USER MOD reduce.3.24.130724 H: found=0, std=0, add=1239, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1240 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 119 ASN : amide:sc= -1.25! C(o=-1.3!,f=-6.2!) USER MOD Set 1.2: A 120 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 115 ASN :FLIP amide:sc= -2.39 F(o=-7.1!,f=-4.8) USER MOD Set 2.2: A 121 ASN : amide:sc= -2.45! K(o=-4.8!,f=-5.7) USER MOD Set 3.1: A 41 ASN : amide:sc= 0.221 K(o=0.28,f=-1.4!) USER MOD Set 3.2: A 90 SER OG : rot 60:sc= 0.174 USER MOD Set 3.3: A 113 MET CE :methyl -114:sc= -0.12 (180deg=-1.04) USER MOD Set 4.1: A 35 THR OG1 : rot 160:sc= 0 USER MOD Set 4.2: A 103 LYS NZ :NH3+ 149:sc= 0.792 (180deg=-0.855) USER MOD Single : A 9 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 16 MET CE :methyl 176:sc= -1.16 (180deg=-1.22) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= -0.168 X(o=-0.17,f=0) USER MOD Single : A 28 MET CE :methyl -154:sc= -0.353 (180deg=-1.71!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -160:sc= -0.112 USER MOD Single : A 46 CYS SG : rot -76:sc= -1.12 USER MOD Single : A 47 THR OG1 : rot -160:sc= -0.414 USER MOD Single : A 50 LYS NZ :NH3+ -152:sc= 1.13 (180deg=0.352) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -149:sc= -1.17 (180deg=-1.97) USER MOD Single : A 60 HIS : no HD1:sc= -1.43 K(o=-1.4,f=-2.4) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.136) USER MOD Single : A 64 SER OG : rot -160:sc= -1.46 USER MOD Single : A 65 SER OG : rot 90:sc= 1.12 USER MOD Single : A 67 HIS : no HE2:sc= -1.56 K(o=-1.6,f=-3.3!) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 CYS SG : rot 180:sc= -0.769 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 THR OG1 : rot -23:sc= 1.44 USER MOD Single : A 84 ASN : amide:sc=-0.00232 K(o=-0.0023,f=-1.6!) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot 85:sc= -1.54! USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN :FLIP amide:sc= -1.94 F(o=-3.3!,f=-1.9) USER MOD Single : A 104 LYS NZ :NH3+ 157:sc= -0.0768 (180deg=-0.702) USER MOD Single : A 105 HIS : no HD1:sc= -1.39 K(o=-1.4,f=-6.5!) USER MOD Single : A 106 THR OG1 : rot 9:sc= 0.811 USER MOD Single : A 112 SER OG : rot 180:sc= -0.412 USER MOD Single : A 123 SER OG : rot -149:sc= 0.875 USER MOD Single : A 124 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 128 CYS SG : rot 170:sc= -1.01 USER MOD Single : A 129 THR OG1 : rot -115:sc= 0.748 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot -80:sc= -2.56 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 144 GLN : amide:sc= -0.0399 K(o=-0.04,f=-0.74) USER MOD Single : A 149 MET CE :methyl -148:sc= -0.242 (180deg=-1.53!) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 SER OG : rot 180:sc= -0.117 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 165 THR OG1 : rot 132:sc= 1.22 USER MOD Single : A 167 LYS NZ :NH3+ 161:sc= -0.0228 (180deg=-0.36) USER MOD Single : A 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 174 CYS SG : rot 27:sc= -0.624 USER MOD Single : A 176 GLN : amide:sc= -7.51! C(o=-7.5!,f=-9.8!) USER MOD Single : A 178 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 104 N ASN A 9 2.581 4.379 18.775 1.00 0.00 N ATOM 105 CA ASN A 9 1.771 3.878 17.626 1.00 0.00 C ATOM 106 C ASN A 9 2.631 2.947 16.765 1.00 0.00 C ATOM 107 O ASN A 9 3.839 3.079 16.718 1.00 0.00 O ATOM 108 CB ASN A 9 1.302 5.069 16.782 1.00 0.00 C ATOM 109 CG ASN A 9 0.081 5.715 17.440 1.00 0.00 C ATOM 110 OD1 ASN A 9 -1.112 5.260 17.164 1.00 0.00 O flip ATOM 111 ND2 ASN A 9 0.212 6.645 18.212 1.00 0.00 N flip ATOM 0 HA ASN A 9 0.905 3.330 17.998 1.00 0.00 H new ATOM 0 HB2 ASN A 9 2.106 5.799 16.687 1.00 0.00 H new ATOM 0 HB3 ASN A 9 1.052 4.737 15.774 1.00 0.00 H new ATOM 0 HD21 ASN A 9 1.143 7.001 18.428 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -0.609 7.069 18.643 1.00 0.00 H new ATOM 118 N PRO A 10 2.015 2.013 16.085 1.00 0.00 N ATOM 119 CA PRO A 10 2.736 1.042 15.204 1.00 0.00 C ATOM 120 C PRO A 10 3.390 1.727 14.002 1.00 0.00 C ATOM 121 O PRO A 10 2.835 2.635 13.415 1.00 0.00 O ATOM 122 CB PRO A 10 1.630 0.087 14.736 1.00 0.00 C ATOM 123 CG PRO A 10 0.372 0.881 14.850 1.00 0.00 C ATOM 124 CD PRO A 10 0.561 1.774 16.073 1.00 0.00 C ATOM 0 HA PRO A 10 3.550 0.544 15.731 1.00 0.00 H new ATOM 0 HB2 PRO A 10 1.799 -0.243 13.711 1.00 0.00 H new ATOM 0 HB3 PRO A 10 1.591 -0.808 15.356 1.00 0.00 H new ATOM 0 HG2 PRO A 10 0.201 1.476 13.953 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -0.493 0.229 14.970 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -0.001 2.704 15.985 1.00 0.00 H new ATOM 0 HD3 PRO A 10 0.225 1.284 16.987 1.00 0.00 H new ATOM 132 N ARG A 11 4.561 1.288 13.624 1.00 0.00 N ATOM 133 CA ARG A 11 5.251 1.897 12.449 1.00 0.00 C ATOM 134 C ARG A 11 5.675 0.782 11.491 1.00 0.00 C ATOM 135 O ARG A 11 6.231 -0.219 11.899 1.00 0.00 O ATOM 136 CB ARG A 11 6.487 2.664 12.924 1.00 0.00 C ATOM 137 CG ARG A 11 6.048 3.849 13.789 1.00 0.00 C ATOM 138 CD ARG A 11 7.273 4.684 14.169 1.00 0.00 C ATOM 139 NE ARG A 11 6.885 5.700 15.186 1.00 0.00 N ATOM 140 CZ ARG A 11 7.786 6.501 15.687 1.00 0.00 C ATOM 141 NH1 ARG A 11 9.026 6.412 15.294 1.00 0.00 N ATOM 142 NH2 ARG A 11 7.444 7.390 16.579 1.00 0.00 N ATOM 0 H ARG A 11 5.071 0.531 14.080 1.00 0.00 H new ATOM 0 HA ARG A 11 4.577 2.585 11.939 1.00 0.00 H new ATOM 0 HB2 ARG A 11 7.141 2.005 13.495 1.00 0.00 H new ATOM 0 HB3 ARG A 11 7.061 3.018 12.067 1.00 0.00 H new ATOM 0 HG2 ARG A 11 5.330 4.463 13.246 1.00 0.00 H new ATOM 0 HG3 ARG A 11 5.546 3.491 14.688 1.00 0.00 H new ATOM 0 HD2 ARG A 11 8.058 4.039 14.565 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.680 5.175 13.285 1.00 0.00 H new ATOM 0 HE ARG A 11 5.914 5.770 15.492 1.00 0.00 H new ATOM 0 HH11 ARG A 11 9.291 5.717 14.596 1.00 0.00 H new ATOM 0 HH12 ARG A 11 9.731 7.037 15.685 1.00 0.00 H new ATOM 0 HH21 ARG A 11 6.473 7.459 16.884 1.00 0.00 H new ATOM 0 HH22 ARG A 11 8.147 8.016 16.971 1.00 0.00 H new ATOM 156 N VAL A 12 5.415 0.945 10.221 1.00 0.00 N ATOM 157 CA VAL A 12 5.799 -0.109 9.235 1.00 0.00 C ATOM 158 C VAL A 12 6.415 0.545 7.998 1.00 0.00 C ATOM 159 O VAL A 12 5.997 1.602 7.568 1.00 0.00 O ATOM 160 CB VAL A 12 4.556 -0.907 8.835 1.00 0.00 C ATOM 161 CG1 VAL A 12 3.555 0.014 8.134 1.00 0.00 C ATOM 162 CG2 VAL A 12 4.960 -2.038 7.886 1.00 0.00 C ATOM 0 H VAL A 12 4.953 1.763 9.823 1.00 0.00 H new ATOM 0 HA VAL A 12 6.530 -0.780 9.685 1.00 0.00 H new ATOM 0 HB VAL A 12 4.094 -1.328 9.728 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.671 -0.558 7.851 1.00 0.00 H new ATOM 0 HG12 VAL A 12 3.265 0.818 8.810 1.00 0.00 H new ATOM 0 HG13 VAL A 12 4.014 0.438 7.241 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.075 -2.607 7.601 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.424 -1.616 6.994 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.669 -2.697 8.387 1.00 0.00 H new ATOM 172 N PHE A 13 7.410 -0.076 7.422 1.00 0.00 N ATOM 173 CA PHE A 13 8.060 0.503 6.211 1.00 0.00 C ATOM 174 C PHE A 13 8.386 -0.618 5.222 1.00 0.00 C ATOM 175 O PHE A 13 8.566 -1.757 5.601 1.00 0.00 O ATOM 176 CB PHE A 13 9.354 1.208 6.625 1.00 0.00 C ATOM 177 CG PHE A 13 10.331 0.189 7.159 1.00 0.00 C ATOM 178 CD1 PHE A 13 10.235 -0.242 8.486 1.00 0.00 C ATOM 179 CD2 PHE A 13 11.331 -0.327 6.327 1.00 0.00 C ATOM 180 CE1 PHE A 13 11.140 -1.188 8.983 1.00 0.00 C ATOM 181 CE2 PHE A 13 12.236 -1.273 6.821 1.00 0.00 C ATOM 182 CZ PHE A 13 12.141 -1.703 8.151 1.00 0.00 C ATOM 0 H PHE A 13 7.802 -0.963 7.740 1.00 0.00 H new ATOM 0 HA PHE A 13 7.386 1.218 5.739 1.00 0.00 H new ATOM 0 HB2 PHE A 13 9.786 1.730 5.771 1.00 0.00 H new ATOM 0 HB3 PHE A 13 9.144 1.960 7.385 1.00 0.00 H new ATOM 0 HD1 PHE A 13 9.462 0.155 9.128 1.00 0.00 H new ATOM 0 HD2 PHE A 13 11.404 0.005 5.302 1.00 0.00 H new ATOM 0 HE1 PHE A 13 11.066 -1.520 10.008 1.00 0.00 H new ATOM 0 HE2 PHE A 13 13.007 -1.671 6.178 1.00 0.00 H new ATOM 0 HZ PHE A 13 12.840 -2.432 8.534 1.00 0.00 H new ATOM 192 N PHE A 14 8.467 -0.300 3.957 1.00 0.00 N ATOM 193 CA PHE A 14 8.785 -1.342 2.938 1.00 0.00 C ATOM 194 C PHE A 14 9.961 -0.873 2.073 1.00 0.00 C ATOM 195 O PHE A 14 10.048 0.280 1.700 1.00 0.00 O ATOM 196 CB PHE A 14 7.557 -1.571 2.053 1.00 0.00 C ATOM 197 CG PHE A 14 6.420 -2.093 2.899 1.00 0.00 C ATOM 198 CD1 PHE A 14 6.271 -3.470 3.095 1.00 0.00 C ATOM 199 CD2 PHE A 14 5.521 -1.199 3.491 1.00 0.00 C ATOM 200 CE1 PHE A 14 5.220 -3.955 3.883 1.00 0.00 C ATOM 201 CE2 PHE A 14 4.469 -1.684 4.280 1.00 0.00 C ATOM 202 CZ PHE A 14 4.318 -3.061 4.475 1.00 0.00 C ATOM 0 H PHE A 14 8.326 0.639 3.585 1.00 0.00 H new ATOM 0 HA PHE A 14 9.055 -2.272 3.438 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.266 -0.639 1.568 1.00 0.00 H new ATOM 0 HB3 PHE A 14 7.793 -2.283 1.262 1.00 0.00 H new ATOM 0 HD1 PHE A 14 6.966 -4.159 2.639 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.638 -0.136 3.340 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.105 -5.018 4.034 1.00 0.00 H new ATOM 0 HE2 PHE A 14 3.775 -0.995 4.737 1.00 0.00 H new ATOM 0 HZ PHE A 14 3.506 -3.435 5.082 1.00 0.00 H new ATOM 212 N ASP A 15 10.859 -1.763 1.741 1.00 0.00 N ATOM 213 CA ASP A 15 12.020 -1.373 0.889 1.00 0.00 C ATOM 214 C ASP A 15 11.657 -1.603 -0.579 1.00 0.00 C ATOM 215 O ASP A 15 11.132 -2.639 -0.934 1.00 0.00 O ATOM 216 CB ASP A 15 13.235 -2.231 1.255 1.00 0.00 C ATOM 217 CG ASP A 15 13.677 -1.907 2.682 1.00 0.00 C ATOM 218 OD1 ASP A 15 13.224 -0.904 3.210 1.00 0.00 O ATOM 219 OD2 ASP A 15 14.461 -2.668 3.225 1.00 0.00 O ATOM 0 H ASP A 15 10.838 -2.743 2.023 1.00 0.00 H new ATOM 0 HA ASP A 15 12.260 -0.322 1.051 1.00 0.00 H new ATOM 0 HB2 ASP A 15 12.985 -3.289 1.172 1.00 0.00 H new ATOM 0 HB3 ASP A 15 14.051 -2.041 0.558 1.00 0.00 H new ATOM 224 N MET A 16 11.921 -0.650 -1.434 1.00 0.00 N ATOM 225 CA MET A 16 11.573 -0.825 -2.877 1.00 0.00 C ATOM 226 C MET A 16 12.811 -0.617 -3.749 1.00 0.00 C ATOM 227 O MET A 16 13.734 0.086 -3.385 1.00 0.00 O ATOM 228 CB MET A 16 10.501 0.192 -3.271 1.00 0.00 C ATOM 229 CG MET A 16 9.265 -0.008 -2.392 1.00 0.00 C ATOM 230 SD MET A 16 7.875 0.926 -3.077 1.00 0.00 S ATOM 231 CE MET A 16 7.416 -0.255 -4.370 1.00 0.00 C ATOM 0 H MET A 16 12.361 0.239 -1.198 1.00 0.00 H new ATOM 0 HA MET A 16 11.196 -1.837 -3.028 1.00 0.00 H new ATOM 0 HB2 MET A 16 10.885 1.205 -3.153 1.00 0.00 H new ATOM 0 HB3 MET A 16 10.237 0.071 -4.322 1.00 0.00 H new ATOM 0 HG2 MET A 16 9.013 -1.067 -2.337 1.00 0.00 H new ATOM 0 HG3 MET A 16 9.473 0.323 -1.374 1.00 0.00 H new ATOM 0 HE1 MET A 16 6.519 0.095 -4.881 1.00 0.00 H new ATOM 0 HE2 MET A 16 8.231 -0.343 -5.088 1.00 0.00 H new ATOM 0 HE3 MET A 16 7.221 -1.229 -3.921 1.00 0.00 H new ATOM 241 N SER A 17 12.830 -1.225 -4.905 1.00 0.00 N ATOM 242 CA SER A 17 13.995 -1.073 -5.821 1.00 0.00 C ATOM 243 C SER A 17 13.510 -1.186 -7.268 1.00 0.00 C ATOM 244 O SER A 17 12.405 -1.617 -7.525 1.00 0.00 O ATOM 245 CB SER A 17 15.010 -2.179 -5.536 1.00 0.00 C ATOM 246 OG SER A 17 14.492 -3.421 -5.993 1.00 0.00 O ATOM 0 H SER A 17 12.083 -1.824 -5.255 1.00 0.00 H new ATOM 0 HA SER A 17 14.464 -0.102 -5.665 1.00 0.00 H new ATOM 0 HB2 SER A 17 15.954 -1.960 -6.035 1.00 0.00 H new ATOM 0 HB3 SER A 17 15.219 -2.230 -4.467 1.00 0.00 H new ATOM 0 HG SER A 17 15.142 -4.132 -5.813 1.00 0.00 H new ATOM 252 N VAL A 18 14.327 -0.804 -8.216 1.00 0.00 N ATOM 253 CA VAL A 18 13.908 -0.892 -9.647 1.00 0.00 C ATOM 254 C VAL A 18 14.942 -1.697 -10.434 1.00 0.00 C ATOM 255 O VAL A 18 16.132 -1.487 -10.310 1.00 0.00 O ATOM 256 CB VAL A 18 13.811 0.518 -10.232 1.00 0.00 C ATOM 257 CG1 VAL A 18 12.822 1.346 -9.409 1.00 0.00 C ATOM 258 CG2 VAL A 18 15.188 1.182 -10.193 1.00 0.00 C ATOM 0 H VAL A 18 15.265 -0.435 -8.061 1.00 0.00 H new ATOM 0 HA VAL A 18 12.938 -1.385 -9.713 1.00 0.00 H new ATOM 0 HB VAL A 18 13.465 0.460 -11.264 1.00 0.00 H new ATOM 0 HG11 VAL A 18 12.753 2.351 -9.826 1.00 0.00 H new ATOM 0 HG12 VAL A 18 11.840 0.873 -9.437 1.00 0.00 H new ATOM 0 HG13 VAL A 18 13.167 1.405 -8.377 1.00 0.00 H new ATOM 0 HG21 VAL A 18 15.119 2.187 -10.610 1.00 0.00 H new ATOM 0 HG22 VAL A 18 15.535 1.240 -9.161 1.00 0.00 H new ATOM 0 HG23 VAL A 18 15.893 0.593 -10.780 1.00 0.00 H new ATOM 268 N GLY A 19 14.498 -2.616 -11.247 1.00 0.00 N ATOM 269 CA GLY A 19 15.454 -3.433 -12.047 1.00 0.00 C ATOM 270 C GLY A 19 16.471 -4.095 -11.114 1.00 0.00 C ATOM 271 O GLY A 19 17.513 -4.549 -11.541 1.00 0.00 O ATOM 0 H GLY A 19 13.513 -2.837 -11.392 1.00 0.00 H new ATOM 0 HA2 GLY A 19 14.914 -4.194 -12.611 1.00 0.00 H new ATOM 0 HA3 GLY A 19 15.968 -2.803 -12.773 1.00 0.00 H new ATOM 275 N GLY A 20 16.177 -4.153 -9.843 1.00 0.00 N ATOM 276 CA GLY A 20 17.129 -4.785 -8.883 1.00 0.00 C ATOM 277 C GLY A 20 18.057 -3.716 -8.304 1.00 0.00 C ATOM 278 O GLY A 20 18.971 -4.010 -7.559 1.00 0.00 O ATOM 0 H GLY A 20 15.319 -3.790 -9.427 1.00 0.00 H new ATOM 0 HA2 GLY A 20 16.579 -5.277 -8.081 1.00 0.00 H new ATOM 0 HA3 GLY A 20 17.714 -5.554 -9.388 1.00 0.00 H new ATOM 282 N GLN A 21 17.828 -2.475 -8.642 1.00 0.00 N ATOM 283 CA GLN A 21 18.690 -1.375 -8.116 1.00 0.00 C ATOM 284 C GLN A 21 17.920 -0.600 -7.038 1.00 0.00 C ATOM 285 O GLN A 21 16.956 0.078 -7.334 1.00 0.00 O ATOM 286 CB GLN A 21 19.044 -0.423 -9.261 1.00 0.00 C ATOM 287 CG GLN A 21 20.017 -1.114 -10.217 1.00 0.00 C ATOM 288 CD GLN A 21 20.308 -0.192 -11.404 1.00 0.00 C ATOM 289 OE1 GLN A 21 20.248 -0.613 -12.542 1.00 0.00 O ATOM 290 NE2 GLN A 21 20.622 1.054 -11.184 1.00 0.00 N ATOM 0 H GLN A 21 17.077 -2.174 -9.263 1.00 0.00 H new ATOM 0 HA GLN A 21 19.601 -1.794 -7.688 1.00 0.00 H new ATOM 0 HB2 GLN A 21 18.141 -0.128 -9.795 1.00 0.00 H new ATOM 0 HB3 GLN A 21 19.492 0.488 -8.865 1.00 0.00 H new ATOM 0 HG2 GLN A 21 20.943 -1.358 -9.697 1.00 0.00 H new ATOM 0 HG3 GLN A 21 19.592 -2.054 -10.569 1.00 0.00 H new ATOM 0 HE21 GLN A 21 20.672 1.406 -10.228 1.00 0.00 H new ATOM 0 HE22 GLN A 21 20.818 1.677 -11.968 1.00 0.00 H new ATOM 299 N PRO A 22 18.330 -0.693 -5.794 1.00 0.00 N ATOM 300 CA PRO A 22 17.646 0.022 -4.676 1.00 0.00 C ATOM 301 C PRO A 22 17.396 1.499 -5.001 1.00 0.00 C ATOM 302 O PRO A 22 18.259 2.188 -5.508 1.00 0.00 O ATOM 303 CB PRO A 22 18.625 -0.110 -3.506 1.00 0.00 C ATOM 304 CG PRO A 22 19.410 -1.348 -3.789 1.00 0.00 C ATOM 305 CD PRO A 22 19.479 -1.484 -5.313 1.00 0.00 C ATOM 0 HA PRO A 22 16.662 -0.398 -4.469 1.00 0.00 H new ATOM 0 HB2 PRO A 22 19.276 0.762 -3.437 1.00 0.00 H new ATOM 0 HB3 PRO A 22 18.095 -0.188 -2.557 1.00 0.00 H new ATOM 0 HG2 PRO A 22 20.410 -1.279 -3.361 1.00 0.00 H new ATOM 0 HG3 PRO A 22 18.932 -2.220 -3.343 1.00 0.00 H new ATOM 0 HD2 PRO A 22 20.420 -1.100 -5.706 1.00 0.00 H new ATOM 0 HD3 PRO A 22 19.405 -2.526 -5.625 1.00 0.00 H new ATOM 313 N ALA A 23 16.218 1.986 -4.711 1.00 0.00 N ATOM 314 CA ALA A 23 15.901 3.416 -4.998 1.00 0.00 C ATOM 315 C ALA A 23 15.913 4.212 -3.691 1.00 0.00 C ATOM 316 O ALA A 23 16.645 5.171 -3.544 1.00 0.00 O ATOM 317 CB ALA A 23 14.512 3.509 -5.638 1.00 0.00 C ATOM 0 H ALA A 23 15.459 1.453 -4.286 1.00 0.00 H new ATOM 0 HA ALA A 23 16.646 3.825 -5.680 1.00 0.00 H new ATOM 0 HB1 ALA A 23 14.278 4.552 -5.849 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.501 2.940 -6.567 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.768 3.101 -4.954 1.00 0.00 H new ATOM 323 N GLY A 24 15.106 3.825 -2.741 1.00 0.00 N ATOM 324 CA GLY A 24 15.069 4.560 -1.448 1.00 0.00 C ATOM 325 C GLY A 24 14.209 3.789 -0.445 1.00 0.00 C ATOM 326 O GLY A 24 13.797 2.675 -0.695 1.00 0.00 O ATOM 0 H GLY A 24 14.470 3.030 -2.806 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.080 4.682 -1.058 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.663 5.560 -1.598 1.00 0.00 H new ATOM 330 N ARG A 25 13.934 4.378 0.690 1.00 0.00 N ATOM 331 CA ARG A 25 13.099 3.688 1.718 1.00 0.00 C ATOM 332 C ARG A 25 11.782 4.445 1.893 1.00 0.00 C ATOM 333 O ARG A 25 11.740 5.658 1.824 1.00 0.00 O ATOM 334 CB ARG A 25 13.854 3.665 3.050 1.00 0.00 C ATOM 335 CG ARG A 25 13.072 2.834 4.069 1.00 0.00 C ATOM 336 CD ARG A 25 13.802 2.858 5.414 1.00 0.00 C ATOM 337 NE ARG A 25 13.103 1.959 6.375 1.00 0.00 N ATOM 338 CZ ARG A 25 13.588 1.782 7.573 1.00 0.00 C ATOM 339 NH1 ARG A 25 14.685 2.391 7.931 1.00 0.00 N ATOM 340 NH2 ARG A 25 12.975 0.995 8.414 1.00 0.00 N ATOM 0 H ARG A 25 14.253 5.311 0.950 1.00 0.00 H new ATOM 0 HA ARG A 25 12.892 2.667 1.397 1.00 0.00 H new ATOM 0 HB2 ARG A 25 14.849 3.243 2.908 1.00 0.00 H new ATOM 0 HB3 ARG A 25 13.989 4.681 3.421 1.00 0.00 H new ATOM 0 HG2 ARG A 25 12.064 3.233 4.183 1.00 0.00 H new ATOM 0 HG3 ARG A 25 12.971 1.808 3.716 1.00 0.00 H new ATOM 0 HD2 ARG A 25 14.835 2.537 5.285 1.00 0.00 H new ATOM 0 HD3 ARG A 25 13.831 3.875 5.806 1.00 0.00 H new ATOM 0 HE ARG A 25 12.246 1.482 6.096 1.00 0.00 H new ATOM 0 HH11 ARG A 25 15.164 3.006 7.274 1.00 0.00 H new ATOM 0 HH12 ARG A 25 15.063 2.252 8.868 1.00 0.00 H new ATOM 0 HH21 ARG A 25 12.117 0.519 8.134 1.00 0.00 H new ATOM 0 HH22 ARG A 25 13.353 0.856 9.351 1.00 0.00 H new ATOM 354 N ILE A 26 10.706 3.738 2.120 1.00 0.00 N ATOM 355 CA ILE A 26 9.388 4.405 2.305 1.00 0.00 C ATOM 356 C ILE A 26 8.850 4.067 3.691 1.00 0.00 C ATOM 357 O ILE A 26 8.775 2.916 4.069 1.00 0.00 O ATOM 358 CB ILE A 26 8.408 3.902 1.242 1.00 0.00 C ATOM 359 CG1 ILE A 26 8.970 4.210 -0.150 1.00 0.00 C ATOM 360 CG2 ILE A 26 7.058 4.601 1.418 1.00 0.00 C ATOM 361 CD1 ILE A 26 8.109 3.529 -1.215 1.00 0.00 C ATOM 0 H ILE A 26 10.686 2.720 2.185 1.00 0.00 H new ATOM 0 HA ILE A 26 9.504 5.484 2.207 1.00 0.00 H new ATOM 0 HB ILE A 26 8.272 2.826 1.350 1.00 0.00 H new ATOM 0 HG12 ILE A 26 8.987 5.287 -0.316 1.00 0.00 H new ATOM 0 HG13 ILE A 26 10.000 3.860 -0.223 1.00 0.00 H new ATOM 0 HG21 ILE A 26 6.361 4.242 0.661 1.00 0.00 H new ATOM 0 HG22 ILE A 26 6.661 4.382 2.409 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.189 5.678 1.310 1.00 0.00 H new ATOM 0 HD11 ILE A 26 8.511 3.750 -2.204 1.00 0.00 H new ATOM 0 HD12 ILE A 26 8.115 2.451 -1.053 1.00 0.00 H new ATOM 0 HD13 ILE A 26 7.086 3.900 -1.148 1.00 0.00 H new ATOM 373 N VAL A 27 8.477 5.059 4.452 1.00 0.00 N ATOM 374 CA VAL A 27 7.948 4.791 5.818 1.00 0.00 C ATOM 375 C VAL A 27 6.496 5.270 5.909 1.00 0.00 C ATOM 376 O VAL A 27 6.167 6.363 5.494 1.00 0.00 O ATOM 377 CB VAL A 27 8.794 5.544 6.846 1.00 0.00 C ATOM 378 CG1 VAL A 27 8.318 5.192 8.256 1.00 0.00 C ATOM 379 CG2 VAL A 27 10.262 5.142 6.687 1.00 0.00 C ATOM 0 H VAL A 27 8.516 6.043 4.187 1.00 0.00 H new ATOM 0 HA VAL A 27 7.991 3.721 6.020 1.00 0.00 H new ATOM 0 HB VAL A 27 8.691 6.617 6.687 1.00 0.00 H new ATOM 0 HG11 VAL A 27 8.921 5.729 8.988 1.00 0.00 H new ATOM 0 HG12 VAL A 27 7.272 5.477 8.369 1.00 0.00 H new ATOM 0 HG13 VAL A 27 8.421 4.119 8.418 1.00 0.00 H new ATOM 0 HG21 VAL A 27 10.867 5.677 7.419 1.00 0.00 H new ATOM 0 HG22 VAL A 27 10.365 4.069 6.847 1.00 0.00 H new ATOM 