USER MOD reduce.3.24.130724 H: found=0, std=0, add=1378, rem=0, adj=59 USER MOD reduce.3.24.130724 removed 1380 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 88 SER OG : rot 140:sc= -0.0839 USER MOD Set 1.2: B 55 HIS : no HE2:sc= -15! C(o=-18!,f=-18!) USER MOD Set 1.3: B 88 SER OG : rot -38:sc= -2.95! USER MOD Set 2.1: B 64 SER OG : rot -98:sc= -0.783! USER MOD Set 2.2: B 75 TYR OH : rot 45:sc= 1.44 USER MOD Set 3.1: B 70 THR OG1 : rot -163:sc= -0.824! USER MOD Set 3.2: B 72 HIS : no HD1:sc= -1.34 X(o=-2.2,f=-1.9) USER MOD Set 4.1: B 32 TYR OH : rot 180:sc= 0.486 USER MOD Set 4.2: B 41 HIS : no HE2:sc= -16! C(o=-16!,f=-25!) USER MOD Set 5.1: B 24 CYS SG : rot 170:sc= -0.0547 USER MOD Set 5.2: B 50 TYR OH : rot 30:sc= -3.31! USER MOD Set 6.1: B 13 MET CE :methyl 179:sc= -5.46! (180deg=-5.52!) USER MOD Set 6.2: B 17 MET CE :methyl 159:sc= -5.47 (180deg=-8.85!) USER MOD Set 7.1: A 70 THR OG1 : rot -80:sc= -5! USER MOD Set 7.2: A 87 LYS NZ :NH3+ -178:sc= -1.35 (180deg=-1.26) USER MOD Set 8.1: A 67 THR OG1 : rot 180:sc= 0.00439 USER MOD Set 8.2: A 68 HIS :FLIP no HE2:sc= -5.31! C(o=-11!,f=-8.2!) USER MOD Set 8.3: A 72 HIS : no HD1:sc= -2.94! C(o=-8.2!,f=-13!) USER MOD Set 9.1: A 64 SER OG : rot -109:sc= -2.79! USER MOD Set 9.2: A 75 TYR OH : rot -25:sc= 1.91 USER MOD Set10.1: A 44 LYS NZ :NH3+ -107:sc= -0.446 (180deg=-1.14) USER MOD Set10.2: B 65 TYR OH : rot 180:sc= 0.584 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN :FLIP amide:sc= -0.346 F(o=-2.8!,f=-0.35) USER MOD Single : A 13 MET CE :methyl -172:sc= -0.58 (180deg=-0.807) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -120:sc= -7.05! (180deg=-12.8!) USER MOD Single : A 18 GLN : amide:sc= -15.3! C(o=-15!,f=-15!) USER MOD Single : A 19 GLN : amide:sc= -0.115 K(o=-0.11,f=-2!) USER MOD Single : A 21 SER OG : rot -70:sc= -6.84! USER MOD Single : A 24 CYS SG : rot 166:sc= 0.279 USER MOD Single : A 26 THR OG1 : rot -6:sc= -2.14! USER MOD Single : A 27 GLN :FLIP amide:sc= -1.23 F(o=-3.6!,f=-1.2) USER MOD Single : A 31 LYS NZ :NH3+ 178:sc=-0.00518 (180deg=-0.00885) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.0144 X(o=-0.014,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS :FLIP no HD1:sc= -16.8! C(o=-26!,f=-17!) USER MOD Single : A 43 LYS NZ :NH3+ -149:sc=-0.00166 (180deg=-0.573) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 146:sc= -0.591 (180deg=-1.91!) USER MOD Single : A 50 TYR OH : rot -92:sc= -3.33! USER MOD Single : A 51 ASN :FLIP amide:sc= -1.93 F(o=-3.2!,f=-1.9) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.00374 USER MOD Single : A 55 HIS : no HE2:sc= -11.2! C(o=-11!,f=-15!) USER MOD Single : A 56 CYS SG : rot -38:sc= -7.29! USER MOD Single : A 61 ASN : amide:sc= -0.027 X(o=-0.027,f=-0.24) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 173:sc= -0.517 (180deg=-0.569) USER MOD Single : B 10 ASN :FLIP amide:sc= 0 F(o=-0.96,f=0) USER MOD Single : B 14 SER OG : rot -160:sc= -2.22! USER MOD Single : B 18 GLN :FLIP amide:sc= -11! C(o=-13!,f=-11!) USER MOD Single : B 19 GLN : amide:sc= -3.48! C(o=-3.5!,f=-5.4!) USER MOD Single : B 21 SER OG : rot -88:sc= -1.82! USER MOD Single : B 26 THR OG1 : rot 74:sc= 1.16 USER MOD Single : B 27 GLN :FLIP amide:sc= -0.27 F(o=-2.6!,f=-0.27) USER MOD Single : B 31 LYS NZ :NH3+ 153:sc= -0.322 (180deg=-1.22!) USER MOD Single : B 33 ASN : amide:sc= -0.179 K(o=-0.18,f=-4.9!) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 LYS NZ :NH3+ -159:sc= -0.14 (180deg=-0.913) USER MOD Single : B 44 LYS NZ :NH3+ -156:sc= -0.0859 (180deg=-0.411) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 LYS NZ :NH3+ -170:sc= 0.0234 (180deg=0.016) USER MOD Single : B 51 ASN :FLIP amide:sc= -0.943 F(o=-8.4!,f=-0.94) USER MOD Single : B 53 THR OG1 : rot 89:sc= -1.99! USER MOD Single : B 56 CYS SG : rot 143:sc= -5.69! USER MOD Single : B 61 ASN :FLIP amide:sc= 0.0726! C(o=-2.3!,f=0.073!) USER MOD Single : B 67 THR OG1 : rot -61:sc= 1.11 USER MOD Single : B 68 HIS :FLIP no HD1:sc= -4.63 F(o=-8.3!,f=-4.6) USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 77 TYR OH : rot 180:sc= -1.3 USER MOD Single : B 80 GLN : amide:sc= -0.407 X(o=-0.41,f=-0.025) USER MOD Single : B 87 LYS NZ :NH3+ 161:sc= -10.9! (180deg=-12.5!) USER MOD ----------------------------------------------------------------- ATOM 67 N LYS A 5 -18.405 7.189 6.504 1.00 0.00 N ATOM 68 CA LYS A 5 -17.509 7.139 7.655 1.00 0.00 C ATOM 69 C LYS A 5 -16.101 7.574 7.266 1.00 0.00 C ATOM 70 O LYS A 5 -15.874 8.068 6.161 1.00 0.00 O ATOM 71 CB LYS A 5 -17.475 5.727 8.240 1.00 0.00 C ATOM 72 CG LYS A 5 -18.494 5.502 9.347 1.00 0.00 C ATOM 73 CD LYS A 5 -17.820 5.165 10.667 1.00 0.00 C ATOM 74 CE LYS A 5 -18.836 5.009 11.786 1.00 0.00 C ATOM 75 NZ LYS A 5 -19.120 3.577 12.083 1.00 0.00 N ATOM 0 HA LYS A 5 -17.888 7.828 8.410 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -17.654 5.007 7.441 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -16.477 5.528 8.630 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -19.105 6.397 9.468 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -19.167 4.692 9.064 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -17.250 4.242 10.561 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -17.110 5.951 10.925 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -18.464 5.499 12.685 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -19.762 5.513 11.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -19.818 3.514 12.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -19.499 3.115 11.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -18.241 3.102 12.373 1.00 0.00 H new ATOM 89 N ALA A 6 -15.158 7.383 8.182 1.00 0.00 N ATOM 90 CA ALA A 6 -13.768 7.748 7.942 1.00 0.00 C ATOM 91 C ALA A 6 -13.534 9.235 8.178 1.00 0.00 C ATOM 92 O ALA A 6 -14.441 10.051 8.026 1.00 0.00 O ATOM 93 CB ALA A 6 -13.357 7.366 6.528 1.00 0.00 C ATOM 0 H ALA A 6 -15.333 6.976 9.101 1.00 0.00 H new ATOM 0 HA ALA A 6 -13.151 7.196 8.651 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.316 7.645 6.364 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -13.470 6.290 6.394 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -13.990 7.889 5.811 1.00 0.00 H new ATOM 99 N VAL A 7 -12.305 9.576 8.549 1.00 0.00 N ATOM 100 CA VAL A 7 -11.939 10.962 8.804 1.00 0.00 C ATOM 101 C VAL A 7 -10.926 11.453 7.775 1.00 0.00 C ATOM 102 O VAL A 7 -9.740 11.590 8.073 1.00 0.00 O ATOM 103 CB VAL A 7 -11.352 11.138 10.220 1.00 0.00 C ATOM 104 CG1 VAL A 7 -10.744 12.522 10.385 1.00 0.00 C ATOM 105 CG2 VAL A 7 -12.421 10.892 11.275 1.00 0.00 C ATOM 0 H VAL A 7 -11.544 8.909 8.680 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.850 11.555 8.726 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.559 10.402 10.355 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -10.337 12.623 11.391 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -9.946 12.658 9.655 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -11.513 13.278 10.227 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -11.989 11.020 12.267 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -13.236 11.603 11.139 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -12.804 9.877 11.175 1.00 0.00 H new ATOM 115 N ILE A 8 -11.403 11.710 6.562 1.00 0.00 N ATOM 116 CA ILE A 8 -10.541 12.183 5.486 1.00 0.00 C ATOM 117 C ILE A 8 -9.509 13.180 6.017 1.00 0.00 C ATOM 118 O ILE A 8 -9.697 13.784 7.073 1.00 0.00 O ATOM 119 CB ILE A 8 -11.383 12.811 4.337 1.00 0.00 C ATOM 120 CG1 ILE A 8 -11.582 11.785 3.219 1.00 0.00 C ATOM 121 CG2 ILE A 8 -10.744 14.080 3.776 1.00 0.00 C ATOM 122 CD1 ILE A 8 -12.918 11.075 3.274 1.00 0.00 C ATOM 0 H ILE A 8 -12.382 11.599 6.300 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.004 11.326 5.079 1.00 0.00 H new ATOM 0 HB ILE A 8 -12.349 13.094 4.756 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -11.487 12.287 2.256 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -10.784 11.044 3.272 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.369 14.480 2.978 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -10.650 14.822 4.569 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.756 13.845 3.380 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -12.986 10.364 2.451 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -13.009 10.543 4.221 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -13.722 11.806 3.190 1.00 0.00 H new ATOM 134 N LYS A 9 -8.418 13.340 5.275 1.00 0.00 N ATOM 135 CA LYS A 9 -7.351 14.257 5.661 1.00 0.00 C ATOM 136 C LYS A 9 -6.618 14.782 4.431 1.00 0.00 C ATOM 137 O LYS A 9 -5.792 15.690 4.525 1.00 0.00 O ATOM 138 CB LYS A 9 -6.362 13.556 6.595 1.00 0.00 C ATOM 139 CG LYS A 9 -6.926 12.304 7.250 1.00 0.00 C ATOM 140 CD LYS A 9 -7.007 12.453 8.762 1.00 0.00 C ATOM 141 CE LYS A 9 -7.112 11.102 9.451 1.00 0.00 C ATOM 142 NZ LYS A 9 -6.502 11.123 10.809 1.00 0.00 N ATOM 0 H LYS A 9 -8.249 12.844 4.400 1.00 0.00 H new ATOM 0 HA LYS A 9 -7.801 15.101 6.185 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.468 13.290 6.031 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.052 14.254 7.372 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -7.919 12.099 6.850 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.299 11.448 7.001 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.124 12.980 9.124 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.872 13.063 9.023 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.161 10.814 9.528 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -6.618 10.345 8.