B 128 3.475 -1.021 7.805 1.00 0.51 H new ATOM 0 HA HIS B 128 1.101 -0.443 6.253 1.00 0.50 H new ATOM 0 HB2 HIS B 128 1.793 1.765 6.316 1.00 0.55 H new ATOM 0 HB3 HIS B 128 2.311 1.121 7.862 1.00 0.55 H new ATOM 0 HD2 HIS B 128 5.208 0.602 7.968 1.00 0.58 H new ATOM 0 HE1 HIS B 128 6.014 3.350 4.847 1.00 0.57 H new ATOM 0 HE2 HIS B 128 7.042 1.990 6.737 1.00 0.57 H new ATOM 1330 N PHE B 129 1.891 -0.497 3.905 1.00 0.48 N ATOM 1331 CA PHE B 129 2.288 -0.735 2.525 1.00 0.48 C ATOM 1332 C PHE B 129 3.067 0.445 1.951 1.00 0.52 C ATOM 1333 O PHE B 129 3.115 1.526 2.542 1.00 0.59 O ATOM 1334 CB PHE B 129 1.054 -1.012 1.664 1.00 0.47 C ATOM 1335 CG PHE B 129 0.449 -2.373 1.891 1.00 0.41 C ATOM 1336 CD1 PHE B 129 -0.201 -2.669 3.077 1.00 0.47 C ATOM 1337 CD2 PHE B 129 0.528 -3.351 0.915 1.00 0.35 C ATOM 1338 CE1 PHE B 129 -0.755 -3.917 3.289 1.00 0.45 C ATOM 1339 CE2 PHE B 129 -0.024 -4.602 1.119 1.00 0.32 C ATOM 1340 CZ PHE B 129 -0.666 -4.884 2.307 1.00 0.37 C ATOM 0 H PHE B 129 0.908 -0.250 4.023 1.00 0.48 H new ATOM 0 HA PHE B 129 2.943 -1.606 2.514 1.00 0.48 H new ATOM 0 HB2 PHE B 129 0.301 -0.251 1.869 1.00 0.47 H new ATOM 0 HB3 PHE B 129 1.327 -0.916 0.613 1.00 0.47 H new ATOM 0 HD1 PHE B 129 -0.276 -1.915 3.846 1.00 0.47 H new ATOM 0 HD2 PHE B 129 1.027 -3.134 -0.018 1.00 0.35 H new ATOM 0 HE1 PHE B 129 -1.256 -4.136 4.220 1.00 0.45 H new ATOM 0 HE2 PHE B 129 0.047 -5.357 0.350 1.00 0.32 H new ATOM 0 HZ PHE B 129 -1.099 -5.860 2.469 1.00 0.37 H new ATOM 1350 N SER B 130 3.683 0.214 0.800 1.00 0.55 N ATOM 1351 CA SER B 130 4.454 1.235 0.116 1.00 0.63 C ATOM 1352 C SER B 130 3.725 1.648 -1.162 1.00 0.60 C ATOM 1353 O SER B 130 2.614 1.182 -1.427 1.00 0.84 O ATOM 1354 CB SER B 130 5.861 0.709 -0.207 1.00 0.74 C ATOM 1355 OG SER B 130 6.718 1.746 -0.659 1.00 0.86 O ATOM 0 H SER B 130 3.661 -0.685 0.318 1.00 0.55 H new ATOM 0 HA SER B 130 4.558 2.107 0.762 1.00 0.63 H new ATOM 0 HB2 SER B 130 6.289 0.245 0.682 1.00 0.74 H new ATOM 0 HB3 SER B 130 5.793 -0.066 -0.970 1.00 0.74 H new ATOM 0 HG SER B 130 7.305 1.401 -1.364 1.00 0.86 H new ATOM 1361 N VAL B 131 4.343 2.511 -1.950 1.00 0.63 N ATOM 1362 CA VAL B 131 3.740 2.967 -3.191 1.00 0.63 C ATOM 1363 C VAL B 131 4.546 2.461 -4.387 1.00 0.63 C ATOM 1364 O VAL B 131 5.771 2.584 -4.426 1.00 0.70 O ATOM 1365 CB VAL B 131 3.610 4.513 -3.234 1.00 0.78 C ATOM 1366 CG1 VAL B 131 4.970 5.191 -3.145 1.00 0.92 C ATOM 1367 CG2 VAL B 131 2.865 4.957 -4.488 1.00 0.81 C ATOM 0 H VAL B 131 5.261 2.910 -1.753 1.00 0.63 H new ATOM 0 HA VAL B 131 2.732 2.555 -3.242 1.00 0.63 H new ATOM 0 HB VAL B 131 3.032 4.820 -2.363 1.00 0.78 H new ATOM 0 HG11 VAL B 131 4.840 6.273 -3.178 1.00 0.92 H new ATOM 0 HG12 VAL B 131 5.455 4.912 -2.210 1.00 0.92 H new ATOM 0 HG13 VAL B 131 5.590 4.874 -3.984 1.00 0.92 H new ATOM 0 HG21 VAL B 131 2.785 6.044 -4.498 1.00 0.81 H new ATOM 0 HG22 VAL B 131 3.410 4.625 -5.372 1.00 0.81 H new ATOM 0 HG23 VAL B 131 1.867 4.520 -4.492 1.00 0.81 H new ATOM 1377 N GLY B 132 3.850 1.860 -5.344 1.00 0.63 N ATOM 1378 CA GLY B 132 4.511 1.332 -6.521 1.00 0.72 C ATOM 1379 C GLY B 132 4.963 -0.100 -6.327 1.00 0.63 C ATOM 1380 O GLY B 132 5.707 -0.645 -7.147 1.00 0.63 O ATOM 0 H GLY B 132 2.839 1.729 -5.326 1.00 0.63 H new ATOM 0 HA2 GLY B 132 3.832 1.385 -7.372 1.00 0.72 H new ATOM 0 HA3 GLY B 132 5.373 1.954 -6.762 1.00 0.72 H new ATOM 1384 N ASP B 133 4.509 -0.705 -5.240 1.00 0.61 N ATOM 1385 CA ASP B 133 4.858 -2.084 -4.916 1.00 0.56 C ATOM 1386 C ASP B 133 3.717 -3.020 -5.291 1.00 0.46 C ATOM 1387 O ASP B 133 2.627 -2.569 -5.647 1.00 0.50 O ATOM 1388 CB ASP B 133 5.178 -2.222 -3.423 1.00 0.55 C ATOM 1389 CG ASP B 133 6.564 -1.720 -3.065 1.00 0.80 C ATOM 1390 OD1 ASP B 133 7.257 -1.181 -3.948 1.00 1.12 O ATOM 1391 OD2 ASP B 133 6.969 -1.866 -1.894 1.00 1.06 O ATOM 0 H ASP B 133 3.892 -0.260 -4.560 1.00 0.61 H new ATOM 0 HA ASP B 133 5.743 -2.357 -5.490 1.00 0.56 H new ATOM 0 HB2 ASP B 133 4.437 -1.669 -2.846 1.00 0.55 H new ATOM 0 HB3 ASP B 133 5.091 -3.269 -3.134 1.00 0.55 H new ATOM 1396 N ARG B 134 3.961 -4.316 -5.210 1.00 0.42 N ATOM 1397 CA ARG B 134 2.941 -5.299 -5.544 1.00 0.36 C ATOM 1398 C ARG B 134 2.233 -5.771 -4.280 1.00 0.27 C ATOM 1399 O ARG B 134 2.813 -5.763 -3.196 1.00 0.33 O ATOM 1400 CB ARG B 134 3.563 -6.486 -6.282 1.00 0.41 C ATOM 1401 CG ARG B 134 4.607 -7.225 -5.465 1.00 0.52 C ATOM 1402 CD ARG B 134 5.450 -8.155 -6.323 1.00 0.66 C ATOM 1403 NE ARG B 134 5.907 -7.513 -7.558 1.00 1.05 N ATOM 1404 CZ ARG B 134 6.909 -6.633 -7.628 1.00 1.25 C ATOM 1405 NH1 ARG B 134 7.517 -6.201 -6.526 1.00 1.52 N ATOM 1406 NH2 ARG B 134 7.284 -6.157 -8.810 1.00 1.82 N ATOM 0 H ARG B 134 4.854 -4.713 -4.917 1.00 0.42 H new ATOM 0 HA ARG B 134 2.208 -4.831 -6.201 