0 HG23 VAL A 27 10.601 5.393 5.682 1.00 0.00 H new ATOM 389 N MET A 28 5.628 4.458 6.453 1.00 0.00 N ATOM 390 CA MET A 28 4.196 4.857 6.583 1.00 0.00 C ATOM 391 C MET A 28 3.800 4.819 8.059 1.00 0.00 C ATOM 392 O MET A 28 4.341 4.056 8.834 1.00 0.00 O ATOM 393 CB MET A 28 3.324 3.883 5.790 1.00 0.00 C ATOM 394 CG MET A 28 3.639 4.020 4.298 1.00 0.00 C ATOM 395 SD MET A 28 2.512 2.978 3.341 1.00 0.00 S ATOM 396 CE MET A 28 3.036 1.388 4.028 1.00 0.00 C ATOM 0 H MET A 28 5.851 3.531 6.815 1.00 0.00 H new ATOM 0 HA MET A 28 4.055 5.865 6.193 1.00 0.00 H new ATOM 0 HB2 MET A 28 3.509 2.861 6.120 1.00 0.00 H new ATOM 0 HB3 MET A 28 2.269 4.091 5.971 1.00 0.00 H new ATOM 0 HG2 MET A 28 3.539 5.060 3.989 1.00 0.00 H new ATOM 0 HG3 MET A 28 4.672 3.728 4.106 1.00 0.00 H new ATOM 0 HE1 MET A 28 2.838 0.596 3.305 1.00 0.00 H new ATOM 0 HE2 MET A 28 4.103 1.420 4.248 1.00 0.00 H new ATOM 0 HE3 MET A 28 2.483 1.188 4.946 1.00 0.00 H new ATOM 406 N GLU A 29 2.868 5.642 8.458 1.00 0.00 N ATOM 407 CA GLU A 29 2.448 5.657 9.891 1.00 0.00 C ATOM 408 C GLU A 29 1.127 4.903 10.057 1.00 0.00 C ATOM 409 O GLU A 29 0.173 5.133 9.341 1.00 0.00 O ATOM 410 CB GLU A 29 2.265 7.107 10.346 1.00 0.00 C ATOM 411 CG GLU A 29 1.985 7.143 11.851 1.00 0.00 C ATOM 412 CD GLU A 29 1.703 8.582 12.283 1.00 0.00 C ATOM 413 OE1 GLU A 29 1.709 9.449 11.426 1.00 0.00 O ATOM 414 OE2 GLU A 29 1.485 8.792 13.465 1.00 0.00 O ATOM 0 H GLU A 29 2.379 6.304 7.855 1.00 0.00 H new ATOM 0 HA GLU A 29 3.214 5.172 10.496 1.00 0.00 H new ATOM 0 HB2 GLU A 29 3.160 7.686 10.119 1.00 0.00 H new ATOM 0 HB3 GLU A 29 1.441 7.568 9.802 1.00 0.00 H new ATOM 0 HG2 GLU A 29 1.132 6.507 12.088 1.00 0.00 H new ATOM 0 HG3 GLU A 29 2.840 6.748 12.400 1.00 0.00 H new ATOM 421 N LEU A 30 1.067 4.012 11.010 1.00 0.00 N ATOM 422 CA LEU A 30 -0.186 3.238 11.255 1.00 0.00 C ATOM 423 C LEU A 30 -0.807 3.707 12.573 1.00 0.00 C ATOM 424 O LEU A 30 -0.144 3.775 13.589 1.00 0.00 O ATOM 425 CB LEU A 30 0.149 1.743 11.361 1.00 0.00 C ATOM 426 CG LEU A 30 0.213 1.093 9.970 1.00 0.00 C ATOM 427 CD1 LEU A 30 -1.201 0.841 9.448 1.00 0.00 C ATOM 428 CD2 LEU A 30 0.972 2.004 8.996 1.00 0.00 C ATOM 0 H LEU A 30 1.840 3.785 11.636 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.885 3.397 10.434 1.00 0.00 H new ATOM 0 HB2 LEU A 30 1.104 1.616 11.870 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.604 1.240 11.967 1.00 0.00 H new ATOM 0 HG LEU A 30 0.740 0.142 10.049 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -1.148 0.380 8.462 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.728 0.175 10.132 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.737 1.787 9.378 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.011 1.534 8.014 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.459 2.962 8.919 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.986 2.164 9.363 1.00 0.00 H new ATOM 440 N PHE A 31 -2.077 4.021 12.574 1.00 0.00 N ATOM 441 CA PHE A 31 -2.727 4.471 13.840 1.00 0.00 C ATOM 442 C PHE A 31 -3.448 3.285 14.477 1.00 0.00 C ATOM 443 O PHE A 31 -4.355 2.715 13.904 1.00 0.00 O ATOM 444 CB PHE A 31 -3.737 5.579 13.534 1.00 0.00 C ATOM 445 CG PHE A 31 -3.005 6.799 13.030 1.00 0.00 C ATOM 446 CD1 PHE A 31 -2.466 7.717 13.939 1.00 0.00 C ATOM 447 CD2 PHE A 31 -2.866 7.012 11.654 1.00 0.00 C ATOM 448 CE1 PHE A 31 -1.788 8.849 13.470 1.00 0.00 C ATOM 449 CE2 PHE A 31 -2.187 8.142 11.187 1.00 0.00 C ATOM 450 CZ PHE A 31 -1.647 9.061 12.094 1.00 0.00 C ATOM 0 H PHE A 31 -2.688 3.986 11.758 1.00 0.00 H new ATOM 0 HA PHE A 31 -1.971 4.855 14.525 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -4.454 5.237 12.787 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -4.305 5.827 14.431 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -2.573 7.552 15.001 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -3.283 6.304 10.953 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.374 9.559 14.171 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -2.079 8.306 10.125 1.00 0.00 H new ATOM 0 HZ PHE A 31 -1.122 9.933 11.732 1.00 0.00 H new ATOM 460 N ALA A 32 -3.047 2.907 15.657 1.00 0.00 N ATOM 461 CA ALA A 32 -3.703 1.754 16.332 1.00 0.00 C ATOM 462 C ALA A 32 -5.021 2.203 16.962 1.00 0.00 C ATOM 463 O ALA A 32 -6.023 1.521 16.884 1.00 0.00 O ATOM 464 CB ALA A 32 -2.777 1.207 17.420 1.00 0.00 C ATOM 0 H ALA A 32 -2.293 3.347 16.184 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.904 0.974 15.597 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.256 0.363 17.915 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.840 0.879 16.969 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.574 1.989 18.152 1.00 0.00 H new ATOM 470 N ASP A 33 -5.026 3.342 17.601 1.00 0.00 N ATOM 471 CA ASP A 33 -6.279 3.825 18.250 1.00 0.00 C ATOM 472 C ASP A 33 -7.341 4.118 17.187 1.00 0.00 C ATOM 473 O ASP A 33 -8.461 3.653 17.272 1.00 0.00 O ATOM 474 CB ASP A 33 -5.984 5.102 19.039 1.00 0.00 C ATOM 475 CG ASP A 33 -7.210 5.487 19.867 1.00 0.00 C ATOM 476 OD1 ASP A 33 -8.158 4.720 19.876 1.00 0.00 O ATOM 477 OD2 ASP A 33 -7.180 6.542 20.479 1.00 0.00 O ATOM 0 H ASP A 33 -4.219 3.957 17.702 1.00 0.00 H new ATOM 0 HA ASP A 33 -6.652 3.054 18.924 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -5.125 4.948 19.692 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -5.724 5.911 18.357 1.00 0.00 H new ATOM 482 N THR A 34 -7.004 4.889 16.192 1.00 0.00 N ATOM 483 CA THR A 34 -7.998 5.211 15.129 1.00 0.00 C ATOM 484 C THR A 34 -8.317 3.952 14.323 1.00 0.00 C ATOM 485 O THR A 34 -9.454 3.688 13.989 1.00 0.00 O ATOM 486 CB THR A 34 -7.421 6.280 14.199 1.00 0.00 C ATOM 487 OG1 THR A 34 -7.025 7.409 14.966 1.00 0.00 O ATOM 488 CG2 THR A 34 -8.481 6.700 13.180 1.00 0.00 C ATOM 0 H THR A 34 -6.084 5.311 16.068 1.00 0.00 H new ATOM 0 HA THR A 34 -8.912 5.584 15.591 1.00 0.00 H new ATOM 0 HB THR A 34 -6.556 5.875 13.673 1.00 0.00 H new ATOM 0 HG1 THR A 34 -6.654 8.094 14.372 1.00 0.00 H new ATOM 0 HG21 THR A 34 -8.068 7.462 12.518 1.00 0.00 H new ATOM 0 HG22 THR A 34 -8.784 5.834 12.592 1.00 0.00 H new ATOM 0 HG23 THR A 34 -9.348 7.105 13.702 1.00 0.00 H new ATOM 496 N THR A 35 -7.316 3.175 14.006 1.00 0.00 N ATOM 497 CA THR A 35 -7.548 1.931 13.215 1.00 0.00 C ATOM 498 C THR A 35 -6.710 0.789 13.812 1.00 0.00 C ATOM 499 O THR A 35 -5.646 0.469 13.320 1.00 0.00 O ATOM 500 CB THR A 35 -7.142 2.188 11.755 1.00 0.00 C ATOM 501 OG1 THR A 35 -6.585 3.490 11.645 1.00 0.00 O ATOM 502 CG2 THR A 35 -8.376 2.085 10.852 1.00 0.00 C ATOM 0 H THR A 35 -6.344 3.349 14.262 1.00 0.00 H new ATOM 0 HA THR A 35 -8.601 1.650 13.249 1.00 0.00 H new ATOM 0 HB THR A 35 -6.405 1.446 11.447 1.00 0.00 H new ATOM 0 HG1 THR A 35 -6.044 3.547 10.830 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.086 2.268 9.817 1.00 0.00 H new ATOM 0 HG22 THR A 35 -8.807 1.088 10.937 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.114 2.827 11.158 1.00 0.00 H new ATOM 510 N PRO A 36 -7.183 0.186 14.872 1.00 0.00 N ATOM 511 CA PRO A 36 -6.462 -0.930 15.550 1.00 0.00 C ATOM 512 C PRO A 36 -6.459 -2.224 14.730 1.00 0.00 C ATOM 513 O PRO A 36 -5.428 -2.695 14.294 1.00 0.00 O ATOM 514 CB PRO A 36 -7.234 -1.133 16.860 1.00 0.00 C ATOM 515 CG PRO A 36 -8.600 -0.574 16.615 1.00 0.00 C ATOM 516 CD PRO A 36 -8.457 0.505 15.541 1.00 0.00 C ATOM 0 HA PRO A 36 -5.410 -0.685 15.695 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -7.285 -2.189 17.125 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -6.743 -0.620 17.687 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -9.283 -1.357 16.286 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -9.014 -0.153 17.531 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -9.291 0.481 14.840 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -8.437 1.503 15.980 1.00 0.00 H new ATOM 524 N ARG A 37 -7.606 -2.808 14.537 1.00 0.00 N ATOM 525 CA ARG A 37 -7.680 -4.081 13.768 1.00 0.00 C ATOM 526 C ARG A 37 -7.182 -3.877 12.333 1.00 0.00 C ATOM 527 O ARG A 37 -6.527 -4.732 11.772 1.00 0.00 O ATOM 528 CB ARG A 37 -9.131 -4.557 13.751 1.00 0.00 C ATOM 529 CG ARG A 37 -9.575 -4.837 15.187 1.00 0.00 C ATOM 530 CD ARG A 37 -11.054 -5.217 15.206 1.00 0.00 C ATOM 531 NE ARG A 37 -11.234 -6.556 14.579 1.00 0.00 N ATOM 532 CZ ARG A 37 -12.363 -7.196 14.717 1.00 0.00 C ATOM 533 NH1 ARG A 37 -13.335 -6.662 15.404 1.00 0.00 N ATOM 534 NH2 ARG A 37 -12.518 -8.370 14.168 1.00 0.00 N ATOM 0 H ARG A 37 -8.500 -2.458 14.880 1.00 0.00 H new ATOM 0 HA ARG A 37 -7.045 -4.828 14.244 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -9.771 -3.800 13.299 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -9.226 -5.458 13.144 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -8.977 -5.644 15.611 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -9.408 -3.956 15.807 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -11.423 -5.232 16.232 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -11.639 -4.471 14.668 1.00 0.00 H new ATOM 0 HE ARG A 37 -10.474 -6.973 14.041 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -13.212 -5.745 15.833 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -14.218 -7.162 15.512 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -11.757 -8.787 13.632 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -13.400 -8.871 14.275 1.00 0.00 H new ATOM 548 N THR A 38 -7.488 -2.761 11.729 1.00 0.00 N ATOM 549 CA THR A 38 -7.026 -2.531 10.329 1.00 0.00 C ATOM 550 C THR A 38 -5.495 -2.513 10.282 1.00 0.00 C ATOM 551 O THR A 38 -4.887 -3.080 9.397 1.00 0.00 O ATOM 552 CB THR A 38 -7.572 -1.196 9.821 1.00 0.00 C ATOM 553 OG1 THR A 38 -8.984 -1.172 9.984 1.00 0.00 O ATOM 554 CG2 THR A 38 -7.224 -1.029 8.341 1.00 0.00 C ATOM 0 H THR A 38 -8.034 -2.003 12.140 1.00 0.00 H new ATOM 0 HA THR A 38 -7.393 -3.337 9.694 1.00 0.00 H new ATOM 0 HB THR A 38 -7.126 -0.380 10.390 1.00 0.00 H new ATOM 0 HG1 THR A 38 -9.370 -0.491 9.394 1.00 0.00 H new ATOM 0 HG21 THR A 38 -7.614 -0.077 7.981 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.141 -1.048 8.217 1.00 0.00 H new ATOM 0 HG23 THR A 38 -7.669 -1.843 7.769 1.00 0.00 H new ATOM 562 N ALA A 39 -4.867 -1.872 11.231 1.00 0.00 N ATOM 563 CA ALA A 39 -3.376 -1.831 11.239 1.00 0.00 C ATOM 564 C ALA A 39 -2.846 -3.255 11.394 1.00 0.00 C ATOM 565 O ALA A 39 -1.790 -3.595 10.900 1.00 0.00 O ATOM 566 CB ALA A 39 -2.895 -0.977 12.414 1.00 0.00 C ATOM 0 H ALA A 39 -5.320 -1.376 11.999 1.00 0.00 H new ATOM 0 HA ALA A 39 -3.011 -1.398 10.308 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -1.805 -0.947 12.420 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -3.285 0.036 12.312 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.251 -1.410 13.349 1.00 0.00 H new ATOM 572 N GLU A 40 -3.579 -4.091 12.076 1.00 0.00 N ATOM 573 CA GLU A 40 -3.130 -5.496 12.265 1.00 0.00 C ATOM 574 C GLU A 40 -3.112 -6.212 10.914 1.00 0.00 C ATOM 575 O GLU A 40 -2.259 -7.034 10.647 1.00 0.00 O ATOM 576 CB GLU A 40 -4.093 -6.216 13.212 1.00 0.00 C ATOM 577 CG GLU A 40 -3.554 -7.613 13.529 1.00 0.00 C ATOM 578 CD GLU A 40 -4.563 -8.365 14.400 1.00 0.00 C ATOM 579 OE1 GLU A 40 -5.604 -7.800 14.686 1.00 0.00 O ATOM 580 OE2 GLU A 40 -4.275 -9.492 14.764 1.00 0.00 O ATOM 0 H GLU A 40 -4.472 -3.859 12.511 1.00 0.00 H new ATOM 0 HA GLU A 40 -2.127 -5.503 12.692 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.210 -5.643 14.132 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.080 -6.291 12.755 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -3.374 -8.163 12.605 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -2.597 -7.536 14.046 1.00 0.00 H new ATOM 587 N ASN A 41 -4.050 -5.906 10.060 1.00 0.00 N ATOM 588 CA ASN A 41 -4.089 -6.573 8.728 1.00 0.00 C ATOM 589 C ASN A 41 -2.775 -6.309 7.988 1.00 0.00 C ATOM 590 O ASN A 41 -2.206 -7.195 7.381 1.00 0.00 O ATOM 591 CB ASN A 41 -5.252 -6.006 7.911 1.00 0.00 C ATOM 592 CG ASN A 41 -5.502 -6.895 6.691 1.00 0.00 C ATOM 593 OD1 ASN A 41 -4.791 -7.856 6.471 1.00 0.00 O ATOM 594 ND2 ASN A 41 -6.488 -6.613 5.885 1.00 0.00 N ATOM 0 H ASN A 41 -4.790 -5.224 10.227 1.00 0.00 H new ATOM 0 HA ASN A 41 -4.224 -7.646 8.862 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -6.150 -5.954 8.526 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -5.024 -4.989 7.592 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -6.663 -7.199 5.069 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -7.084 -5.806 6.071 1.00 0.00 H new ATOM 601 N PHE A 42 -2.288 -5.100 8.037 1.00 0.00 N ATOM 602 CA PHE A 42 -1.009 -4.784 7.337 1.00 0.00 C ATOM 603 C PHE A 42 0.171 -5.237 8.195 1.00 0.00 C ATOM 604 O PHE A 42 1.108 -5.840 7.712 1.00 0.00 O ATOM 605 CB PHE A 42 -0.917 -3.276 7.096 1.00 0.00 C ATOM 606 CG PHE A 42 -1.944 -2.866 6.069 1.00 0.00 C ATOM 607 CD1 PHE A 42 -1.642 -2.959 4.705 1.00 0.00 C ATOM 608 CD2 PHE A 42 -3.195 -2.394 6.479 1.00 0.00 C ATOM 609 CE1 PHE A 42 -2.592 -2.578 3.750 1.00 0.00 C ATOM 610 CE2 PHE A 42 -4.146 -2.013 5.524 1.00 0.00 C ATOM 611 CZ PHE A 42 -3.845 -2.106 4.161 1.00 0.00 C ATOM 0 H PHE A 42 -2.719 -4.318 8.530 1.00 0.00 H new ATOM 0 HA PHE A 42 -0.982 -5.307 6.381 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -1.085 -2.737 8.029 1.00 0.00 H new ATOM 0 HB3 PHE A 42 0.083 -3.013 6.751 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -0.676 -3.325 4.390 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -3.428 -2.323 7.531 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -2.359 -2.648 2.698 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -5.112 -1.647 5.840 1.00 0.00 H new ATOM 0 HZ PHE A 42 -4.579 -1.814 3.425 1.00 0.00 H new ATOM 621 N ARG A 43 0.136 -4.946 9.467 1.00 0.00 N ATOM 622 CA ARG A 43 1.260 -5.357 10.352 1.00 0.00 C ATOM 623 C ARG A 43 1.446 -6.875 10.272 1.00 0.00 C ATOM 624 O ARG A 43 2.552 -7.373 10.204 1.00 0.00 O ATOM 625 CB ARG A 43 0.940 -4.961 11.794 1.00 0.00 C ATOM 626 CG ARG A 43 2.142 -5.264 12.691 1.00 0.00 C ATOM 627 CD ARG A 43 1.811 -4.873 14.132 1.00 0.00 C ATOM 628 NE ARG A 43 0.772 -5.795 14.670 1.00 0.00 N ATOM 629 CZ ARG A 43 0.103 -5.469 15.744 1.00 0.00 C ATOM 630 NH1 ARG A 43 0.342 -4.335 16.343 1.00 0.00 N ATOM 631 NH2 ARG A 43 -0.806 -6.279 16.217 1.00 0.00 N ATOM 0 H ARG A 43 -0.621 -4.443 9.930 1.00 0.00 H new ATOM 0 HA ARG A 43 2.176 -4.861 10.030 1.00 0.00 H new ATOM 0 HB2 ARG A 43 0.695 -3.900 11.844 1.00 0.00 H new ATOM 0 HB3 ARG A 43 0.065 -5.507 12.146 1.00 0.00 H new ATOM 0 HG2 ARG A 43 2.391 -6.324 12.638 1.00 0.00 H new ATOM 0 HG3 ARG A 43 3.016 -4.713 12.345 1.00 0.00 H new ATOM 0 HD2 ARG A 43 2.709 -4.920 14.748 1.00 0.00 H new ATOM 0 HD3 ARG A 43 1.453 -3.844 14.168 1.00 0.00 H new ATOM 0 HE ARG A 43 0.583 -6.680 14.200 1.00 0.00 H new ATOM 0 HH11 ARG A 43 1.051 -3.702 15.973 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -0.181 -4.081 17.181 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -0.993 -7.165 15.748 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -1.329 -6.025 17.055 1.00 0.00 H new ATOM 645 N ALA A 44 0.369 -7.614 10.277 1.00 0.00 N ATOM 646 CA ALA A 44 0.477 -9.098 10.201 1.00 0.00 C ATOM 647 C ALA A 44 0.992 -9.503 8.819 1.00 0.00 C ATOM 648 O ALA A 44 1.742 -10.447 8.676 1.00 0.00 O ATOM 649 CB ALA A 44 -0.899 -9.726 10.435 1.00 0.00 C ATOM 0 H ALA A 44 -0.583 -7.252 10.331 1.00 0.00 H new ATOM 0 HA ALA A 44 1.170 -9.449 10.965 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -0.818 -10.812 10.379 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -1.267 -9.440 11.420 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -1.594 -9.374 9.672 1.00 0.00 H new ATOM 655 N LEU A 45 0.589 -8.800 7.797 1.00 0.00 N ATOM 656 CA LEU A 45 1.051 -9.150 6.425 1.00 0.00 C ATOM 657 C LEU A 45 2.577 -9.047 6.357 1.00 0.00 C ATOM 658 O LEU A 45 3.230 -9.821 5.685 1.00 0.00 O ATOM 659 CB LEU A 45 0.413 -8.190 5.413 1.00 0.00 C ATOM 660 CG LEU A 45 0.807 -8.593 3.986 1.00 0.00 C ATOM 661 CD1 LEU A 45 0.303 -10.009 3.681 1.00 0.00 C ATOM 662 CD2 LEU A 45 0.186 -7.605 2.986 1.00 0.00 C ATOM 0 H LEU A 45 -0.040 -7.999 7.853 1.00 0.00 H new ATOM 0 HA LEU A 45 0.753 -10.171 6.186 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.672 -8.207 5.518 1.00 0.00 H new ATOM 0 HB3 LEU A 45 0.737 -7.169 5.614 1.00 0.00 H new ATOM 0 HG LEU A 45 1.893 -8.574 3.898 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.588 -10.286 2.666 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.745 -10.712 4.386 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.783 -10.037 3.774 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.465 -7.890 1.972 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.900 -7.624 3.082 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.551 -6.599 3.194 1.00 0.00 H new ATOM 674 N CYS A 46 3.151 -8.096 7.043 1.00 0.00 N ATOM 675 CA CYS A 46 4.636 -7.948 7.011 1.00 0.00 C ATOM 676 C CYS A 46 5.299 -9.162 7.666 1.00 0.00 C ATOM 677 O CYS A 46 6.073 -9.864 7.047 1.00 0.00 O ATOM 678 CB CYS A 46 5.034 -6.681 7.771 1.00 0.00 C ATOM 679 SG CYS A 46 4.491 -5.226 6.842 1.00 0.00 S ATOM 0 H CYS A 46 2.658 -7.417 7.623 1.00 0.00 H new ATOM 0 HA CYS A 46 4.966 -7.878 5.975 1.00 0.00 H new ATOM 0 HB2 CYS A 46 4.582 -6.682 8.763 1.00 0.00 H new ATOM 0 HB3 CYS A 46 6.114 -6.653 7.913 1.00 0.00 H new ATOM 0 HG CYS A 46 5.290 -5.031 5.835 1.00 0.00 H new ATOM 685 N THR A 47 5.011 -9.413 8.915 1.00 0.00 N ATOM 686 CA THR A 47 5.635 -10.581 9.600 1.00 0.00 C ATOM 687 C THR A 47 4.980 -11.879 9.122 1.00 0.00 C ATOM 688 O THR A 47 5.637 -12.884 8.940 1.00 0.00 O ATOM 689 CB THR A 47 5.445 -10.442 11.112 1.00 0.00 C ATOM 690 OG1 THR A 47 4.060 -10.522 11.422 1.00 0.00 O ATOM 691 CG2 THR A 47 5.996 -9.093 11.578 1.00 0.00 C ATOM 0 H THR A 47 4.373 -8.862 9.489 1.00 0.00 H new ATOM 0 HA THR A 47 6.699 -10.610 9.363 1.00 0.00 H new ATOM 0 HB THR A 47 5.980 -11.244 11.620 1.00 0.00 H new ATOM 0 HG1 THR A 47 3.899 -10.128 12.305 1.00 0.00 H new ATOM 0 HG21 THR A 47 5.859 -8.997 12.655 1.00 0.00 H new ATOM 0 HG22 THR A 47 7.058 -9.032 11.340 1.00 0.00 H new ATOM 0 HG23 THR A 47 5.464 -8.288 11.071 1.00 0.00 H new ATOM 699 N GLY A 48 3.692 -11.867 8.921 1.00 0.00 N ATOM 700 CA GLY A 48 2.998 -13.101 8.459 1.00 0.00 C ATOM 701 C GLY A 48 2.946 -14.110 9.610 1.00 0.00 C ATOM 702 O GLY A 48 2.552 -15.246 9.438 1.00 0.00 O ATOM 0 H GLY A 48 3.089 -11.055 9.057 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.989 -12.861 8.124 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.524 -13.531 7.606 1.00 0.00 H new ATOM 706 N GLU A 49 3.351 -13.700 10.780 1.00 0.00 N ATOM 707 CA GLU A 49 3.336 -14.627 11.949 1.00 0.00 C ATOM 708 C GLU A 49 1.896 -14.864 12.412 1.00 0.00 C ATOM 709 O GLU A 49 1.616 -15.792 13.144 1.00 0.00 O ATOM 710 CB GLU A 49 4.151 -14.012 13.092 1.00 0.00 C ATOM 711 CG GLU A 49 3.405 -12.806 13.673 1.00 0.00 C ATOM 712 CD GLU A 49 4.305 -12.090 14.682 1.00 0.00 C ATOM 713 OE1 GLU A 49 5.384 -12.594 14.947 1.00 0.00 O ATOM 714 OE2 GLU A 49 3.900 -11.048 15.173 1.00 0.00 O ATOM 0 H GLU A 49 3.693 -12.760 10.979 1.00 0.00 H new ATOM 0 HA GLU A 49 3.775 -15.581 11.658 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.321 -14.756 13.871 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.131 -13.704 12.727 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.119 -12.122 12.874 1.00 0.00 H new ATOM 0 HG3 GLU A 49 2.485 -13.132 14.157 1.00 0.00 H new ATOM 721 N LYS A 50 0.983 -14.027 12.004 1.00 0.00 N ATOM 722 CA LYS A 50 -0.432 -14.205 12.437 1.00 0.00 C ATOM 723 C LYS A 50 -0.918 -15.605 12.053 1.00 0.00 C ATOM 724 O LYS A 50 -1.638 -16.242 12.794 1.00 0.00 O ATOM 725 CB LYS A 50 -1.309 -13.148 11.754 1.00 0.00 C ATOM 726 CG LYS A 50 -2.740 -13.214 12.305 1.00 0.00 C ATOM 727 CD LYS A 50 -2.810 -12.511 13.666 1.00 0.00 C ATOM 728 CE LYS A 50 -4.265 -12.443 14.132 1.00 0.00 C ATOM 729 NZ LYS A 50 -4.306 -12.087 15.579 1.00 0.00 N ATOM 0 H LYS A 50 1.154 -13.230 11.391 1.00 0.00 H new ATOM 0 HA LYS A 50 -0.498 -14.089 13.519 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -0.892 -12.155 11.921 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -1.318 -13.313 10.677 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -3.430 -12.741 11.606 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -3.052 -14.253 12.407 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -2.208 -13.051 14.397 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -2.394 -11.506 13.590 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -4.811 -11.702 13.548 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -4.756 -13.402 13.