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -6.594 10.184 11.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -5.495 11.373 10.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.990 11.828 11.398 1.00 0.00 H new ATOM 156 N ASN A 10 -6.928 14.201 3.277 1.00 0.00 N ATOM 157 CA ASN A 10 -6.306 14.601 2.021 1.00 0.00 C ATOM 158 C ASN A 10 -6.973 13.892 0.848 1.00 0.00 C ATOM 159 O ASN A 10 -6.590 12.781 0.482 1.00 0.00 O ATOM 160 CB ASN A 10 -4.810 14.280 2.041 1.00 0.00 C ATOM 161 CG ASN A 10 -3.949 15.521 1.914 1.00 0.00 C ATOM 162 OD1 ASN A 10 -4.530 16.595 1.392 1.00 0.00 O flip ATOM 163 ND2 ASN A 10 -2.773 15.515 2.281 1.00 0.00 N flip ATOM 0 H ASN A 10 -7.610 13.448 3.186 1.00 0.00 H new ATOM 0 HA ASN A 10 -6.434 15.677 1.902 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -4.565 13.765 2.970 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -4.578 13.595 1.225 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -2.367 14.667 2.677 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -2.206 16.358 2.189 1.00 0.00 H new ATOM 170 N ALA A 11 -7.981 14.537 0.267 1.00 0.00 N ATOM 171 CA ALA A 11 -8.705 13.958 -0.857 1.00 0.00 C ATOM 172 C ALA A 11 -8.796 14.926 -2.030 1.00 0.00 C ATOM 173 O ALA A 11 -9.844 15.526 -2.270 1.00 0.00 O ATOM 174 CB ALA A 11 -10.098 13.534 -0.420 1.00 0.00 C ATOM 0 H ALA A 11 -8.313 15.457 0.556 1.00 0.00 H new ATOM 0 HA ALA A 11 -8.149 13.083 -1.193 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.630 13.103 -1.268 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -10.020 12.792 0.375 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -10.644 14.403 -0.053 1.00 0.00 H new ATOM 180 N ASP A 12 -7.701 15.063 -2.769 1.00 0.00 N ATOM 181 CA ASP A 12 -7.675 15.945 -3.927 1.00 0.00 C ATOM 182 C ASP A 12 -8.458 15.323 -5.075 1.00 0.00 C ATOM 183 O ASP A 12 -8.191 15.589 -6.246 1.00 0.00 O ATOM 184 CB ASP A 12 -6.234 16.221 -4.359 1.00 0.00 C ATOM 185 CG ASP A 12 -5.887 17.694 -4.305 1.00 0.00 C ATOM 186 OD1 ASP A 12 -6.260 18.427 -5.246 1.00 0.00 O ATOM 187 OD2 ASP A 12 -5.242 18.117 -3.322 1.00 0.00 O ATOM 0 H ASP A 12 -6.823 14.576 -2.587 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.141 16.892 -3.653 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -5.552 15.666 -3.715 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -6.085 15.852 -5.374 1.00 0.00 H new ATOM 192 N MET A 13 -9.424 14.486 -4.717 1.00 0.00 N ATOM 193 CA MET A 13 -10.258 13.803 -5.696 1.00 0.00 C ATOM 194 C MET A 13 -11.695 14.321 -5.632 1.00 0.00 C ATOM 195 O MET A 13 -12.052 15.077 -4.728 1.00 0.00 O ATOM 196 CB MET A 13 -10.209 12.287 -5.443 1.00 0.00 C ATOM 197 CG MET A 13 -11.510 11.549 -5.722 1.00 0.00 C ATOM 198 SD MET A 13 -11.918 10.366 -4.426 1.00 0.00 S ATOM 199 CE MET A 13 -10.678 9.108 -4.717 1.00 0.00 C ATOM 0 H MET A 13 -9.650 14.263 -3.748 1.00 0.00 H new ATOM 0 HA MET A 13 -9.876 14.006 -6.697 1.00 0.00 H new ATOM 0 HB2 MET A 13 -9.423 11.855 -6.063 1.00 0.00 H new ATOM 0 HB3 MET A 13 -9.926 12.116 -4.404 1.00 0.00 H new ATOM 0 HG2 MET A 13 -12.321 12.271 -5.820 1.00 0.00 H new ATOM 0 HG3 MET A 13 -11.431 11.027 -6.676 1.00 0.00 H new ATOM 0 HE1 MET A 13 -10.884 8.241 -4.089 1.00 0.00 H new ATOM 0 HE2 MET A 13 -10.701 8.810 -5.765 1.00 0.00 H new ATOM 0 HE3 MET A 13 -9.692 9.506 -4.474 1.00 0.00 H new ATOM 209 N SER A 14 -12.512 13.908 -6.594 1.00 0.00 N ATOM 210 CA SER A 14 -13.907 14.329 -6.646 1.00 0.00 C ATOM 211 C SER A 14 -14.627 13.976 -5.349 1.00 0.00 C ATOM 212 O SER A 14 -14.268 13.013 -4.670 1.00 0.00 O ATOM 213 CB SER A 14 -14.617 13.670 -7.832 1.00 0.00 C ATOM 214 OG SER A 14 -14.253 14.289 -9.054 1.00 0.00 O ATOM 0 H SER A 14 -12.232 13.282 -7.349 1.00 0.00 H new ATOM 0 HA SER A 14 -13.931 15.411 -6.773 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.364 12.610 -7.868 1.00 0.00 H new ATOM 0 HB3 SER A 14 -15.696 13.735 -7.695 1.00 0.00 H new ATOM 0 HG SER A 14 -14.719 13.848 -9.795 1.00 0.00 H new ATOM 220 N GLU A 15 -15.645 14.759 -5.009 1.00 0.00 N ATOM 221 CA GLU A 15 -16.412 14.525 -3.792 1.00 0.00 C ATOM 222 C GLU A 15 -16.984 13.111 -3.771 1.00 0.00 C ATOM 223 O GLU A 15 -16.613 12.294 -2.930 1.00 0.00 O ATOM 224 CB GLU A 15 -17.545 15.548 -3.670 1.00 0.00 C ATOM 225 CG GLU A 15 -17.554 16.287 -2.342 1.00 0.00 C ATOM 226 CD GLU A 15 -18.765 17.187 -2.184 1.00 0.00 C ATOM 227 OE1 GLU A 15 -19.800 16.907 -2.825 1.00 0.00 O ATOM 228 OE2 GLU A 15 -18.678 18.170 -1.420 1.00 0.00 O ATOM 0 H GLU A 15 -15.957 15.560 -5.558 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.738 14.638 -2.943 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.458 16.273 -4.479 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -18.500 15.038 -3.800 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -17.535 15.563 -1.527 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -16.647 16.886 -2.257 1.00 0.00 H new ATOM 235 N GLU A 16 -17.890 12.830 -4.701 1.00 0.00 N ATOM 236 CA GLU A 16 -18.514 11.514 -4.786 1.00 0.00 C ATOM 237 C GLU A 16 -17.464 10.409 -4.805 1.00 0.00 C ATOM 238 O GLU A 16 -17.738 9.273 -4.419 1.00 0.00 O ATOM 239 CB GLU A 16 -19.390 11.421 -6.037 1.00 0.00 C ATOM 240 CG GLU A 16 -20.880 11.475 -5.741 1.00 0.00 C ATOM 241 CD GLU A 16 -21.522 10.101 -5.725 1.00 0.00 C ATOM 242 OE1 GLU A 16 -21.117 9.247 -6.541 1.00 0.00 O ATOM 243 OE2 GLU A 16 -22.428 9.879 -4.895 1.00 0.00 O ATOM 0 H GLU A 16 -18.209 13.495 -5.406 1.00 0.00 H new ATOM 0 HA GLU A 16 -19.137 11.381 -3.902 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -19.132 12.237 -6.712 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -19.165 10.491 -6.560 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -21.038 11.957 -4.776 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -21.373 12.094 -6.491 1.00 0.00 H new ATOM 250 N MET A 17 -16.260 10.746 -5.257 1.00 0.00 N ATOM 251 CA MET A 17 -15.174 9.775 -5.322 1.00 0.00 C ATOM 252 C MET A 17 -14.545 9.563 -3.948 1.00 0.00 C ATOM 253 O MET A 17 -14.147 8.450 -3.604 1.00 0.00 O ATOM 254 CB MET A 17 -14.112 10.231 -6.324 1.00 0.00 C ATOM 255 CG MET A 17 -14.495 9.980 -7.772 1.00 0.00 C ATOM 256 SD MET A 17 -15.142 8.318 -8.041 1.00 0.00 S ATOM 257 CE MET A 17 -13.722 7.322 -7.596 1.00 0.00 C ATOM 0 H MET A 17 -16.013 11.680 -5.582 1.00 0.00 H new ATOM 0 HA MET A 17 -15.591 8.825 -5.656 1.00 0.00 H new ATOM 0 HB2 MET A 17 -13.927 11.296 -6.185 1.00 0.00 H new ATOM 0 HB3 MET A 17 -13.176 9.714 -6.110 1.00 0.00 H new ATOM 0 HG2 MET A 17 -15.243 10.711 -8.078 1.00 0.00 H new ATOM 0 HG3 MET A 17 -13.622 10.133 -8.407 1.00 0.00 H new ATOM 0 HE1 MET A 17 -13.418 6.719 -8.452 1.00 0.00 H new ATOM 0 HE2 MET A 17 -12.899 7.973 -7.300 1.00 0.00 H new ATOM 0 HE3 MET A 17 -13.983 6.666 -6.765 1.00 0.00 H new ATOM 267 N GLN A 18 -14.458 10.635 -3.164 1.00 0.00 N ATOM 268 CA GLN A 18 -13.877 10.551 -1.828 1.00 0.00 C ATOM 269 C GLN A 18 -14.826 9.842 -0.870 1.00 0.00 C ATOM 270 O GLN A 18 -14.395 9.078 -0.005 1.00 0.00 O ATOM 271 CB GLN A 18 -13.540 11.945 -1.296 1.00 0.00 C ATOM 272 CG GLN A 18 -14.259 13.065 -2.028 1.00 0.00 C ATOM 273 CD GLN A 18 -13.317 14.161 -2.485 1.00 0.00 C ATOM 274 OE1 GLN A 18 -13.751 15.247 -2.870 1.00 0.00 O ATOM 275 NE2 GLN A 18 -12.019 13.883 -2.444 1.00 0.00 