1.00 0.36 H new ATOM 0 HB2 ARG B 134 2.774 -7.183 -6.564 1.00 0.41 H new ATOM 0 HB3 ARG B 134 4.020 -6.131 -7.206 1.00 0.41 H new ATOM 0 HG2 ARG B 134 5.255 -6.503 -4.968 1.00 0.52 H new ATOM 0 HG3 ARG B 134 4.113 -7.802 -4.683 1.00 0.52 H new ATOM 0 HD2 ARG B 134 6.314 -8.490 -5.750 1.00 0.66 H new ATOM 0 HD3 ARG B 134 4.868 -9.043 -6.572 1.00 0.66 H new ATOM 0 HE ARG B 134 5.426 -7.755 -8.425 1.00 1.05 H new ATOM 0 HH11 ARG B 134 7.219 -6.542 -5.612 1.00 1.52 H new ATOM 0 HH12 ARG B 134 8.281 -5.529 -6.595 1.00 1.52 H new ATOM 0 HH21 ARG B 134 6.807 -6.464 -9.658 1.00 1.82 H new ATOM 0 HH22 ARG B 134 8.049 -5.485 -8.870 1.00 1.82 H new ATOM 1420 N TYR B 135 0.981 -6.171 -4.422 1.00 0.25 N ATOM 1421 CA TYR B 135 0.203 -6.642 -3.291 1.00 0.20 C ATOM 1422 C TYR B 135 -0.777 -7.721 -3.729 1.00 0.25 C ATOM 1423 O TYR B 135 -1.106 -7.838 -4.912 1.00 0.33 O ATOM 1424 CB TYR B 135 -0.556 -5.475 -2.639 1.00 0.24 C ATOM 1425 CG TYR B 135 -1.829 -5.077 -3.364 1.00 0.29 C ATOM 1426 CD1 TYR B 135 -1.780 -4.405 -4.580 1.00 0.40 C ATOM 1427 CD2 TYR B 135 -3.078 -5.372 -2.829 1.00 0.31 C ATOM 1428 CE1 TYR B 135 -2.935 -4.040 -5.243 1.00 0.48 C ATOM 1429 CE2 TYR B 135 -4.239 -5.010 -3.488 1.00 0.39 C ATOM 1430 CZ TYR B 135 -4.161 -4.345 -4.694 1.00 0.46 C ATOM 1431 OH TYR B 135 -5.313 -3.985 -5.355 1.00 0.56 O ATOM 0 H TYR B 135 0.482 -6.179 -5.311 1.00 0.25 H new ATOM 0 HA TYR B 135 0.888 -7.069 -2.559 1.00 0.20 H new ATOM 0 HB2 TYR B 135 -0.805 -5.747 -1.613 1.00 0.24 H new ATOM 0 HB3 TYR B 135 0.105 -4.610 -2.588 1.00 0.24 H new ATOM 0 HD1 TYR B 135 -0.821 -4.164 -5.014 1.00 0.40 H new ATOM 0 HD2 TYR B 135 -3.143 -5.892 -1.884 1.00 0.31 H new ATOM 0 HE1 TYR B 135 -2.877 -3.518 -6.187 1.00 0.48 H new ATOM 0 HE2 TYR B 135 -5.202 -5.247 -3.060 1.00 0.39 H new ATOM 0 HH TYR B 135 -6.092 -4.274 -4.835 1.00 0.56 H new ATOM 1441 N LEU B 136 -1.232 -8.508 -2.770 1.00 0.25 N ATOM 1442 CA LEU B 136 -2.191 -9.565 -3.033 1.00 0.34 C ATOM 1443 C LEU B 136 -3.507 -9.234 -2.344 1.00 0.33 C ATOM 1444 O LEU B 136 -3.529 -8.903 -1.158 1.00 0.32 O ATOM 1445 CB LEU B 136 -1.651 -10.912 -2.544 1.00 0.43 C ATOM 1446 CG LEU B 136 -2.598 -12.104 -2.720 1.00 0.55 C ATOM 1447 CD1 LEU B 136 -2.814 -12.409 -4.196 1.00 0.66 C ATOM 1448 CD2 LEU B 136 -2.052 -13.327 -1.997 1.00 0.68 C ATOM 0 H LEU B 136 -0.949 -8.433 -1.793 1.00 0.25 H new ATOM 0 HA LEU B 136 -2.359 -9.640 -4.107 1.00 0.34 H new ATOM 0 HB2 LEU B 136 -0.723 -11.126 -3.074 1.00 0.43 H new ATOM 0 HB3 LEU B 136 -1.401 -10.822 -1.487 1.00 0.43 H new ATOM 0 HG LEU B 136 -3.561 -11.843 -2.282 1.00 0.55 H new ATOM 0 HD11 LEU B 136 -3.489 -13.259 -4.297 1.00 0.66 H new ATOM 0 HD12 LEU B 136 -3.249 -11.539 -4.687 1.00 0.66 H new ATOM 0 HD13 LEU B 136 -1.858 -12.648 -4.662 1.00 0.66 H new ATOM 0 HD21 LEU B 136 -2.736 -14.165 -2.132 1.00 0.68 H new ATOM 0 HD22 LEU B 136 -1.076 -13.586 -2.407 1.00 0.68 H new ATOM 0 HD23 LEU B 136 -1.953 -13.107 -0.934 1.00 0.68 H new ATOM 1460 N LEU B 137 -4.601 -9.306 -3.083 1.00 0.39 N ATOM 1461 CA LEU B 137 -5.904 -8.991 -2.522 1.00 0.43 C ATOM 1462 C LEU B 137 -6.681 -10.253 -2.186 1.00 0.51 C ATOM 1463 O LEU B 137 -6.940 -11.088 -3.053 1.00 0.58 O ATOM 1464 CB LEU B 137 -6.713 -8.122 -3.490 1.00 0.47 C ATOM 1465 CG LEU B 137 -8.041 -7.595 -2.934 1.00 0.65 C ATOM 1466 CD1 LEU B 137 -8.145 -6.095 -3.144 1.00 0.89 C ATOM 1467 CD2 LEU B 137 -9.218 -8.303 -3.590 1.00 1.12 C ATOM 0 H LEU B 137 -4.614 -9.578 -4.066 1.00 0.39 H new ATOM 0 HA LEU B 137 -5.739 -8.435 -1.599 1.00 0.43 H new ATOM 0 HB2 LEU B 137 -6.100 -7.272 -3.791 1.00 0.47 H new ATOM 0 HB3 LEU B 137 -6.918 -8.702 -4.390 1.00 0.47 H new ATOM 0 HG LEU B 137 -8.069 -7.801 -1.864 1.00 0.65 H new ATOM 0 HD11 LEU B 137 -9.093 -5.736 -2.744 1.00 0.89 H new ATOM 0 HD12 LEU B 137 -7.323 -5.598 -2.629 1.00 0.89 H new ATOM 0 HD13 LEU B 137 -8.094 -5.872 -4.210 1.00 0.89 H new ATOM 0 HD21 LEU B 137 -10.150 -7.914 -3.181 1.00 1.12 H new ATOM 0 HD22 LEU B 137 -9.193 -8.130 -4.666 1.00 1.12 H new ATOM 0 HD23 LEU B 137 -9.154 -9.373 -3.394 1.00 1.12 H new ATOM 1479 N ILE B 138 -7.031 -10.386 -0.918 1.00 0.57 N ATOM 1480 CA ILE B 138 -7.808 -11.517 -0.444 1.00 0.69 C ATOM 1481 C ILE B 138 -9.250 -11.055 -0.251 1.00 0.75 C ATOM 1482 O ILE B 138 -9.513 -9.852 -0.219 1.00 0.87 O ATOM 1483 CB ILE B 138 -7.237 -12.076 0.890 1.00 0.76 C ATOM 1484 CG1 ILE B 138 -5.720 -12.283 0.777 1.00 0.71 C ATOM 1485 CG2 ILE B 138 -7.917 -13.385 1.285 1.00 0.91 C ATOM 1486 CD1 ILE B 138 -5.319 -13.361 -0.211 1.00 0.73 C ATOM 0 H ILE B 138 -6.785 -9.715 -0.190 1.00 0.57 H new ATOM 0 HA ILE B 138 -7.761 -12.322 -1.177 1.00 0.69 H new ATOM 0 HB ILE B 138 -7.441 -11.343 1.670 1.00 0.76 H new ATOM 0 HG12 ILE B 138 -5.256 -11.342 0.481 