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -5.166 -12.483 16.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -3.468 -12.477 16.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -4.312 -11.052 15.682 1.00 0.00 H new ATOM 743 N GLY A 51 -0.532 -16.093 10.906 1.00 0.00 N ATOM 744 CA GLY A 51 -0.982 -17.452 10.494 1.00 0.00 C ATOM 745 C GLY A 51 -0.545 -17.735 9.055 1.00 0.00 C ATOM 746 O GLY A 51 0.178 -16.967 8.453 1.00 0.00 O ATOM 0 H GLY A 51 0.072 -15.612 10.240 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -0.562 -18.202 11.164 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -2.067 -17.525 10.574 1.00 0.00 H new ATOM 750 N THR A 52 -0.985 -18.836 8.506 1.00 0.00 N ATOM 751 CA THR A 52 -0.611 -19.194 7.104 1.00 0.00 C ATOM 752 C THR A 52 -1.880 -19.321 6.260 1.00 0.00 C ATOM 753 O THR A 52 -2.913 -19.743 6.742 1.00 0.00 O ATOM 754 CB THR A 52 0.139 -20.528 7.102 1.00 0.00 C ATOM 755 OG1 THR A 52 1.279 -20.430 7.944 1.00 0.00 O ATOM 756 CG2 THR A 52 0.579 -20.870 5.676 1.00 0.00 C ATOM 0 H THR A 52 -1.593 -19.509 8.972 1.00 0.00 H new ATOM 0 HA THR A 52 0.030 -18.417 6.686 1.00 0.00 H new ATOM 0 HB THR A 52 -0.519 -21.315 7.472 1.00 0.00 H new ATOM 0 HG1 THR A 52 1.759 -21.284 7.945 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.113 -21.820 5.678 1.00 0.00 H new ATOM 0 HG22 THR A 52 -0.298 -20.948 5.033 1.00 0.00 H new ATOM 0 HG23 THR A 52 1.236 -20.086 5.300 1.00 0.00 H new ATOM 764 N GLY A 53 -1.810 -18.955 5.005 1.00 0.00 N ATOM 765 CA GLY A 53 -3.008 -19.045 4.115 1.00 0.00 C ATOM 766 C GLY A 53 -3.911 -20.205 4.546 1.00 0.00 C ATOM 767 O GLY A 53 -4.963 -19.999 5.119 1.00 0.00 O ATOM 0 H GLY A 53 -0.968 -18.595 4.555 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -3.566 -18.109 4.151 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -2.691 -19.188 3.082 1.00 0.00 H new ATOM 771 N ARG A 54 -3.515 -21.423 4.279 1.00 0.00 N ATOM 772 CA ARG A 54 -4.357 -22.585 4.677 1.00 0.00 C ATOM 773 C ARG A 54 -3.463 -23.711 5.203 1.00 0.00 C ATOM 774 O ARG A 54 -2.851 -23.595 6.247 1.00 0.00 O ATOM 775 CB ARG A 54 -5.146 -23.079 3.461 1.00 0.00 C ATOM 776 CG ARG A 54 -6.118 -21.989 3.006 1.00 0.00 C ATOM 777 CD ARG A 54 -6.979 -22.518 1.858 1.00 0.00 C ATOM 778 NE ARG A 54 -7.774 -21.400 1.279 1.00 0.00 N ATOM 779 CZ ARG A 54 -8.250 -21.496 0.066 1.00 0.00 C ATOM 780 NH1 ARG A 54 -8.027 -22.572 -0.638 1.00 0.00 N ATOM 781 NH2 ARG A 54 -8.947 -20.517 -0.441 1.00 0.00 N ATOM 0 H ARG A 54 -2.645 -21.661 3.803 1.00 0.00 H new ATOM 0 HA ARG A 54 -5.050 -22.281 5.462 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -4.463 -23.334 2.650 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -5.694 -23.987 3.714 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -6.752 -21.682 3.838 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -5.566 -21.106 2.683 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -6.347 -22.964 1.091 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -7.644 -23.302 2.219 1.00 0.00 H new ATOM 0 HE ARG A 54 -7.947 -20.559 1.830 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -7.482 -23.337 -0.241 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -8.398 -22.648 -1.585 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -9.121 -19.676 0.110 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -9.318 -20.592 -1.388 1.00 0.00 H new ATOM 795 N SER A 55 -3.392 -24.802 4.494 1.00 0.00 N ATOM 796 CA SER A 55 -2.549 -25.945 4.952 1.00 0.00 C ATOM 797 C SER A 55 -1.107 -25.758 4.478 1.00 0.00 C ATOM 798 O SER A 55 -0.180 -26.296 5.051 1.00 0.00 O ATOM 799 CB SER A 55 -3.105 -27.248 4.377 1.00 0.00 C ATOM 800 OG SER A 55 -2.877 -27.278 2.974 1.00 0.00 O ATOM 0 H SER A 55 -3.883 -24.954 3.613 1.00 0.00 H new ATOM 0 HA SER A 55 -2.565 -25.984 6.041 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.625 -28.103 4.853 1.00 0.00 H new ATOM 0 HB3 SER A 55 -4.172 -27.325 4.585 1.00 0.00 H new ATOM 0 HG SER A 55 -3.231 -28.113 2.603 1.00 0.00 H new ATOM 806 N GLY A 56 -0.907 -25.003 3.435 1.00 0.00 N ATOM 807 CA GLY A 56 0.477 -24.787 2.925 1.00 0.00 C ATOM 808 C GLY A 56 0.486 -23.592 1.975 1.00 0.00 C ATOM 809 O GLY A 56 0.228 -23.722 0.794 1.00 0.00 O ATOM 0 H GLY A 56 -1.642 -24.526 2.913 1.00 0.00 H new ATOM 0 HA2 GLY A 56 1.159 -24.610 3.756 1.00 0.00 H new ATOM 0 HA3 GLY A 56 0.829 -25.679 2.408 1.00 0.00 H new ATOM 813 N LYS A 57 0.778 -22.430 2.483 1.00 0.00 N ATOM 814 CA LYS A 57 0.805 -21.217 1.621 1.00 0.00 C ATOM 815 C LYS A 57 1.310 -20.039 2.452 1.00 0.00 C ATOM 816 O LYS A 57 0.546 -19.189 2.866 1.00 0.00 O ATOM 817 CB LYS A 57 -0.607 -20.913 1.114 1.00 0.00 C ATOM 818 CG LYS A 57 -0.540 -19.842 0.021 1.00 0.00 C ATOM 819 CD LYS A 57 -1.934 -19.249 -0.200 1.00 0.00 C ATOM 820 CE LYS A 57 -2.927 -20.372 -0.499 1.00 0.00 C ATOM 821 NZ LYS A 57 -2.313 -21.339 -1.452 1.00 0.00 N ATOM 0 H LYS A 57 1.001 -22.266 3.465 1.00 0.00 H new ATOM 0 HA LYS A 57 1.462 -21.384 0.768 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -1.066 -21.820 0.721 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -1.234 -20.569 1.937 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.159 -19.057 0.309 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -0.167 -20.277 -0.906 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -2.250 -18.697 0.685 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -1.912 -18.540 -1.027 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -3.205 -20.881 0.424 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -3.842 -19.959 -0.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -3.056 -21.760 -2.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -1.627 -20.843 -2.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -1.828 -22.090 -0.920 1.00 0.00 H new ATOM 835 N PRO A 58 2.588 -20.000 2.704 1.00 0.00 N ATOM 836 CA PRO A 58 3.213 -18.915 3.513 1.00 0.00 C ATOM 837 C PRO A 58 2.755 -17.528 3.058 1.00 0.00 C ATOM 838 O PRO A 58 2.795 -17.202 1.888 1.00 0.00 O ATOM 839 CB PRO A 58 4.711 -19.110 3.270 1.00 0.00 C ATOM 840 CG PRO A 58 4.860 -20.566 2.969 1.00 0.00 C ATOM 841 CD PRO A 58 3.582 -20.983 2.245 1.00 0.00 C ATOM 0 HA PRO A 58 2.938 -18.969 4.566 1.00 0.00 H new ATOM 0 HB2 PRO A 58 5.061 -18.496 2.440 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.295 -18.825 4.145 1.00 0.00 H new ATOM 0 HG2 PRO A 58 5.737 -20.747 2.347 1.00 0.00 H new ATOM 0 HG3 PRO A 58 4.994 -21.141 3.885 1.00 0.00 H new ATOM 0 HD2 PRO A 58 3.706 -20.952 1.163 1.00 0.00 H new ATOM 0 HD3 PRO A 58 3.289 -22.000 2.503 1.00 0.00 H new ATOM 849 N LEU A 59 2.309 -16.716 3.978 1.00 0.00 N ATOM 850 CA LEU A 59 1.831 -15.352 3.613 1.00 0.00 C ATOM 851 C LEU A 59 2.863 -14.316 4.064 1.00 0.00 C ATOM 852 O LEU A 59 3.172 -14.204 5.235 1.00 0.00 O ATOM 853 CB LEU A 59 0.500 -15.097 4.328 1.00 0.00 C ATOM 854 CG LEU A 59 -0.155 -13.818 3.795 1.00 0.00 C ATOM 855 CD1 LEU A 59 -0.876 -14.115 2.476 1.00 0.00 C ATOM 856 CD2 LEU A 59 -1.171 -13.310 4.820 1.00 0.00 C ATOM 0 H LEU A 59 2.255 -16.940 4.972 1.00 0.00 H new ATOM 0 HA LEU A 59 1.695 -15.275 2.534 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.169 -15.945 4.179 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.668 -15.008 5.401 1.00 0.00 H new ATOM 0 HG LEU A 59 0.612 -13.063 3.625 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.340 -13.203 2.101 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -0.158 -14.484 1.744 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -1.644 -14.870 2.643 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.641 -12.400 4.447 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.934 -14.071 4.984 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.663 -13.097 5.761 1.00 0.00 H new ATOM 868 N HIS A 60 3.401 -13.558 3.148 1.00 0.00 N ATOM 869 CA HIS A 60 4.412 -12.532 3.529 1.00 0.00 C ATOM 870 C HIS A 60 4.349 -11.356 2.550 1.00 0.00 C ATOM 871 O HIS A 60 4.190 -11.536 1.359 1.00 0.00 O ATOM 872 CB HIS A 60 5.810 -13.152 3.489 1.00 0.00 C ATOM 873 CG HIS A 60 5.943 -14.163 4.594 1.00 0.00 C ATOM 874 ND1 HIS A 60 5.644 -15.506 4.411 1.00 0.00 N ATOM 875 CD2 HIS A 60 6.342 -14.042 5.904 1.00 0.00 C ATOM 876 CE1 HIS A 60 5.866 -16.134 5.580 1.00 0.00 C ATOM 877 NE2 HIS A 60 6.291 -15.287 6.519 1.00 0.00 N ATOM 0 H HIS A 60 3.184 -13.605 2.152 1.00 0.00 H new ATOM 0 HA HIS A 60 4.200 -12.175 4.537 1.00 0.00 H new ATOM 0 HB2 HIS A 60 5.980 -13.628 2.524 1.00 0.00 H new ATOM 0 HB3 HIS A 60 6.567 -12.375 3.599 1.00 0.00 H new ATOM 0 HD2 HIS A 60 6.648 -13.122 6.381 1.00 0.00 H new ATOM 0 HE1 HIS A 60 5.719 -17.192 5.738 1.00 0.00 H new ATOM 0 HE2 HIS A 60 6.529 -15.507 7.486 1.00 0.00 H new ATOM 886 N TYR A 61 4.485 -10.157 3.044 1.00 0.00 N ATOM 887 CA TYR A 61 4.446 -8.969 2.142 1.00 0.00 C ATOM 888 C TYR A 61 5.614 -9.066 1.156 1.00 0.00 C ATOM 889 O TYR A 61 5.507 -8.688 0.006 1.00 0.00 O ATOM 890 CB TYR A 61 4.585 -7.695 2.982 1.00 0.00 C ATOM 891 CG TYR A 61 3.959 -6.526 2.255 1.00 0.00 C ATOM 892 CD1 TYR A 61 4.542 -6.028 1.083 1.00 0.00 C ATOM 893 CD2 TYR A 61 2.793 -5.939 2.760 1.00 0.00 C ATOM 894 CE1 TYR A 61 3.954 -4.945 0.417 1.00 0.00 C ATOM 895 CE2 TYR A 61 2.207 -4.858 2.096 1.00 0.00 C ATOM 896 CZ TYR A 61 2.786 -4.360 0.923 1.00 0.00 C ATOM 897 OH TYR A 61 2.209 -3.293 0.266 1.00 0.00 O ATOM 0 H TYR A 61 4.621 -9.947 4.033 1.00 0.00 H new ATOM 0 HA TYR A 61 3.503 -8.939 1.596 1.00 0.00 H new ATOM 0 HB2 TYR A 61 4.102 -7.833 3.950 1.00 0.00 H new ATOM 0 HB3 TYR A 61 5.638 -7.491 3.177 1.00 0.00 H new ATOM 0 HD1 TYR A 61 5.443 -6.478 0.693 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.345 -6.322 3.665 1.00 0.00 H new ATOM 0 HE1 TYR A 61 4.402 -4.561 -0.488 1.00 0.00 H new ATOM 0 HE2 TYR A 61 1.307 -4.407 2.488 1.00 0.00 H new ATOM 0 HH TYR A 61 1.405 -3.008 0.749 1.00 0.00 H new ATOM 907 N LYS A 62 6.729 -9.574 1.606 1.00 0.00 N ATOM 908 CA LYS A 62 7.916 -9.704 0.716 1.00 0.00 C ATOM 909 C LYS A 62 7.515 -10.394 -0.587 1.00 0.00 C ATOM 910 O LYS A 62 6.577 -11.163 -0.631 1.00 0.00 O ATOM 911 CB LYS A 62 8.988 -10.537 1.425 1.00 0.00 C ATOM 912 CG LYS A 62 10.260 -10.568 0.583 1.00 0.00 C ATOM 913 CD LYS A 62 11.307 -11.435 1.288 1.00 0.00 C ATOM 914 CE LYS A 62 12.703 -10.939 0.929 1.00 0.00 C ATOM 915 NZ LYS A 62 12.921 -11.081 -0.539 1.00 0.00 N ATOM 0 H LYS A 62 6.869 -9.907 2.560 1.00 0.00 H new ATOM 0 HA LYS A 62 8.308 -8.713 0.489 1.00 0.00 H new ATOM 0 HB2 LYS A 62 9.201 -10.113 2.406 1.00 0.00 H new ATOM 0 HB3 LYS A 62 8.624 -11.551 1.588 1.00 0.00 H new ATOM 0 HG2 LYS A 62 10.045 -10.969 -0.408 1.00 0.00 H new ATOM 0 HG3 LYS A 62 10.642 -9.557 0.442 1.00 0.00 H new ATOM 0 HD2 LYS A 62 11.161 -11.394 2.367 1.00 0.00 H new ATOM 0 HD3 LYS A 62 11.192 -12.477 0.990 1.00 0.00 H new ATOM 0 HE2 LYS A 62 12.817 -9.896 1.225 1.00 0.00 H new ATOM 0 HE3 LYS A 62 13.454 -11.509 1.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 13.931 -10.955 -0.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 12.617 -12.027 -0.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 12.367 -10.360 -1.044 1.00 0.00 H new ATOM 929 N ASP A 63 8.222 -10.114 -1.649 1.00 0.00 N ATOM 930 CA ASP A 63 7.898 -10.740 -2.965 1.00 0.00 C ATOM 931 C ASP A 63 6.596 -10.148 -3.505 1.00 0.00 C ATOM 932 O ASP A 63 5.750 -10.851 -4.021 1.00 0.00 O ATOM 933 CB ASP A 63 7.747 -12.256 -2.800 1.00 0.00 C ATOM 934 CG ASP A 63 7.868 -12.936 -4.166 1.00 0.00 C ATOM 935 OD1 ASP A 63 8.081 -12.231 -5.140 1.00 0.00 O ATOM 936 OD2 ASP A 63 7.745 -14.147 -4.216 1.00 0.00 O ATOM 0 H ASP A 63 9.016 -9.474 -1.662 1.00 0.00 H new ATOM 0 HA ASP A 63 8.707 -10.538 -3.667 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.513 -12.636 -2.124 1.00 0.00 H new ATOM 0 HB3 ASP A 63 6.781 -12.489 -2.351 1.00 0.00 H new ATOM 941 N SER A 64 6.440 -8.855 -3.399 1.00 0.00 N ATOM 942 CA SER A 64 5.203 -8.196 -3.911 1.00 0.00 C ATOM 943 C SER A 64 5.594 -7.192 -4.996 1.00 0.00 C ATOM 944 O SER A 64 6.691 -6.671 -5.002 1.00 0.00 O ATOM 945 CB SER A 64 4.501 -7.464 -2.766 1.00 0.00 C ATOM 946 OG SER A 64 5.351 -6.439 -2.271 1.00 0.00 O ATOM 0 H SER A 64 7.121 -8.223 -2.977 1.00 0.00 H new ATOM 0 HA SER A 64 4.527 -8.945 -4.324 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.561 -7.036 -3.115 1.00 0.00 H new ATOM 0 HB3 SER A 64 4.255 -8.165 -1.968 1.00 0.00 H new ATOM 0 HG SER A 64 5.065 -6.184 -1.369 1.00 0.00 H new ATOM 952 N SER A 65 4.712 -6.922 -5.920 1.00 0.00 N ATOM 953 CA SER A 65 5.047 -5.956 -7.006 1.00 0.00 C ATOM 954 C SER A 65 3.797 -5.174 -7.406 1.00 0.00 C ATOM 955 O SER A 65 2.685 -5.635 -7.244 1.00 0.00 O ATOM 956 CB SER A 65 5.577 -6.720 -8.219 1.00 0.00 C ATOM 957 OG SER A 65 6.001 -5.794 -9.210 1.00 0.00 O ATOM 0 H SER A 65 3.777 -7.327 -5.970 1.00 0.00 H new ATOM 0 HA SER A 65 5.807 -5.262 -6.648 1.00 0.00 H new ATOM 0 HB2 SER A 65 6.408 -7.361 -7.925 1.00 0.00 H new ATOM 0 HB3 SER A 65 4.800 -7.370 -8.621 1.00 0.00 H new ATOM 0 HG SER A 65 6.947 -5.578 -9.072 1.00 0.00 H new ATOM 963 N PHE A 66 3.972 -3.993 -7.934 1.00 0.00 N ATOM 964 CA PHE A 66 2.794 -3.180 -8.354 1.00 0.00 C ATOM 965 C PHE A 66 2.453 -3.501 -9.809 1.00 0.00 C ATOM 966 O PHE A 66 3.300 -3.456 -10.680 1.00 0.00 O ATOM 967 CB PHE A 66 3.129 -1.693 -8.219 1.00 0.00 C ATOM 968 CG PHE A 66 3.128 -1.307 -6.760 1.00 0.00 C ATOM 969 CD1 PHE A 66 4.207 -1.660 -5.938 1.00 0.00 C ATOM 970 CD2 PHE A 66 2.046 -0.597 -6.227 1.00 0.00 C ATOM 971 CE1 PHE A 66 4.202 -1.303 -4.584 1.00 0.00 C ATOM 972 CE2 PHE A 66 2.042 -0.239 -4.873 1.00 0.00 C ATOM 973 CZ PHE A 66 3.119 -0.592 -4.051 1.00 0.00 C ATOM 0 H PHE A 66 4.880 -3.556 -8.093 1.00 0.00 H new ATOM 0 HA PHE A 66 1.939 -3.416 -7.720 1.00 0.00 H new ATOM 0 HB2 PHE A 66 4.105 -1.488 -8.660 1.00 0.00 H new ATOM 0 HB3 PHE A 66 2.400 -1.094 -8.765 1.00 0.00 H new ATOM 0 HD1 PHE A 66 5.042 -2.207 -6.349 1.00 0.00 H new ATOM 0 HD2 PHE A 66 1.214 -0.325 -6.860 1.00 0.00 H new ATOM 0 HE1 PHE A 66 5.033 -1.576 -3.951 1.00 0.00 H new ATOM 0 HE2 PHE A 66 1.207 0.310 -4.463 1.00 0.00 H new ATOM 0 HZ PHE A 66 3.115 -0.316 -3.007 1.00 0.00 H new ATOM 983 N HIS A 67 1.219 -3.838 -10.078 1.00 0.00 N ATOM 984 CA HIS A 67 0.821 -4.180 -11.476 1.00 0.00 C ATOM 985 C HIS A 67 0.149 -2.978 -12.146 1.00 0.00 C ATOM 986 O HIS A 67 0.045 -2.919 -13.355 1.00 0.00 O ATOM 987 CB HIS A 67 -0.157 -5.355 -11.449 1.00 0.00 C ATOM 988 CG HIS A 67 0.496 -6.535 -10.784 1.00 0.00 C ATOM 989 ND1 HIS A 67 1.497 -7.273 -11.402 1.00 0.00 N ATOM 990 CD2 HIS A 67 0.304 -7.118 -9.556 1.00 0.00 C ATOM 991 CE1 HIS A 67 1.865 -8.250 -10.552 1.00 0.00 C ATOM 992 NE2 HIS A 67 1.169 -8.198 -9.415 1.00 0.00 N ATOM 0 H HIS A 67 0.469 -3.891 -9.389 1.00 0.00 H new ATOM 0 HA HIS A 67 1.712 -4.449 -12.043 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -1.063 -5.076 -10.911 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -0.457 -5.616 -12.464 1.00 0.00 H new ATOM 0 HD1 HIS A 67 1.883 -7.105 -12.331 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -0.409 -6.789 -8.814 1.00 0.00 H new ATOM 0 HE1 HIS A 67 2.628 -8.984 -10.764 1.00 0.00 H new ATOM 1001 N ARG A 68 -0.314 -2.023 -11.380 1.00 0.00 N ATOM 1002 CA ARG A 68 -0.983 -0.836 -11.996 1.00 0.00 C ATOM 1003 C ARG A 68 -0.345 0.452 -11.482 1.00 0.00 C ATOM 1004 O ARG A 68 -0.075 0.601 -10.306 1.00 0.00 O ATOM 1005 CB ARG A 68 -2.468 -0.833 -11.628 1.00 0.00 C ATOM 1006 CG ARG A 68 -3.128 -2.105 -12.157 1.00 0.00 C ATOM 1007 CD ARG A 68 -4.646 -2.002 -11.988 1.00 0.00 C ATOM 1008 NE ARG A 68 -5.178 -0.967 -12.917 1.00 0.00 N ATOM 1009 CZ ARG A 68 -5.231 -1.207 -14.198 1.00 0.00 C ATOM 1010 NH1 ARG A 68 -4.820 -2.353 -14.666 1.00 0.00 N ATOM 1011 NH2 ARG A 68 -5.699 -0.299 -15.013 1.00 0.00 N ATOM 0 H ARG A 68 -0.259 -2.013 -10.362 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.868 -0.893 -13.078 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -2.585 -0.773 -10.546 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.956 0.045 -12.050 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -2.877 -2.247 -13.208 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -2.750 -2.974 -11.619 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -5.112 -2.966 -12.194 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.892 -1.743 -10.958 1.00 0.00 H new ATOM 0 HE ARG A 68 -5.501 -0.071 -12.552 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -4.457 -3.063 -14.030 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -4.862 -2.539 -15.668 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -6.022 0.597 -14.647 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -5.741 -0.486 -16.015 1.00 0.00 H new ATOM 1025 N VAL A 69 -0.114 1.391 -12.357 1.00 0.00 N ATOM 1026 CA VAL A 69 0.495 2.681 -11.933 1.00 0.00 C ATOM 1027 C VAL A 69 0.062 3.780 -12.907 1.00 0.00 C ATOM 1028 O VAL A 69 0.783 4.137 -13.816 1.00 0.00 O ATOM 1029 CB VAL A 69 2.016 2.554 -11.959 1.00 0.00 C ATOM 1030 CG1 VAL A 69 2.493 1.791 -10.719 1.00 0.00 C ATOM 1031 CG2 VAL A 69 2.435 1.792 -13.218 1.00 0.00 C ATOM 0 H VAL A 69 -0.322 1.319 -13.353 1.00 0.00 H new ATOM 0 HA VAL A 69 0.168 2.931 -10.924 1.00 0.00 H new ATOM 0 HB VAL A 69 2.464 3.548 -11.963 1.00 0.00 H new ATOM 0 HG11 VAL A 69 3.579 1.703 -10.742 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.191 2.331 -9.821 1.00 0.00 H new ATOM 0 HG13 VAL A 69 2.048 0.796 -10.711 1.00 0.00 H new ATOM 0 HG21 VAL A 69 3.521 1.698 -13.242 1.00 0.00 H new ATOM 0 HG22 VAL A 69 1.985 0.799 -13.209 1.00 0.00 H new ATOM 0 HG23 VAL A 69 2.098 2.335 -14.101 1.00 0.00 H new ATOM 1041 N ILE A 70 -1.114 4.314 -12.731 1.00 0.00 N ATOM 1042 CA ILE A 70 -1.593 5.381 -13.656 1.00 0.00 C ATOM 1043 C ILE A 70 -1.303 6.758 -13.042 1.00 0.00 C ATOM 1044 O ILE A 70 -1.684 7.028 -11.920 1.00 0.00 O ATOM 1045 CB ILE A 70 -3.101 5.223 -13.865 1.00 0.00 C ATOM 1046 CG1 ILE A 70 -3.416 3.763 -14.213 1.00 0.00 C ATOM 1047 CG2 ILE A 70 -3.557 6.130 -15.010 1.00 0.00 C ATOM 1048 CD1 ILE A 70 -4.909 3.499 -14.007 1.00 0.00 C ATOM 0 H ILE A 70 -1.764 4.059 -11.988 1.00 0.00 H new ATOM 0 HA ILE A 70 -1.078 5.296 -14.613 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.626 5.502 -12.951 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.139 3.557 -15.247 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -2.828 3.094 -13.586 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.631 6.017 -15.158 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -3.332 7.168 -14.764 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -3.033 5.852 -15.925 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -5.133 2.461 -14.254 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -5.172 3.689 -12.966 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -5.488 4.159 -14.653 1.00 0.00 H new ATOM 1060 N PRO A 71 -0.626 7.626 -13.761 1.00 0.00 N ATOM 1061 CA PRO A 71 -0.287 8.988 -13.251 1.00 0.00 C ATOM 1062 C PRO A 71 -1.514 9.904 -13.176 1.00 0.00 C ATOM 1063 O PRO A 71 -2.342 9.924 -14.065 1.00 0.00 O ATOM 1064 CB PRO A 71 0.726 9.521 -14.270 1.00 0.00 C ATOM 1065 CG PRO A 71 0.435 8.785 -15.537 1.00 0.00 C ATOM 1066 CD PRO A 71 -0.117 7.417 -15.130 1.00 0.00 C ATOM 0 HA PRO A 71 0.102 8.953 -12.234 1.00 0.00 H new ATOM 0 HB2 PRO A 71 0.618 10.597 -14.406 1.00 0.00 H new ATOM 0 HB3 PRO A 71 1.749 9.343 -13.938 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -0.288 9.330 -16.144 1.00 0.00 H new ATOM 0 HG3 PRO A 71 1.338 8.676 -16.138 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -0.909 7.090 -15.804 1.00 0.00 H new ATOM 0 HD3 PRO A 71 0.658 6.651 -15.154 1.00 0.00 H new ATOM 1074 N GLY A 72 -1.631 10.666 -12.122 1.00 0.00 N ATOM 1075 CA GLY A 72 -2.797 11.588 -11.989 1.00 0.00 C ATOM 1076 C GLY A 72 -3.920 10.891 -11.217 1.00 0.00 C ATOM 1077 O GLY A 72 -4.697 11.524 -10.532 1.00 0.00 O ATOM 0 H GLY A 72 -0.969 10.690 -11.346 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -2.496 12.498 -11.470 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -3.152 11.886 -12.976 1.00 0.00 H new ATOM 1081 N PHE A 73 -4.012 9.591 -11.324 1.00 0.00 N ATOM 1082 CA PHE A 73 -5.087 8.853 -10.598 1.00 0.00 C ATOM 1083 C PHE A 73 -4.500 8.172 -9.357 1.00 0.00 C ATOM 1084 O PHE A 73 -4.473 8.738 -8.282 1.00 0.00 O ATOM 1085 CB PHE A 73 -5.691 7.794 -11.522 1.00 0.00 C ATOM 1086 CG PHE A 73 -6.413 8.475 -12.661 1.00 0.00 C ATOM 1087 CD1 PHE A 73 -7.756 8.844 -12.516 1.00 0.00 C ATOM 1088 CD2 PHE A 73 -5.740 8.737 -13.860 1.00 0.00 C ATOM 1089 CE1 PHE A 73 -8.426 9.474 -13.572 1.00 0.00 C ATOM 1090 CE2 PHE A 73 -6.410 9.366 -14.916 1.00 0.00 C ATOM 1091 CZ PHE A 73 -7.753 9.734 -14.771 1.00 0.00 C ATOM 0 H PHE A 73 -3.389 9.009 -11.883 1.00 0.00 H new ATOM 0 HA PHE A 73 -5.862 9.555 -10.291 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.907 7.144 -11.911 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -6.382 7.161 -10.965 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -8.275 8.643 -11.590 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -4.704 8.454 -13.970 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -9.462 9.759 -13.461 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -5.891 9.567 -15.842 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.270 10.219 -15.586 1.00 0.00 H new ATOM 1101 N MET A 74 -4.037 6.959 -9.495 1.00 0.00 N ATOM 1102 CA MET A 74 -3.461 6.247 -8.317 1.00 0.00 C ATOM 1103 C MET A 74 -2.810 4.939 -8.772 1.00 0.00 C ATOM 1104 O MET A 74 -2.740 4.642 -9.948 1.00 0.00 O ATOM 1105 CB MET A 74 -4.577 5.936 -7.313 1.00 0.00 C ATOM 1106 CG MET A 74 -5.848 5.531 -8.064 1.00 0.00 C ATOM 1107 SD MET A 74 -7.139 5.091 -6.871 1.00 0.00 S ATOM 1108 CE MET A 74 -8.395 4.592 -8.073 1.00 0.00 C ATOM 0 H MET A 74 -4.032 6.432 -10.368 1.00 0.00 H new ATOM 0 HA MET A 74 -2.710 6.880 -7.846 1.00 0.00 H new ATOM 0 HB2 MET A 74 -4.266 5.132 -6.646 1.00 0.00 H new ATOM 0 HB3 MET A 74 -4.773 6.809 -6.691 1.00 0.00 H new ATOM 0 HG2 MET A 74 -6.187 6.351 -8.697 1.00 0.00 H new ATOM 0 HG3 MET A 74 -5.642 4.686 -8.721 1.00 0.00 H new ATOM 0 HE1 MET A 74 -9.296 4.276 -7.548 1.00 0.00 H new ATOM 0 HE2 MET A 74 -8.631 5.434 -8.724 1.00 0.00 H new ATOM 0 HE3 MET A 74 -8.016 3.765 -8.673 1.00 0.00 H new ATOM 1118 N CYS A 75 -2.338 4.152 -7.839 1.00 0.00 N ATOM 1119 CA CYS A 75 -1.692 2.852 -8.192 1.00 0.00 C ATOM 1120 C CYS A 75 -2.362 1.737 -7.383 1.00 0.00 C ATOM 1121 O CYS A 75 -2.711 1.923 -6.234 1.00 0.00 O ATOM 1122 CB CYS A 75 -0.201 2.915 -7.844 1.00 0.00 C ATOM 1123 SG CYS A 75 0.032 3.959 -6.384 1.00 0.00 S ATOM 0 H CYS A 75 -2.373 4.356 -6.840 1.00 0.00 H new ATOM 0 HA CYS A 75 -1.803 2.655 -9.258 1.00 0.00 H new ATOM 0 HB2 CYS A 75 0.182 1.912 -7.653 1.00 0.00 H new ATOM 0 HB3 CYS A 75 0.364 3.316 -8.686 1.00 0.00 H new ATOM 0 HG CYS A 75 1.296 4.012 -6.086 1.00 0.00 H new ATOM 1129 N GLN A 76 -2.555 0.585 -7.972 1.00 0.00 N ATOM 1130 CA GLN A 76 -3.214 -0.532 -7.226 1.00 0.00 C ATOM 1131 C GLN A 76 -2.172 -1.585 -6.840 1.00 0.00 C ATOM 1132 O GLN A 76 -1.249 -1.862 -7.581 1.00 0.00 O ATOM 1133 CB GLN A 76 -4.283 -1.180 -8.108 1.00 0.00 C ATOM 1134 CG GLN A 76 -5.106 -2.162 -7.274 1.00 0.00 C ATOM 1135 CD GLN A 76 -6.087 -2.908 -8.181 1.00 0.00 C ATOM 1136 OE1 GLN A 76 -5.679 -3.628 -9.072 1.00 0.00 O ATOM 1137 NE2 GLN A 76 -7.370 -2.765 -7.993 1.00 0.00 N ATOM 0 H GLN A 76 -2.287 0.369 -8.932 1.00 0.00 H new ATOM 0 HA GLN A 76 -3.677 -0.132 -6.324 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -4.932 -0.414 -8.533 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.814 -1.700 -8.943 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -4.447 -2.871 -6.773 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -5.650 -1.627 -6.495 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -7.712 -2.161 -7.245 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -8.031 -3.257 -8.594 1.00 0.00 H new ATOM 1146 N GLY A 77 -2.317 -2.176 -5.684 1.00 0.00 N ATOM 1147 CA GLY A 77 -1.342 -3.213 -5.242 1.00 0.00 C ATOM 1148 C GLY A 77 -2.009 -4.136 -4.220 1.00 0.00 C ATOM 1149 O GLY A 77 -3.193 -4.042 -3.966 1.00 0.00 O ATOM 0 H GLY A 77 -3.072 -1.984 -5.025 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -0.996 -3.791 -6.099 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -0.465 -2.739 -4.802 1.00 0.00 H new ATOM 1153 N GLY A 78 -1.258 -5.027 -3.629 1.00 0.00 N ATOM 1154 CA GLY A 78 -1.850 -5.958 -2.622 1.00 0.00 C ATOM 1155 C GLY A 78 -2.207 -7.286 -3.295 1.00 0.00 C ATOM 1156 O GLY A 78 -2.739 -8.183 -2.673 1.00 0.00 O ATOM 0 H GLY A 78 -0.260 -5.151 -3.799 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.143 -6.129 -1.810 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -2.741 -5.512 -2.180 1.00 0.00 H new ATOM 1160 N ASP A 79 -1.914 -7.418 -4.559 1.00 0.00 N ATOM 1161 CA ASP A 79 -2.232 -8.688 -5.274 1.00 0.00 C ATOM 1162 C ASP A 79 -1.018 -9.619 -5.211 1.00 0.00 C ATOM 1163 O ASP A 79 -0.927 -10.591 -5.931 1.00 0.00 O ATOM 1164 CB ASP A 79 -2.567 -8.379 -6.735 1.00 0.00 C ATOM 1165 CG ASP A 79 -3.870 -7.578 -6.802 1.00 0.00 C ATOM 1166 OD1 ASP A 79 -4.553 -7.513 -5.793 1.00 0.00 O ATOM 1167 OD2 ASP A 79 -4.159 -7.044 -7.859 1.00 0.00 O ATOM 0 H ASP A 79 -1.467 -6.700 -5.130 1.00 0.00 H new ATOM 0 HA ASP A 79 -3.087 -9.172 -4.802 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -1.756 -7.813 -7.193 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -2.668 -9.306 -7.300 1.00 0.00 H new ATOM 1172 N PHE A 80 -0.085 -9.323 -4.350 1.00 0.00 N ATOM 1173 CA PHE A 80 1.134 -10.176 -4.227 1.00 0.00 C ATOM 1174 C PHE A 80 0.748 -11.657 -4.230 1.00 0.00 C ATOM 1175 O PHE A 80 1.500 -12.501 -4.677 1.00 0.00 O ATOM 1176 CB PHE A 80 1.830 -9.861 -2.904 1.00 0.00 C ATOM 1177 CG PHE A 80 0.874 -10.137 -1.769 1.00 0.00 C ATOM 1178 CD1 PHE A 80 0.729 -11.439 -1.274 1.00 0.00 C ATOM 1179 CD2 PHE A 80 0.131 -9.089 -1.210 1.00 0.00 C ATOM 1180 CE1 PHE A 80 -0.159 -11.692 -0.222 1.00 0.00 C ATOM 1181 CE2 PHE A 80 -0.756 -9.343 -0.159 1.00 0.00 C ATOM 1182 CZ PHE A 80 -0.902 -10.645 0.335 1.00 0.00 C ATOM 0 H PHE A 80 -0.113 -8.521 -3.721 1.00 0.00 H new ATOM 0 HA PHE A 80 1.795 -9.971 -5.069 1.00 0.00 H new ATOM 0 HB2 PHE A 80 2.728 -10.470 -2.797 1.00 0.00 H new ATOM 0 HB3 PHE A 80 2.147 -8.818 -2.884 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.302 -12.247 -1.704 1.00 0.00 H new ATOM 0 HD2 PHE A 80 0.243 -8.085 -1.591 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -0.271 -12.696 0.160 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -1.328 -8.535 0.272 1.00 0.00 H new ATOM 0 HZ PHE A 80 -1.588 -10.841 1.146 1.00 0.00 H new ATOM 1192 N THR A 81 -0.404 -11.984 -3.717 1.00 0.00 N ATOM 1193 CA THR A 81 -0.818 -13.408 -3.674 1.00 0.00 C ATOM 1194 C THR A 81 -0.828 -13.983 -5.088 1.00 0.00 C ATOM 1195 O THR A 81 -0.470 -15.123 -5.304 1.00 0.00 O ATOM 1196 CB THR A 81 -2.218 -13.513 -3.067 1.00 0.00 C ATOM 1197 OG1 THR A 81 -2.264 -12.763 -1.861 1.00 0.00 O ATOM 1198 CG2 THR A 81 -2.530 -14.978 -2.764 1.00 0.00 C ATOM 0 H THR A 81 -1.076 -11.324 -3.326 1.00 0.00 H new ATOM 0 HA THR A 81 -0.114 -13.972 -3.062 1.00 0.00 H new ATOM 0 HB THR A 81 -2.953 -13.121 -3.771 1.00 0.00 H new ATOM 0 HG1 THR A 81 -1.358 -12.669 -1.499 1.00 0.00 H new ATOM 0 HG21 THR A 81 -3.527 -15.056 -2.331 1.00 0.00 H new ATOM 0 HG22 THR A 81 -2.489 -15.557 -3.686 1.00 0.00 H new ATOM 0 HG23 THR A 81 -1.797 -15.368 -2.058 1.00 0.00 H new ATOM 1206 N ALA A 82 -1.234 -13.207 -6.056 1.00 0.00 N ATOM 1207 CA ALA A 82 -1.261 -13.725 -7.453 1.00 0.00 C ATOM 1208 C ALA A 82 -0.918 -12.602 -8.436 1.00 0.00 C ATOM 1209 O ALA A 82 -0.318 -12.832 -9.466 1.00 0.00 O ATOM 1210 CB ALA A 82 -2.655 -14.271 -7.769 1.00 0.00 C ATOM 0 H ALA A 82 -1.546 -12.243 -5.941 1.00 0.00 H new ATOM 0 HA ALA A 82 -0.524 -14.522 -7.551 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -2.674 -14.650 -8.791 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -2.895 -15.079 -7.078 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -3.391 -13.474 -7.664 1.00 0.00 H new ATOM 1216 N GLY A 83 -1.292 -11.391 -8.128 1.00 0.00 N ATOM 1217 CA GLY A 83 -0.988 -10.253 -9.044 1.00 0.00 C ATOM 1218 C GLY A 83 -2.234 -9.915 -9.867 1.00 0.00 C ATOM 1219 O GLY A 83 -2.512 -8.765 -10.142 1.00 0.00 O ATOM 0 H GLY A 83 -1.797 -11.139 -7.278 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -0.672 -9.383 -8.468 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -0.162 -10.515 -9.705 1.00 0.00 H new ATOM 1223 N ASN A 84 -2.986 -10.907 -10.259 1.00 0.00 N ATOM 1224 CA ASN A 84 -4.214 -10.639 -11.061 1.00 0.00 C ATOM 1225 C ASN A 84 -5.402 -10.436 -10.118 1.00 0.00 C ATOM 1226 O ASN A 84 -6.521 -10.232 -10.548 1.00 0.00 O ATOM 1227 CB ASN A 84 -4.492 -11.829 -11.982 1.00 0.00 C ATOM 1228 CG ASN A 84 -3.327 -12.002 -12.960 1.00 0.00 C ATOM 1229 OD1 ASN A 84 -2.545 -11.093 -13.154 1.00 0.00 O ATOM 1230 ND2 ASN A 84 -3.179 -13.137 -13.585 1.00 0.00 N ATOM 0 H ASN A 84 -2.804 -11.890 -10.059 1.00 0.00 H new ATOM 0 HA ASN A 84 -4.068 -9.741 -11.662 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -4.623 -12.736 -11.392 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -5.420 -11.669 -12.530 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -2.406 -13.263 -14.238 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -3.837 -13.899 -13.421 1.00 0.00 H new ATOM 1237 N GLY A 85 -5.168 -10.493 -8.835 1.00 0.00 N ATOM 1238 CA GLY A 85 -6.283 -10.305 -7.862 1.00 0.00 C ATOM 1239 C GLY A 85 -6.939 -11.656 -7.572 1.00 0.00 C ATOM 1240 O GLY A 85 -7.902 -11.744 -6.837 1.00 0.00 O ATOM 0 H GLY A 85 -4.253 -10.662 -8.418 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -5.904 -9.867 -6.939 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -7.019 -9.610 -8.266 1.00 0.00 H new ATOM 1244 N THR A 86 -6.424 -12.709 -8.146 1.00 0.00 N ATOM 1245 CA THR A 86 -7.018 -14.056 -7.906 1.00 0.00 C ATOM 1246 C THR A 86 -6.964 -14.383 -6.412 1.00 0.00 C ATOM 1247 O THR A 86 -7.876 -14.966 -5.861 1.00 0.00 O ATOM 1248 CB THR A 86 -6.226 -15.108 -8.687 1.00 0.00 C ATOM 1249 OG1 THR A 86 -6.184 -14.742 -10.058 1.00 0.00 O ATOM 1250 CG2 THR A 86 -6.903 -16.472 -8.539 1.00 0.00 C ATOM 0 H THR A 86 -5.618 -12.695 -8.771 1.00 0.00 H new ATOM 0 HA THR A 86 -8.056 -14.058 -8.239 1.00 0.00 H new ATOM 0 HB THR A 86 -5.211 -15.166 -8.295 1.00 0.00 H new ATOM 0 HG1 THR A 86 -5.676 -15.413 -10.560 1.00 0.00 H new ATOM 0 HG21 THR A 86 -6.339 -17.221 -9.095 1.00 0.00 H new ATOM 0 HG22 THR A 86 -6.935 -16.750 -7.486 1.00 0.00 H new ATOM 0 HG23 THR A 86 -7.919 -16.418 -8.931 1.00 0.00 H new ATOM 1258 N GLY A 87 -5.896 -14.017 -5.753 1.00 0.00 N ATOM 1259 CA GLY A 87 -5.777 -14.311 -4.296 1.00 0.00 C ATOM 1260 C GLY A 87 -6.210 -13.091 -3.483 1.00 0.00 C ATOM 1261 O GLY A 87 -7.358 -12.690 -3.510 1.00 0.00 O ATOM 0 H GLY A 87 -5.101 -13.527 -6.162 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.396 -15.170 -4.037 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.748 -14.575 -4.052 1.00 0.00 H new ATOM 1265 N GLY A 88 -5.303 -12.498 -2.752 1.00 0.00 N ATOM 1266 CA GLY A 88 -5.665 -11.309 -1.931 1.00 0.00 C ATOM 1267 C GLY A 88 -6.302 -11.777 -0.622 1.00 0.00 C ATOM 1268 O GLY A 88 -7.107 -11.087 -0.027 1.00 0.00 O ATOM 0 H GLY A 88 -4.327 -12.787 -2.689 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -4.777 -10.711 -1.724 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -6.358 -10.671 -2.479 1.00 0.00 H new ATOM 1272 N GLU A 89 -5.949 -12.950 -0.171 1.00 0.00 N ATOM 1273 CA GLU A 89 -6.533 -13.472 1.098 1.00 0.00 C ATOM 1274 C GLU A 89 -6.208 -12.520 2.250 1.00 0.00 C ATOM 1275 O GLU A 89 -5.135 -11.953 2.317 1.00 0.00 O ATOM 1276 CB GLU A 89 -5.945 -14.853 1.397 1.00 0.00 C ATOM 1277 CG GLU A 89 -6.326 -15.824 0.277 1.00 0.00 C ATOM 1278 CD GLU A 89 -5.799 -17.221 0.613 1.00 0.00 C ATOM 1279 OE1 GLU A 89 -5.047 -17.336 1.566 1.00 0.00 O ATOM 1280 OE2 GLU A 89 -6.157 -18.151 -0.091 1.00 0.00 O ATOM 0 H GLU A 89 -5.280 -13.571 -0.627 1.00 0.00 H new ATOM 0 HA GLU A 89 -7.615 -13.549 0.991 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -4.860 -14.787 1.482 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -6.318 -15.220 2.353 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.409 -15.851 0.157 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -5.909 -15.484 -0.671 1.00 0.00 H new ATOM 1287 N SER A 90 -7.128 -12.344 3.161 1.00 0.00 N ATOM 1288 CA SER A 90 -6.880 -11.434 4.318 1.00 0.00 C ATOM 1289 C SER A 90 -7.504 -12.038 5.579 1.00 0.00 C ATOM 1290 O SER A 90 -8.522 -12.697 5.525 1.00 0.00 O ATOM 1291 CB SER A 90 -7.515 -10.071 4.040 1.00 0.00 C ATOM 1292 OG SER A 90 -7.200 -9.181 5.102 1.00 0.00 O ATOM 0 H SER A 90 -8.044 -12.793 3.154 1.00 0.00 H new ATOM 0 HA SER A 90 -5.807 -11.312 4.463 1.00 0.00 H new ATOM 0 HB2 SER A 90 -7.148 -9.672 3.095 1.00 0.00 H new ATOM 0 HB3 SER A 90 -8.596 -10.173 3.944 1.00 0.00 H new ATOM 0 HG SER A 90 -6.227 -9.084 5.170 1.00 0.00 H new ATOM 1298 N ILE A 91 -6.899 -11.821 6.717 1.00 0.00 N ATOM 1299 CA ILE A 91 -7.459 -12.386 7.976 1.00 0.00 C ATOM 1300 C ILE A 91 -8.766 -11.664 8.323 1.00 0.00 C ATOM 1301 O ILE A 91 -9.508 -12.085 9.188 1.00 0.00 O ATOM 1302 CB ILE A 91 -6.441 -12.213 9.112 1.00 0.00 C ATOM 1303 CG1 ILE A 91 -6.372 -10.743 9.545 1.00 0.00 C ATOM 1304 CG2 ILE A 91 -5.059 -12.658 8.628 1.00 0.00 C ATOM 1305 CD1 ILE A 91 -5.353 -10.592 10.679 1.00 0.00 C ATOM 0 H ILE A 91 -6.043 -11.278 6.827 1.00 0.00 H new ATOM 0 HA ILE A 91 -7.665 -13.448 7.843 1.00 0.00 H new ATOM 0 HB ILE A 91 -6.753 -12.821 9.961 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -6.087 -10.117 8.700 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.354 -10.404 9.876 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -4.335 -12.536 9.433 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.098 -13.706 8.331 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -4.759 -12.050 7.775 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.304 -9.548 10.987 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.658 -11.206 11.526 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -4.372 -10.915 10.332 1.00 0.00 H new ATOM 1317 N TYR A 92 -9.050 -10.580 7.651 1.00 0.00 N ATOM 1318 CA TYR A 92 -10.305 -9.819 7.930 1.00 0.00 C ATOM 1319 C TYR A 92 -11.299 -10.023 6.786 1.00 0.00 C ATOM 1320 O TYR A 92 -12.109 -9.164 6.496 1.00 0.00 O ATOM 1321 CB TYR A 92 -9.983 -8.330 8.061 1.00 0.00 C ATOM 1322 CG TYR A 92 -9.209 -8.095 9.335 1.00 0.00 C ATOM 1323 CD1 TYR A 92 -9.882 -8.042 10.561 1.00 0.00 C ATOM 1324 CD2 TYR A 92 -7.820 -7.930 9.291 1.00 0.00 C ATOM 1325 CE1 TYR A 92 -9.167 -7.825 11.744 1.00 0.00 C ATOM 1326 CE2 TYR A 92 -7.103 -7.713 10.475 1.00 0.00 C ATOM 1327 CZ TYR A 92 -7.777 -7.661 11.701 1.00 0.00 C ATOM 1328 OH TYR A 92 -7.074 -7.447 12.868 1.00 0.00 O ATOM 0 H TYR A 92 -8.463 -10.186 6.916 1.00 0.00 H new ATOM 0 HA TYR A 92 -10.744 -10.181 8.860 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -9.401 -7.995 7.202 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -10.904 -7.747 8.069 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -10.954 -8.169 10.594 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -7.301 -7.970 8.345 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -9.687 -7.784 12.690 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.031 -7.586 10.442 1.00 0.00 H new ATOM 0 HH TYR A 92 -6.870 -8.308 13.290 1.00 0.00 H new ATOM 1338 N GLY A 93 -11.247 -11.149 6.130 1.00 0.00 N ATOM 1339 CA GLY A 93 -12.191 -11.399 5.005 1.00 0.00 C ATOM 1340 C GLY A 93 -13.609 -11.023 5.439 1.00 0.00 C ATOM 1341 O GLY A 93 -14.420 -10.593 4.642 1.00 0.00 O ATOM 0 H GLY A 93 -10.592 -11.906 6.324 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -11.898 -10.814 4.133 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -12.155 -12.448 4.711 1.00 0.00 H new ATOM 1345 N ALA A 94 -13.915 -11.173 6.699 1.00 0.00 N ATOM 1346 CA ALA A 94 -15.275 -10.817 7.184 1.00 0.00 C ATOM 1347 C ALA A 94 -15.498 -9.317 6.984 1.00 0.00 C ATOM 1348 O ALA A 94 -14.588 -8.522 7.106 1.00 0.00 O ATOM 1349 CB ALA A 94 -15.395 -11.159 8.670 1.00 0.00 C ATOM 0 H ALA A 94 -13.279 -11.528 7.413 1.00 0.00 H new ATOM 0 HA ALA A 94 -16.024 -11.379 6.626 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -16.392 -10.898 9.024 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -15.228 -12.227 8.812 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -14.651 -10.597 9.234 1.00 0.00 H new ATOM 1355 N LYS A 95 -16.700 -8.928 6.674 1.00 0.00 N ATOM 1356 CA LYS A 95 -16.984 -7.480 6.457 1.00 0.00 C ATOM 1357 C LYS A 95 -17.341 -6.820 7.792 1.00 0.00 C ATOM 1358 O LYS A 95 -18.107 -7.350 8.573 1.00 0.00 O ATOM 1359 CB LYS A 95 -18.158 -7.330 5.489 1.00 0.00 C ATOM 1360 CG LYS A 95 -17.770 -7.899 4.123 1.00 0.00 C ATOM 1361 CD LYS A 95 -18.901 -7.645 3.125 1.00 0.00 C ATOM 1362 CE LYS A 95 -18.570 -8.321 1.793 1.00 0.00 C ATOM 1363 NZ LYS A 95 -19.778 -8.322 0.922 1.00 0.00 N ATOM 0 H LYS A 95 -17.501 -9.549 6.561 1.00 0.00 H new ATOM 0 HA LYS A 95 -16.100 -6.998 6.038 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -19.032 -7.853 5.877 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -18.432 -6.279 5.393 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -16.849 -7.434 3.772 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -17.576 -8.968 4.204 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -19.841 -8.033 3.518 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -19.036 -6.573 2.977 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -17.753 -7.795 1.299 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -18.232 -9.343 1.