N ATOM 0 H GLN A 18 -14.780 11.566 -3.429 1.00 0.00 H new ATOM 0 HA GLN A 18 -12.956 9.972 -1.898 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -13.795 11.992 -0.237 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -12.464 12.104 -1.373 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -14.779 12.654 -2.893 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -15.018 13.493 -1.374 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -11.703 12.970 -2.118 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.338 14.583 -2.739 1.00 0.00 H new ATOM 284 N GLN A 19 -16.121 10.086 -1.039 1.00 0.00 N ATOM 285 CA GLN A 19 -17.127 9.455 -0.198 1.00 0.00 C ATOM 286 C GLN A 19 -17.289 8.000 -0.605 1.00 0.00 C ATOM 287 O GLN A 19 -17.483 7.122 0.237 1.00 0.00 O ATOM 288 CB GLN A 19 -18.464 10.190 -0.313 1.00 0.00 C ATOM 289 CG GLN A 19 -18.587 11.381 0.624 1.00 0.00 C ATOM 290 CD GLN A 19 -19.599 12.400 0.139 1.00 0.00 C ATOM 291 OE1 GLN A 19 -19.941 12.438 -1.043 1.00 0.00 O ATOM 292 NE2 GLN A 19 -20.083 13.236 1.051 1.00 0.00 N ATOM 0 H GLN A 19 -16.496 10.715 -1.749 1.00 0.00 H new ATOM 0 HA GLN A 19 -16.801 9.504 0.841 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -18.594 10.531 -1.340 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -19.273 9.490 -0.105 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -18.875 11.031 1.615 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -17.614 11.861 0.726 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -19.772 13.169 2.020 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -20.766 13.945 0.782 1.00 0.00 H new ATOM 301 N ASP A 20 -17.183 7.752 -1.907 1.00 0.00 N ATOM 302 CA ASP A 20 -17.293 6.404 -2.435 1.00 0.00 C ATOM 303 C ASP A 20 -16.037 5.615 -2.092 1.00 0.00 C ATOM 304 O ASP A 20 -16.087 4.404 -1.877 1.00 0.00 O ATOM 305 CB ASP A 20 -17.500 6.435 -3.950 1.00 0.00 C ATOM 306 CG ASP A 20 -18.679 5.589 -4.391 1.00 0.00 C ATOM 307 OD1 ASP A 20 -18.538 4.349 -4.431 1.00 0.00 O ATOM 308 OD2 ASP A 20 -19.743 6.167 -4.696 1.00 0.00 O ATOM 0 H ASP A 20 -17.021 8.470 -2.613 1.00 0.00 H new ATOM 0 HA ASP A 20 -18.157 5.918 -1.982 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -17.655 7.465 -4.272 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -16.596 6.079 -4.445 1.00 0.00 H new ATOM 313 N SER A 21 -14.913 6.321 -2.025 1.00 0.00 N ATOM 314 CA SER A 21 -13.641 5.701 -1.689 1.00 0.00 C ATOM 315 C SER A 21 -13.686 5.170 -0.264 1.00 0.00 C ATOM 316 O SER A 21 -13.287 4.036 0.003 1.00 0.00 O ATOM 317 CB SER A 21 -12.498 6.706 -1.839 1.00 0.00 C ATOM 318 OG SER A 21 -11.711 6.761 -0.662 1.00 0.00 O ATOM 0 H SER A 21 -14.860 7.325 -2.200 1.00 0.00 H new ATOM 0 HA SER A 21 -13.464 4.872 -2.375 1.00 0.00 H new ATOM 0 HB2 SER A 21 -11.872 6.426 -2.686 1.00 0.00 H new ATOM 0 HB3 SER A 21 -12.904 7.694 -2.055 1.00 0.00 H new ATOM 0 HG SER A 21 -12.226 7.185 0.056 1.00 0.00 H new ATOM 324 N VAL A 22 -14.190 5.996 0.650 1.00 0.00 N ATOM 325 CA VAL A 22 -14.304 5.604 2.047 1.00 0.00 C ATOM 326 C VAL A 22 -15.195 4.377 2.183 1.00 0.00 C ATOM 327 O VAL A 22 -14.819 3.390 2.814 1.00 0.00 O ATOM 328 CB VAL A 22 -14.886 6.737 2.911 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.079 6.264 4.342 1.00 0.00 C ATOM 330 CG2 VAL A 22 -13.991 7.966 2.865 1.00 0.00 C ATOM 0 H VAL A 22 -14.524 6.938 0.446 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.298 5.377 2.399 1.00 0.00 H new ATOM 0 HB VAL A 22 -15.859 7.014 2.505 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.491 7.076 4.941 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.766 5.418 4.356 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.118 5.958 4.757 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.422 8.754 3.483 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -13.001 7.710 3.243 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.907 8.317 1.836 1.00 0.00 H new ATOM 340 N GLU A 23 -16.378 4.445 1.577 1.00 0.00 N ATOM 341 CA GLU A 23 -17.321 3.334 1.625 1.00 0.00 C ATOM 342 C GLU A 23 -16.647 2.047 1.170 1.00 0.00 C ATOM 343 O GLU A 23 -16.895 0.978 1.724 1.00 0.00 O ATOM 344 CB GLU A 23 -18.537 3.626 0.745 1.00 0.00 C ATOM 345 CG GLU A 23 -19.120 5.013 0.952 1.00 0.00 C ATOM 346 CD GLU A 23 -20.631 5.034 0.828 1.00 0.00 C ATOM 347 OE1 GLU A 23 -21.236 3.944 0.769 1.00 0.00 O ATOM 348 OE2 GLU A 23 -21.208 6.140 0.788 1.00 0.00 O ATOM 0 H GLU A 23 -16.704 5.255 1.049 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.655 3.212 2.655 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.253 3.513 -0.301 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.308 2.883 0.948 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -18.835 5.380 1.938 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -18.689 5.697 0.221 1.00 0.00 H new ATOM 355 N CYS A 24 -15.784 2.161 0.166 1.00 0.00 N ATOM 356 CA CYS A 24 -15.063 1.006 -0.351 1.00 0.00 C ATOM 357 C CYS A 24 -14.120 0.458 0.715 1.00 0.00 C ATOM 358 O CYS A 24 -14.005 -0.757 0.902 1.00 0.00 O ATOM 359 CB CYS A 24 -14.278 1.386 -1.608 1.00 0.00 C ATOM 360 SG CYS A 24 -15.305 1.589 -3.083 1.00 0.00 S ATOM 0 H CYS A 24 -15.568 3.040 -0.304 1.00 0.00 H new ATOM 0 HA CYS A 24 -15.785 0.233 -0.614 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -13.741 2.316 -1.421 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -13.529 0.618 -1.802 1.00 0.00 H new ATOM 0 HG CYS A 24 -14.617 2.183 -4.013 1.00 0.00 H new ATOM 366 N ALA A 25 -13.476 1.369 1.440 1.00 0.00 N ATOM 367 CA ALA A 25 -12.575 0.983 2.511 1.00 0.00 C ATOM 368 C ALA A 25 -13.396 0.378 3.626 1.00 0.00 C ATOM 369 O ALA A 25 -12.968 -0.549 4.314 1.00 0.00 O ATOM 370 CB ALA A 25 -11.789 2.188 3.010 1.00 0.00 C ATOM 0 H ALA A 25 -13.564 2.376 1.302 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.854 0.252 2.146 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.119 1.879 3.812 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.205 2.606 2.190 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.480 2.943 3.385 1.00 0.00 H new ATOM 376 N THR A 26 -14.602 0.907 3.769 1.00 0.00 N ATOM 377 CA THR A 26 -15.539 0.439 4.766 1.00 0.00 C ATOM 378 C THR A 26 -16.068 -0.932 4.371 1.00 0.00 C ATOM 379 O THR A 26 -16.289 -1.796 5.219 1.00 0.00 O ATOM 380 CB THR A 26 -16.693 1.426 4.896 1.00 0.00 C ATOM 381 OG1 THR A 26 -16.300 2.717 4.464 1.00 0.00 O ATOM 382 CG2 THR A 26 -17.211 1.554 6.307 1.00 0.00 C ATOM 0 H THR A 26 -14.954 1.673 3.194 1.00 0.00 H new ATOM 0 HA THR A 26 -15.031 0.361 5.727 1.00 0.00 H new ATOM 0 HB THR A 26 -17.489 1.025 4.268 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.340 2.718 4.266 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.031 2.272 6.330 1.00 0.00 H new ATOM 0 HG22 THR A 26 -17.568 0.584 6.653 1.00 0.00 H new ATOM 0 HG23 THR A 26 -16.409 1.899 6.959 1.00 0.00 H new ATOM 390 N GLN A 27 -16.250 -1.129 3.067 1.00 0.00 N ATOM 391 CA GLN A 27 -16.731 -2.399 2.548 1.00 0.00 C ATOM 392 C GLN A 27 -15.794 -3.509 2.986 1.00 0.00 C ATOM 393 O GLN A 27 -16.227 -4.579 3.413 1.00 0.00 O ATOM 394 CB GLN A 27 -16.814 -2.355 1.020 1.00 0.00 C ATOM 395 CG GLN A 27 -18.219 -2.118 0.493 1.00 0.00 C ATOM 396 CD GLN A 27 -18.406 -2.635 -0.920 1.00 0.00 C ATOM 397 OE1 GLN A 27 -17.343 -2.581 -1.715 1.00 0.00 O flip ATOM 398 NE2 GLN A 27 -19.492 -3.078 -1.291 1.00 0.00 N flip ATOM 0 H GLN A 27 -16.070 -0.423 2.353 1.00 0.00 H new ATOM 0 HA GLN A 27 -17.729 -2.590 2.942 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -16.159 -1.565 0.652 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -16.438 -3.295 0.617 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -18.937 -2.605 1.152 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -18.437 -1.050 0.517 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -20.281 -3.100 -0.645 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -19.603 -3.423 -2.244 1.00 0.00 H new ATOM 407 N ALA A 28 -14.499 -3.229 2.894 1.00 0.00 N ATOM 408 CA ALA A 28 -13.481 -4.188 3.297 1.00 0.00 C ATOM 409 C ALA A 28 -13.204 -4.070 4.793 1.00 0.00 C ATOM 410 O ALA A 28 -12.748 -5.019 5.431 1.00 0.00 O ATOM 411 CB ALA A 28 -12.205 -3.980 2.497 1.00 0.00 C ATOM 0 H ALA A 28 -14.131 -2.345 2.544 1.00 0.00 H new ATOM 0 HA ALA A 28 -13.851 -5.193 3.093 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.456 -4.706 2.812 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.415 -4.113 1.436 