1.00 0.71 H new ATOM 0 HG13 ILE B 138 -5.324 -12.539 1.760 1.00 0.71 H new ATOM 0 HG21 ILE B 138 -7.493 -13.747 2.222 1.00 0.91 H new ATOM 0 HG22 ILE B 138 -8.986 -13.216 1.412 1.00 0.91 H new ATOM 0 HG23 ILE B 138 -7.758 -14.128 0.504 1.00 0.91 H new ATOM 0 HD11 ILE B 138 -4.233 -13.447 -0.234 1.00 0.73 H new ATOM 0 HD12 ILE B 138 -5.752 -14.313 0.094 1.00 0.73 H new ATOM 0 HD13 ILE B 138 -5.683 -13.098 -1.204 1.00 0.73 H new ATOM 1498 N ASN B 139 -10.180 -11.991 -0.146 1.00 0.90 N ATOM 1499 CA ASN B 139 -11.588 -11.649 0.033 1.00 0.96 C ATOM 1500 C ASN B 139 -11.813 -10.860 1.322 1.00 0.92 C ATOM 1501 O ASN B 139 -12.641 -9.943 1.362 1.00 0.96 O ATOM 1502 CB ASN B 139 -12.448 -12.916 0.039 1.00 1.16 C ATOM 1503 CG ASN B 139 -12.530 -13.573 -1.326 1.00 1.32 C ATOM 1504 OD1 ASN B 139 -12.441 -12.908 -2.357 1.00 1.45 O ATOM 1505 ND2 ASN B 139 -12.698 -14.886 -1.343 1.00 1.50 N ATOM 0 H ASN B 139 -9.989 -12.992 -0.181 1.00 0.90 H new ATOM 0 HA ASN B 139 -11.884 -11.018 -0.805 1.00 0.96 H new ATOM 0 HB2 ASN B 139 -12.036 -13.627 0.756 1.00 1.16 H new ATOM 0 HB3 ASN B 139 -13.453 -12.667 0.379 1.00 1.16 H new ATOM 0 HD21 ASN B 139 -12.758 -15.381 -2.233 1.00 1.50 H new ATOM 0 HD22 ASN B 139 -12.767 -15.403 -0.466 1.00 1.50 H new ATOM 1512 N SER B 140 -11.067 -11.210 2.359 1.00 0.96 N ATOM 1513 CA SER B 140 -11.184 -10.556 3.653 1.00 1.01 C ATOM 1514 C SER B 140 -10.250 -9.349 3.773 1.00 0.89 C ATOM 1515 O SER B 140 -10.702 -8.206 3.860 1.00 0.89 O ATOM 1516 CB SER B 140 -10.870 -11.575 4.745 1.00 1.18 C ATOM 1517 OG SER B 140 -10.034 -12.604 4.235 1.00 1.47 O ATOM 0 H SER B 140 -10.367 -11.951 2.328 1.00 0.96 H new ATOM 0 HA SER B 140 -12.202 -10.182 3.762 1.00 1.01 H new ATOM 0 HB2 SER B 140 -10.379 -11.080 5.583 1.00 1.18 H new ATOM 0 HB3 SER B 140 -11.796 -12.005 5.127 1.00 1.18 H new ATOM 0 HG SER B 140 -9.839 -13.250 4.946 1.00 1.47 H new ATOM 1523 N ASP B 141 -8.950 -9.610 3.769 1.00 0.87 N ATOM 1524 CA ASP B 141 -7.955 -8.552 3.910 1.00 0.77 C ATOM 1525 C ASP B 141 -6.980 -8.550 2.736 1.00 0.63 C ATOM 1526 O ASP B 141 -7.236 -9.165 1.702 1.00 0.65 O ATOM 1527 CB ASP B 141 -7.176 -8.732 5.219 1.00 0.81 C ATOM 1528 CG ASP B 141 -8.041 -8.603 6.456 1.00 0.89 C ATOM 1529 OD1 ASP B 141 -8.207 -7.470 6.957 1.00 1.12 O ATOM 1530 OD2 ASP B 141 -8.555 -9.632 6.941 1.00 1.10 O ATOM 0 H ASP B 141 -8.558 -10.546 3.670 1.00 0.87 H new ATOM 0 HA ASP B 141 -8.482 -7.598 3.924 1.00 0.77 H new ATOM 0 HB2 ASP B 141 -6.700 -9.713 5.218 1.00 0.81 H new ATOM 0 HB3 ASP B 141 -6.378 -7.991 5.263 1.00 0.81 H new ATOM 1535 N ILE B 142 -5.859 -7.860 2.904 1.00 0.52 N ATOM 1536 CA ILE B 142 -4.839 -7.783 1.864 1.00 0.40 C ATOM 1537 C ILE B 142 -3.517 -8.332 2.382 1.00 0.37 C ATOM 1538 O ILE B 142 -3.329 -8.471 3.591 1.00 0.43 O ATOM 1539 CB ILE B 142 -4.622 -6.339 1.342 1.00 0.36 C ATOM 1540 CG1 ILE B 142 -4.313 -5.373 2.501 1.00 0.51 C ATOM 1541 CG2 ILE B 142 -5.829 -5.868 0.537 1.00 0.40 C ATOM 1542 CD1 ILE B 142 -5.537 -4.791 3.182 1.00 0.65 C ATOM 0 H ILE B 142 -5.632 -7.344 3.754 1.00 0.52 H new ATOM 0 HA ILE B 142 -5.199 -8.386 1.030 1.00 0.40 H new ATOM 0 HB ILE B 142 -3.758 -6.345 0.678 1.00 0.36 H new ATOM 0 HG12 ILE B 142 -3.715 -5.899 3.245 1.00 0.51 H new ATOM 0 HG13 ILE B 142 -3.701 -4.555 2.121 1.00 0.51 H new ATOM 0 HG21 ILE B 142 -5.655 -4.853 0.181 1.00 0.40 H new ATOM 0 HG22 ILE B 142 -5.979 -6.531 -0.315 1.00 0.40 H new ATOM 0 HG23 ILE B 142 -6.717 -5.883 1.169 1.00 0.40 H new ATOM 0 HD11 ILE B 142 -5.224 -4.123 3.985 1.00 0.65 H new ATOM 0 HD12 ILE B 142 -6.127 -4.233 2.455 1.00 0.65 H new ATOM 0 HD13 ILE B 142 -6.141 -5.598 3.597 1.00 0.65 H new ATOM 1554 N VAL B 143 -2.617 -8.657 1.467 1.00 0.29 N ATOM 1555 CA VAL B 143 -1.313 -9.200 1.824 1.00 0.27 C ATOM 1556 C VAL B 143 -0.212 -8.464 1.060 1.00 0.18 C ATOM 1557 O VAL B 143 -0.422 -8.032 -0.078 1.00 0.17 O ATOM 1558 CB VAL B 143 -1.240 -10.716 1.511 1.00 0.32 C ATOM 1559 CG1 VAL B 143 0.070 -11.322 1.988 1.00 0.26 C ATOM 1560 CG2 VAL B 143 -2.417 -11.454 2.132 1.00 0.52 C ATOM 0 H VAL B 143 -2.767 -8.553 0.463 1.00 0.29 H new ATOM 0 HA VAL B 143 -1.168 -9.059 2.895 1.00 0.27 H new ATOM 0 HB VAL B 143 -1.288 -10.827 0.428 1.00 0.32 H new ATOM 0 HG11 VAL B 143 0.086 -12.386 1.752 1.00 0.26 H new ATOM 0 HG12 VAL B 143 0.903 -10.827 1.489 1.00 0.26 H new ATOM 0 HG13 VAL B 143 0.162 -11.188 3.066 1.00 0.26 H new ATOM 0 HG21 VAL B 143 -2.344 -12.516 1.899 1.00 0.52 H new ATOM 0 HG22 VAL B 143 -2.402 -11.318 3.213 1.00 0.52 H new ATOM 0 HG23 VAL B 143 -3.349 -11.057 1.729 1.00 0.52 H new ATOM 1570 N CYS B 144 0.945 -8.309 1.693 1.00 0.19 N ATOM 1571 CA CYS B 144 2.074 -7.628 1.074 1.00 0.15 C ATOM 1572 C CYS B 144 2.814 -8.569 0.127 1.00 0.14 C ATOM 1573 O