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -19.553 -8.782 0.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -20.545 -8.843 1.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -20.081 -7.343 0.747 1.00 0.00 H new ATOM 1377 N PHE A 96 -16.795 -5.663 8.055 1.00 0.00 N ATOM 1378 CA PHE A 96 -17.103 -4.959 9.333 1.00 0.00 C ATOM 1379 C PHE A 96 -17.142 -3.449 9.084 1.00 0.00 C ATOM 1380 O PHE A 96 -16.656 -2.964 8.083 1.00 0.00 O ATOM 1381 CB PHE A 96 -16.024 -5.280 10.370 1.00 0.00 C ATOM 1382 CG PHE A 96 -14.694 -4.737 9.905 1.00 0.00 C ATOM 1383 CD1 PHE A 96 -13.871 -5.513 9.080 1.00 0.00 C ATOM 1384 CD2 PHE A 96 -14.282 -3.459 10.301 1.00 0.00 C ATOM 1385 CE1 PHE A 96 -12.635 -5.012 8.652 1.00 0.00 C ATOM 1386 CE2 PHE A 96 -13.048 -2.958 9.872 1.00 0.00 C ATOM 1387 CZ PHE A 96 -12.225 -3.734 9.048 1.00 0.00 C ATOM 0 H PHE A 96 -16.147 -5.174 7.438 1.00 0.00 H new ATOM 0 HA PHE A 96 -18.071 -5.292 9.707 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -16.290 -4.843 11.333 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -15.956 -6.358 10.517 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -14.189 -6.498 8.773 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -14.916 -2.860 10.937 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -11.999 -5.611 8.017 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -12.730 -1.972 10.177 1.00 0.00 H new ATOM 0 HZ PHE A 96 -11.273 -3.346 8.717 1.00 0.00 H new ATOM 1397 N ALA A 97 -17.717 -2.702 9.990 1.00 0.00 N ATOM 1398 CA ALA A 97 -17.789 -1.224 9.809 1.00 0.00 C ATOM 1399 C ALA A 97 -16.652 -0.562 10.591 1.00 0.00 C ATOM 1400 O ALA A 97 -16.275 -1.013 11.654 1.00 0.00 O ATOM 1401 CB ALA A 97 -19.131 -0.710 10.333 1.00 0.00 C ATOM 0 H ALA A 97 -18.140 -3.054 10.849 1.00 0.00 H new ATOM 0 HA ALA A 97 -17.695 -0.982 8.750 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -19.183 0.371 10.201 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -19.943 -1.183 9.780 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -19.224 -0.951 11.392 1.00 0.00 H new ATOM 1407 N ASP A 98 -16.102 0.503 10.075 1.00 0.00 N ATOM 1408 CA ASP A 98 -14.989 1.186 10.793 1.00 0.00 C ATOM 1409 C ASP A 98 -15.528 1.820 12.078 1.00 0.00 C ATOM 1410 O ASP A 98 -16.572 2.441 12.087 1.00 0.00 O ATOM 1411 CB ASP A 98 -14.395 2.272 9.894 1.00 0.00 C ATOM 1412 CG ASP A 98 -13.735 1.617 8.679 1.00 0.00 C ATOM 1413 OD1 ASP A 98 -13.505 0.419 8.728 1.00 0.00 O ATOM 1414 OD2 ASP A 98 -13.472 2.323 7.720 1.00 0.00 O ATOM 0 H ASP A 98 -16.375 0.929 9.189 1.00 0.00 H new ATOM 0 HA ASP A 98 -14.215 0.461 11.044 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -15.176 2.960 9.571 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -13.662 2.859 10.448 1.00 0.00 H new ATOM 1419 N GLU A 99 -14.824 1.661 13.167 1.00 0.00 N ATOM 1420 CA GLU A 99 -15.296 2.246 14.454 1.00 0.00 C ATOM 1421 C GLU A 99 -15.336 3.772 14.355 1.00 0.00 C ATOM 1422 O GLU A 99 -16.224 4.412 14.882 1.00 0.00 O ATOM 1423 CB GLU A 99 -14.343 1.833 15.578 1.00 0.00 C ATOM 1424 CG GLU A 99 -14.905 2.295 16.925 1.00 0.00 C ATOM 1425 CD GLU A 99 -13.906 1.967 18.035 1.00 0.00 C ATOM 1426 OE1 GLU A 99 -12.852 1.440 17.719 1.00 0.00 O ATOM 1427 OE2 GLU A 99 -14.212 2.248 19.182 1.00 0.00 O ATOM 0 H GLU A 99 -13.942 1.151 13.220 1.00 0.00 H new ATOM 0 HA GLU A 99 -16.300 1.878 14.667 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -14.213 0.751 15.579 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -13.359 2.272 15.414 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.099 3.367 16.901 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -15.858 1.803 17.122 1.00 0.00 H new ATOM 1434 N ASN A 100 -14.380 4.367 13.692 1.00 0.00 N ATOM 1435 CA ASN A 100 -14.368 5.856 13.575 1.00 0.00 C ATOM 1436 C ASN A 100 -13.841 6.270 12.198 1.00 0.00 C ATOM 1437 O ASN A 100 -13.349 5.459 11.438 1.00 0.00 O ATOM 1438 CB ASN A 100 -13.464 6.443 14.660 1.00 0.00 C ATOM 1439 CG ASN A 100 -13.962 5.997 16.038 1.00 0.00 C ATOM 1440 OD1 ASN A 100 -15.232 6.086 16.317 1.00 0.00 O flip ATOM 1441 ND2 ASN A 100 -13.186 5.564 16.866 1.00 0.00 N flip ATOM 0 H ASN A 100 -13.608 3.888 13.227 1.00 0.00 H new ATOM 0 HA ASN A 100 -15.384 6.232 13.697 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -12.436 6.113 14.509 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -13.462 7.531 14.597 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -12.192 5.495 16.647 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -13.528 5.270 17.781 1.00 0.00 H new ATOM 1448 N PHE A 101 -13.939 7.532 11.878 1.00 0.00 N ATOM 1449 CA PHE A 101 -13.444 8.015 10.557 1.00 0.00 C ATOM 1450 C PHE A 101 -13.006 9.477 10.690 1.00 0.00 C ATOM 1451 O PHE A 101 -13.208 10.282 9.804 1.00 0.00 O ATOM 1452 CB PHE A 101 -14.566 7.906 9.522 1.00 0.00 C ATOM 1453 CG PHE A 101 -15.713 8.804 9.921 1.00 0.00 C ATOM 1454 CD1 PHE A 101 -16.628 8.381 10.893 1.00 0.00 C ATOM 1455 CD2 PHE A 101 -15.861 10.063 9.322 1.00 0.00 C ATOM 1456 CE1 PHE A 101 -17.689 9.213 11.266 1.00 0.00 C ATOM 1457 CE2 PHE A 101 -16.924 10.895 9.696 1.00 0.00 C ATOM 1458 CZ PHE A 101 -17.837 10.471 10.667 1.00 0.00 C ATOM 0 H PHE A 101 -14.342 8.252 12.477 1.00 0.00 H new ATOM 0 HA PHE A 101 -12.598 7.408 10.235 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -14.195 8.189 8.537 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -14.908 6.874 9.449 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -16.514 7.411 11.355 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -15.156 10.391 8.573 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -18.394 8.886 12.016 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -17.039 11.865 9.234 1.00 0.00 H new ATOM 0 HZ PHE A 101 -18.656 11.113 10.955 1.00 0.00 H new ATOM 1468 N ILE A 102 -12.408 9.823 11.798 1.00 0.00 N ATOM 1469 CA ILE A 102 -11.958 11.231 11.999 1.00 0.00 C ATOM 1470 C ILE A 102 -10.994 11.635 10.882 1.00 0.00 C ATOM 1471 O ILE A 102 -10.966 12.773 10.456 1.00 0.00 O ATOM 1472 CB ILE A 102 -11.251 11.350 13.352 1.00 0.00 C ATOM 1473 CG1 ILE A 102 -12.230 10.978 14.469 1.00 0.00 C ATOM 1474 CG2 ILE A 102 -10.772 12.790 13.551 1.00 0.00 C ATOM 1475 CD1 ILE A 102 -11.488 10.928 15.806 1.00 0.00 C ATOM 0 H ILE A 102 -12.211 9.191 12.574 1.00 0.00 H new ATOM 0 HA ILE A 102 -12.825 11.891 11.978 1.00 0.00 H new ATOM 0 HB ILE A 102 -10.395 10.676 13.378 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -13.038 11.709 14.517 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -12.687 10.011 14.259 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -10.268 12.876 14.514 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -10.078 13.056 12.754 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -11.628 13.465 13.527 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -12.186 10.663 16.600 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -10.696 10.181 15.755 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -11.052 11.905 16.017 1.00 0.00 H new ATOM 1487 N LYS A 103 -10.199 10.718 10.402 1.00 0.00 N ATOM 1488 CA LYS A 103 -9.240 11.064 9.314 1.00 0.00 C ATOM 1489 C LYS A 103 -9.993 11.185 7.989 1.00 0.00 C ATOM 1490 O LYS A 103 -10.933 10.460 7.731 1.00 0.00 O ATOM 1491 CB LYS A 103 -8.178 9.968 9.198 1.00 0.00 C ATOM 1492 CG LYS A 103 -7.408 9.859 10.515 1.00 0.00 C ATOM 1493 CD LYS A 103 -6.187 8.958 10.321 1.00 0.00 C ATOM 1494 CE LYS A 103 -6.644 7.550 9.928 1.00 0.00 C ATOM 1495 NZ LYS A 103 -5.553 6.576 10.213 1.00 0.00 N ATOM 0 H LYS A 103 -10.172 9.747 10.715 1.00 0.00 H new ATOM 0 HA LYS A 103 -8.757 12.013 9.546 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -8.649 9.014 8.961 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -7.492 10.197 8.382 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -7.094 10.848 10.847 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -8.054 9.452 11.293 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -5.538 9.370 9.548 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -5.602 8.918 11.240 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -7.542 7.279 10.483 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -6.903 7.522 8.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -5.966 5.654 10.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -4.951 6.472 9.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -4.979 6.921 11.008 1.00 0.00 H new ATOM 1509 N LYS A 104 -9.585 12.097 7.147 1.00 0.00 N ATOM 1510 CA LYS A 104 -10.272 12.277 5.834 1.00 0.00 C ATOM 1511 C LYS A 104 -9.231 12.295 4.714 1.00 0.00 C ATOM 1512 O LYS A 104 -8.069 12.573 4.938 1.00 0.00 O ATOM 1513 CB LYS A 104 -11.041 13.600 5.836 1.00 0.00 C ATOM 1514 CG LYS A 104 -12.022 13.619 4.662 1.00 0.00 C ATOM 1515 CD LYS A 104 -12.733 14.972 4.613 1.00 0.00 C ATOM 1516 CE LYS A 104 -13.890 14.907 3.615 1.00 0.00 C ATOM 1517 NZ LYS A 104 -14.933 13.971 4.123 1.00 0.00 N ATOM 0 H LYS A 104 -8.801 12.728 7.313 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.968 11.454 5.672 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -11.579 13.719 6.776 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -10.347 14.437 5.758 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -11.490 13.442 3.727 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -12.752 12.817 4.771 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -13.107 15.234 5.603 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -12.031 15.753 4.321 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -14.316 15.900 3.471 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -13.528 14.572 2.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -15.849 14.203 3.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -14.672 12.994 3.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -15.007 14.061 5.156 1.00 0.00 H new ATOM 1531 N HIS A 105 -9.638 12.000 3.510 1.00 0.00 N ATOM 1532 CA HIS A 105 -8.676 11.996 2.368 1.00 0.00 C ATOM 1533 C HIS A 105 -8.796 13.313 1.598 1.00 0.00 C ATOM 1534 O HIS A 105 -9.870 13.709 1.192 1.00 0.00 O ATOM 1535 CB HIS A 105 -9.006 10.831 1.433 1.00 0.00 C ATOM 1536 CG HIS A 105 -8.070 10.849 0.255 1.00 0.00 C ATOM 1537 ND1 HIS A 105 -6.715 10.579 0.382 1.00 0.00 N ATOM 1538 CD2 HIS A 105 -8.280 11.100 -1.079 1.00 0.00 C ATOM 1539 CE1 HIS A 105 -6.165 10.675 -0.844 1.00 0.00 C ATOM 1540 NE2 HIS A 105 -7.078 10.990 -1.766 1.00 0.00 N ATOM 0 H HIS A 105 -10.599 11.760 3.266 1.00 0.00 H new ATOM 0 HA HIS A 105 -7.660 11.886 2.747 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -8.916 9.885 1.968 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -10.038 10.907 1.091 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -9.233 11.345 -1.525 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -5.118 10.517 -1.055 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -6.925 11.122 -2.766 1.00 0.00 H new ATOM 1549 N THR A 106 -7.701 13.996 1.394 1.00 0.00 N ATOM 1550 CA THR A 106 -7.761 15.286 0.649 1.00 0.00 C ATOM 1551 C THR A 106 -6.368 15.645 0.126 1.00 0.00 C ATOM 1552 O THR A 106 -6.199 16.595 -0.613 1.00 0.00 O ATOM 1553 CB THR A 106 -8.255 16.392 1.583 1.00 0.00 C ATOM 1554 OG1 THR A 106 -7.891 17.658 1.050 1.00 0.00 O ATOM 1555 CG2 THR A 106 -7.623 16.218 2.965 1.00 0.00 C ATOM 0 H THR A 106 -6.772 13.718 1.710 1.00 0.00 H new ATOM 0 HA THR A 106 -8.447 15.185 -0.192 1.00 0.00 H new ATOM 0 HB THR A 106 -9.340 16.333 1.673 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.537 17.542 0.143 1.00 0.00 H new ATOM 0 HG21 THR A 106 -7.976 17.007 3.629 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.904 15.247 3.374 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.538 16.275 2.879 1.00 0.00 H new ATOM 1563 N GLY A 107 -5.368 14.893 0.503 1.00 0.00 N ATOM 1564 CA GLY A 107 -3.981 15.187 0.033 1.00 0.00 C ATOM 1565 C GLY A 107 -3.370 13.922 -0.576 1.00 0.00 C ATOM 1566 O GLY A 107 -3.935 12.852 -0.491 1.00 0.00 O ATOM 0 H GLY A 107 -5.452 14.084 1.119 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.998 15.988 -0.706 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -3.369 15.535 0.866 1.00 0.00 H new ATOM 1570 N PRO A 108 -2.224 14.052 -1.189 1.00 0.00 N ATOM 1571 CA PRO A 108 -1.510 12.909 -1.829 1.00 0.00 C ATOM 1572 C PRO A 108 -0.729 12.066 -0.810 1.00 0.00 C ATOM 1573 O PRO A 108 -0.335 12.548 0.233 1.00 0.00 O ATOM 1574 CB PRO A 108 -0.553 13.602 -2.799 1.00 0.00 C ATOM 1575 CG PRO A 108 -0.232 14.908 -2.149 1.00 0.00 C ATOM 1576 CD PRO A 108 -1.474 15.312 -1.345 1.00 0.00 C ATOM 0 HA PRO A 108 -2.195 12.209 -2.307 1.00 0.00 H new ATOM 0 HB2 PRO A 108 0.347 13.008 -2.959 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -1.016 13.749 -3.775 1.00 0.00 H new ATOM 0 HG2 PRO A 108 0.637 14.814 -1.498 1.00 0.00 H new ATOM 0 HG3 PRO A 108 0.009 15.664 -2.896 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -1.203 15.737 -0.379 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -2.062 16.064 -1.871 1.00 0.00 H new ATOM 1584 N GLY A 109 -0.495 10.816 -1.110 1.00 0.00 N ATOM 1585 CA GLY A 109 0.270 9.951 -0.162 1.00 0.00 C ATOM 1586 C GLY A 109 -0.637 9.508 0.990 1.00 0.00 C ATOM 1587 O GLY A 109 -0.270 9.591 2.145 1.00 0.00 O ATOM 0 H GLY A 109 -0.799 10.356 -1.968 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.659 9.078 -0.686 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.129 10.497 0.229 1.00 0.00 H new ATOM 1591 N ILE A 110 -1.818 9.041 0.682 1.00 0.00 N ATOM 1592 CA ILE A 110 -2.757 8.592 1.755 1.00 0.00 C ATOM 1593 C ILE A 110 -3.002 7.086 1.623 1.00 0.00 C ATOM 1594 O ILE A 110 -3.235 6.578 0.545 1.00 0.00 O ATOM 1595 CB ILE A 110 -4.085 9.334 1.600 1.00 0.00 C ATOM 1596 CG1 ILE A 110 -3.829 10.846 1.575 1.00 0.00 C ATOM 1597 CG2 ILE A 110 -5.009 8.987 2.768 1.00 0.00 C ATOM 1598 CD1 ILE A 110 -3.052 11.275 2.825 1.00 0.00 C ATOM 0 H ILE A 110 -2.175 8.950 -0.269 1.00 0.00 H new ATOM 0 HA ILE A 110 -2.325 8.806 2.733 1.00 0.00 H new ATOM 0 HB ILE A 110 -4.559 9.033 0.666 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -3.267 11.112 0.680 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -4.777 11.381 1.526 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -5.954 9.518 2.654 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -5.195 7.913 2.778 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -4.538 9.283 3.705 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -2.877 12.350 2.794 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -3.630 11.027 3.715 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -2.096 10.753 2.856 1.00 0.00 H new ATOM 1610 N LEU A 111 -2.957 6.367 2.716 1.00 0.00 N ATOM 1611 CA LEU A 111 -3.195 4.894 2.651 1.00 0.00 C ATOM 1612 C LEU A 111 -4.675 4.608 2.917 1.00 0.00 C ATOM 1613 O LEU A 111 -5.167 4.808 4.010 1.00 0.00 O ATOM 1614 CB LEU A 111 -2.345 4.193 3.720 1.00 0.00 C ATOM 1615 CG LEU A 111 -0.907 4.000 3.225 1.00 0.00 C ATOM 1616 CD1 LEU A 111 -0.854 2.886 2.171 1.00 0.00 C ATOM 1617 CD2 LEU A 111 -0.387 5.304 2.615 1.00 0.00 C ATOM 0 H LEU A 111 -2.766 6.735 3.648 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.921 4.523 1.663 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.344 4.784 4.636 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.784 3.226 3.965 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.281 3.720 4.072 1.00 0.00 H new ATOM 0 HD11 LEU A 111 0.173 2.759 1.827 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -1.208 1.953 2.610 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.489 3.154 1.326 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.635 5.160 2.265 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -1.021 5.591 1.776 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.405 6.091 3.369 1.00 0.00 H new ATOM 1629 N SER A 112 -5.388 4.135 1.928 1.00 0.00 N ATOM 1630 CA SER A 112 -6.837 3.829 2.123 1.00 0.00 C ATOM 1631 C SER A 112 -7.139 2.427 1.590 1.00 0.00 C ATOM 1632 O SER A 112 -6.532 1.971 0.640 1.00 0.00 O ATOM 1633 CB SER A 112 -7.679 4.856 1.365 1.00 0.00 C ATOM 1634 OG SER A 112 -7.359 6.161 1.830 1.00 0.00 O ATOM 0 H SER A 112 -5.029 3.947 0.992 1.00 0.00 H new ATOM 0 HA SER A 112 -7.079 3.872 3.185 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.487 4.782 0.295 1.00 0.00 H new ATOM 0 HB3 SER A 112 -8.740 4.654 1.514 1.00 0.00 H new ATOM 0 HG SER A 112 -7.896 6.822 1.345 1.00 0.00 H new ATOM 1640 N MET A 113 -8.075 1.739 2.188 1.00 0.00 N ATOM 1641 CA MET A 113 -8.415 0.367 1.711 1.00 0.00 C ATOM 1642 C MET A 113 -9.587 0.446 0.730 1.00 0.00 C ATOM 1643 O MET A 113 -10.509 1.214 0.912 1.00 0.00 O ATOM 1644 CB MET A 113 -8.812 -0.507 2.904 1.00 0.00 C ATOM 1645 CG MET A 113 -7.608 -0.684 3.830 1.00 0.00 C ATOM 1646 SD MET A 113 -8.017 -1.870 5.138 1.00 0.00 S ATOM 1647 CE MET A 113 -7.965 -3.374 4.127 1.00 0.00 C ATOM 0 H MET A 113 -8.619 2.068 2.986 1.00 0.00 H new ATOM 0 HA MET A 113 -7.548 -0.068 1.213 1.00 0.00 H new ATOM 0 HB2 MET A 113 -9.637 -0.046 3.447 1.00 0.00 H