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.828 -2.972 2.669 1.00 0.00 H new ATOM 417 N LEU A 29 -13.490 -2.896 5.348 1.00 0.00 N ATOM 418 CA LEU A 29 -13.283 -2.649 6.768 1.00 0.00 C ATOM 419 C LEU A 29 -14.367 -3.327 7.597 1.00 0.00 C ATOM 420 O LEU A 29 -14.155 -3.667 8.762 1.00 0.00 O ATOM 421 CB LEU A 29 -13.269 -1.152 7.049 1.00 0.00 C ATOM 422 CG LEU A 29 -11.927 -0.481 6.781 1.00 0.00 C ATOM 423 CD1 LEU A 29 -12.130 0.943 6.306 1.00 0.00 C ATOM 424 CD2 LEU A 29 -11.056 -0.514 8.028 1.00 0.00 C ATOM 0 H LEU A 29 -13.867 -2.100 4.833 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.318 -3.070 7.050 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -14.032 -0.671 6.437 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -13.544 -0.986 8.090 1.00 0.00 H new ATOM 0 HG LEU A 29 -11.416 -1.034 5.993 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -11.161 1.406 6.120 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -12.714 0.940 5.385 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -12.662 1.509 7.071 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.102 -0.031 7.818 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -11.560 0.014 8.838 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -10.881 -1.549 8.323 1.00 0.00 H new ATOM 436 N GLU A 30 -15.530 -3.523 6.985 1.00 0.00 N ATOM 437 CA GLU A 30 -16.652 -4.164 7.658 1.00 0.00 C ATOM 438 C GLU A 30 -16.688 -5.654 7.340 1.00 0.00 C ATOM 439 O GLU A 30 -17.045 -6.473 8.187 1.00 0.00 O ATOM 440 CB GLU A 30 -17.969 -3.508 7.240 1.00 0.00 C ATOM 441 CG GLU A 30 -18.626 -2.706 8.352 1.00 0.00 C ATOM 442 CD GLU A 30 -20.106 -3.001 8.486 1.00 0.00 C ATOM 443 OE1 GLU A 30 -20.733 -3.367 7.471 1.00 0.00 O ATOM 444 OE2 GLU A 30 -20.639 -2.865 9.608 1.00 0.00 O ATOM 0 H GLU A 30 -15.720 -3.246 6.022 1.00 0.00 H new ATOM 0 HA GLU A 30 -16.522 -4.040 8.733 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -17.785 -2.852 6.389 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -18.660 -4.281 6.903 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -18.128 -2.926 9.297 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -18.487 -1.642 8.159 1.00 0.00 H new ATOM 451 N LYS A 31 -16.309 -6.001 6.114 1.00 0.00 N ATOM 452 CA LYS A 31 -16.288 -7.392 5.686 1.00 0.00 C ATOM 453 C LYS A 31 -14.988 -8.057 6.114 1.00 0.00 C ATOM 454 O LYS A 31 -14.829 -9.272 5.997 1.00 0.00 O ATOM 455 CB LYS A 31 -16.453 -7.486 4.169 1.00 0.00 C ATOM 456 CG LYS A 31 -17.876 -7.793 3.734 1.00 0.00 C ATOM 457 CD LYS A 31 -18.307 -6.908 2.578 1.00 0.00 C ATOM 458 CE LYS A 31 -19.669 -6.283 2.833 1.00 0.00 C ATOM 459 NZ LYS A 31 -19.693 -4.838 2.472 1.00 0.00 N ATOM 0 H LYS A 31 -16.012 -5.336 5.400 1.00 0.00 H new ATOM 0 HA LYS A 31 -17.120 -7.912 6.160 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -16.138 -6.545 3.718 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -15.789 -8.261 3.786 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -17.950 -8.840 3.439 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -18.554 -7.650 4.576 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -17.568 -6.122 2.425 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -18.341 -7.496 1.661 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -20.426 -6.814 2.256 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -19.931 -6.399 3.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -20.648 -4.457 2.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -19.012 -4.321 3.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -19.435 -4.726 1.471 1.00 0.00 H new ATOM 473 N TYR A 32 -14.064 -7.245 6.616 1.00 0.00 N ATOM 474 CA TYR A 32 -12.773 -7.742 7.072 1.00 0.00 C ATOM 475 C TYR A 32 -12.182 -6.820 8.131 1.00 0.00 C ATOM 476 O TYR A 32 -12.821 -5.859 8.562 1.00 0.00 O ATOM 477 CB TYR A 32 -11.798 -7.868 5.900 1.00 0.00 C ATOM 478 CG TYR A 32 -12.462 -8.185 4.580 1.00 0.00 C ATOM 479 CD1 TYR A 32 -13.236 -7.239 3.921 1.00 0.00 C ATOM 480 CD2 TYR A 32 -12.305 -9.432 3.989 1.00 0.00 C ATOM 481 CE1 TYR A 32 -13.836 -7.525 2.711 1.00 0.00 C ATOM 482 CE2 TYR A 32 -12.902 -9.726 2.779 1.00 0.00 C ATOM 483 CZ TYR A 32 -13.667 -8.771 2.144 1.00 0.00 C ATOM 484 OH TYR A 32 -14.264 -9.061 0.939 1.00 0.00 O ATOM 0 H TYR A 32 -14.187 -6.237 6.717 1.00 0.00 H new ATOM 0 HA TYR A 32 -12.932 -8.727 7.510 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -11.242 -6.935 5.801 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -11.072 -8.649 6.127 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -13.371 -6.263 4.363 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -11.707 -10.183 4.483 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -14.434 -6.777 2.211 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -12.770 -10.700 2.332 1.00 0.00 H new ATOM 0 HH TYR A 32 -14.045 -9.980 0.678 1.00 0.00 H new ATOM 494 N ASN A 33 -10.953 -7.115 8.539 1.00 0.00 N ATOM 495 CA ASN A 33 -10.265 -6.312 9.542 1.00 0.00 C ATOM 496 C ASN A 33 -8.756 -6.438 9.385 1.00 0.00 C ATOM 497 O ASN A 33 -8.002 -6.268 10.342 1.00 0.00 O ATOM 498 CB ASN A 33 -10.683 -6.739 10.950 1.00 0.00 C ATOM 499 CG ASN A 33 -11.196 -5.579 11.782 1.00 0.00 C ATOM 500 OD1 ASN A 33 -12.303 -5.627 12.318 1.00 0.00 O ATOM 501 ND2 ASN A 33 -10.390 -4.530 11.896 1.00 0.00 N ATOM 0 H ASN A 33 -10.412 -7.906 8.190 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.546 -5.269 9.394 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -11.458 -7.502 10.879 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -9.832 -7.196 11.455 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -10.680 -3.721 12.445 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -9.480 -4.533 11.434 1.00 0.00 H new ATOM 508 N ILE A 34 -8.327 -6.738 8.167 1.00 0.00 N ATOM 509 CA ILE A 34 -6.910 -6.890 7.867 1.00 0.00 C ATOM 510 C ILE A 34 -6.448 -5.826 6.879 1.00 0.00 C ATOM 511 O ILE A 34 -6.704 -5.933 5.681 1.00 0.00 O ATOM 512 CB ILE A 34 -6.605 -8.280 7.281 1.00 0.00 C ATOM 513 CG1 ILE A 34 -7.385 -9.355 8.034 1.00 0.00 C ATOM 514 CG2 ILE A 34 -5.112 -8.565 7.336 1.00 0.00 C ATOM 515 CD1 ILE A 34 -7.061 -9.400 9.507 1.00 0.00 C ATOM 0 H ILE A 34 -8.943 -6.882 7.367 1.00 0.00 H new ATOM 0 HA ILE A 34 -6.371 -6.775 8.808 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.918 -8.293 6.237 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.453 -9.176 7.908 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.171 -10.328 7.591 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.914 -9.552 6.918 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.576 -7.812 6.758 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -4.774 -8.536 8.372 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.648 -10.184 9.985 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.000 -9.609 9.640 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.301 -8.439 9.962 1.00 0.00 H new ATOM 527 N GLU A 35 -5.771 -4.801 7.393 1.00 0.00 N ATOM 528 CA GLU A 35 -5.272 -3.710 6.560 1.00 0.00 C ATOM 529 C GLU A 35 -5.060 -4.168 5.121 1.00 0.00 C ATOM 530 O GLU A 35 -5.885 -3.902 4.248 1.00 0.00 O ATOM 531 CB GLU A 35 -3.962 -3.164 7.134 1.00 0.00 C ATOM 532 CG GLU A 35 -4.127 -2.487 8.485 1.00 0.00 C ATOM 533 CD GLU A 35 -4.236 -3.478 9.627 1.00 0.00 C ATOM 534 OE1 GLU A 35 -3.213 -4.110 9.965 1.00 0.00 O ATOM 535 OE2 GLU A 35 -5.345 -3.625 10.182 1.00 0.00 O ATOM 0 H GLU A 35 -5.555 -4.704 8.385 1.00 0.00 H new ATOM 0 HA GLU A 35 -6.021 -2.918 6.558 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -3.248 -3.982 7.231 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.535 -2.451 6.429 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -3.278 -1.827 8.662 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -5.019 -1.861 8.466 1.00 0.00 H new ATOM 542 N LYS A 36 -3.956 -4.866 4.882 1.00 0.00 N ATOM 543 CA LYS A 36 -3.644 -5.367 3.549 1.00 0.00 C ATOM 544 C LYS A 36 -4.896 -5.921 2.874 1.00 0.00 C ATOM 545 O LYS A 36 -5.169 -5.626 1.711 1.00 0.00 O ATOM 546 CB LYS A 36 -2.570 -6.453 3.633 1.00 0.00 C ATOM 547 CG LYS A 36 -1.729 -6.372 4.898 1.00 0.00 C ATOM 548 CD LYS A 36 -0.907 -7.634 5.102 1.00 0.00 C ATOM 549 CE LYS A 36 -1.508 -8.519 6.182 1.00 0.00 C ATOM 550 NZ LYS A 36 -0.965 -9.904 6.132 1.00 0.00 N ATOM 0 H LYS A 36 -3.263 -5.098 5.593 1.00 0.00 H new ATOM 0 HA LYS A 36 -3.267 -4.538 2.950 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -3.048 -7.431 3.585 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.916 -6.375 2.765 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.065 -5.509 4.840 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.379 -6.217 5.759 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.850 -8.188 4.165 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.113 -7.365 5.376 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.305 -8.085 7.161 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.591 -8.550 6.