CYS B 144 2.291 -9.607 -0.272 1.00 0.31 O ATOM 1574 CB CYS B 144 3.037 -7.109 2.149 1.00 0.20 C ATOM 1575 SG CYS B 144 3.873 -8.418 3.112 1.00 0.21 S ATOM 0 H CYS B 144 1.125 -8.647 2.638 1.00 0.19 H new ATOM 0 HA CYS B 144 1.692 -6.783 0.501 1.00 0.15 H new ATOM 0 HB2 CYS B 144 3.794 -6.487 1.671 1.00 0.20 H new ATOM 0 HB3 CYS B 144 2.484 -6.467 2.835 1.00 0.20 H new ATOM 0 HG CYS B 144 3.131 -8.751 4.126 1.00 0.21 H new ATOM 1580 N GLU B 145 4.031 -8.197 -0.232 1.00 0.20 N ATOM 1581 CA GLU B 145 4.849 -9.019 -1.109 1.00 0.22 C ATOM 1582 C GLU B 145 5.999 -9.619 -0.315 1.00 0.22 C ATOM 1583 O GLU B 145 6.766 -10.438 -0.819 1.00 0.30 O ATOM 1584 CB GLU B 145 5.390 -8.199 -2.278 1.00 0.30 C ATOM 1585 CG GLU B 145 6.405 -7.148 -1.870 1.00 0.37 C ATOM 1586 CD GLU B 145 7.353 -6.787 -2.993 1.00 0.48 C ATOM 1587 OE1 GLU B 145 6.986 -5.955 -3.845 1.00 0.85 O ATOM 1588 OE2 GLU B 145 8.482 -7.321 -3.021 1.00 0.64 O ATOM 0 H GLU B 145 4.475 -7.330 0.070 1.00 0.20 H new ATOM 0 HA GLU B 145 4.230 -9.819 -1.515 1.00 0.22 H new ATOM 0 HB2 GLU B 145 5.849 -8.873 -3.001 1.00 0.30 H new ATOM 0 HB3 GLU B 145 4.557 -7.710 -2.783 1.00 0.30 H new ATOM 0 HG2 GLU B 145 5.881 -6.251 -1.540 1.00 0.37 H new ATOM 0 HG3 GLU B 145 6.979 -7.514 -1.019 1.00 0.37 H new ATOM 1595 N GLN B 146 6.083 -9.222 0.946 1.00 0.19 N ATOM 1596 CA GLN B 146 7.133 -9.686 1.832 1.00 0.22 C ATOM 1597 C GLN B 146 6.782 -11.050 2.417 1.00 0.21 C ATOM 1598 O GLN B 146 7.636 -11.934 2.517 1.00 0.26 O ATOM 1599 CB GLN B 146 7.354 -8.647 2.942 1.00 0.27 C ATOM 1600 CG GLN B 146 7.878 -9.219 4.251 1.00 0.51 C ATOM 1601 CD GLN B 146 7.305 -8.514 5.468 1.00 0.69 C ATOM 1602 OE1 GLN B 146 7.975 -8.377 6.495 1.00 0.45 O ATOM 1603 NE2 GLN B 146 6.063 -8.063 5.367 1.00 1.45 N ATOM 0 H GLN B 146 5.427 -8.572 1.380 1.00 0.19 H new ATOM 0 HA GLN B 146 8.058 -9.802 1.267 1.00 0.22 H new ATOM 0 HB2 GLN B 146 8.056 -7.895 2.583 1.00 0.27 H new ATOM 0 HB3 GLN B 146 6.411 -8.136 3.136 1.00 0.27 H new ATOM 0 HG2 GLN B 146 7.635 -10.280 4.303 1.00 0.51 H new ATOM 0 HG3 GLN B 146 8.965 -9.140 4.268 1.00 0.51 H new ATOM 0 HE21 GLN B 146 5.541 -8.196 4.501 1.00 1.45 H new ATOM 0 HE22 GLN B 146 5.629 -7.583 6.156 1.00 1.45 H new ATOM 1612 N ASP B 147 5.522 -11.230 2.787 1.00 0.23 N ATOM 1613 CA ASP B 147 5.083 -12.492 3.368 1.00 0.29 C ATOM 1614 C ASP B 147 4.072 -13.206 2.470 1.00 0.31 C ATOM 1615 O ASP B 147 3.540 -14.255 2.835 1.00 0.40 O ATOM 1616 CB ASP B 147 4.507 -12.272 4.782 1.00 0.34 C ATOM 1617 CG ASP B 147 3.291 -11.351 4.827 1.00 0.32 C ATOM 1618 OD1 ASP B 147 2.352 -11.577 4.042 1.00 0.32 O ATOM 1619 OD2 ASP B 147 3.266 -10.434 5.685 1.00 0.33 O ATOM 0 H ASP B 147 4.791 -10.525 2.697 1.00 0.23 H new ATOM 0 HA ASP B 147 5.957 -13.138 3.451 1.00 0.29 H new ATOM 0 HB2 ASP B 147 4.232 -13.239 5.204 1.00 0.34 H new ATOM 0 HB3 ASP B 147 5.287 -11.856 5.419 1.00 0.34 H new ATOM 1624 N ILE B 148 3.850 -12.658 1.276 1.00 0.27 N ATOM 1625 CA ILE B 148 2.893 -13.231 0.323 1.00 0.32 C ATOM 1626 C ILE B 148 3.235 -14.680 -0.042 1.00 0.40 C ATOM 1627 O ILE B 148 2.342 -15.522 -0.153 1.00 0.49 O ATOM 1628 CB ILE B 148 2.794 -12.375 -0.967 1.00 0.30 C ATOM 1629 CG1 ILE B 148 1.604 -12.825 -1.835 1.00 0.41 C ATOM 1630 CG2 ILE B 148 4.096 -12.401 -1.760 1.00 0.32 C ATOM 1631 CD1 ILE B 148 1.972 -13.699 -3.022 1.00 0.97 C ATOM 0 H ILE B 148 4.320 -11.816 0.943 1.00 0.27 H new ATOM 0 HA ILE B 148 1.925 -13.228 0.824 1.00 0.32 H new ATOM 0 HB ILE B 148 2.620 -11.342 -0.665 1.00 0.30 H new ATOM 0 HG12 ILE B 148 0.900 -13.370 -1.206 1.00 0.41 H new ATOM 0 HG13 ILE B 148 1.085 -11.939 -2.202 1.00 0.41 H new ATOM 0 HG21 ILE B 148 3.988 -11.790 -2.656 1.00 0.32 H new ATOM 0 HG22 ILE B 148 4.904 -12.004 -1.146 1.00 0.32 H new ATOM 0 HG23 ILE B 148 4.328 -13.427 -2.046 1.00 0.32 H new ATOM 0 HD11 ILE B 148 1.069 -13.965 -3.572 1.00 0.97 H new ATOM 0 HD12 ILE B 148 2.650 -13.154 -3.679 1.00 0.97 H new ATOM 0 HD13 ILE B 148 2.461 -14.606 -2.668 1.00 0.97 H new ATOM 1643 N TYR B 149 4.523 -14.965 -0.212 1.00 0.41 N ATOM 1644 CA TYR B 149 4.977 -16.303 -0.580 1.00 0.49 C ATOM 1645 C TYR B 149 4.654 -17.312 0.517 1.00 0.54 C ATOM 1646 O TYR B 149 4.309 -18.458 0.236 1.00 0.61 O ATOM 1647 CB TYR B 149 6.483 -16.290 -0.862 1.00 0.54 C ATOM 1648 CG TYR B 149 7.054 -17.643 -1.233 1.00 0.64 C ATOM 1649 CD1 TYR B 149 6.635 -18.307 -2.380 1.00 0.94 C ATOM 1650 CD2 TYR B 149 8.011 -18.255 -0.434 1.00 0.90 C ATOM 1651 CE1 TYR B 149 7.155 -19.542 -2.719 1.00 1.17 C ATOM 1652 CE2 TYR B 149 8.534 -19.489 -0.766 1.00 1.10 C ATOM 1653 CZ TYR B 149 8.103 -20.128 -1.908 1.00 1.14 C ATOM 1654 OH TYR B 149 8.620 -21.360 -2.239 1.00 1.43 O ATOM 0 H TYR B 149 5.274 -14.284 -0.100 1.00 0.41 H new ATOM 0 HA TYR B 149 