new ATOM 0 HB3 MET A 113 -9.162 -1.479 2.556 1.00 0.00 H new ATOM 0 HG2 MET A 113 -6.748 -1.037 3.261 1.00 0.00 H new ATOM 0 HG3 MET A 113 -7.329 0.274 4.268 1.00 0.00 H new ATOM 0 HE1 MET A 113 -8.964 -3.805 4.065 1.00 0.00 H new ATOM 0 HE2 MET A 113 -7.613 -3.127 3.125 1.00 0.00 H new ATOM 0 HE3 MET A 113 -7.286 -4.095 4.582 1.00 0.00 H new ATOM 1657 N ALA A 114 -9.557 -0.343 -0.309 1.00 0.00 N ATOM 1658 CA ALA A 114 -10.672 -0.311 -1.297 1.00 0.00 C ATOM 1659 C ALA A 114 -11.967 -0.748 -0.613 1.00 0.00 C ATOM 1660 O ALA A 114 -11.970 -1.630 0.223 1.00 0.00 O ATOM 1661 CB ALA A 114 -10.359 -1.264 -2.452 1.00 0.00 C ATOM 0 H ALA A 114 -8.811 -1.007 -0.516 1.00 0.00 H new ATOM 0 HA ALA A 114 -10.787 0.702 -1.684 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -11.175 -1.240 -3.174 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -9.434 -0.954 -2.939 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -10.245 -2.277 -2.067 1.00 0.00 H new ATOM 1667 N ASN A 115 -13.071 -0.142 -0.962 1.00 0.00 N ATOM 1668 CA ASN A 115 -14.366 -0.524 -0.334 1.00 0.00 C ATOM 1669 C ASN A 115 -15.476 -0.412 -1.374 1.00 0.00 C ATOM 1670 O ASN A 115 -15.811 0.663 -1.829 1.00 0.00 O ATOM 1671 CB ASN A 115 -14.675 0.412 0.831 1.00 0.00 C ATOM 1672 CG ASN A 115 -13.469 0.480 1.771 1.00 0.00 C ATOM 1673 OD1 ASN A 115 -12.917 -0.626 2.185 1.00 0.00 O flip ATOM 1674 ND2 ASN A 115 -13.028 1.553 2.134 1.00 0.00 N flip ATOM 0 H ASN A 115 -13.130 0.603 -1.657 1.00 0.00 H new ATOM 0 HA ASN A 115 -14.300 -1.547 0.035 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -14.913 1.408 0.457 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -15.551 0.057 1.373 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -13.460 2.418 1.810 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -12.226 1.588 2.763 1.00 0.00 H new ATOM 1681 N ALA A 116 -16.051 -1.512 -1.749 1.00 0.00 N ATOM 1682 CA ALA A 116 -17.144 -1.478 -2.756 1.00 0.00 C ATOM 1683 C ALA A 116 -18.370 -0.797 -2.144 1.00 0.00 C ATOM 1684 O ALA A 116 -19.176 -0.206 -2.834 1.00 0.00 O ATOM 1685 CB ALA A 116 -17.492 -2.905 -3.170 1.00 0.00 C ATOM 0 H ALA A 116 -15.812 -2.440 -1.401 1.00 0.00 H new ATOM 0 HA ALA A 116 -16.823 -0.919 -3.635 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -18.293 -2.884 -3.909 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -16.613 -3.383 -3.602 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -17.819 -3.468 -2.296 1.00 0.00 H new ATOM 1691 N GLY A 117 -18.508 -0.880 -0.849 1.00 0.00 N ATOM 1692 CA GLY A 117 -19.672 -0.243 -0.166 1.00 0.00 C ATOM 1693 C GLY A 117 -19.175 0.550 1.043 1.00 0.00 C ATOM 1694 O GLY A 117 -18.038 0.419 1.453 1.00 0.00 O ATOM 0 H GLY A 117 -17.860 -1.366 -0.229 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -20.198 0.416 -0.857 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -20.384 -1.005 0.152 1.00 0.00 H new ATOM 1698 N PRO A 118 -20.020 1.367 1.609 1.00 0.00 N ATOM 1699 CA PRO A 118 -19.667 2.202 2.795 1.00 0.00 C ATOM 1700 C PRO A 118 -19.212 1.346 3.983 1.00 0.00 C ATOM 1701 O PRO A 118 -18.474 1.797 4.837 1.00 0.00 O ATOM 1702 CB PRO A 118 -20.965 2.955 3.129 1.00 0.00 C ATOM 1703 CG PRO A 118 -22.055 2.230 2.405 1.00 0.00 C ATOM 1704 CD PRO A 118 -21.408 1.583 1.183 1.00 0.00 C ATOM 0 HA PRO A 118 -18.832 2.870 2.585 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -21.147 2.962 4.204 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -20.907 3.995 2.808 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -22.512 1.477 3.046 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -22.846 2.917 2.107 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -21.898 0.646 0.918 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -21.464 2.231 0.308 1.00 0.00 H new ATOM 1712 N ASN A 119 -19.647 0.114 4.041 1.00 0.00 N ATOM 1713 CA ASN A 119 -19.246 -0.779 5.169 1.00 0.00 C ATOM 1714 C ASN A 119 -18.698 -2.092 4.610 1.00 0.00 C ATOM 1715 O ASN A 119 -18.994 -3.161 5.105 1.00 0.00 O ATOM 1716 CB ASN A 119 -20.459 -1.062 6.059 1.00 0.00 C ATOM 1717 CG ASN A 119 -21.434 -1.986 5.322 1.00 0.00 C ATOM 1718 OD1 ASN A 119 -21.335 -2.163 4.125 1.00 0.00 O ATOM 1719 ND2 ASN A 119 -22.376 -2.587 5.996 1.00 0.00 N ATOM 0 H ASN A 119 -20.266 -0.314 3.352 1.00 0.00 H new ATOM 0 HA ASN A 119 -18.474 -0.289 5.762 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -20.138 -1.526 6.992 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -20.956 -0.128 6.322 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -23.030 -3.206 5.517 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -22.458 -2.438 7.002 1.00 0.00 H new ATOM 1726 N THR A 120 -17.897 -2.016 3.581 1.00 0.00 N ATOM 1727 CA THR A 120 -17.318 -3.246 2.982 1.00 0.00 C ATOM 1728 C THR A 120 -15.807 -3.073 2.862 1.00 0.00 C ATOM 1729 O THR A 120 -15.323 -2.130 2.269 1.00 0.00 O ATOM 1730 CB THR A 120 -17.921 -3.458 1.593 1.00 0.00 C ATOM 1731 OG1 THR A 120 -19.332 -3.578 1.703 1.00 0.00 O ATOM 1732 CG2 THR A 120 -17.343 -4.729 0.968 1.00 0.00 C ATOM 0 H THR A 120 -17.619 -1.145 3.128 1.00 0.00 H new ATOM 0 HA THR A 120 -17.540 -4.109 3.610 1.00 0.00 H new ATOM 0 HB THR A 120 -17.678 -2.605 0.959 1.00 0.00 H new ATOM 0 HG1 THR A 120 -19.719 -3.712 0.813 1.00 0.00 H new ATOM 0 HG21 THR A 120 -17.775 -4.877 -0.022 1.00 0.00 H new ATOM 0 HG22 THR A 120 -16.261 -4.632 0.881 1.00 0.00 H new ATOM 0 HG23 THR A 120 -17.581 -5.585 1.599 1.00 0.00 H new ATOM 1740 N ASN A 121 -15.063 -3.977 3.426 1.00 0.00 N ATOM 1741 CA ASN A 121 -13.575 -3.886 3.362 1.00 0.00 C ATOM 1742 C ASN A 121 -13.038 -4.975 2.432 1.00 0.00 C ATOM 1743 O ASN A 121 -13.617 -6.036 2.305 1.00 0.00 O ATOM 1744 CB ASN A 121 -12.996 -4.083 4.764 1.00 0.00 C ATOM 1745 CG ASN A 121 -13.530 -2.990 5.692 1.00 0.00 C ATOM 1746 OD1 ASN A 121 -13.601 -1.837 5.316 1.00 0.00 O ATOM 1747 ND2 ASN A 121 -13.914 -3.307 6.898 1.00 0.00 N ATOM 0 H ASN A 121 -15.422 -4.785 3.935 1.00 0.00 H new ATOM 0 HA ASN A 121 -13.285 -2.907 2.981 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -13.269 -5.066 5.147 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -11.907 -4.045 4.728 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -14.274 -2.587 7.525 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -13.855 -4.275 7.214 1.00 0.00 H new ATOM 1754 N GLY A 122 -11.935 -4.720 1.779 1.00 0.00 N ATOM 1755 CA GLY A 122 -11.354 -5.738 0.853 1.00 0.00 C ATOM 1756 C GLY A 122 -9.852 -5.860 1.105 1.00 0.00 C ATOM 1757 O GLY A 122 -9.255 -5.041 1.776 1.00 0.00 O ATOM 0 H GLY A 122 -11.410 -3.848 1.847 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -11.838 -6.702 1.006 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -11.537 -5.450 -0.182 1.00 0.00 H new ATOM 1761 N SER A 123 -9.234 -6.880 0.573 1.00 0.00 N ATOM 1762 CA SER A 123 -7.769 -7.059 0.782 1.00 0.00 C ATOM 1763 C SER A 123 -6.997 -6.192 -0.214 1.00 0.00 C ATOM 1764 O SER A 123 -5.783 -6.153 -0.206 1.00 0.00 O ATOM 1765 CB SER A 123 -7.401 -8.527 0.567 1.00 0.00 C ATOM 1766 OG SER A 123 -7.391 -8.810 -0.826 1.00 0.00 O ATOM 0 H SER A 123 -9.681 -7.597 0.002 1.00 0.00 H new ATOM 0 HA SER A 123 -7.510 -6.761 1.798 1.00 0.00 H new ATOM 0 HB2 SER A 123 -6.422 -8.735 0.999 1.00 0.00 H new ATOM 0 HB3 SER A 123 -8.118 -9.172 1.076 1.00 0.00 H new ATOM 0 HG SER A 123 -7.645 -9.745 -0.972 1.00 0.00 H new ATOM 1772 N GLN A 124 -7.692 -5.499 -1.077 1.00 0.00 N ATOM 1773 CA GLN A 124 -6.999 -4.636 -2.078 1.00 0.00 C ATOM 1774 C GLN A 124 -7.034 -3.178 -1.616 1.00 0.00 C ATOM 1775 O GLN A 124 -7.991 -2.728 -1.018 1.00 0.00 O ATOM 1776 CB GLN A 124 -7.709 -4.759 -3.429 1.00 0.00 C ATOM 1777 CG GLN A 124 -7.605 -6.199 -3.933 1.00 0.00 C ATOM 1778 CD GLN A 124 -8.353 -6.330 -5.261 1.00 0.00 C ATOM 1779 OE1 GLN A 124 -9.147 -5.482 -5.611 1.00 0.00 O ATOM 1780 NE2 GLN A 124 -8.132 -7.368 -6.020 1.00 0.00 N ATOM 0 H GLN A 124 -8.711 -5.493 -1.132 1.00 0.00 H new ATOM 0 HA GLN A 124 -5.962 -4.957 -2.177 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -8.756 -4.473 -3.329 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -7.260 -4.077 -4.151 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -6.559 -6.475 -4.064 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -8.026 -6.884 -3.197 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -7.465 -8.081 -5.727 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -8.627 -7.466 -6.907 1.00 0.00 H new ATOM 1789 N PHE A 125 -5.993 -2.439 -1.893 1.00 0.00 N ATOM 1790 CA PHE A 125 -5.952 -1.006 -1.477 1.00 0.00 C ATOM 1791 C PHE A 125 -5.343 -0.173 -2.605 1.00 0.00 C ATOM 1792 O PHE A 125 -4.718 -0.698 -3.506 1.00 0.00 O ATOM 1793 CB PHE A 125 -5.094 -0.864 -0.217 1.00 0.00 C ATOM 1794 CG PHE A 125 -3.669 -1.251 -0.533 1.00 0.00 C ATOM 1795 CD1 PHE A 125 -3.278 -2.593 -0.468 1.00 0.00 C ATOM 1796 CD2 PHE A 125 -2.738 -0.267 -0.889 1.00 0.00 C ATOM 1797 CE1 PHE A 125 -1.956 -2.953 -0.760 1.00 0.00 C ATOM 1798 CE2 PHE A 125 -1.417 -0.626 -1.181 1.00 0.00 C ATOM 1799 CZ PHE A 125 -1.026 -1.970 -1.116 1.00 0.00 C ATOM 0 H PHE A 125 -5.166 -2.767 -2.391 1.00 0.00 H new ATOM 0 HA PHE A 125 -6.963 -0.656 -1.267 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -5.131 0.163 0.148 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -5.487 -1.499 0.577 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -3.996 -3.352 -0.193 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -3.039 0.769 -0.938 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.655 -3.989 -0.710 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -0.699 0.133 -1.456 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.007 -2.247 -1.341 1.00 0.00 H new ATOM 1809 N PHE A 126 -5.520 1.122 -2.568 1.00 0.00 N ATOM 1810 CA PHE A 126 -4.951 1.987 -3.643 1.00 0.00 C ATOM 1811 C PHE A 126 -4.298 3.223 -3.021 1.00 0.00 C ATOM 1812 O PHE A 126 -4.654 3.651 -1.940 1.00 0.00 O ATOM 1813 CB PHE A 126 -6.073 2.425 -4.586 1.00 0.00 C ATOM 1814 CG PHE A 126 -7.083 3.245 -3.819 1.00 0.00 C ATOM 1815 CD1 PHE A 126 -8.112 2.606 -3.116 1.00 0.00 C ATOM 1816 CD2 PHE A 126 -6.991 4.642 -3.811 1.00 0.00 C ATOM 1817 CE1 PHE A 126 -9.049 3.366 -2.405 1.00 0.00 C ATOM 1818 CE2 PHE A 126 -7.929 5.400 -3.099 1.00 0.00 C ATOM 1819 CZ PHE A 126 -8.958 4.762 -2.396 1.00 0.00 C ATOM 0 H PHE A 126 -6.034 1.618 -1.840 1.00 0.00 H new ATOM 0 HA PHE A 126 -4.201 1.426 -4.200 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -5.663 3.010 -5.409 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -6.555 1.552 -5.025 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -8.183 1.528 -3.122 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -6.198 5.135 -4.353 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -9.843 2.874 -1.863 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -7.859 6.478 -3.092 1.00 0.00 H new ATOM 0 HZ PHE A 126 -9.681 5.347 -1.847 1.00 0.00 H new ATOM 1829 N ILE A 127 -3.343 3.800 -3.704 1.00 0.00 N ATOM 1830 CA ILE A 127 -2.656 5.015 -3.171 1.00 0.00 C ATOM 1831 C ILE A 127 -2.762 6.150 -4.194 1.00 0.00 C ATOM 1832 O ILE A 127 -2.530 5.957 -5.370 1.00 0.00 O ATOM 1833 CB ILE A 127 -1.181 4.697 -2.917 1.00 0.00 C ATOM 1834 CG1 ILE A 127 -1.078 3.501 -1.970 1.00 0.00 C ATOM 1835 CG2 ILE A 127 -0.498 5.909 -2.279 1.00 0.00 C ATOM 1836 CD1 ILE A 127 0.392 3.121 -1.782 1.00 0.00 C ATOM 0 H ILE A 127 -3.008 3.480 -4.613 1.00 0.00 H new ATOM 0 HA ILE A 127 -3.129 5.319 -2.237 1.00 0.00 H new ATOM 0 HB ILE A 127 -0.692 4.461 -3.862 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -1.527 3.747 -1.007 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -1.634 2.655 -2.374 1.00 0.00 H new ATOM 0 HG21 ILE A 127 0.553 5.681 -2.098 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -0.574 6.765 -2.950 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -0.986 6.145 -1.333 1.00 0.00 H new ATOM 0 HD11 ILE A 127 0.464 2.268 -1.107 1.00 0.00 H new ATOM 0 HD12 ILE A 127 0.826 2.858 -2.747 1.00 0.00 H new ATOM 0 HD13 ILE A 127 0.935 3.966 -1.359 1.00 0.00 H new ATOM 1848 N CYS A 128 -3.105 7.333 -3.755 1.00 0.00 N ATOM 1849 CA CYS A 128 -3.223 8.483 -4.701 1.00 0.00 C ATOM 1850 C CYS A 128 -2.147 9.522 -4.373 1.00 0.00 C ATOM 1851 O CYS A 128 -2.173 10.147 -3.331 1.00 0.00 O ATOM 1852 CB CYS A 128 -4.610 9.119 -4.561 1.00 0.00 C ATOM 1853 SG CYS A 128 -5.839 7.821 -4.275 1.00 0.00 S ATOM 0 H CYS A 128 -3.309 7.553 -2.780 1.00 0.00 H new ATOM 0 HA CYS A 128 -3.088 8.130 -5.724 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -4.615 9.829 -3.734 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -4.859 9.679 -5.463 1.00 0.00 H new ATOM 0 HG CYS A 128 -6.974 8.363 -3.945 1.00 0.00 H new ATOM 1859 N THR A 129 -1.201 9.711 -5.253 1.00 0.00 N ATOM 1860 CA THR A 129 -0.123 10.707 -4.992 1.00 0.00 C ATOM 1861 C THR A 129 -0.501 12.045 -5.632 1.00 0.00 C ATOM 1862 O THR A 129 0.224 13.016 -5.539 1.00 0.00 O ATOM 1863 CB THR A 129 1.188 10.211 -5.604 1.00 0.00 C ATOM 1864 OG1 THR A 129 1.174 10.459 -7.002 1.00 0.00 O ATOM 1865 CG2 THR A 129 1.334 8.710 -5.355 1.00 0.00 C ATOM 0 H THR A 129 -1.128 9.218 -6.143 1.00 0.00 H new ATOM 0 HA THR A 129 -0.001 10.835 -3.916 1.00 0.00 H new ATOM 0 HB THR A 129 2.026 10.736 -5.146 1.00 0.00 H new ATOM 0 HG1 THR A 129 1.176 9.607 -7.485 1.00 0.00 H new ATOM 0 HG21 THR A 129 2.269 8.358 -5.792 1.00 0.00 H new ATOM 0 HG22 THR A 129 1.340 8.518 -4.282 1.00 0.00 H new ATOM 0 HG23 THR A 129 0.498 8.182 -5.813 1.00 0.00 H new ATOM 1873 N ALA A 130 -1.632 12.100 -6.285 1.00 0.00 N ATOM 1874 CA ALA A 130 -2.068 13.368 -6.942 1.00 0.00 C ATOM 1875 C ALA A 130 -3.265 13.945 -6.185 1.00 0.00 C ATOM 1876 O ALA A 130 -4.023 13.228 -5.564 1.00 0.00 O ATOM 1877 CB ALA A 130 -2.472 13.078 -8.388 1.00 0.00 C ATOM 0 H ALA A 130 -2.276 11.317 -6.392 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.248 14.086 -6.930 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -2.791 14.003 -8.869 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -1.621 12.663 -8.927 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -3.293 12.361 -8.400 1.00 0.00 H new ATOM 1883 N LYS A 131 -3.444 15.237 -6.233 1.00 0.00 N ATOM 1884 CA LYS A 131 -4.596 15.853 -5.517 1.00 0.00 C ATOM 1885 C LYS A 131 -5.873 15.623 -6.326 1.00 0.00 C ATOM 1886 O LYS A 131 -6.020 16.117 -7.426 1.00 0.00 O ATOM 1887 CB LYS A 131 -4.353 17.354 -5.361 1.00 0.00 C ATOM 1888 CG LYS A 131 -3.126 17.582 -4.475 1.00 0.00 C ATOM 1889 CD LYS A 131 -2.818 19.081 -4.394 1.00 0.00 C ATOM 1890 CE LYS A 131 -3.931 19.803 -3.629 1.00 0.00 C ATOM 1891 NZ LYS A 131 -3.409 21.095 -3.100 1.00 0.00 N ATOM 0 H LYS A 131 -2.844 15.891 -6.736 1.00 0.00 H new ATOM 0 HA LYS A 131 -4.701 15.399 -4.532 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -4.200 17.812 -6.338 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -5.228 17.831 -4.919 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -3.307 17.184 -3.477 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -2.268 17.046 -4.881 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -1.862 19.238 -3.895 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -2.726 19.497 -5.397 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -4.782 19.983 -4.286 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -4.288 19.179 -2.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -4.163 21.587 -2.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -2.610 20.911 -2.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -3.089 21.690 -3.891 1.00 0.00 H new ATOM 1905 N THR A 132 -6.799 14.874 -5.785 1.00 0.00 N ATOM 1906 CA THR A 132 -8.074 14.602 -6.514 1.00 0.00 C ATOM 1907 C THR A 132 -9.259 14.907 -5.595 1.00 0.00 C ATOM 1908 O THR A 132 -9.130 14.917 -4.387 1.00 0.00 O ATOM 1909 CB THR A 132 -8.112 13.128 -6.924 1.00 0.00 C ATOM 1910 OG1 THR A 132 -8.179 12.324 -5.756 1.00 0.00 O ATOM 1911 CG2 THR A 132 -6.850 12.782 -7.714 1.00 0.00 C ATOM 0 H THR A 132 -6.727 14.437 -4.866 1.00 0.00 H new ATOM 0 HA THR A 132 -8.133 15.231 -7.402 1.00 0.00 H new ATOM 0 HB THR A 132 -8.986 12.943 -7.548 1.00 0.00 H new ATOM 0 HG1 THR A 132 -7.284 12.238 -5.367 1.00 0.00 H new ATOM 0 HG21 THR A 132 -6.879 11.732 -8.005 1.00 0.00 H new ATOM 0 HG22 THR A 132 -6.798 13.405 -8.607 1.00 0.00 H new ATOM 0 HG23 THR A 132 -5.972 12.962 -7.094 1.00 0.00 H new ATOM 1919 N GLU A 133 -10.413 15.151 -6.158 1.00 0.00 N ATOM 1920 CA GLU A 133 -11.612 15.453 -5.319 1.00 0.00 C ATOM 1921 C GLU A 133 -12.605 14.289 -5.400 1.00 0.00 C ATOM 1922 O GLU A 133 -13.205 13.906 -4.417 1.00 0.00 O ATOM 1923 CB GLU A 133 -12.280 16.731 -5.830 1.00 0.00 C ATOM 1924 CG GLU A 133 -11.312 17.907 -5.691 1.00 0.00 C ATOM 1925 CD GLU A 133 -12.006 19.195 -6.135 1.00 0.00 C ATOM 1926 OE1 GLU A 133 -13.099 19.102 -6.670 1.00 0.00 O ATOM 1927 OE2 GLU A 133 -11.434 20.254 -5.933 1.00 0.00 O ATOM 0 H GLU A 133 -10.578 15.154 -7.165 1.00 0.00 H new ATOM 0 HA GLU A 133 -11.304 15.591 -4.283 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -12.572 16.609 -6.873 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -13.191 16.928 -5.265 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -10.980 17.998 -4.657 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -10.423 17.733 -6.297 1.00 0.00 H new ATOM 1934 N TRP A 134 -12.789 13.729 -6.566 1.00 0.00 N ATOM 1935 CA TRP A 134 -13.750 12.598 -6.706 1.00 0.00 C ATOM 1936 C TRP A 134 -13.281 11.411 -5.855 1.00 0.00 C ATOM 1937 O TRP A 134 -14.080 10.678 -5.306 1.00 0.00 O ATOM 1938 CB TRP A 134 -13.864 12.184 -8.183 1.00 0.00 C ATOM 1939 CG TRP A 134 -12.552 12.374 -8.879 1.00 0.00 C ATOM 1940 CD1 TRP A 134 -11.747 11.372 -9.299 1.00 0.00 C ATOM 1941 CD2 TRP A 134 -11.888 13.616 -9.255 1.00 0.00 C ATOM 1942 NE1 TRP A 134 -10.625 11.920 -9.895 1.00 0.00 N ATOM 1943 CE2 TRP A 134 -10.666 13.299 -9.894 1.00 0.00 C ATOM 1944 CE3 TRP A 134 -12.223 14.974 -9.102 1.00 0.00 C ATOM 1945 CZ2 TRP A 134 -9.806 14.292 -10.362 1.00 0.00 C ATOM 1946 CZ3 TRP A 134 -11.359 15.977 -9.574 1.00 0.00 C ATOM 1947 CH2 TRP A 134 -10.154 15.637 -10.203 1.00 0.00 C ATOM 0 H TRP A 134 -12.316 14.006 -7.426 1.00 0.00 H new ATOM 0 HA TRP A 134 -14.732 12.917 -6.357 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -14.172 11.141 -8.253 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -14.634 12.778 -8.676 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -11.947 10.317 -9.187 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -9.860 11.371 -10.288 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -13.150 15.247 -8.619 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -8.877 14.024 -10.844 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -11.626 17.016 -9.451 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -9.495 16.413 -10.564 1.00 0.00 H new ATOM 1958 N LEU A 