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.400 -10.475 6.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -1.180 -10.328 5.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 0.066 -9.878 6.269 1.00 0.00 H new ATOM 564 N ASP A 37 -5.655 -6.722 3.616 1.00 0.00 N ATOM 565 CA ASP A 37 -6.881 -7.317 3.098 1.00 0.00 C ATOM 566 C ASP A 37 -7.852 -6.237 2.633 1.00 0.00 C ATOM 567 O ASP A 37 -8.234 -6.187 1.460 1.00 0.00 O ATOM 568 CB ASP A 37 -7.535 -8.184 4.178 1.00 0.00 C ATOM 569 CG ASP A 37 -9.046 -8.213 4.064 1.00 0.00 C ATOM 570 OD1 ASP A 37 -9.677 -7.158 4.286 1.00 0.00 O ATOM 571 OD2 ASP A 37 -9.597 -9.288 3.752 1.00 0.00 O ATOM 0 H ASP A 37 -5.441 -6.974 4.581 1.00 0.00 H new ATOM 0 HA ASP A 37 -6.628 -7.941 2.241 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.149 -9.201 4.106 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -7.255 -7.806 5.161 1.00 0.00 H new ATOM 576 N ILE A 38 -8.246 -5.371 3.561 1.00 0.00 N ATOM 577 CA ILE A 38 -9.166 -4.286 3.257 1.00 0.00 C ATOM 578 C ILE A 38 -8.723 -3.533 2.005 1.00 0.00 C ATOM 579 O ILE A 38 -9.527 -3.260 1.114 1.00 0.00 O ATOM 580 CB ILE A 38 -9.264 -3.292 4.432 1.00 0.00 C ATOM 581 CG1 ILE A 38 -9.336 -4.045 5.762 1.00 0.00 C ATOM 582 CG2 ILE A 38 -10.472 -2.384 4.268 1.00 0.00 C ATOM 583 CD1 ILE A 38 -8.466 -3.442 6.844 1.00 0.00 C ATOM 0 H ILE A 38 -7.940 -5.402 4.533 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.145 -4.733 3.085 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.368 -2.671 4.433 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.370 -4.062 6.106 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.037 -5.081 5.601 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.523 -1.691 5.107 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.381 -1.822 3.338 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.379 -2.987 4.241 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.566 -4.026 7.759 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -7.425 -3.450 6.520 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -8.780 -2.415 7.033 1.00 0.00 H new ATOM 595 N ALA A 39 -7.436 -3.202 1.947 1.00 0.00 N ATOM 596 CA ALA A 39 -6.881 -2.481 0.807 1.00 0.00 C ATOM 597 C ALA A 39 -7.066 -3.272 -0.484 1.00 0.00 C ATOM 598 O ALA A 39 -7.600 -2.758 -1.467 1.00 0.00 O ATOM 599 CB ALA A 39 -5.408 -2.182 1.037 1.00 0.00 C ATOM 0 H ALA A 39 -6.758 -3.422 2.677 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.420 -1.539 0.707 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.008 -1.644 0.178 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.296 -1.571 1.933 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.863 -3.117 1.166 1.00 0.00 H new ATOM 605 N ALA A 40 -6.620 -4.524 -0.474 1.00 0.00 N ATOM 606 CA ALA A 40 -6.737 -5.383 -1.646 1.00 0.00 C ATOM 607 C ALA A 40 -8.099 -5.223 -2.308 1.00 0.00 C ATOM 608 O ALA A 40 -8.190 -4.898 -3.493 1.00 0.00 O ATOM 609 CB ALA A 40 -6.504 -6.836 -1.261 1.00 0.00 C ATOM 0 H ALA A 40 -6.175 -4.965 0.331 1.00 0.00 H new ATOM 0 HA ALA A 40 -5.974 -5.082 -2.364 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.594 -7.466 -2.146 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.505 -6.945 -0.839 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.245 -7.140 -0.522 1.00 0.00 H new ATOM 615 N HIS A 41 -9.157 -5.451 -1.537 1.00 0.00 N ATOM 616 CA HIS A 41 -10.516 -5.331 -2.055 1.00 0.00 C ATOM 617 C HIS A 41 -10.780 -3.920 -2.568 1.00 0.00 C ATOM 618 O HIS A 41 -11.141 -3.727 -3.728 1.00 0.00 O ATOM 619 CB HIS A 41 -11.533 -5.686 -0.971 1.00 0.00 C ATOM 620 CG HIS A 41 -11.007 -6.647 0.048 1.00 0.00 C ATOM 621 ND1 HIS A 41 -9.981 -7.528 -0.013 1.00 0.00 N flip ATOM 622 CD2 HIS A 41 -11.552 -6.782 1.307 1.00 0.00 C flip ATOM 623 CE1 HIS A 41 -9.927 -8.171 1.198 1.00 0.00 C flip ATOM 624 NE2 HIS A 41 -10.884 -7.703 1.977 1.00 0.00 N flip ATOM 0 H HIS A 41 -9.101 -5.719 -0.554 1.00 0.00 H new ATOM 0 HA HIS A 41 -10.622 -6.029 -2.886 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -11.850 -4.772 -0.468 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -12.418 -6.115 -1.441 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -12.394 -6.222 1.686 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -9.216 -8.937 1.470 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -11.075 -8.002 2.933 1.00 0.00 H new ATOM 633 N ILE A 42 -10.600 -2.935 -1.694 1.00 0.00 N ATOM 634 CA ILE A 42 -10.821 -1.543 -2.058 1.00 0.00 C ATOM 635 C ILE A 42 -10.242 -1.236 -3.435 1.00 0.00 C ATOM 636 O ILE A 42 -10.979 -0.982 -4.387 1.00 0.00 O ATOM 637 CB ILE A 42 -10.195 -0.581 -1.030 1.00 0.00 C ATOM 638 CG1 ILE A 42 -10.703 -0.900 0.378 1.00 0.00 C ATOM 639 CG2 ILE A 42 -10.507 0.861 -1.400 1.00 0.00 C ATOM 640 CD1 ILE A 42 -9.914 -0.219 1.476 1.00 0.00 C ATOM 0 H ILE A 42 -10.302 -3.077 -0.729 1.00 0.00 H new ATOM 0 HA ILE A 42 -11.900 -1.393 -2.074 1.00 0.00 H new ATOM 0 HB ILE A 42 -9.113 -0.713 -1.041 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -11.748 -0.601 0.454 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -10.668 -1.978 0.532 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -10.059 1.530 -0.666 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -10.099 1.080 -2.387 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.587 1.008 -1.413 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -10.331 -0.491 2.446 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -8.873 -0.537 1.426 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -9.970 0.862 1.347 1.00 0.00 H new ATOM 652 N LYS A 43 -8.918 -1.264 -3.531 1.00 0.00 N ATOM 653 CA LYS A 43 -8.238 -0.988 -4.791 1.00 0.00 C ATOM 654 C LYS A 43 -8.819 -1.832 -5.920 1.00 0.00 C ATOM 655 O LYS A 43 -8.897 -1.386 -7.065 1.00 0.00 O ATOM 656 CB LYS A 43 -6.739 -1.259 -4.654 1.00 0.00 C ATOM 657 CG LYS A 43 -5.943 -0.929 -5.907 1.00 0.00 C ATOM 658 CD LYS A 43 -6.137 -1.983 -6.986 1.00 0.00 C ATOM 659 CE LYS A 43 -4.842 -2.260 -7.731 1.00 0.00 C ATOM 660 NZ LYS A 43 -5.089 -2.821 -9.089 1.00 0.00 N ATOM 0 H LYS A 43 -8.294 -1.475 -2.752 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.390 0.064 -5.035 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.348 -0.675 -3.821 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.590 -2.310 -4.405 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -6.251 0.044 -6.289 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -4.885 -0.853 -5.657 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -6.503 -2.905 -6.534 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -6.899 -1.649 -7.690 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -4.269 -1.337 -7.819 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -4.235 -2.958 -7.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.308 -3.457 -9.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -5.983 -3.353 -9.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.149 -2.045 -9.779 1.00 0.00 H new ATOM 674 N LYS A 44 -9.223 -3.055 -5.591 1.00 0.00 N ATOM 675 CA LYS A 44 -9.797 -3.962 -6.578 1.00 0.00 C ATOM 676 C LYS A 44 -11.068 -3.375 -7.180 1.00 0.00 C ATOM 677 O LYS A 44 -11.100 -3.008 -8.355 1.00 0.00 O ATOM 678 CB LYS A 44 -10.099 -5.320 -5.940 1.00 0.00 C ATOM 679 CG LYS A 44 -9.295 -6.464 -6.535 1.00 0.00 C ATOM 680 CD LYS A 44 -9.456 -7.739 -5.724 1.00 0.00 C ATOM 681 CE LYS A 44 -8.127 -8.456 -5.540 1.00 0.00 C ATOM 682 NZ LYS A 44 -7.504 -8.144 -4.222 1.00 0.00 N ATOM 0 H LYS A 44 -9.163 -3.440 -4.649 1.00 0.00 H new ATOM 0 HA LYS A 44 -9.068 -4.099 -7.377 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.897 -5.263 -4.870 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -11.161 -5.537 -6.052 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -9.617 -6.641 -7.561 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -8.241 -6.187 -6.575 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -9.879 -7.500 -4.748 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.162 -8.402 -6.224 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -8.281 -9.532 -5.623 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -7.446 -8.168 -6.