4.449 -16.605 -1.484 1.00 0.49 H new ATOM 0 HB2 TYR B 149 6.684 -15.588 -1.671 1.00 0.54 H new ATOM 0 HB3 TYR B 149 7.004 -15.917 0.020 1.00 0.54 H new ATOM 0 HD1 TYR B 149 5.891 -17.851 -3.016 1.00 0.94 H new ATOM 0 HD2 TYR B 149 8.352 -17.757 0.462 1.00 0.90 H new ATOM 0 HE1 TYR B 149 6.820 -20.045 -3.614 1.00 1.17 H new ATOM 0 HE2 TYR B 149 9.277 -19.951 -0.133 1.00 1.10 H new ATOM 0 HH TYR B 149 9.277 -21.631 -1.564 1.00 1.43 H new ATOM 1664 N GLU B 150 4.745 -16.876 1.760 1.00 0.54 N ATOM 1665 CA GLU B 150 4.471 -17.747 2.891 1.00 0.61 C ATOM 1666 C GLU B 150 2.966 -17.883 3.095 1.00 0.64 C ATOM 1667 O GLU B 150 2.451 -18.978 3.325 1.00 0.73 O ATOM 1668 CB GLU B 150 5.135 -17.196 4.155 1.00 0.63 C ATOM 1669 CG GLU B 150 6.550 -16.683 3.921 1.00 0.63 C ATOM 1670 CD GLU B 150 7.586 -17.790 3.821 1.00 0.94 C ATOM 1671 OE1 GLU B 150 7.263 -18.885 3.316 1.00 1.45 O ATOM 1672 OE2 GLU B 150 8.737 -17.561 4.242 1.00 1.76 O ATOM 0 H GLU B 150 5.007 -15.923 2.013 1.00 0.54 H new ATOM 0 HA GLU B 150 4.885 -18.734 2.685 1.00 0.61 H new ATOM 0 HB2 GLU B 150 4.524 -16.386 4.554 1.00 0.63 H new ATOM 0 HB3 GLU B 150 5.161 -17.979 4.913 1.00 0.63 H new ATOM 0 HG2 GLU B 150 6.568 -16.095 3.003 1.00 0.63 H new ATOM 0 HG3 GLU B 150 6.824 -16.012 4.735 1.00 0.63 H new ATOM 1679 N TRP B 151 2.268 -16.759 2.976 1.00 0.57 N ATOM 1680 CA TRP B 151 0.818 -16.716 3.147 1.00 0.60 C ATOM 1681 C TRP B 151 0.107 -17.631 2.147 1.00 0.64 C ATOM 1682 O TRP B 151 -0.815 -18.365 2.512 1.00 0.72 O ATOM 1683 CB TRP B 151 0.327 -15.273 2.986 1.00 0.54 C ATOM 1684 CG TRP B 151 -1.140 -15.088 3.247 1.00 0.58 C ATOM 1685 CD1 TRP B 151 -2.137 -15.009 2.317 1.00 0.60 C ATOM 1686 CD2 TRP B 151 -1.773 -14.946 4.527 1.00 0.68 C ATOM 1687 NE1 TRP B 151 -3.350 -14.834 2.939 1.00 0.67 N ATOM 1688 CE2 TRP B 151 -3.154 -14.790 4.294 1.00 0.72 C ATOM 1689 CE3 TRP B 151 -1.309 -14.939 5.845 1.00 0.79 C ATOM 1690 CZ2 TRP B 151 -4.069 -14.631 5.328 1.00 0.85 C ATOM 1691 CZ3 TRP B 151 -2.221 -14.780 6.873 1.00 0.94 C ATOM 1692 CH2 TRP B 151 -3.588 -14.629 6.609 1.00 0.96 C ATOM 0 H TRP B 151 2.688 -15.855 2.759 1.00 0.57 H new ATOM 0 HA TRP B 151 0.580 -17.075 4.148 1.00 0.60 H new ATOM 0 HB2 TRP B 151 0.889 -14.632 3.666 1.00 0.54 H new ATOM 0 HB3 TRP B 151 0.549 -14.936 1.973 1.00 0.54 H new ATOM 0 HD1 TRP B 151 -1.993 -15.074 1.249 1.00 0.60 H new ATOM 0 HE1 TRP B 151 -4.251 -14.750 2.468 1.00 0.67 H new ATOM 0 HE3 TRP B 151 -0.257 -15.056 6.057 1.00 0.79 H new ATOM 0 HZ2 TRP B 151 -5.124 -14.513 5.127 1.00 0.85 H new ATOM 0 HZ3 TRP B 151 -1.873 -14.772 7.895 1.00 0.94 H new ATOM 0 HH2 TRP B 151 -4.276 -14.509 7.433 1.00 0.96 H new ATOM 1703 N THR B 152 0.548 -17.601 0.895 1.00 0.59 N ATOM 1704 CA THR B 152 -0.063 -18.413 -0.151 1.00 0.64 C ATOM 1705 C THR B 152 0.136 -19.909 0.091 1.00 0.75 C ATOM 1706 O THR B 152 -0.791 -20.700 -0.101 1.00 0.81 O ATOM 1707 CB THR B 152 0.486 -18.048 -1.541 1.00 0.60 C ATOM 1708 OG1 THR B 152 1.888 -17.773 -1.453 1.00 0.58 O ATOM 1709 CG2 THR B 152 -0.241 -16.839 -2.111 1.00 0.56 C ATOM 0 H THR B 152 1.327 -17.023 0.579 1.00 0.59 H new ATOM 0 HA THR B 152 -1.131 -18.195 -0.118 1.00 0.64 H new ATOM 0 HB THR B 152 0.322 -18.895 -2.208 1.00 0.60 H new ATOM 0 HG1 THR B 152 2.025 -16.812 -1.316 1.00 0.58 H new ATOM 0 HG21 THR B 152 0.165 -16.600 -3.094 1.00 0.56 H new ATOM 0 HG22 THR B 152 -1.304 -17.063 -2.202 1.00 0.56 H new ATOM 0 HG23 THR B 152 -0.106 -15.986 -1.446 1.00 0.56 H new ATOM 1717 N LYS B 153 1.335 -20.295 0.517 1.00 0.79 N ATOM 1718 CA LYS B 153 1.634 -21.700 0.779 1.00 0.90 C ATOM 1719 C LYS B 153 0.753 -22.245 1.895 1.00 0.95 C ATOM 1720 O LYS B 153 0.165 -23.316 1.761 1.00 1.01 O ATOM 1721 CB LYS B 153 3.103 -21.879 1.155 1.00 0.96 C ATOM 1722 CG LYS B 153 4.055 -21.795 -0.029 1.00 0.94 C ATOM 1723 CD LYS B 153 5.491 -22.054 0.401 1.00 1.07 C ATOM 1724 CE LYS B 153 6.032 -20.899 1.227 1.00 1.08 C ATOM 1725 NZ LYS B 153 7.009 -21.346 2.254 1.00 1.30 N ATOM 0 H LYS B 153 2.113 -19.658 0.688 1.00 0.79 H new ATOM 0 HA LYS B 153 1.430 -22.257 -0.135 1.00 0.90 H new ATOM 0 HB2 LYS B 153 3.377 -21.117 1.884 1.00 0.96 H new ATOM 0 HB3 LYS B 153 3.228 -22.846 1.642 1.00 0.96 H new ATOM 0 HG2 LYS B 153 3.763 -22.522 -0.787 1.00 0.94 H new ATOM 0 HG3 LYS B 153 3.982 -20.809 -0.488 1.00 0.94 H new ATOM 0 HD2 LYS B 153 5.539 -22.975 0.982 1.00 1.07 H new ATOM 0 HD3 LYS B 153 6.117 -22.200 -0.479 1.00 1.07 H new ATOM 0 HE2 LYS B 153 6.509 -20.175 0.566 1.00 1.08 H new ATOM 0 HE3 LYS B 153 5.204 -20.386 1.716 1.00 1.08 H new ATOM 0 HZ1 LYS B 153 7.323 -20.528 2.813 1.00 1.30 H new ATOM 0 HZ2 LYS B 153 6.559 -22.042 2.882 1.00 1.30 H new ATOM 0 HZ3 LYS B 153 7.829 -21.781 1.786 1.00 1.30 H new ATOM 1739 N ILE B 154 