135 -11.995 11.215 -5.734 1.00 0.00 N ATOM 1959 CA LEU A 135 -11.487 10.078 -4.910 1.00 0.00 C ATOM 1960 C LEU A 135 -11.925 10.260 -3.456 1.00 0.00 C ATOM 1961 O LEU A 135 -12.173 9.302 -2.748 1.00 0.00 O ATOM 1962 CB LEU A 135 -9.966 10.033 -4.976 1.00 0.00 C ATOM 1963 CG LEU A 135 -9.505 9.935 -6.435 1.00 0.00 C ATOM 1964 CD1 LEU A 135 -8.069 9.452 -6.458 1.00 0.00 C ATOM 1965 CD2 LEU A 135 -10.367 8.941 -7.215 1.00 0.00 C ATOM 0 H LEU A 135 -11.275 11.792 -6.169 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.895 9.145 -5.300 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -9.548 10.927 -4.513 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -9.595 9.178 -4.411 1.00 0.00 H new ATOM 0 HG LEU A 135 -9.596 10.918 -6.898 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -7.727 9.377 -7.490 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -7.439 10.158 -5.917 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -8.007 8.473 -5.983 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -10.020 8.890 -8.247 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -10.290 7.955 -6.757 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -11.406 9.269 -7.198 1.00 0.00 H new ATOM 1977 N ASP A 136 -12.018 11.478 -3.001 1.00 0.00 N ATOM 1978 CA ASP A 136 -12.434 11.718 -1.591 1.00 0.00 C ATOM 1979 C ASP A 136 -13.954 11.586 -1.477 1.00 0.00 C ATOM 1980 O ASP A 136 -14.698 12.316 -2.102 1.00 0.00 O ATOM 1981 CB ASP A 136 -12.010 13.125 -1.169 1.00 0.00 C ATOM 1982 CG ASP A 136 -12.313 13.327 0.317 1.00 0.00 C ATOM 1983 OD1 ASP A 136 -12.744 12.377 0.948 1.00 0.00 O ATOM 1984 OD2 ASP A 136 -12.105 14.429 0.799 1.00 0.00 O ATOM 0 H ASP A 136 -11.824 12.319 -3.545 1.00 0.00 H new ATOM 0 HA ASP A 136 -11.958 10.984 -0.941 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -10.946 13.267 -1.356 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -12.540 13.869 -1.763 1.00 0.00 H new ATOM 1989 N GLY A 137 -14.420 10.660 -0.683 1.00 0.00 N ATOM 1990 CA GLY A 137 -15.891 10.481 -0.530 1.00 0.00 C ATOM 1991 C GLY A 137 -16.179 9.617 0.701 1.00 0.00 C ATOM 1992 O GLY A 137 -15.870 9.986 1.816 1.00 0.00 O ATOM 0 H GLY A 137 -13.845 10.020 -0.134 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -16.377 11.451 -0.427 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -16.305 10.010 -1.422 1.00 0.00 H new ATOM 1996 N LYS A 138 -16.773 8.472 0.504 1.00 0.00 N ATOM 1997 CA LYS A 138 -17.087 7.581 1.659 1.00 0.00 C ATOM 1998 C LYS A 138 -15.882 6.692 1.969 1.00 0.00 C ATOM 1999 O LYS A 138 -15.958 5.790 2.781 1.00 0.00 O ATOM 2000 CB LYS A 138 -18.294 6.703 1.312 1.00 0.00 C ATOM 2001 CG LYS A 138 -19.537 7.587 1.099 1.00 0.00 C ATOM 2002 CD LYS A 138 -19.935 7.585 -0.381 1.00 0.00 C ATOM 2003 CE LYS A 138 -20.686 6.294 -0.714 1.00 0.00 C ATOM 2004 NZ LYS A 138 -21.165 6.348 -2.124 1.00 0.00 N ATOM 0 H LYS A 138 -17.055 8.114 -0.408 1.00 0.00 H new ATOM 0 HA LYS A 138 -17.318 8.191 2.532 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -18.088 6.125 0.411 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -18.478 5.988 2.114 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -20.364 7.219 1.707 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -19.329 8.606 1.427 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -20.563 8.449 -0.599 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -19.046 7.671 -1.006 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -20.032 5.434 -0.574 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -21.530 6.167 -0.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -21.676 5.471 -2.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -21.803 7.161 -2.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -20.351 6.450 -2.763 1.00 0.00 H new ATOM 2018 N HIS A 139 -14.772 6.930 1.327 1.00 0.00 N ATOM 2019 CA HIS A 139 -13.568 6.090 1.584 1.00 0.00 C ATOM 2020 C HIS A 139 -13.016 6.398 2.978 1.00 0.00 C ATOM 2021 O HIS A 139 -13.164 7.493 3.485 1.00 0.00 O ATOM 2022 CB HIS A 139 -12.498 6.397 0.534 1.00 0.00 C ATOM 2023 CG HIS A 139 -13.000 5.996 -0.826 1.00 0.00 C ATOM 2024 ND1 HIS A 139 -13.668 6.884 -1.659 1.00 0.00 N ATOM 2025 CD2 HIS A 139 -12.942 4.808 -1.512 1.00 0.00 C ATOM 2026 CE1 HIS A 139 -13.982 6.221 -2.789 1.00 0.00 C ATOM 2027 NE2 HIS A 139 -13.563 4.955 -2.747 1.00 0.00 N ATOM 0 H HIS A 139 -14.646 7.669 0.636 1.00 0.00 H new ATOM 0 HA HIS A 139 -13.843 5.037 1.527 1.00 0.00 H new ATOM 0 HB2 HIS A 139 -12.257 7.460 0.545 1.00 0.00 H new ATOM 0 HB3 HIS A 139 -11.579 5.859 0.767 1.00 0.00 H new ATOM 0 HD2 HIS A 139 -12.485 3.900 -1.148 1.00 0.00 H new ATOM 0 HE1 HIS A 139 -14.507 6.660 -3.625 1.00 0.00 H new ATOM 0 HE2 HIS A 139 -13.675 4.244 -3.470 1.00 0.00 H new ATOM 2036 N VAL A 140 -12.382 5.438 3.599 1.00 0.00 N ATOM 2037 CA VAL A 140 -11.818 5.658 4.965 1.00 0.00 C ATOM 2038 C VAL A 140 -10.299 5.470 4.926 1.00 0.00 C ATOM 2039 O VAL A 140 -9.790 4.595 4.253 1.00 0.00 O ATOM 2040 CB VAL A 140 -12.430 4.653 5.940 1.00 0.00 C ATOM 2041 CG1 VAL A 140 -11.938 4.953 7.357 1.00 0.00 C ATOM 2042 CG2 VAL A 140 -13.957 4.768 5.895 1.00 0.00 C ATOM 0 H VAL A 140 -12.229 4.505 3.216 1.00 0.00 H new ATOM 0 HA VAL A 140 -12.052 6.670 5.294 1.00 0.00 H new ATOM 0 HB VAL A 140 -12.131 3.643 5.659 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -12.374 4.236 8.053 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -10.851 4.875 7.389 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -12.237 5.962 7.640 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -14.396 4.052 6.590 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -14.254 5.778 6.178 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -14.308 4.556 4.885 1.00 0.00 H new ATOM 2052 N VAL A 141 -9.574 6.288 5.640 1.00 0.00 N ATOM 2053 CA VAL A 141 -8.087 6.168 5.649 1.00 0.00 C ATOM 2054 C VAL A 141 -7.640 5.433 6.914 1.00 0.00 C ATOM 2055 O VAL A 141 -8.088 5.731 8.004 1.00 0.00 O ATOM 2056 CB VAL A 141 -7.475 7.570 5.634 1.00 0.00 C ATOM 2057 CG1 VAL A 141 -5.951 7.469 5.583 1.00 0.00 C ATOM 2058 CG2 VAL A 141 -7.976 8.329 4.404 1.00 0.00 C ATOM 0 H VAL A 141 -9.949 7.038 6.220 1.00 0.00 H new ATOM 0 HA VAL A 141 -7.758 5.610 4.772 1.00 0.00 H new ATOM 0 HB VAL A 141 -7.770 8.102 6.539 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -5.520 8.470 5.572 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -5.593 6.929 6.459 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -5.652 6.936 4.681 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -7.541 9.328 4.391 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -7.682 7.794 3.501 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -9.063 8.407 4.442 1.00 0.00 H new ATOM 2068 N PHE A 142 -6.760 4.472 6.780 1.00 0.00 N ATOM 2069 CA PHE A 142 -6.282 3.719 7.978 1.00 0.00 C ATOM 2070 C PHE A 142 -4.830 4.095 8.282 1.00 0.00 C ATOM 2071 O PHE A 142 -4.230 3.592 9.211 1.00 0.00 O ATOM 2072 CB PHE A 142 -6.387 2.212 7.715 1.00 0.00 C ATOM 2073 CG PHE A 142 -5.353 1.781 6.701 1.00 0.00 C ATOM 2074 CD1 PHE A 142 -5.619 1.906 5.332 1.00 0.00 C ATOM 2075 CD2 PHE A 142 -4.134 1.242 7.131 1.00 0.00 C ATOM 2076 CE1 PHE A 142 -4.665 1.495 4.394 1.00 0.00 C ATOM 2077 CE2 PHE A 142 -3.181 0.829 6.193 1.00 0.00 C ATOM 2078 CZ PHE A 142 -3.446 0.955 4.824 1.00 0.00 C ATOM 0 H PHE A 142 -6.353 4.177 5.893 1.00 0.00 H new ATOM 0 HA PHE A 142 -6.902 3.977 8.836 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -6.244 1.663 8.646 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -7.385 1.968 7.352 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -6.560 2.319 5.000 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -3.929 1.145 8.187 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -4.869 1.594 3.338 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -2.241 0.413 6.525 1.00 0.00 H new ATOM 0 HZ PHE A 142 -2.711 0.636 4.100 1.00 0.00 H new ATOM 2088 N GLY A 143 -4.259 4.983 7.512 1.00 0.00 N ATOM 2089 CA GLY A 143 -2.849 5.392 7.767 1.00 0.00 C ATOM 2090 C GLY A 143 -2.464 6.535 6.823 1.00 0.00 C ATOM 2091 O GLY A 143 -3.262 6.990 6.027 1.00 0.00 O ATOM 0 H GLY A 143 -4.708 5.441 6.719 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -2.734 5.709 8.803 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -2.181 4.543 7.617 1.00 0.00 H new ATOM 2095 N GLN A 144 -1.249 7.006 6.909 1.00 0.00 N ATOM 2096 CA GLN A 144 -0.811 8.124 6.025 1.00 0.00 C ATOM 2097 C GLN A 144 0.672 7.953 5.678 1.00 0.00 C ATOM 2098 O GLN A 144 1.369 7.156 6.273 1.00 0.00 O ATOM 2099 CB GLN A 144 -1.016 9.454 6.753 1.00 0.00 C ATOM 2100 CG GLN A 144 -0.102 9.506 7.979 1.00 0.00 C ATOM 2101 CD GLN A 144 -0.495 10.689 8.862 1.00 0.00 C ATOM 2102 OE1 GLN A 144 -1.664 10.945 9.071 1.00 0.00 O ATOM 2103 NE2 GLN A 144 0.440 11.429 9.395 1.00 0.00 N ATOM 0 H GLN A 144 -0.539 6.663 7.556 1.00 0.00 H new ATOM 0 HA GLN A 144 -1.399 8.115 5.107 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -0.794 10.286 6.084 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -2.058 9.559 7.057 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -0.180 8.577 8.543 1.00 0.00 H new ATOM 0 HG3 GLN A 144 0.938 9.602 7.666 1.00 0.00 H new ATOM 0 HE21 GLN A 144 1.422 11.215 9.220 1.00 0.00 H new ATOM 0 HE22 GLN A 144 0.188 12.221 9.986 1.00 0.00 H new ATOM 2112 N VAL A 145 1.160 8.694 4.716 1.00 0.00 N ATOM 2113 CA VAL A 145 2.583 8.579 4.327 1.00 0.00 C ATOM 2114 C VAL A 145 3.389 9.688 5.007 1.00 0.00 C ATOM 2115 O VAL A 145 3.022 10.845 4.971 1.00 0.00 O ATOM 2116 CB VAL A 145 2.676 8.738 2.813 1.00 0.00 C ATOM 2117 CG1 VAL A 145 4.133 8.893 2.412 1.00 0.00 C ATOM 2118 CG2 VAL A 145 2.088 7.504 2.129 1.00 0.00 C ATOM 0 H VAL A 145 0.622 9.378 4.183 1.00 0.00 H new ATOM 0 HA VAL A 145 2.982 7.612 4.632 1.00 0.00 H new ATOM 0 HB VAL A 145 2.116 9.621 2.506 1.00 0.00 H new ATOM 0 HG11 VAL A 145 4.203 9.007 1.330 1.00 0.00 H new ATOM 0 HG12 VAL A 145 4.552 9.774 2.897 1.00 0.00 H new ATOM 0 HG13 VAL A 145 4.691 8.009 2.720 1.00 0.00 H new ATOM 0 HG21 VAL A 145 2.156 7.621 1.047 1.00 0.00 H new ATOM 0 HG22 VAL A 145 2.645 6.618 2.434 1.00 0.00 H new ATOM 0 HG23 VAL A 145 1.043 7.392 2.417 1.00 0.00 H new ATOM 2128 N VAL A 146 4.491 9.342 5.622 1.00 0.00 N ATOM 2129 CA VAL A 146 5.329 10.373 6.300 1.00 0.00 C ATOM 2130 C VAL A 146 6.611 10.606 5.495 1.00 0.00 C ATOM 2131 O VAL A 146 7.121 11.707 5.429 1.00 0.00 O ATOM 2132 CB VAL A 146 5.688 9.890 7.708 1.00 0.00 C ATOM 2133 CG1 VAL A 146 4.432 9.882 8.580 1.00 0.00 C ATOM 2134 CG2 VAL A 146 6.260 8.472 7.633 1.00 0.00 C ATOM 0 H VAL A 146 4.846 8.388 5.683 1.00 0.00 H new ATOM 0 HA VAL A 146 4.772 11.307 6.366 1.00 0.00 H new ATOM 0 HB VAL A 146 6.430 10.560 8.141 1.00 0.00 H new ATOM 0 HG11 VAL A 146 4.687 9.538 9.582 1.00 0.00 H new ATOM 0 HG12 VAL A 146 4.021 10.890 8.636 1.00 0.00 H new ATOM 0 HG13 VAL A 146 3.691 9.212 8.144 1.00 0.00 H new ATOM 0 HG21 VAL A 146 6.515 8.129 8.636 1.00 0.00 H new ATOM 0 HG22 VAL A 146 5.517 7.803 7.199 1.00 0.00 H new ATOM 0 HG23 VAL A 146 7.155 8.473 7.011 1.00 0.00 H new ATOM 2144 N GLU A 147 7.139 9.577 4.885 1.00 0.00 N ATOM 2145 CA GLU A 147 8.392 9.740 4.087 1.00 0.00 C ATOM 2146 C GLU A 147 8.344 8.828 2.859 1.00 0.00 C ATOM 2147 O GLU A 147 7.521 7.939 2.764 1.00 0.00 O ATOM 2148 CB GLU A 147 9.599 9.361 4.949 1.00 0.00 C ATOM 2149 CG GLU A 147 9.659 10.269 6.178 1.00 0.00 C ATOM 2150 CD GLU A 147 10.925 9.957 6.980 1.00 0.00 C ATOM 2151 OE1 GLU A 147 11.580 8.979 6.659 1.00 0.00 O ATOM 2152 OE2 GLU A 147 11.216 10.700 7.902 1.00 0.00 O ATOM 0 H GLU A 147 6.758 8.631 4.904 1.00 0.00 H new ATOM 0 HA GLU A 147 8.481 10.778 3.766 1.00 0.00 H new ATOM 0 HB2 GLU A 147 9.524 8.318 5.258 1.00 0.00 H new ATOM 0 HB3 GLU A 147 10.517 9.457 4.369 1.00 0.00 H new ATOM 0 HG2 GLU A 147 9.658 11.315 5.871 1.00 0.00 H new ATOM 0 HG3 GLU A 147 8.776 10.118 6.799 1.00 0.00 H new ATOM 2159 N GLY A 148 9.232 9.035 1.922 1.00 0.00 N ATOM 2160 CA GLY A 148 9.252 8.173 0.701 1.00 0.00 C ATOM 2161 C GLY A 148 8.496 8.856 -0.440 1.00 0.00 C ATOM 2162 O GLY A 148 8.325 8.298 -1.505 1.00 0.00 O ATOM 0 H GLY A 148 9.945 9.764 1.949 1.00 0.00 H new ATOM 0 HA2 GLY A 148 10.282 7.980 0.400 1.00 0.00 H new ATOM 0 HA3 GLY A 148 8.797 7.207 0.921 1.00 0.00 H new ATOM 2166 N MET A 149 8.041 10.060 -0.232 1.00 0.00 N ATOM 2167 CA MET A 149 7.300 10.768 -1.312 1.00 0.00 C ATOM 2168 C MET A 149 8.207 10.939 -2.535 1.00 0.00 C ATOM 2169 O MET A 149 7.755 10.929 -3.662 1.00 0.00 O ATOM 2170 CB MET A 149 6.859 12.143 -0.808 1.00 0.00 C ATOM 2171 CG MET A 149 5.846 11.972 0.326 1.00 0.00 C ATOM 2172 SD MET A 149 5.188 13.591 0.800 1.00 0.00 S ATOM 2173 CE MET A 149 6.757 14.339 1.303 1.00 0.00 C ATOM 0 H MET A 149 8.150 10.583 0.637 1.00 0.00 H new ATOM 0 HA MET A 149 6.424 10.183 -1.593 1.00 0.00 H new ATOM 0 HB2 MET A 149 7.723 12.707 -0.456 1.00 0.00 H new ATOM 0 HB3 MET A 149 6.415 12.715 -1.623 1.00 0.00 H new ATOM 0 HG2 MET A 149 5.035 11.317 0.007 1.00 0.00 H new ATOM 0 HG3 MET A 149 6.321 11.496 1.184 1.00 0.00 H new ATOM 0 HE1 MET A 149 6.579 15.049 2.111 1.00 0.00 H new ATOM 0 HE2 MET A 149 7.438 13.560 1.647 1.00 0.00 H new ATOM 0 HE3 MET A 149 7.201 14.860 0.454 1.00 0.00 H new ATOM 2183 N ASP A 150 9.483 11.113 -2.328 1.00 0.00 N ATOM 2184 CA ASP A 150 10.402 11.294 -3.488 1.00 0.00 C ATOM 2185 C ASP A 150 10.442 10.015 -4.332 1.00 0.00 C ATOM 2186 O ASP A 150 10.442 10.065 -5.547 1.00 0.00 O ATOM 2187 CB ASP A 150 11.810 11.608 -2.977 1.00 0.00 C ATOM 2188 CG ASP A 150 11.808 12.971 -2.282 1.00 0.00 C ATOM 2189 OD1 ASP A 150 10.835 13.690 -2.435 1.00 0.00 O ATOM 2190 OD2 ASP A 150 12.781 13.272 -1.608 1.00 0.00 O ATOM 0 H ASP A 150 9.928 11.138 -1.411 1.00 0.00 H new ATOM 0 HA ASP A 150 10.040 12.117 -4.104 1.00 0.00 H new ATOM 0 HB2 ASP A 150 12.137 10.834 -2.283 1.00 0.00 H new ATOM 0 HB3 ASP A 150 12.517 11.612 -3.807 1.00 0.00 H new ATOM 2195 N VAL A 151 10.491 8.873 -3.702 1.00 0.00 N ATOM 2196 CA VAL A 151 10.545 7.597 -4.471 1.00 0.00 C ATOM 2197 C VAL A 151 9.144 7.176 -4.919 1.00 0.00 C ATOM 2198 O VAL A 151 8.971 6.594 -5.972 1.00 0.00 O ATOM 2199 CB VAL A 151 11.157 6.500 -3.596 1.00 0.00 C ATOM 2200 CG1 VAL A 151 10.358 6.369 -2.299 1.00 0.00 C ATOM 2201 CG2 VAL A 151 11.124 5.167 -4.348 1.00 0.00 C ATOM 0 H VAL A 151 10.496 8.768 -2.687 1.00 0.00 H new ATOM 0 HA VAL A 151 11.161 7.749 -5.357 1.00 0.00 H new ATOM 0 HB VAL A 151 12.189 6.762 -3.362 1.00 0.00 H new ATOM 0 HG11 VAL A 151 10.797 5.587 -1.679 1.00 0.00 H new ATOM 0 HG12 VAL A 151 10.382 7.316 -1.760 1.00 0.00 H new ATOM 0 HG13 VAL A 151 9.325 6.110 -2.532 1.00 0.00 H new ATOM 0 HG21 VAL A 151 11.560 4.387 -3.724 1.00 0.00 H new ATOM 0 HG22 VAL A 151 10.092 4.908 -4.585 1.00 0.00 H new ATOM 0 HG23 VAL A 151 11.697 5.256 -5.271 1.00 0.00 H new ATOM 2211 N VAL A 152 8.139 7.444 -4.128 1.00 0.00 N ATOM 2212 CA VAL A 152 6.761 7.033 -4.525 1.00 0.00 C ATOM 2213 C VAL A 152 6.431 7.621 -5.903 1.00 0.00 C ATOM 2214 O VAL A 152 5.870 6.956 -6.753 1.00 0.00 O ATOM 2215 CB VAL A 152 5.753 7.525 -3.470 1.00 0.00 C ATOM 2216 CG1 VAL A 152 5.284 8.946 -3.791 1.00 0.00 C ATOM 2217 CG2 VAL A 152 4.539 6.596 -3.442 1.00 0.00 C ATOM 0 H VAL A 152 8.211 7.926 -3.232 1.00 0.00 H new ATOM 0 HA VAL A 152 6.701 5.946 -4.584 1.00 0.00 H new ATOM 0 HB VAL A 152 6.247 7.523 -2.498 1.00 0.00 H new ATOM 0 HG11 VAL A 152 4.572 9.274 -3.033 1.00 0.00 H new ATOM 0 HG12 VAL A 152 6.141 9.619 -3.799 1.00 0.00 H new ATOM 0 HG13 VAL A 152 4.804 8.958 -4.769 1.00 0.00 H new ATOM 0 HG21 VAL A 152 3.829 6.948 -2.694 1.00 0.00 H new ATOM 0 HG22 VAL A 152 4.062 6.591 -4.422 1.00 0.00 H new ATOM 0 HG23 VAL A 152 4.860 5.585 -3.190 1.00 0.00 H new ATOM 2227 N LYS A 153 6.781 8.856 -6.135 1.00 0.00 N ATOM 2228 CA LYS A 153 6.497 9.479 -7.460 1.00 0.00 C ATOM 2229 C LYS A 153 7.310 8.774 -8.548 1.00 0.00 C ATOM 2230 O LYS A 153 6.884 8.659 -9.679 1.00 0.00 O ATOM 2231 CB LYS A 153 6.879 10.962 -7.426 1.00 0.00 C ATOM 2232 CG LYS A 153 5.970 11.704 -6.443 1.00 0.00 C ATOM 2233 CD LYS A 153 6.268 13.203 -6.510 1.00 0.00 C ATOM 2234 CE LYS A 153 5.452 13.933 -5.443 1.00 0.00 C ATOM 2235 NZ LYS A 153 5.752 15.391 -5.499 1.00 0.00 N ATOM 0 H LYS A 153 7.252 9.462 -5.464 1.00 0.00 H new ATOM 0 HA LYS A 153 5.434 9.381 -7.679 1.00 0.00 H new ATOM 0 HB2 LYS A 153 7.921 11.073 -7.127 1.00 0.00 H new ATOM 0 HB3 LYS A 153 6.785 11.395 -8.422 1.00 0.00 H new ATOM 0 HG2 LYS A 153 4.924 11.518 -6.687 1.00 0.00 H new ATOM 0 HG3 LYS A 153 6.132 11.334 -5.430 1.00 0.00 H new ATOM 0 HD2 LYS A 153 7.332 13.380 -6.354 1.00 0.00 H new ATOM 0 HD3 LYS A 153 6.022 13.590 -7.499 1.00 0.00 H new ATOM 0 HE2 LYS A 153 4.388 13.763 -5.605 1.00 0.00 H new ATOM 0 HE3 LYS A 153 5.691 13.539 -4.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 5.197 15.888 -4.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 6.766 15.544 -5.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 5.503 15.761 -6.439 1.00 0.00 H new ATOM 2249 N ALA A 154 8.487 8.318 -8.217 1.00 0.00 N ATOM 2250 CA ALA A 154 9.340 7.637 -9.234 1.00 0.00 C ATOM 2251 C ALA A 154 8.627 6.399 -9.781 1.00 0.00 C ATOM 2252 O ALA A 154 8.688 6.107 -10.958 1.00 0.00 O ATOM 2253 CB ALA A 154 10.659 7.216 -8.587 1.00 0.00 C ATOM 0 H ALA A 154 8.896 8.387 -7.285 1.00 0.00 H new ATOM 0 HA ALA A 154 9.532 8.327 -10.055 1.00 0.00 H new ATOM 0 HB1 ALA A 154 11.285 6.718 -9.328 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.176 8.098 -8.209 1.00 0.00 H new ATOM 0 HB3 ALA A 154 10.458 6.532 -7.763 1.00 0.00 H new ATOM 2259 N ILE A 155 7.963 5.659 -8.939 1.00 0.00 N ATOM 2260 CA ILE A 155 7.259 4.435 -9.418 1.00 0.00 C ATOM 2261 C ILE A 155 6.029 4.815 -10.249 1.00 0.00 C ATOM 2262 O ILE A 155 5.677 4.143 -11.198 1.00 0.00 O ATOM 2263 CB ILE A 155 6.820 3.601 -8.215 1.00 0.00 C ATOM 2264 CG1 ILE A 155 8.053 3.178 -7.411 1.00 0.00 C ATOM 2265 CG2 ILE A 155 6.074 2.356 -8.704 1.00 0.00 C ATOM 2266 CD1 ILE A 155 7.614 2.498 -6.113 1.00 0.00 C ATOM 0 H ILE A 155 7.876 5.847 -7.940 1.00 0.00 H new ATOM 0 HA ILE A 155 7.941 3.858 -10.043 1.00 0.00 H new ATOM 0 HB ILE A 155 6.160 4.193 -7.581 1.00 0.00 H new ATOM 0 HG12 ILE A 155 8.667 2.497 -8.000 1.00 0.00 H new ATOM 0 HG13 ILE A 155 8.669 4.049 -7.186 1.00 0.00 H new ATOM 0 HG21 ILE A 155 5.760 1.760 -7.847 1.00 0.00 H new ATOM 0 HG22 ILE A 155 5.197 2.659 -9.276 1.00 0.00 H new ATOM 0 HG23 ILE A 155 6.733 1.762 -9.337 1.00 0.00 H new ATOM 0 HD11 ILE A 155 8.494 2.198 -5.544 1.00 0.00 H new ATOM 0 HD12 ILE A 155 7.018 3.193 -5.521 1.00 0.00 H new ATOM 0 HD13 ILE A 155 7.017 1.617 -6.348 1.00 0.00 H new ATOM 2278 N GLU A 156 5.349 5.867 -9.883 1.00 0.00 N ATOM 2279 CA GLU A 156 4.124 6.264 -10.638 1.00 0.00 C ATOM 2280 C GLU A 156 4.482 6.990 -11.943 1.00 0.00 C ATOM 2281 O GLU A 156 3.849 6.785 -12.960 1.00 0.00 O ATOM 2282 CB GLU A 156 3.272 7.183 -9.762 1.00 0.00 C ATOM 2283 CG GLU A 156 1.924 7.435 -10.441 1.00 0.00 C ATOM 2284 CD GLU A 156 1.109 8.417 -9.599 1.00 0.00 C ATOM 2285 OE1 GLU A 156 1.629 8.876 -8.597 1.00 0.00 O ATOM 2286 OE2 GLU A 156 -0.021 8.689 -9.967 1.00 0.00 O ATOM 0 H GLU A 156 5.587 6.469 -9.095 1.00 0.00 H new ATOM 0 HA GLU A 156 3.569 5.361 -10.894 1.00 0.00 H new ATOM 0 HB2 GLU A 156 3.118 6.729 -8.783 1.00 0.00 H new ATOM 0 HB3 GLU A 156 3.790 8.128 -9.597 1.00 0.00 H new ATOM 0 HG2 GLU A 156 2.078 7.837 -11.442 1.00 0.00 H new ATOM 0 HG3 GLU A 156 1.380 6.497 -10.555 1.00 0.00 H new ATOM 2293 N LYS A 157 5.468 7.848 -11.930 1.00 0.00 N ATOM 2294 CA LYS A 157 5.815 8.585 -13.183 1.00 0.00 C ATOM 2295 C LYS A 157 6.227 7.595 -14.276 1.00 0.00 C ATOM 2296 O LYS A 157 5.964 7.806 -15.444 1.00 0.00 O ATOM 2297 CB LYS A 157 6.957 9.575 -12.919 1.00 0.00 C ATOM 2298 CG LYS A 157 8.271 8.821 -12.695 1.00 0.00 C ATOM 2299 CD LYS A 157 9.375 9.822 -12.341 1.00 0.00 C ATOM 2300 CE LYS A 157 10.740 9.139 -12.443 1.00 0.00 C ATOM 2301 NZ LYS A 157 11.740 9.905 -11.646 1.00 0.00 N ATOM 0 H LYS A 157 6.043 8.069 -11.117 1.00 0.00 H new ATOM 0 HA LYS A 157 4.938 9.140 -13.516 1.00 0.00 H new ATOM 0 HB2 LYS A 157 7.060 10.256 -13.764 1.00 0.00 H new ATOM 0 HB3 LYS A 157 6.725 10.184 -12.045 1.00 0.00 H new ATOM 0 HG2 LYS A 157 8.154 8.093 -11.892 1.00 0.00 H new ATOM 0 HG3 LYS A 157 8.542 8.265 -13.593 1.00 0.00 H new ATOM 0 HD2 LYS A 157 9.334 10.677 -13.015 1.00 0.00 H new ATOM 0 HD3 LYS A 157 9.223 10.204 -11.332 1.00 0.00 H new ATOM 0 HE2 LYS A 157 10.674 8.115 -12.076 1.00 0.00 H new ATOM 0 HE3 LYS A 157 11.054 9.085 -13.