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -6.691 -7.512 -4.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -8.203 -7.677 -3.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -7.183 -9.025 -3.772 1.00 0.00 H new ATOM 696 N GLU A 45 -12.111 -3.290 -6.366 1.00 0.00 N ATOM 697 CA GLU A 45 -13.386 -2.746 -6.815 1.00 0.00 C ATOM 698 C GLU A 45 -13.180 -1.425 -7.549 1.00 0.00 C ATOM 699 O GLU A 45 -13.622 -1.260 -8.684 1.00 0.00 O ATOM 700 CB GLU A 45 -14.329 -2.544 -5.626 1.00 0.00 C ATOM 701 CG GLU A 45 -15.079 -3.805 -5.223 1.00 0.00 C ATOM 702 CD GLU A 45 -15.522 -3.782 -3.773 1.00 0.00 C ATOM 703 OE1 GLU A 45 -15.332 -2.741 -3.111 1.00 0.00 O ATOM 704 OE2 GLU A 45 -16.060 -4.805 -3.301 1.00 0.00 O ATOM 0 H GLU A 45 -12.100 -3.591 -5.391 1.00 0.00 H new ATOM 0 HA GLU A 45 -13.836 -3.460 -7.505 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.753 -2.185 -4.773 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.051 -1.765 -5.873 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.952 -3.924 -5.864 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.440 -4.672 -5.390 1.00 0.00 H new ATOM 711 N PHE A 46 -12.500 -0.489 -6.894 1.00 0.00 N ATOM 712 CA PHE A 46 -12.232 0.817 -7.487 1.00 0.00 C ATOM 713 C PHE A 46 -11.742 0.669 -8.925 1.00 0.00 C ATOM 714 O PHE A 46 -12.273 1.299 -9.840 1.00 0.00 O ATOM 715 CB PHE A 46 -11.185 1.570 -6.662 1.00 0.00 C ATOM 716 CG PHE A 46 -11.749 2.710 -5.860 1.00 0.00 C ATOM 717 CD1 PHE A 46 -12.468 2.469 -4.701 1.00 0.00 C ATOM 718 CD2 PHE A 46 -11.554 4.022 -6.263 1.00 0.00 C ATOM 719 CE1 PHE A 46 -12.983 3.514 -3.958 1.00 0.00 C ATOM 720 CE2 PHE A 46 -12.067 5.072 -5.525 1.00 0.00 C ATOM 721 CZ PHE A 46 -12.782 4.818 -4.371 1.00 0.00 C ATOM 0 H PHE A 46 -12.125 -0.610 -5.953 1.00 0.00 H new ATOM 0 HA PHE A 46 -13.163 1.384 -7.491 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -10.696 0.869 -5.985 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -10.416 1.955 -7.332 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -12.628 1.452 -4.374 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -10.995 4.226 -7.164 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -13.542 3.312 -3.056 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -11.909 6.090 -5.850 1.00 0.00 H new ATOM 0 HZ PHE A 46 -13.183 5.637 -3.792 1.00 0.00 H new ATOM 731 N ASP A 47 -10.726 -0.166 -9.114 1.00 0.00 N ATOM 732 CA ASP A 47 -10.160 -0.396 -10.438 1.00 0.00 C ATOM 733 C ASP A 47 -11.180 -1.049 -11.368 1.00 0.00 C ATOM 734 O ASP A 47 -11.073 -0.943 -12.589 1.00 0.00 O ATOM 735 CB ASP A 47 -8.906 -1.271 -10.334 1.00 0.00 C ATOM 736 CG ASP A 47 -9.180 -2.726 -10.666 1.00 0.00 C ATOM 737 OD1 ASP A 47 -9.617 -3.002 -11.802 1.00 0.00 O ATOM 738 OD2 ASP A 47 -8.954 -3.587 -9.790 1.00 0.00 O ATOM 0 H ASP A 47 -10.277 -0.695 -8.366 1.00 0.00 H new ATOM 0 HA ASP A 47 -9.886 0.571 -10.860 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -8.142 -0.886 -11.009 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -8.503 -1.203 -9.324 1.00 0.00 H new ATOM 743 N LYS A 48 -12.164 -1.724 -10.785 1.00 0.00 N ATOM 744 CA LYS A 48 -13.194 -2.393 -11.571 1.00 0.00 C ATOM 745 C LYS A 48 -14.558 -1.744 -11.361 1.00 0.00 C ATOM 746 O LYS A 48 -15.585 -2.287 -11.769 1.00 0.00 O ATOM 747 CB LYS A 48 -13.262 -3.878 -11.208 1.00 0.00 C ATOM 748 CG LYS A 48 -12.548 -4.782 -12.200 1.00 0.00 C ATOM 749 CD LYS A 48 -13.532 -5.497 -13.111 1.00 0.00 C ATOM 750 CE LYS A 48 -14.254 -4.522 -14.027 1.00 0.00 C ATOM 751 NZ LYS A 48 -14.750 -5.185 -15.264 1.00 0.00 N ATOM 0 H LYS A 48 -12.270 -1.822 -9.775 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.926 -2.294 -12.623 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.826 -4.022 -10.219 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -14.307 -4.180 -11.142 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.858 -4.190 -12.801 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.951 -5.517 -11.660 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.002 -6.237 -13.711 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -14.261 -6.038 -12.508 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -15.093 -4.076 -13.493 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.579 -3.709 -14.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.236 -4.486 -15.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -13.947 -5.589 -15.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.414 -5.944 -15.009 1.00 0.00 H new ATOM 765 N LYS A 49 -14.564 -0.580 -10.723 1.00 0.00 N ATOM 766 CA LYS A 49 -15.801 0.142 -10.462 1.00 0.00 C ATOM 767 C LYS A 49 -15.677 1.599 -10.893 1.00 0.00 C ATOM 768 O LYS A 49 -16.659 2.341 -10.905 1.00 0.00 O ATOM 769 CB LYS A 49 -16.164 0.063 -8.978 1.00 0.00 C ATOM 770 CG LYS A 49 -17.651 -0.118 -8.724 1.00 0.00 C ATOM 771 CD LYS A 49 -18.194 0.961 -7.801 1.00 0.00 C ATOM 772 CE LYS A 49 -19.072 1.949 -8.553 1.00 0.00 C ATOM 773 NZ LYS A 49 -20.022 1.263 -9.471 1.00 0.00 N ATOM 0 H LYS A 49 -13.724 -0.116 -10.377 1.00 0.00 H new ATOM 0 HA LYS A 49 -16.595 -0.325 -11.044 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.623 -0.767 -8.524 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -15.827 0.973 -8.481 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -18.189 -0.092 -9.672 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -17.829 -1.099 -8.283 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -18.769 0.499 -6.999 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -17.365 1.492 -7.334 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -19.631 2.554 -7.839 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -18.443 2.631 -9.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -20.912 1.800 -9.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -19.606 1.206 -10.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -20.213 0.303 -9.119 1.00 0.00 H new ATOM 787 N TYR A 50 -14.461 1.999 -11.247 1.00 0.00 N ATOM 788 CA TYR A 50 -14.199 3.365 -11.682 1.00 0.00 C ATOM 789 C TYR A 50 -13.286 3.380 -12.904 1.00 0.00 C ATOM 790 O TYR A 50 -13.684 3.825 -13.982 1.00 0.00 O ATOM 791 CB TYR A 50 -13.557 4.173 -10.551 1.00 0.00 C ATOM 792 CG TYR A 50 -14.392 4.243 -9.293 1.00 0.00 C ATOM 793 CD1 TYR A 50 -14.259 3.286 -8.294 1.00 0.00 C ATOM 794 CD2 TYR A 50 -15.308 5.269 -9.103 1.00 0.00 C ATOM 795 CE1 TYR A 50 -15.018 3.349 -7.140 1.00 0.00 C ATOM 796 CE2 TYR A 50 -16.071 5.339 -7.951 1.00 0.00 C ATOM 797 CZ TYR A 50 -15.922 4.378 -6.974 1.00 0.00 C ATOM 798 OH TYR A 50 -16.678 4.444 -5.826 1.00 0.00 O ATOM 0 H TYR A 50 -13.639 1.395 -11.241 1.00 0.00 H new ATOM 0 HA TYR A 50 -15.152 3.820 -11.951 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -12.590 3.733 -10.308 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -13.367 5.186 -10.905 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -13.551 2.480 -8.421 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -15.427 6.024 -9.866 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -14.904 2.597 -6.373 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -16.780 6.143 -7.818 1.00 0.00 H new ATOM 0 HH TYR A 50 -17.530 3.981 -5.968 1.00 0.00 H new ATOM 808 N ASN A 51 -12.062 2.891 -12.718 1.00 0.00 N ATOM 809 CA ASN A 51 -11.069 2.840 -13.787 1.00 0.00 C ATOM 810 C ASN A 51 -9.660 2.780 -13.198 1.00 0.00 C ATOM 811 O ASN A 51 -9.235 3.701 -12.501 1.00 0.00 O ATOM 812 CB ASN A 51 -11.192 4.062 -14.702 1.00 0.00 C ATOM 813 CG ASN A 51 -11.864 3.732 -16.021 1.00 0.00 C ATOM 814 OD1 ASN A 51 -12.824 2.815 -15.984 1.00 0.00 O flip ATOM 815 ND2 ASN A 51 -11.523 4.293 -17.062 1.00 0.00 N flip ATOM 0 H ASN A 51 -11.732 2.521 -11.827 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.252 1.941 -14.376 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -11.762 4.839 -14.192 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -10.200 4.469 -14.895 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -10.780 4.992 -17.045 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -11.983 4.059 -17.942 1.00 0.00 H new ATOM 822 N PRO A 52 -8.914 1.693 -13.465 