0.652 -21.495 2.984 1.00 0.94 N ATOM 1740 CA ILE B 154 -0.154 -21.909 4.128 1.00 1.01 C ATOM 1741 C ILE B 154 -1.644 -21.945 3.772 1.00 1.04 C ATOM 1742 O ILE B 154 -2.390 -22.793 4.258 1.00 1.11 O ATOM 1743 CB ILE B 154 0.069 -20.967 5.332 1.00 0.99 C ATOM 1744 CG1 ILE B 154 1.559 -20.901 5.686 1.00 0.94 C ATOM 1745 CG2 ILE B 154 -0.739 -21.432 6.536 1.00 1.12 C ATOM 1746 CD1 ILE B 154 1.909 -19.789 6.651 1.00 0.91 C ATOM 0 H ILE B 154 1.118 -20.595 3.101 1.00 0.94 H new ATOM 0 HA ILE B 154 0.165 -22.915 4.402 1.00 1.01 H new ATOM 0 HB ILE B 154 -0.271 -19.969 5.055 1.00 0.99 H new ATOM 0 HG12 ILE B 154 1.863 -21.854 6.119 1.00 0.94 H new ATOM 0 HG13 ILE B 154 2.135 -20.769 4.770 1.00 0.94 H new ATOM 0 HG21 ILE B 154 -0.568 -20.755 7.373 1.00 1.12 H new ATOM 0 HG22 ILE B 154 -1.799 -21.435 6.283 1.00 1.12 H new ATOM 0 HG23 ILE B 154 -0.429 -22.439 6.815 1.00 1.12 H new ATOM 0 HD11 ILE B 154 2.980 -19.806 6.853 1.00 0.91 H new ATOM 0 HD12 ILE B 154 1.638 -18.828 6.213 1.00 0.91 H new ATOM 0 HD13 ILE B 154 1.361 -19.930 7.583 1.00 0.91 H new ATOM 1758 N ASN B 155 -2.063 -21.033 2.905 1.00 1.02 N ATOM 1759 CA ASN B 155 -3.464 -20.959 2.488 1.00 1.07 C ATOM 1760 C ASN B 155 -3.813 -22.076 1.511 1.00 1.14 C ATOM 1761 O ASN B 155 -4.956 -22.531 1.458 1.00 1.24 O ATOM 1762 CB ASN B 155 -3.762 -19.604 1.844 1.00 1.00 C ATOM 1763 CG ASN B 155 -4.282 -18.591 2.845 1.00 1.17 C ATOM 1764 OD1 ASN B 155 -5.488 -18.413 2.995 1.00 1.32 O ATOM 1765 ND2 ASN B 155 -3.376 -17.923 3.535 1.00 1.49 N ATOM 0 H ASN B 155 -1.457 -20.334 2.475 1.00 1.02 H new ATOM 0 HA ASN B 155 -4.077 -21.077 3.381 1.00 1.07 H new ATOM 0 HB2 ASN B 155 -2.855 -19.218 1.379 1.00 1.00 H new ATOM 0 HB3 ASN B 155 -4.496 -19.736 1.050 1.00 1.00 H new ATOM 0 HD21 ASN B 155 -3.668 -17.229 4.223 1.00 1.49 H new ATOM 0 HD22 ASN B 155 -2.384 -18.101 3.380 1.00 1.49 H new ATOM 1772 N GLY B 156 -2.824 -22.513 0.746 1.00 1.14 N ATOM 1773 CA GLY B 156 -3.048 -23.563 -0.225 1.00 1.23 C ATOM 1774 C GLY B 156 -3.265 -23.007 -1.615 1.00 1.19 C ATOM 1775 O GLY B 156 -4.156 -23.452 -2.337 1.00 1.42 O ATOM 0 H GLY B 156 -1.868 -22.158 0.781 1.00 1.14 H new ATOM 0 HA2 GLY B 156 -2.193 -24.239 -0.233 1.00 1.23 H new ATOM 0 HA3 GLY B 156 -3.916 -24.152 0.070 1.00 1.23 H new ATOM 1779 N GLY B 157 -2.457 -22.021 -1.982 1.00 1.10 N ATOM 1780 CA GLY B 157 -2.565 -21.411 -3.292 1.00 1.07 C ATOM 1781 C GLY B 157 -1.250 -21.455 -4.040 1.00 1.04 C ATOM 1782 O GLY B 157 -0.912 -20.533 -4.783 1.00 1.10 O ATOM 0 H GLY B 157 -1.723 -21.631 -1.390 1.00 1.10 H new ATOM 0 HA2 GLY B 157 -3.331 -21.927 -3.872 1.00 1.07 H new ATOM 0 HA3 GLY B 157 -2.889 -20.376 -3.186 1.00 1.07 H new ATOM 1786 N SER B 158 -0.503 -22.525 -3.825 1.00 1.04 N ATOM 1787 CA SER B 158 0.786 -22.713 -4.467 1.00 1.03 C ATOM 1788 C SER B 158 0.622 -22.960 -5.969 1.00 1.05 C ATOM 1789 O SER B 158 -0.444 -23.383 -6.426 1.00 1.18 O ATOM 1790 CB SER B 158 1.493 -23.892 -3.800 1.00 1.10 C ATOM 1791 OG SER B 158 0.692 -24.411 -2.748 1.00 1.16 O ATOM 0 H SER B 158 -0.773 -23.286 -3.202 1.00 1.04 H new ATOM 0 HA SER B 158 1.384 -21.809 -4.352 1.00 1.03 H new ATOM 0 HB2 SER B 158 1.690 -24.672 -4.536 1.00 1.10 H new ATOM 0 HB3 SER B 158 2.459 -23.572 -3.408 1.00 1.10 H new ATOM 0 HG SER B 158 0.025 -25.027 -3.118 1.00 1.16 H new ATOM 1797 N GLY B 159 1.671 -22.687 -6.734 1.00 1.05 N ATOM 1798 CA GLY B 159 1.610 -22.887 -8.169 1.00 1.09 C ATOM 1799 C GLY B 159 2.915 -23.381 -8.746 1.00 1.14 C ATOM 1800 O GLY B 159 3.354 -22.909 -9.795 1.00 1.18 O ATOM 0 H GLY B 159 2.562 -22.331 -6.387 1.00 1.05 H new ATOM 0 HA2 GLY B 159 0.822 -23.604 -8.398 1.00 1.09 H new ATOM 0 HA3 GLY B 159 1.337 -21.948 -8.651 1.00 1.09 H new ATOM 1804 N GLY B 160 3.537 -24.333 -8.064 1.00 1.19 N ATOM 1805 CA GLY B 160 4.790 -24.879 -8.537 1.00 1.27 C ATOM 1806 C GLY B 160 5.985 -24.104 -8.031 1.00 1.23 C ATOM 1807 O GLY B 160 5.872 -22.928 -7.678 1.00 1.27 O ATOM 0 H GLY B 160 3.195 -24.736 -7.192 1.00 1.19 H new ATOM 0 HA2 GLY B 160 4.873 -25.918 -8.219 1.00 1.27 H new ATOM 0 HA3 GLY B 160 4.795 -24.878 -9.627 1.00 1.27 H new ATOM 1811 N SER B 161 7.131 -24.753 -7.998 1.00 1.21 N ATOM 1812 CA SER B 161 8.350 -24.119 -7.535 1.00 1.18 C ATOM 1813 C SER B 161 9.018 -23.351 -8.673 1.00 1.16 C ATOM 1814 O SER B 161 9.820 -23.903 -9.425 1.00 1.26 O ATOM 1815 CB SER B 161 9.296 -25.179 -6.975 1.00 1.30 C ATOM 1816 OG SER B 161 8.718 -26.474 -7.080 1.00 1.46 O ATOM 0 H SER B 161 7.244 -25.724 -8.288 1.00 1.21 H new ATOM 0 HA SER B 161 8.105 -23.408 -6.746 1.00 1.18 H new ATOM 0 HB2 SER B 161 10.242 -25.152 -7.517 1.00 1.30 H new ATOM 0 HB3 SER B 161 9.520 -24.959 -5.931 1.00 1.30 H new ATOM 0 HG SER B 161 9.339 -27.140 -6.718 1.00 1.46 H new ATOM 1822 N GLY