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 12.668 9.441 -11.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 11.809 10.875 -12.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 11.441 9.935 -10.650 1.00 0.00 H new ATOM 2315 N VAL A 158 6.869 6.520 -13.914 1.00 0.00 N ATOM 2316 CA VAL A 158 7.287 5.528 -14.944 1.00 0.00 C ATOM 2317 C VAL A 158 6.060 4.760 -15.436 1.00 0.00 C ATOM 2318 O VAL A 158 6.108 4.060 -16.429 1.00 0.00 O ATOM 2319 CB VAL A 158 8.306 4.554 -14.346 1.00 0.00 C ATOM 2320 CG1 VAL A 158 9.565 5.320 -13.943 1.00 0.00 C ATOM 2321 CG2 VAL A 158 7.709 3.880 -13.109 1.00 0.00 C ATOM 0 H VAL A 158 7.122 6.286 -12.954 1.00 0.00 H new ATOM 0 HA VAL A 158 7.748 6.050 -15.783 1.00 0.00 H new ATOM 0 HB VAL A 158 8.558 3.796 -15.088 1.00 0.00 H new ATOM 0 HG11 VAL A 158 10.291 4.628 -13.517 1.00 0.00 H new ATOM 0 HG12 VAL A 158 9.995 5.802 -14.821 1.00 0.00 H new ATOM 0 HG13 VAL A 158 9.309 6.078 -13.203 1.00 0.00 H new ATOM 0 HG21 VAL A 158 8.436 3.187 -12.685 1.00 0.00 H new ATOM 0 HG22 VAL A 158 7.456 4.638 -12.368 1.00 0.00 H new ATOM 0 HG23 VAL A 158 6.809 3.334 -13.391 1.00 0.00 H new ATOM 2331 N GLY A 159 4.958 4.883 -14.747 1.00 0.00 N ATOM 2332 CA GLY A 159 3.728 4.159 -15.172 1.00 0.00 C ATOM 2333 C GLY A 159 3.079 4.889 -16.348 1.00 0.00 C ATOM 2334 O GLY A 159 3.497 5.963 -16.733 1.00 0.00 O ATOM 0 H GLY A 159 4.857 5.454 -13.908 1.00 0.00 H new ATOM 0 HA2 GLY A 159 3.977 3.137 -15.459 1.00 0.00 H new ATOM 0 HA3 GLY A 159 3.027 4.095 -14.340 1.00 0.00 H new ATOM 2338 N SER A 160 2.062 4.309 -16.924 1.00 0.00 N ATOM 2339 CA SER A 160 1.383 4.959 -18.080 1.00 0.00 C ATOM 2340 C SER A 160 -0.063 4.467 -18.162 1.00 0.00 C ATOM 2341 O SER A 160 -0.493 3.645 -17.377 1.00 0.00 O ATOM 2342 CB SER A 160 2.117 4.601 -19.371 1.00 0.00 C ATOM 2343 OG SER A 160 1.587 5.370 -20.443 1.00 0.00 O ATOM 0 H SER A 160 1.671 3.410 -16.643 1.00 0.00 H new ATOM 0 HA SER A 160 1.393 6.041 -17.946 1.00 0.00 H new ATOM 0 HB2 SER A 160 3.184 4.795 -19.262 1.00 0.00 H new ATOM 0 HB3 SER A 160 2.007 3.537 -19.582 1.00 0.00 H new ATOM 0 HG SER A 160 2.058 5.143 -21.272 1.00 0.00 H new ATOM 2349 N SER A 161 -0.815 4.957 -19.107 1.00 0.00 N ATOM 2350 CA SER A 161 -2.230 4.512 -19.238 1.00 0.00 C ATOM 2351 C SER A 161 -2.272 2.986 -19.337 1.00 0.00 C ATOM 2352 O SER A 161 -3.218 2.352 -18.916 1.00 0.00 O ATOM 2353 CB SER A 161 -2.842 5.122 -20.498 1.00 0.00 C ATOM 2354 OG SER A 161 -4.231 4.814 -20.543 1.00 0.00 O ATOM 0 H SER A 161 -0.511 5.646 -19.794 1.00 0.00 H new ATOM 0 HA SER A 161 -2.798 4.838 -18.366 1.00 0.00 H new ATOM 0 HB2 SER A 161 -2.697 6.202 -20.500 1.00 0.00 H new ATOM 0 HB3 SER A 161 -2.342 4.732 -21.385 1.00 0.00 H new ATOM 0 HG SER A 161 -4.627 5.205 -21.350 1.00 0.00 H new ATOM 2360 N SER A 162 -1.250 2.391 -19.890 1.00 0.00 N ATOM 2361 CA SER A 162 -1.229 0.906 -20.015 1.00 0.00 C ATOM 2362 C SER A 162 -1.332 0.277 -18.623 1.00 0.00 C ATOM 2363 O SER A 162 -1.803 -0.832 -18.466 1.00 0.00 O ATOM 2364 CB SER A 162 0.077 0.468 -20.677 1.00 0.00 C ATOM 2365 OG SER A 162 1.161 0.732 -19.796 1.00 0.00 O ATOM 0 H SER A 162 -0.429 2.869 -20.261 1.00 0.00 H new ATOM 0 HA SER A 162 -2.071 0.580 -20.625 1.00 0.00 H new ATOM 0 HB2 SER A 162 0.038 -0.595 -20.916 1.00 0.00 H new ATOM 0 HB3 SER A 162 0.219 1.002 -21.617 1.00 0.00 H new ATOM 0 HG SER A 162 2.000 0.451 -20.217 1.00 0.00 H new ATOM 2371 N GLY A 163 -0.895 0.978 -17.611 1.00 0.00 N ATOM 2372 CA GLY A 163 -0.973 0.420 -16.229 1.00 0.00 C ATOM 2373 C GLY A 163 0.276 -0.414 -15.938 1.00 0.00 C ATOM 2374 O GLY A 163 0.283 -1.247 -15.053 1.00 0.00 O ATOM 0 H GLY A 163 -0.488 1.911 -17.681 1.00 0.00 H new ATOM 0 HA2 GLY A 163 -1.059 1.229 -15.504 1.00 0.00 H new ATOM 0 HA3 GLY A 163 -1.866 -0.196 -16.125 1.00 0.00 H new ATOM 2378 N ARG A 164 1.335 -0.199 -16.674 1.00 0.00 N ATOM 2379 CA ARG A 164 2.589 -0.977 -16.442 1.00 0.00 C ATOM 2380 C ARG A 164 3.738 -0.011 -16.147 1.00 0.00 C ATOM 2381 O ARG A 164 3.799 1.078 -16.684 1.00 0.00 O ATOM 2382 CB ARG A 164 2.919 -1.795 -17.692 1.00 0.00 C ATOM 2383 CG ARG A 164 1.813 -2.822 -17.938 1.00 0.00 C ATOM 2384 CD ARG A 164 2.193 -3.712 -19.121 1.00 0.00 C ATOM 2385 NE ARG A 164 1.029 -4.563 -19.495 1.00 0.00 N ATOM 2386 CZ ARG A 164 1.213 -5.654 -20.189 1.00 0.00 C ATOM 2387 NH1 ARG A 164 2.417 -5.997 -20.557 1.00 0.00 N ATOM 2388 NH2 ARG A 164 0.192 -6.398 -20.517 1.00 0.00 N ATOM 0 H ARG A 164 1.386 0.485 -17.429 1.00 0.00 H new ATOM 0 HA ARG A 164 2.451 -1.648 -15.595 1.00 0.00 H new ATOM 0 HB2 ARG A 164 3.016 -1.136 -18.555 1.00 0.00 H new ATOM 0 HB3 ARG A 164 3.877 -2.300 -17.567 1.00 0.00 H new ATOM 0 HG2 ARG A 164 1.663 -3.430 -17.046 1.00 0.00 H new ATOM 0 HG3 ARG A 164 0.870 -2.314 -18.140 1.00 0.00 H new ATOM 0 HD2 ARG A 164 2.496 -3.098 -19.969 1.00 0.00 H new ATOM 0 HD3 ARG A 164 3.046 -4.338 -18.860 1.00 0.00 H new ATOM 0 HE ARG A 164 0.088 -4.294 -19.209 1.00 0.00 H new ATOM 0 HH11 ARG A 164 3.214 -5.413 -20.303 1.00 0.00 H new ATOM 0 HH12 ARG A 164 2.561 -6.849 -21.099 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -0.749 -6.127 -20.231 1.00 0.00 H new ATOM 0 HH22 ARG A 164 0.335 -7.250 -21.059 1.00 0.00 H new ATOM 2402 N THR A 165 4.651 -0.397 -15.296 1.00 0.00 N ATOM 2403 CA THR A 165 5.793 0.503 -14.970 1.00 0.00 C ATOM 2404 C THR A 165 6.870 0.378 -16.048 1.00 0.00 C ATOM 2405 O THR A 165 7.020 -0.652 -16.674 1.00 0.00 O ATOM 2406 CB THR A 165 6.382 0.112 -13.612 1.00 0.00 C ATOM 2407 OG1 THR A 165 6.877 -1.218 -13.679 1.00 0.00 O ATOM 2408 CG2 THR A 165 5.299 0.203 -12.532 1.00 0.00 C ATOM 0 H THR A 165 4.655 -1.296 -14.814 1.00 0.00 H new ATOM 0 HA THR A 165 5.440 1.533 -14.930 1.00 0.00 H new ATOM 0 HB THR A 165 7.196 0.792 -13.361 1.00 0.00 H new ATOM 0 HG1 THR A 165 7.783 -1.249 -13.306 1.00 0.00 H new ATOM 0 HG21 THR A 165 5.723 -0.076 -11.567 1.00 0.00 H new ATOM 0 HG22 THR A 165 4.921 1.224 -12.481 1.00 0.00 H new ATOM 0 HG23 THR A 165 4.481 -0.474 -12.779 1.00 0.00 H new ATOM 2416 N ALA A 166 7.627 1.420 -16.265 1.00 0.00 N ATOM 2417 CA ALA A 166 8.699 1.358 -17.298 1.00 0.00 C ATOM 2418 C ALA A 166 9.778 0.373 -16.848 1.00 0.00 C ATOM 2419 O ALA A 166 10.352 -0.343 -17.643 1.00 0.00 O ATOM 2420 CB ALA A 166 9.315 2.747 -17.479 1.00 0.00 C ATOM 0 H ALA A 166 7.549 2.310 -15.772 1.00 0.00 H new ATOM 0 HA ALA A 166 8.275 1.026 -18.246 1.00 0.00 H new ATOM 0 HB1 ALA A 166 10.099 2.702 -18.235 1.00 0.00 H new ATOM 0 HB2 ALA A 166 8.544 3.448 -17.798 1.00 0.00 H new ATOM 0 HB3 ALA A 166 9.741 3.082 -16.533 1.00 0.00 H new ATOM 2426 N LYS A 167 10.051 0.334 -15.571 1.00 0.00 N ATOM 2427 CA LYS A 167 11.090 -0.600 -15.044 1.00 0.00 C ATOM 2428 C LYS A 167 10.435 -1.592 -14.083 1.00 0.00 C ATOM 2429 O LYS A 167 9.391 -1.327 -13.521 1.00 0.00 O ATOM 2430 CB LYS A 167 12.161 0.199 -14.296 1.00 0.00 C ATOM 2431 CG LYS A 167 12.860 1.152 -15.268 1.00 0.00 C ATOM 2432 CD LYS A 167 14.008 1.863 -14.549 1.00 0.00 C ATOM 2433 CE LYS A 167 14.626 2.907 -15.480 1.00 0.00 C ATOM 2434 NZ LYS A 167 13.669 4.035 -15.665 1.00 0.00 N ATOM 0 H LYS A 167 9.596 0.913 -14.865 1.00 0.00 H new ATOM 0 HA LYS A 167 11.550 -1.140 -15.872 1.00 0.00 H new ATOM 0 HB2 LYS A 167 11.706 0.763 -13.481 1.00 0.00 H new ATOM 0 HB3 LYS A 167 12.888 -0.478 -13.848 1.00 0.00 H new ATOM 0 HG2 LYS A 167 13.242 0.598 -16.126 1.00 0.00 H new ATOM 0 HG3 LYS A 167 12.149 1.883 -15.652 1.00 0.00 H new ATOM 0 HD2 LYS A 167 13.641 2.342 -13.641 1.00 0.00 H new ATOM 0 HD3 LYS A 167 14.764 1.139 -14.244 1.00 0.00 H new ATOM 0 HE2 LYS A 167 15.562 3.275 -15.061 1.00 0.00 H new ATOM 0 HE3 LYS A 167 14.864 2.456 -16.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 14.181 4.871 -16.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 12.940 3.762 -16.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 13.218 4.260 -14.755 1.00 0.00 H new ATOM 2448 N LYS A 168 11.034 -2.733 -13.888 1.00 0.00 N ATOM 2449 CA LYS A 168 10.439 -3.734 -12.962 1.00 0.00 C ATOM 2450 C LYS A 168 10.540 -3.215 -11.527 1.00 0.00 C ATOM 2451 O LYS A 168 11.584 -2.770 -11.093 1.00 0.00 O ATOM 2452 CB LYS A 168 11.204 -5.054 -13.080 1.00 0.00 C ATOM 2453 CG LYS A 168 11.021 -5.627 -14.486 1.00 0.00 C ATOM 2454 CD LYS A 168 11.686 -7.002 -14.567 1.00 0.00 C ATOM 2455 CE LYS A 168 11.610 -7.523 -16.003 1.00 0.00 C ATOM 2456 NZ LYS A 168 12.496 -8.713 -16.148 1.00 0.00 N ATOM 0 H LYS A 168 11.909 -3.015 -14.330 1.00 0.00 H new ATOM 0 HA LYS A 168 9.393 -3.896 -13.221 1.00 0.00 H new ATOM 0 HB2 LYS A 168 12.263 -4.892 -12.877 1.00 0.00 H new ATOM 0 HB3 LYS A 168 10.842 -5.764 -12.337 1.00 0.00 H new ATOM 0 HG2 LYS A 168 9.960 -5.710 -14.721 1.00 0.00 H new ATOM 0 HG3 LYS A 168 11.459 -4.955 -15.224 1.00 0.00 H new ATOM 0 HD2 LYS A 168 12.726 -6.934 -14.248 1.00 0.00 H new ATOM 0 HD3 LYS A 168 11.190 -7.698 -13.890 1.00 0.00 H new ATOM 0 HE2 LYS A 168 10.582 -7.789 -16.251 1.00 0.00 H new ATOM 0 HE3 LYS A 168 11.914 -6.743 -16.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 12.444 -9.067 -17.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 13.476 -8.445 -15.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 12.186 -9.458 -15.492 1.00 0.00 H new ATOM 2470 N VAL A 169 9.462 -3.267 -10.786 1.00 0.00 N ATOM 2471 CA VAL A 169 9.497 -2.773 -9.377 1.00 0.00 C ATOM 2472 C VAL A 169 9.086 -3.899 -8.427 1.00 0.00 C ATOM 2473 O VAL A 169 8.030 -4.485 -8.559 1.00 0.00 O ATOM 2474 CB VAL A 169 8.522 -1.604 -9.227 1.00 0.00 C ATOM 2475 CG1 VAL A 169 8.637 -1.020 -7.818 1.00 0.00 C ATOM 2476 CG2 VAL A 169 8.861 -0.523 -10.255 1.00 0.00 C ATOM 0 H VAL A 169 8.560 -3.630 -11.096 1.00 0.00 H new ATOM 0 HA VAL A 169 10.507 -2.444 -9.133 1.00 0.00 H new ATOM 0 HB VAL A 169 7.504 -1.957 -9.392 1.00 0.00 H new ATOM 0 HG11 VAL A 169 7.942 -0.187 -7.712 1.00 0.00 H new ATOM 0 HG12 VAL A 169 8.396 -1.789 -7.084 1.00 0.00 H new ATOM 0 HG13 VAL A 169 9.655 -0.667 -7.652 1.00 0.00 H new ATOM 0 HG21 VAL A 169 8.167 0.311 -10.149 1.00 0.00 H new ATOM 0 HG22 VAL A 169 9.879 -0.170 -10.090 1.00 0.00 H new ATOM 0 HG23 VAL A 169 8.779 -0.938 -11.260 1.00 0.00 H new ATOM 2486 N VAL A 170 9.914 -4.199 -7.464 1.00 0.00 N ATOM 2487 CA VAL A 170 9.583 -5.279 -6.491 1.00 0.00 C ATOM 2488 C VAL A 170 10.123 -4.900 -5.122 1.00 0.00 C ATOM 2489 O VAL A 170 11.160 -4.279 -4.998 1.00 0.00 O ATOM 2490 CB VAL A 170 10.204 -6.600 -6.949 1.00 0.00 C ATOM 2491 CG1 VAL A 170 9.776 -7.720 -5.999 1.00 0.00 C ATOM 2492 CG2 VAL A 170 9.727 -6.923 -8.366 1.00 0.00 C ATOM 0 H VAL A 170 10.811 -3.739 -7.308 1.00 0.00 H new ATOM 0 HA VAL A 170 8.501 -5.400 -6.435 1.00 0.00 H new ATOM 0 HB VAL A 170 11.291 -6.513 -6.942 1.00 0.00 H new ATOM 0 HG11 VAL A 170 10.218 -8.662 -6.324 1.00 0.00 H new ATOM 0 HG12 VAL A 170 10.115 -7.490 -4.989 1.00 0.00 H new ATOM 0 HG13 VAL A 170 8.690 -7.808 -6.006 1.00 0.00 H new ATOM 0 HG21 VAL A 170 10.169 -7.864 -8.693 1.00 0.00 H new ATOM 0 HG22 VAL A 170 8.641 -7.011 -8.373 1.00 0.00 H new ATOM 0 HG23 VAL A 170 10.031 -6.125 -9.043 1.00 0.00 H new ATOM 2502 N VAL A 171 9.418 -5.257 -4.093 1.00 0.00 N ATOM 2503 CA VAL A 171 9.878 -4.906 -2.731 1.00 0.00 C ATOM 2504 C VAL A 171 11.049 -5.800 -2.335 1.00 0.00 C ATOM 2505 O VAL A 171 10.954 -7.011 -2.346 1.00 0.00 O ATOM 2506 CB VAL A 171 8.727 -5.110 -1.753 1.00 0.00 C ATOM 2507 CG1 VAL A 171 9.006 -4.320 -0.489 1.00 0.00 C ATOM 2508 CG2 VAL A 171 7.434 -4.606 -2.379 1.00 0.00 C ATOM 0 H VAL A 171 8.542 -5.777 -4.137 1.00 0.00 H new ATOM 0 HA VAL A 171 10.202 -3.866 -2.710 1.00 0.00 H new ATOM 0 HB VAL A 171 8.630 -6.170 -1.517 1.00 0.00 H new ATOM 0 HG11 VAL A 171 8.187 -4.461 0.216 1.00 0.00 H new ATOM 0 HG12 VAL A 171 9.936 -4.669 -0.040 1.00 0.00 H new ATOM 0 HG13 VAL A 171 9.096 -3.262 -0.734 1.00 0.00 H new ATOM 0 HG21 VAL A 171 6.610 -4.752 -1.680 1.00 0.00 H new ATOM 0 HG22 VAL A 171 7.531 -3.545 -2.610 1.00 0.00 H new ATOM 0 HG23 VAL A 171 7.234 -5.160 -3.296 1.00 0.00 H new ATOM 2518 N GLU A 172 12.153 -5.210 -1.976 1.00 0.00 N ATOM 2519 CA GLU A 172 13.328 -6.021 -1.567 1.00 0.00 C ATOM 2520 C GLU A 172 13.026 -6.732 -0.248 1.00 0.00 C ATOM 2521 O GLU A 172 13.570 -7.782 0.034 1.00 0.00 O ATOM 2522 CB GLU A 172 14.547 -5.115 -1.385 1.00 0.00 C ATOM 2523 CG GLU A 172 14.988 -4.564 -2.743 1.00 0.00 C ATOM 2524 CD GLU A 172 16.265 -3.742 -2.566 1.00 0.00 C ATOM 2525 OE1 GLU A 172 16.578 -3.406 -1.434 1.00 0.00 O ATOM 2526 OE2 GLU A 172 16.912 -3.466 -3.561 1.00 0.00 O ATOM 0 H GLU A 172 12.291 -4.200 -1.949 1.00 0.00 H new ATOM 0 HA GLU A 172 13.538 -6.759 -2.341 1.00 0.00 H new ATOM 0 HB2 GLU A 172 14.304 -4.294 -0.710 1.00 0.00 H new ATOM 0 HB3 GLU A 172 15.363 -5.674 -0.926 1.00 0.00 H new ATOM 0 HG2 GLU A 172 15.163 -5.383 -3.441 1.00 0.00 H new ATOM 0 HG3 GLU A 172 14.200 -3.944 -3.170 1.00 0.00 H new ATOM 2533 N ASP A 173 12.172 -6.170 0.569 1.00 0.00 N ATOM 2534 CA ASP A 173 11.866 -6.830 1.874 1.00 0.00 C ATOM 2535 C ASP A 173 10.748 -6.079 2.600 1.00 0.00 C ATOM 2536 O ASP A 173 10.299 -5.035 2.168 1.00 0.00 O ATOM 2537 CB ASP A 173 13.121 -6.828 2.752 1.00 0.00 C ATOM 2538 CG ASP A 173 12.923 -7.785 3.929 1.00 0.00 C ATOM 2539 OD1 ASP A 173 11.949 -8.520 3.913 1.00 0.00 O ATOM 2540 OD2 ASP A 173 13.749 -7.768 4.827 1.00 0.00 O ATOM 0 H ASP A 173 11.679 -5.295 0.393 1.00 0.00 H new ATOM 0 HA ASP A 173 11.544 -7.854 1.683 1.00 0.00 H new ATOM 0 HB2 ASP A 173 13.988 -7.131 2.165 1.00 0.00 H new ATOM 0 HB3 ASP A 173 13.320 -5.821 3.118 1.00 0.00 H new ATOM 2545 N CYS A 174 10.304 -6.607 3.709 1.00 0.00 N ATOM 2546 CA CYS A 174 9.221 -5.939 4.487 1.00 0.00 C ATOM 2547 C CYS A 174 9.449 -6.192 5.981 1.00 0.00 C ATOM 2548 O CYS A 174 9.995 -7.207 6.367 1.00 0.00 O ATOM 2549 CB CYS A 174 7.868 -6.522 4.077 1.00 0.00 C ATOM 2550 SG CYS A 174 7.863 -8.305 4.384 1.00 0.00 S ATOM 0 H CYS A 174 10.648 -7.479 4.112 1.00 0.00 H new ATOM 0 HA CYS A 174 9.232 -4.867 4.287 1.00 0.00 H new ATOM 0 HB2 CYS A 174 7.067 -6.043 4.641 1.00 0.00 H new ATOM 0 HB3 CYS A 174 7.679 -6.323 3.022 1.00 0.00 H new ATOM 0 HG CYS A 174 8.697 -8.583 5.342 1.00 0.00 H new ATOM 2556 N GLY A 175 9.036 -5.286 6.825 1.00 0.00 N ATOM 2557 CA GLY A 175 9.236 -5.493 8.288 1.00 0.00 C ATOM 2558 C GLY A 175 8.513 -4.396 9.070 1.00 0.00 C ATOM 2559 O GLY A 175 7.993 -3.456 8.503 1.00 0.00 O ATOM 0 H GLY A 175 8.571 -4.416 6.567 1.00 0.00 H new ATOM 0 HA2 GLY A 175 8.856 -6.472 8.581 1.00 0.00 H new ATOM 0 HA3 GLY A 175 10.300 -5.480 8.524 1.00 0.00 H new ATOM 2563 N GLN A 176 8.476 -4.512 10.374 1.00 0.00 N ATOM 2564 CA GLN A 176 7.788 -3.481 11.208 1.00 0.00 C ATOM 2565 C GLN A 176 8.816 -2.752 12.076 1.00 0.00 C ATOM 2566 O GLN A 176 9.477 -3.348 12.904 1.00 0.00 O ATOM 2567 CB GLN A 176 6.764 -4.167 12.114 1.00 0.00 C ATOM 2568 CG GLN A 176 5.968 -3.109 12.880 1.00 0.00 C ATOM 2569 CD GLN A 176 4.974 -3.798 13.816 1.00 0.00 C ATOM 2570 OE1 GLN A 176 4.830 -5.005 13.786 1.00 0.00 O ATOM 2571 NE2 GLN A 176 4.278 -3.078 14.653 1.00 0.00 N ATOM 0 H GLN A 176 8.895 -5.280 10.898 1.00 0.00 H new ATOM 0 HA GLN A 176 7.287 -2.764 10.557 1.00 0.00 H new ATOM 0 HB2 GLN A 176 6.090 -4.783 11.518 1.00 0.00 H new ATOM 0 HB3 GLN A 176 7.270 -4.833 12.813 1.00 0.00 H new ATOM 0 HG2 GLN A 176 6.644 -2.474 13.453 1.00 0.00 H new ATOM 0 HG3 GLN A 176 5.438 -2.461 12.182 1.00 0.00 H new ATOM 0 HE21 GLN A 176 4.399 -2.066 14.678 1.00 0.00 H new ATOM 0 HE22 GLN A 176 3.613 -3.528 15.282 1.00 0.00 H new ATOM 2580 N LEU A 177 8.951 -1.466 11.904 1.00 0.00 N ATOM 2581 CA LEU A 177 9.928 -0.705 12.732 1.00 0.00 C ATOM 2582 C LEU A 177 9.508 -0.779 14.202 1.00 0.00 C ATOM 2583 O LEU A 177 10.331 -0.873 15.090 1.00 0.00 O ATOM 2584 CB LEU A 177 9.963 0.757 12.275 1.00 0.00 C ATOM 2585 CG LEU A 177 11.036 1.526 13.055 1.00 0.00 C ATOM 2586 CD1 LEU A 177 12.432 1.049 12.635 1.00 0.00 C ATOM 2587 CD2 LEU A 177 10.897 3.021 12.758 1.00 0.00 C ATOM 0 H LEU A 177 8.428 -0.910 11.227 1.00 0.00 H new ATOM 0 HA LEU A 177 10.922 -1.138 12.616 1.00 0.00 H new ATOM 0 HB2 LEU A 177 10.173 0.807 11.207 1.00 0.00 H new ATOM 0 HB3 LEU A 177 8.988 1.219 12.431 1.00 0.00 H new ATOM 0 HG LEU A 177 10.905 1.346 14.122 1.00 0.00 H new ATOM 0 HD11 LEU A 177 13.188 1.600 13.194 1.00 0.00 H new ATOM 0 HD12 LEU A 177 12.531 -0.016 12.844 1.00 0.00 H new ATOM 0 HD13 LEU A 177 12.570 1.223 11.568 1.00 0.00 H new ATOM 0 HD21 LEU A 177 11.657 3.574 13.310 1.00 0.00 H new ATOM 0 HD22 LEU A 177 11.027 3.193 11.690 1.00 0.00 H new ATOM 0 HD23 LEU A 177 9.908 3.362 13.063 1.00 0.00 H new ATOM 2599 N SER A 178 8.227 -0.738 14.466 1.00 0.00 N ATOM 2600 CA SER A 178 7.751 -0.805 15.877 1.00 0.00 C ATOM 2601 C SER A 178 6.399 -1.520 15.925 1.00 0.00 C ATOM 2602 O SER A 178 5.397 -0.841 16.081 1.00 0.00 O ATOM 2603 CB SER A 178 7.597 0.611 16.433 1.00 0.00 C ATOM 2604 OG SER A 178 8.881 1.207 16.561 1.00 0.00 O ATOM 2605 OXT SER A 178 6.388 -2.734 15.802 1.00 0.00 O ATOM 0 H SER A 178 7.491 -0.661 13.764 1.00 0.00 H new ATOM 0 HA SER A 178 8.476 -1.354 16.478 1.00 0.00 H new ATOM 0 HB2 SER A 178 6.971 1.208 15.770 1.00 0.00 H new ATOM 0 HB3 SER A 178 7.099 0.582 17.402 1.00 0.00 H new ATOM 0 HG SER A 178 8.786 2.116 16.916 1.00 0.00 H new