1.00 0.00 N ATOM 823 CA PRO A 52 -7.552 1.528 -12.948 1.00 0.00 C ATOM 824 C PRO A 52 -6.605 2.630 -13.434 1.00 0.00 C ATOM 825 O PRO A 52 -6.946 3.376 -14.352 1.00 0.00 O ATOM 826 CB PRO A 52 -7.113 0.166 -13.495 1.00 0.00 C ATOM 827 CG PRO A 52 -8.029 -0.112 -14.637 1.00 0.00 C ATOM 828 CD PRO A 52 -9.334 0.544 -14.285 1.00 0.00 C ATOM 0 HA PRO A 52 -7.526 1.589 -11.860 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -6.073 0.190 -13.821 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.190 -0.608 -12.731 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -7.628 0.290 -15.567 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -8.157 -1.185 -14.783 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -9.880 0.860 -15.174 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -9.988 -0.130 -13.732 1.00 0.00 H new ATOM 836 N THR A 53 -5.413 2.739 -12.824 1.00 0.00 N ATOM 837 CA THR A 53 -4.992 1.860 -11.733 1.00 0.00 C ATOM 838 C THR A 53 -4.971 2.613 -10.409 1.00 0.00 C ATOM 839 O THR A 53 -4.286 3.626 -10.272 1.00 0.00 O ATOM 840 CB THR A 53 -3.611 1.273 -12.021 1.00 0.00 C ATOM 841 OG1 THR A 53 -3.056 1.846 -13.191 1.00 0.00 O ATOM 842 CG2 THR A 53 -3.627 -0.228 -12.210 1.00 0.00 C ATOM 0 H THR A 53 -4.718 3.441 -13.077 1.00 0.00 H new ATOM 0 HA THR A 53 -5.713 1.046 -11.658 1.00 0.00 H new ATOM 0 HB THR A 53 -3.009 1.507 -11.143 1.00 0.00 H new ATOM 0 HG1 THR A 53 -2.171 1.458 -13.357 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.615 -0.580 -12.411 1.00 0.00 H new ATOM 0 HG22 THR A 53 -4.004 -0.705 -11.305 1.00 0.00 H new ATOM 0 HG23 THR A 53 -4.273 -0.482 -13.050 1.00 0.00 H new ATOM 850 N TRP A 54 -5.732 2.116 -9.442 1.00 0.00 N ATOM 851 CA TRP A 54 -5.810 2.748 -8.132 1.00 0.00 C ATOM 852 C TRP A 54 -4.814 2.146 -7.146 1.00 0.00 C ATOM 853 O TRP A 54 -4.485 0.962 -7.216 1.00 0.00 O ATOM 854 CB TRP A 54 -7.223 2.616 -7.566 1.00 0.00 C ATOM 855 CG TRP A 54 -8.281 3.179 -8.459 1.00 0.00 C ATOM 856 CD1 TRP A 54 -8.713 2.662 -9.647 1.00 0.00 C ATOM 857 CD2 TRP A 54 -9.045 4.368 -8.237 1.00 0.00 C ATOM 858 NE1 TRP A 54 -9.702 3.456 -10.174 1.00 0.00 N ATOM 859 CE2 TRP A 54 -9.923 4.511 -9.327 1.00 0.00 C ATOM 860 CE3 TRP A 54 -9.072 5.327 -7.219 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -10.818 5.572 -9.426 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -9.961 6.379 -7.319 1.00 0.00 C ATOM 863 CH2 TRP A 54 -10.824 6.495 -8.416 1.00 0.00 C ATOM 0 H TRP A 54 -6.304 1.277 -9.541 1.00 0.00 H new ATOM 0 HA TRP A 54 -5.559 3.800 -8.267 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -7.436 1.562 -7.384 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -7.267 3.121 -6.601 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -8.333 1.761 -10.105 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -10.192 3.288 -11.053 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -8.409 5.246 -6.370 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -11.485 5.664 -10.271 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -9.991 7.125 -6.538 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -11.508 7.330 -8.466 1.00 0.00 H new ATOM 874 N HIS A 55 -4.364 2.976 -6.212 1.00 0.00 N ATOM 875 CA HIS A 55 -3.428 2.551 -5.177 1.00 0.00 C ATOM 876 C HIS A 55 -3.983 2.924 -3.808 1.00 0.00 C ATOM 877 O HIS A 55 -3.959 4.092 -3.418 1.00 0.00 O ATOM 878 CB HIS A 55 -2.059 3.204 -5.382 1.00 0.00 C ATOM 879 CG HIS A 55 -1.531 3.073 -6.777 1.00 0.00 C ATOM 880 ND1 HIS A 55 -0.306 2.511 -7.067 1.00 0.00 N ATOM 881 CD2 HIS A 55 -2.069 3.434 -7.966 1.00 0.00 C ATOM 882 CE1 HIS A 55 -0.112 2.533 -8.373 1.00 0.00 C ATOM 883 NE2 HIS A 55 -1.167 3.088 -8.941 1.00 0.00 N ATOM 0 H HIS A 55 -4.636 3.957 -6.150 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.303 1.470 -5.239 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -2.129 4.262 -5.128 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.346 2.756 -4.690 1.00 0.00 H new ATOM 0 HD1 HIS A 55 0.348 2.137 -6.380 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -3.028 3.906 -8.119 1.00 0.00 H new ATOM 0 HE1 HIS A 55 0.761 2.161 -8.889 1.00 0.00 H new ATOM 892 N CYS A 56 -4.508 1.936 -3.093 1.00 0.00 N ATOM 893 CA CYS A 56 -5.097 2.185 -1.783 1.00 0.00 C ATOM 894 C CYS A 56 -4.291 1.551 -0.655 1.00 0.00 C ATOM 895 O CYS A 56 -3.931 0.375 -0.715 1.00 0.00 O ATOM 896 CB CYS A 56 -6.531 1.657 -1.746 1.00 0.00 C ATOM 897 SG CYS A 56 -7.333 1.579 -3.365 1.00 0.00 S ATOM 0 H CYS A 56 -4.538 0.962 -3.395 1.00 0.00 H new ATOM 0 HA CYS A 56 -5.091 3.264 -1.627 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -6.528 0.660 -1.306 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -7.124 2.294 -1.089 1.00 0.00 H new ATOM 0 HG CYS A 56 -6.983 2.612 -4.073 1.00 0.00 H new ATOM 903 N ILE A 57 -4.038 2.340 0.383 1.00 0.00 N ATOM 904 CA ILE A 57 -3.301 1.870 1.552 1.00 0.00 C ATOM 905 C ILE A 57 -4.162 1.998 2.802 1.00 0.00 C ATOM 906 O ILE A 57 -4.400 3.103 3.289 1.00 0.00 O ATOM 907 CB ILE A 57 -1.995 2.658 1.769 1.00 0.00 C ATOM 908 CG1 ILE A 57 -1.146 2.665 0.494 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.214 2.067 2.936 1.00 0.00 C ATOM 910 CD1 ILE A 57 -0.926 1.290 -0.099 1.00 0.00 C ATOM 0 H ILE A 57 -4.334 3.314 0.439 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.048 0.826 1.369 1.00 0.00 H new ATOM 0 HB ILE A 57 -2.248 3.691 2.008 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.629 3.299 -0.250 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -0.178 3.114 0.715 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.293 2.632 3.080 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -1.818 2.120 3.842 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -0.972 1.026 2.722 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.317 1.375 -0.999 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.415 0.658 0.627 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.888 0.845 -0.353 1.00 0.00 H new ATOM 922 N VAL A 58 -4.637 0.869 3.314 1.00 0.00 N ATOM 923 CA VAL A 58 -5.482 0.876 4.500 1.00 0.00 C ATOM 924 C VAL A 58 -4.739 0.347 5.722 1.00 0.00 C ATOM 925 O VAL A 58 -4.112 -0.711 5.673 1.00 0.00 O ATOM 926 CB VAL A 58 -6.761 0.049 4.287 1.00 0.00 C ATOM 927 CG1 VAL A 58 -6.416 -1.355 3.824 1.00 0.00 C ATOM 928 CG2 VAL A 58 -7.595 0.014 5.559 1.00 0.00 C ATOM 0 H VAL A 58 -4.453 -0.057 2.929 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.758 1.916 4.677 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.355 0.526 3.508 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.333 -1.926 3.678 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.867 -1.303 2.883 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.799 -1.845 4.577 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.495 -0.576 5.388 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.013 -0.437 6.363 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -7.874 1.030 5.839 1.00 0.00 H new ATOM 938 N GLY A 59 -4.824 1.093 6.818 1.00 0.00 N ATOM 939 CA GLY A 59 -4.166 0.699 8.048 1.00 0.00 C ATOM 940 C GLY A 59 -4.845 1.293 9.265 1.00 0.00 C ATOM 941 O GLY A 59 -6.070 1.401 9.306 1.00 0.00 O ATOM 0 H GLY A 59 -5.341 1.970 6.875 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -4.164 -0.388 8.127 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -3.124 1.018 8.021 1.00 0.00 H new ATOM 945 N ARG A 60 -4.056 1.678 10.261 1.00 0.00 N ATOM 946 CA ARG A 60 -4.605 2.257 11.474 1.00 0.00 C ATOM 947 C ARG A 60 -3.554 3.050 12.246 1.00 0.00 C ATOM 948 O ARG A 60 -3.827 3.555 13.335 1.00 0.00 O ATOM 949 CB ARG A 60 -5.174 1.153 12.354 1.00 0.00 C ATOM 950 CG ARG A 60 -4.511 -0.197 12.139 1.00 0.00 C ATOM 951 CD ARG A 60 -5.509 -1.335 12.277 1.00 0.00 C ATOM 952 NE ARG A 60 -5.113 -2.285 13.313 1.00 0.00 N ATOM 953 CZ ARG A 60 -5.136 -2.008 14.612 1.00 0.00 C ATOM 954 NH1 ARG A 60 -5.547 -0.819 15.032 1.00 0.00 N ATOM 955 NH2 ARG A 60 -4.750 -2.923 15.492 1.00 0.00 N ATOM 0 H ARG A 60 -3.039 1.599 10.250 1.00 0.00 H new ATOM 0 HA ARG A 60 -5.398 2.949 11.190 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -5.064 1.440 13.400 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -6.242 1.059 12.160 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.057 -0.227 11.148 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.706 -0.328 12.862 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.492 -0.929 12.514 