B 162 8.660 -22.082 -8.811 1.00 1.14 N ATOM 1823 CA GLY B 162 9.232 -21.258 -9.860 1.00 1.17 C ATOM 1824 C GLY B 162 8.227 -20.938 -10.943 1.00 1.16 C ATOM 1825 O GLY B 162 8.496 -20.132 -11.836 1.00 1.28 O ATOM 0 H GLY B 162 7.983 -21.607 -8.215 1.00 1.14 H new ATOM 0 HA2 GLY B 162 9.607 -20.330 -9.428 1.00 1.17 H new ATOM 0 HA3 GLY B 162 10.086 -21.773 -10.299 1.00 1.17 H new ATOM 1829 N GLY B 163 7.068 -21.571 -10.865 1.00 1.13 N ATOM 1830 CA GLY B 163 6.028 -21.333 -11.841 1.00 1.13 C ATOM 1831 C GLY B 163 5.080 -20.244 -11.390 1.00 1.08 C ATOM 1832 O GLY B 163 5.242 -19.686 -10.302 1.00 1.11 O ATOM 0 H GLY B 163 6.829 -22.248 -10.140 1.00 1.13 H new ATOM 0 HA2 GLY B 163 6.479 -21.052 -12.793 1.00 1.13 H new ATOM 0 HA3 GLY B 163 5.470 -22.254 -12.011 1.00 1.13 H new ATOM 1836 N SER B 164 4.104 -19.924 -12.220 1.00 1.09 N ATOM 1837 CA SER B 164 3.133 -18.902 -11.880 1.00 1.06 C ATOM 1838 C SER B 164 2.009 -19.501 -11.039 1.00 0.99 C ATOM 1839 O SER B 164 1.503 -20.584 -11.343 1.00 1.08 O ATOM 1840 CB SER B 164 2.573 -18.259 -13.153 1.00 1.18 C ATOM 1841 OG SER B 164 2.530 -19.190 -14.224 1.00 1.36 O ATOM 0 H SER B 164 3.963 -20.357 -13.133 1.00 1.09 H new ATOM 0 HA SER B 164 3.627 -18.128 -11.293 1.00 1.06 H new ATOM 0 HB2 SER B 164 1.571 -17.877 -12.960 1.00 1.18 H new ATOM 0 HB3 SER B 164 3.190 -17.406 -13.434 1.00 1.18 H new ATOM 0 HG SER B 164 2.167 -18.753 -15.023 1.00 1.36 H new ATOM 1847 N GLY B 165 1.637 -18.807 -9.973 1.00 0.94 N ATOM 1848 CA GLY B 165 0.581 -19.289 -9.108 1.00 0.98 C ATOM 1849 C GLY B 165 -0.769 -18.720 -9.483 1.00 0.93 C ATOM 1850 O GLY B 165 -1.579 -19.390 -10.122 1.00 1.09 O ATOM 0 H GLY B 165 2.049 -17.917 -9.692 1.00 0.94 H new ATOM 0 HA2 GLY B 165 0.541 -20.377 -9.158 1.00 0.98 H new ATOM 0 HA3 GLY B 165 0.811 -19.025 -8.076 1.00 0.98 H new ATOM 1854 N GLY B 166 -1.004 -17.475 -9.104 1.00 0.96 N ATOM 1855 CA GLY B 166 -2.266 -16.839 -9.405 1.00 1.01 C ATOM 1856 C GLY B 166 -2.084 -15.487 -10.059 1.00 0.99 C ATOM 1857 O GLY B 166 -1.456 -15.377 -11.114 1.00 1.31 O ATOM 0 H GLY B 166 -0.341 -16.893 -8.592 1.00 0.96 H new ATOM 0 HA2 GLY B 166 -2.848 -17.484 -10.064 1.00 1.01 H new ATOM 0 HA3 GLY B 166 -2.840 -16.722 -8.486 1.00 1.01 H new ATOM 1861 N ASP B 167 -2.612 -14.456 -9.425 1.00 0.82 N ATOM 1862 CA ASP B 167 -2.514 -13.106 -9.954 1.00 0.80 C ATOM 1863 C ASP B 167 -2.060 -12.142 -8.873 1.00 0.71 C ATOM 1864 O ASP B 167 -2.327 -12.353 -7.688 1.00 0.90 O ATOM 1865 CB ASP B 167 -3.863 -12.652 -10.516 1.00 0.86 C ATOM 1866 CG ASP B 167 -3.797 -12.338 -11.998 1.00 1.19 C ATOM 1867 OD1 ASP B 167 -2.877 -11.601 -12.418 1.00 1.75 O ATOM 1868 OD2 ASP B 167 -4.670 -12.825 -12.750 1.00 1.38 O ATOM 0 H ASP B 167 -3.115 -14.527 -8.540 1.00 0.82 H new ATOM 0 HA ASP B 167 -1.777 -13.109 -10.757 1.00 0.80 H new ATOM 0 HB2 ASP B 167 -4.605 -13.432 -10.346 1.00 0.86 H new ATOM 0 HB3 ASP B 167 -4.200 -11.768 -9.975 1.00 0.86 H new ATOM 1873 N VAL B 168 -1.363 -11.097 -9.284 1.00 0.73 N ATOM 1874 CA VAL B 168 -0.877 -10.083 -8.369 1.00 0.64 C ATOM 1875 C VAL B 168 -1.091 -8.703 -8.989 1.00 0.65 C ATOM 1876 O VAL B 168 -1.152 -8.576 -10.213 1.00 0.78 O ATOM 1877 CB VAL B 168 0.617 -10.304 -8.023 1.00 0.63 C ATOM 1878 CG1 VAL B 168 1.511 -9.975 -9.208 1.00 0.74 C ATOM 1879 CG2 VAL B 168 1.020 -9.496 -6.799 1.00 0.58 C ATOM 0 H VAL B 168 -1.119 -10.929 -10.260 1.00 0.73 H new ATOM 0 HA VAL B 168 -1.437 -10.153 -7.437 1.00 0.64 H new ATOM 0 HB VAL B 168 0.749 -11.360 -7.788 1.00 0.63 H new ATOM 0 HG11 VAL B 168 2.553 -10.140 -8.934 1.00 0.74 H new ATOM 0 HG12 VAL B 168 1.251 -10.617 -10.049 1.00 0.74 H new ATOM 0 HG13 VAL B 168 1.371 -8.932 -9.491 1.00 0.74 H new ATOM 0 HG21 VAL B 168 2.073 -9.670 -6.579 1.00 0.58 H new ATOM 0 HG22 VAL B 168 0.861 -8.436 -6.994 1.00 0.58 H new ATOM 0 HG23 VAL B 168 0.415 -9.803 -5.945 1.00 0.58 H new ATOM 1889 N MET B 169 -1.235 -7.682 -8.160 1.00 0.57 N ATOM 1890 CA MET B 169 -1.453 -6.330 -8.659 1.00 0.62 C ATOM 1891 C MET B 169 -0.499 -5.349 -8.000 1.00 0.57 C ATOM 1892 O MET B 169 0.135 -5.668 -6.995 1.00 0.51 O ATOM 1893 CB MET B 169 -2.898 -5.895 -8.411 1.00 0.69 C ATOM 1894 CG MET B 169 -3.865 -6.345 -9.493 1.00 0.82 C ATOM 1895 SD MET B 169 -5.561 -5.825 -9.166 1.00 0.99 S ATOM 1896 CE MET B 169 -6.385 -6.404 -10.648 1.00 1.23 C ATOM 0 H MET B 169 -1.205 -7.760 -7.143 1.00 0.57 H new ATOM 0 HA MET B 169 -1.262 -6.333 -9.732 1.00 0.62 H new ATOM 0 HB2 MET B 169 -3.229 -6.294 -7.452 1.00 0.69 H new ATOM 0 HB3 MET B 169 -2.933 -4.808 -8.334 1.00 0.69 H new ATOM 0 HG2 MET B 169 -3.544 -5.941 -10.453 1.00 0.82 H new ATOM 0 HG3 MET B 169 -3.831 -7.431 -9.576 1.00 0.82 H new ATOM 0 HE1 MET B 169 -7.386 -5.976 -10.698 1.00 1.23 H new ATOM 0 HE2 MET B 169 -5.815 -6.097 -11.525 1.00 1.23 H new ATOM 0 HE3 MET B 169 -6.456 -7.491 -10.624 1.00 1.23 H new ATOM 1906 N VAL B 170 -0.398 -4.162 -8.573 1.00 0.65 N ATOM 1907 CA VAL B 170 0.466 -3.119 -8.046 1.00 0.64 C ATOM 1908 C VAL B 170 -0.380 -2.031 -7.397 1.00 0.65 C ATOM 1909 O VAL B 170 -1.391 -1.612 -7.960 1.00 0.71 O ATOM 1910 CB VAL B 170 1.340 -2.502 -9.161 1.00 0.70 C ATOM 1911 CG1 VAL B 170 2.248 -1.410 -8.611 1.00 0.72 C ATOM 1912 CG2 VAL B 170 2.162 -3.581 -9.853 1.00 0.77 C ATOM 0 H VAL B 170 -0.910 -3.894 -9.413 1.00 0.65 H new ATOM 0 HA VAL B 170 1.126 -3.566 -7.303 1.00 0.64 H new ATOM 0 HB VAL B 170 0.675 -2.046 -9.894 1.00 0.70 H new ATOM 0 HG11 VAL B 170 2.850 -0.996 -9.420 1.00 0.72 H new ATOM 0 HG12 VAL B 170 1.641 -0.620 -8.169 1.00 0.72 H new ATOM 0 HG13 VAL B 170 2.904 -1.832 -7.850 1.00 0.72 H new ATOM 0 HG21 VAL B 170 2.771 -3.129 -10.635 1.00 0.77 H new ATOM 0 HG22 VAL B 170 2.810 -4.068 -9.124 1.00 0.77 H new ATOM 0 HG23 VAL B 170 1.494 -4.320 -10.295 1.00 0.77 H new ATOM 1922 N VAL B 171 0.023 -1.589 -6.210 1.00 0.60 N ATOM 1923 CA VAL B 171 -0.712 -0.552 -5.498 1.00 0.63 C ATOM 1924 C VAL B 171 -0.646 0.770 -6.252 1.00 0.75 C ATOM 1925 O VAL B 171 0.437 1.323 -6.480 1.00 0.85 O ATOM 1926 CB VAL B 171 -0.203 -0.336 -4.051 1.00 0.61 C ATOM 1927 CG1 VAL B 171 -0.714 -1.433 -3.128 1.00 0.87 C ATOM 1928 CG2 VAL B 171 1.314 -0.273 -4.003 1.00 0.86 C ATOM 0 H VAL B 171 0.851 -1.932 -5.723 1.00 0.60 H new ATOM 0 HA VAL B 171 -1.743 -0.900 -5.440 1.00 0.63 H new ATOM 0 HB VAL B 171 -0.594 0.621 -3.705 1.00 0.61 H new ATOM 0 HG11 VAL B 171 -0.344 -1.260 -2.118 1.00 0.87 H new ATOM 0 HG12 VAL B 171 -1.804 -1.425 -3.121 1.00 0.87 H new ATOM 0 HG13 VAL B 171 -0.361 -2.401 -3.483 1.00 0.87 H new ATOM 0 HG21 VAL B 171 1.639 -0.121 -2.974 1.00 0.86 H new ATOM 0 HG22 VAL B 171 1.729 -1.208 -4.380 1.00 0.86 H new ATOM 0 HG23 VAL B 171 1.664 0.555 -4.620 1.00 0.86 H new ATOM 1938 N GLY B 172 -1.806 1.252 -6.667 1.00 0.79 N ATOM 1939 CA GLY B 172 -1.873 2.503 -7.386 1.00 0.92 C ATOM 1940 C GLY B 172 -1.735 3.691 -6.458 1.00 0.94 C ATOM 1941 O GLY B 172 -1.714 3.529 -5.236 1.00 0.95 O ATOM 0 H GLY B 172 -2.706 0.796 -6.517 1.00 0.79 H new ATOM 0 HA2 GLY B 172 -1.083 2.534 -8.137 1.00 0.92 H new ATOM 0 HA3 GLY B 172 -2.822 2.566 -7.919 1.00 0.92 H new ATOM 1945 N GLU B 173 -1.638 4.877 -7.033 1.00 1.03 N ATOM 1946 CA GLU B 173 -1.505 6.098 -6.250 1.00 1.09 C ATOM 1947 C GLU B 173 -2.754 6.341 -5.406 1.00 0.99 C ATOM 1948 O GLU B 173 -3.868 6.012 -5.822 1.00 0.94 O ATOM 1949 CB GLU B 173 -1.241 7.288 -7.174 1.00 1.26 C ATOM 1950 CG GLU B 173 -2.209 7.375 -8.339 1.00 1.32 C ATOM 1951 CD GLU B 173 -1.750 8.350 -9.397 1.00 1.46 C ATOM 1952 OE1 GLU B 173 -2.072 9.550 -9.287 1.00 1.97 O ATOM 1953 OE2 GLU B 173 -1.062 7.918 -10.347 1.00 1.40 O ATOM 0 H GLU B 173 -1.649 5.023 -8.042 1.00 1.03 H new ATOM 0 HA GLU B 173 -0.658 5.984 -5.573 1.00 1.09 H new ATOM 0 HB2 GLU B 173 -1.300 8.209 -6.594 1.00 1.26 H new ATOM 0 HB3 GLU B 173 -0.224 7.219 -7.561 1.00 1.26 H new ATOM 0 HG2 GLU B 173 -2.326 6.387 -8.785 1.00 1.32 H new ATOM 0 HG3 GLU B 173 -3.190 7.677 -7.971 1.00 1.32 H new ATOM 1960 N PRO B 174 -2.578 6.896 -4.198 1.00 1.03 N ATOM 1961 CA PRO B 174 -3.692 7.186 -3.294 1.00 0.99 C ATOM 1962 C PRO B 174 -4.547 8.356 -3.776 1.00 1.07 C ATOM 1963 O PRO B 174 -4.045 9.293 -4.404 1.00 1.25 O ATOM 1964 CB PRO B 174 -2.998 7.537 -1.978 1.00 1.13 C ATOM 1965 CG PRO B 174 -1.661 8.051 -2.385 1.00 1.28 C ATOM 1966 CD PRO B 174 -1.278 7.271 -3.613 1.00 1.17 C ATOM 0 HA PRO B 174 -4.382 6.346 -3.218 1.00 0.99 H new ATOM 0 HB2 PRO B 174 -3.559 8.288 -1.422 1.00 1.13 H new ATOM 0 HB3 PRO B 174 -2.907 6.664 -1.332 1.00 1.13 H new ATOM 0 HG2 PRO B 174 -1.701 9.119 -2.597 1.00 1.28 H new ATOM 0 HG3 PRO B 174 -0.930 7.911 -1.589 1.00 1.28 H new ATOM 0 HD2 PRO B 174 -0.685 7.872 -4.302 1.00 1.17 H new ATOM 0 HD3 PRO B 174 -0.682 6.394 -3.362 1.00 1.17 H new ATOM 1974 N THR B 175 -5.835 8.293 -3.484 1.00 1.00 N ATOM 1975 CA THR B 175 -6.760 9.338 -3.878 1.00 1.09 C ATOM 1976 C THR B 175 -6.661 10.535 -2.939 1.00 1.16 C ATOM 1977 O THR B 175 -6.608 10.376 -1.718 1.00 1.13 O ATOM 1978 CB THR B 175 -8.202 8.812 -3.881 1.00 1.09 C ATOM 1979 OG1 THR B 175 -8.237 7.501 -3.292 1.00 1.44 O ATOM 1980 CG2 THR B 175 -8.754 8.763 -5.299 1.00 1.27 C ATOM 0 H THR B 175 -6.265 7.523 -2.972 1.00 1.00 H new ATOM 0 HA THR B 175 -6.491 9.654 -4.886 1.00 1.09 H new ATOM 0 HB THR B 175 -8.824 9.489 -3.296 1.00 1.09 H new ATOM 0 HG1 THR B 175 -8.933 7.471 -2.603 1.00 1.44 H new ATOM 0 HG21 THR B 175 -9.777 8.387 -5.278 1.00 1.27 H new ATOM 0 HG22 THR B 175 -8.744 9.765 -5.728 1.00 1.27 H new ATOM 0 HG23 THR B 175 -8.137 8.102 -5.907 1.00 1.27 H new