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.600 -1.855 11.323 1.00 0.00 H new ATOM 0 HE ARG A 60 -4.802 -3.212 13.023 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -5.846 -0.115 14.357 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -5.564 -0.608 16.030 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -4.436 -3.839 15.171 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -4.768 -2.711 16.489 1.00 0.00 H new ATOM 969 N ASN A 61 -2.355 3.158 11.684 1.00 0.00 N ATOM 970 CA ASN A 61 -1.278 3.895 12.338 1.00 0.00 C ATOM 971 C ASN A 61 -0.022 3.932 11.472 1.00 0.00 C ATOM 972 O ASN A 61 1.094 3.962 11.990 1.00 0.00 O ATOM 973 CB ASN A 61 -0.954 3.264 13.693 1.00 0.00 C ATOM 974 CG ASN A 61 -1.257 4.193 14.852 1.00 0.00 C ATOM 975 OD1 ASN A 61 -2.216 3.984 15.595 1.00 0.00 O ATOM 976 ND2 ASN A 61 -0.438 5.225 15.012 1.00 0.00 N ATOM 0 H ASN A 61 -2.105 2.748 10.784 1.00 0.00 H new ATOM 0 HA ASN A 61 -1.619 4.920 12.487 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.528 2.344 13.809 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.100 2.987 13.719 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.591 5.884 15.775 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.345 5.359 14.372 1.00 0.00 H new ATOM 983 N PHE A 62 -0.207 3.936 10.157 1.00 0.00 N ATOM 984 CA PHE A 62 0.920 3.975 9.235 1.00 0.00 C ATOM 985 C PHE A 62 1.264 5.410 8.854 1.00 0.00 C ATOM 986 O PHE A 62 0.892 6.356 9.548 1.00 0.00 O ATOM 987 CB PHE A 62 0.604 3.164 7.979 1.00 0.00 C ATOM 988 CG PHE A 62 -0.419 3.808 7.089 1.00 0.00 C ATOM 989 CD1 PHE A 62 -1.576 4.354 7.621 1.00 0.00 C ATOM 990 CD2 PHE A 62 -0.222 3.869 5.720 1.00 0.00 C ATOM 991 CE1 PHE A 62 -2.518 4.947 6.803 1.00 0.00 C ATOM 992 CE2 PHE A 62 -1.161 4.460 4.895 1.00 0.00 C ATOM 993 CZ PHE A 62 -2.311 5.000 5.438 1.00 0.00 C ATOM 0 H PHE A 62 -1.122 3.913 9.708 1.00 0.00 H new ATOM 0 HA PHE A 62 1.782 3.536 9.737 1.00 0.00 H new ATOM 0 HB2 PHE A 62 1.523 3.014 7.413 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.247 2.177 8.274 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -1.743 4.316 8.687 1.00 0.00 H new ATOM 0 HD2 PHE A 62 0.676 3.450 5.291 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -3.416 5.369 7.230 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -0.996 4.499 3.828 1.00 0.00 H new ATOM 0 HZ PHE A 62 -3.047 5.463 4.797 1.00 0.00 H new ATOM 1003 N GLY A 63 1.975 5.563 7.743 1.00 0.00 N ATOM 1004 CA GLY A 63 2.360 6.882 7.277 1.00 0.00 C ATOM 1005 C GLY A 63 2.547 6.919 5.776 1.00 0.00 C ATOM 1006 O GLY A 63 3.673 6.878 5.280 1.00 0.00 O ATOM 0 H GLY A 63 2.293 4.793 7.154 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.598 7.606 7.566 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.287 7.183 7.766 1.00 0.00 H new ATOM 1010 N SER A 64 1.439 6.986 5.050 1.00 0.00 N ATOM 1011 CA SER A 64 1.478 7.017 3.593 1.00 0.00 C ATOM 1012 C SER A 64 1.972 8.366 3.085 1.00 0.00 C ATOM 1013 O SER A 64 1.619 9.414 3.625 1.00 0.00 O ATOM 1014 CB SER A 64 0.095 6.714 3.015 1.00 0.00 C ATOM 1015 OG SER A 64 -0.749 7.852 3.088 1.00 0.00 O ATOM 0 H SER A 64 0.500 7.020 5.447 1.00 0.00 H new ATOM 0 HA SER A 64 2.177 6.250 3.261 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.193 6.396 1.977 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.357 5.886 3.561 1.00 0.00 H new ATOM 0 HG SER A 64 -1.439 7.704 3.768 1.00 0.00 H new ATOM 1021 N TYR A 65 2.790 8.328 2.039 1.00 0.00 N ATOM 1022 CA TYR A 65 3.337 9.540 1.445 1.00 0.00 C ATOM 1023 C TYR A 65 3.646 9.319 -0.030 1.00 0.00 C ATOM 1024 O TYR A 65 4.778 9.006 -0.399 1.00 0.00 O ATOM 1025 CB TYR A 65 4.605 9.970 2.184 1.00 0.00 C ATOM 1026 CG TYR A 65 5.160 11.295 1.715 1.00 0.00 C ATOM 1027 CD1 TYR A 65 4.732 12.488 2.283 1.00 0.00 C ATOM 1028 CD2 TYR A 65 6.115 11.353 0.708 1.00 0.00 C ATOM 1029 CE1 TYR A 65 5.238 13.702 1.859 1.00 0.00 C ATOM 1030 CE2 TYR A 65 6.626 12.563 0.279 1.00 0.00 C ATOM 1031 CZ TYR A 65 6.185 13.733 0.858 1.00 0.00 C ATOM 1032 OH TYR A 65 6.693 14.940 0.434 1.00 0.00 O ATOM 0 H TYR A 65 3.089 7.466 1.584 1.00 0.00 H new ATOM 0 HA TYR A 65 2.592 10.330 1.533 1.00 0.00 H new ATOM 0 HB2 TYR A 65 4.390 10.033 3.251 1.00 0.00 H new ATOM 0 HB3 TYR A 65 5.367 9.201 2.058 1.00 0.00 H new ATOM 0 HD1 TYR A 65 3.992 12.467 3.069 1.00 0.00 H new ATOM 0 HD2 TYR A 65 6.464 10.438 0.253 1.00 0.00 H new ATOM 0 HE1 TYR A 65 4.893 14.621 2.309 1.00 0.00 H new ATOM 0 HE2 TYR A 65 7.367 12.592 -0.506 1.00 0.00 H new ATOM 0 HH TYR A 65 7.351 14.787 -0.276 1.00 0.00 H new ATOM 1042 N VAL A 66 2.629 9.476 -0.869 1.00 0.00 N ATOM 1043 CA VAL A 66 2.789 9.288 -2.303 1.00 0.00 C ATOM 1044 C VAL A 66 2.172 10.443 -3.085 1.00 0.00 C ATOM 1045 O VAL A 66 1.438 11.260 -2.528 1.00 0.00 O ATOM 1046 CB VAL A 66 2.151 7.962 -2.765 1.00 0.00 C ATOM 1047 CG1 VAL A 66 2.529 6.833 -1.819 1.00 0.00 C ATOM 1048 CG2 VAL A 66 0.638 8.092 -2.866 1.00 0.00 C ATOM 0 H VAL A 66 1.685 9.733 -0.580 1.00 0.00 H new ATOM 0 HA VAL A 66 3.860 9.257 -2.503 1.00 0.00 H new ATOM 0 HB VAL A 66 2.536 7.727 -3.757 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.071 5.904 -2.159 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.613 6.718 -1.804 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.175 7.066 -0.815 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.212 7.144 -3.194 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.230 8.355 -1.890 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.387 8.870 -3.586 1.00 0.00 H new ATOM 1058 N THR A 67 2.470 10.502 -4.376 1.00 0.00 N ATOM 1059 CA THR A 67 1.939 11.556 -5.232 1.00 0.00 C ATOM 1060 C THR A 67 0.540 11.195 -5.724 1.00 0.00 C ATOM 1061 O THR A 67 0.000 10.147 -5.371 1.00 0.00 O ATOM 1062 CB THR A 67 2.876 11.807 -6.415 1.00 0.00 C ATOM 1063 OG1 THR A 67 2.744 13.137 -6.884 1.00 0.00 O ATOM 1064 CG2 THR A 67 2.632 10.884 -7.587 1.00 0.00 C ATOM 0 H THR A 67 3.075 9.834 -4.853 1.00 0.00 H new ATOM 0 HA THR A 67 1.870 12.473 -4.646 1.00 0.00 H new ATOM 0 HB THR A 67 3.878 11.617 -6.030 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.352 13.279 -7.639 1.00 0.00 H new ATOM 0 HG21 THR A 67 3.333 11.120 -8.388 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.776 9.850 -7.272 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.612 11.015 -7.947 1.00 0.00 H new ATOM 1072 N HIS A 68 -0.041 12.067 -6.542 1.00 0.00 N ATOM 1073 CA HIS A 68 -1.377 11.834 -7.079 1.00 0.00 C ATOM 1074 C HIS A 68 -1.392 12.030 -8.591 1.00 0.00 C ATOM 1075 O HIS A 68 -0.583 12.778 -9.138 1.00 0.00 O ATOM 1076 CB HIS A 68 -2.387 12.773 -6.419 1.00 0.00 C ATOM 1077 CG HIS A 68 -1.850 14.147 -6.162 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -2.456 15.358 -6.213 1.00 0.00 N flip ATOM 1079 CD2 HIS A 68 -0.541 14.391 -5.804 1.00 0.00 C flip ATOM 1080 CE1 HIS A 68 -1.510 16.298 -5.888 1.00 0.00 C flip ATOM 1081 NE2 HIS A 68 -0.364 15.691 -5.644 1.00 0.00 N flip ATOM 0 H HIS A 68 0.391 12.939 -6.847 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.657 10.804 -6.860 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.269 12.850 -7.055 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.713 12.337 -5.475 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -3.432 15.537 -6.449 1.00 0.00 H new ATOM 0 HD2 HIS A 68 0.221 13.637 -5.674 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -1.677 17.364 -5.840 1.00 0.00 H new ATOM 1090 N GLU A 69 -2.315 11.350 -9.264 1.00 0.00 N ATOM 1091 CA GLU A 69 -2.425 11.450 -10.714 1.00 0.00 C ATOM 1092 C GLU A 69 -3.850 11.807 -11.139 1.00 0.00 C ATOM 1093 O GLU A 69 -4.405 12.813 -10.700 1.00 0.00 O ATOM 1094 CB GLU A 69 -1.991 10.136 -11.369 1.00 0.00 C ATOM 1095 CG GLU A 69 -0.609 9.669 -10.938 1.00 0.00 C ATOM 1096 CD GLU A 69 0.499 10.279 -11.773 1.00 0.00 C ATOM 1097 OE1 GLU A 69 0.514 11.519 -11.925 1.00 0.00 O ATOM 1098 OE2 GLU A 69 1.353 9.518 -12.274 1.00 0.00 O ATOM 0 H GLU A 69 -2.995 10.726 -8.830 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.764 12.250 -11.047 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.719 9.361 -11.128 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -2.003 10.258 -12.452 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -0.453 9.926 -9.890 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.558 8.583 -11.011 1.00 0.00 H new ATOM 1105 N THR A 70 -4.430 10.976 -12.002 1.00 0.00 N ATOM 1106 CA THR A 70 -5.784 11.198 -12.501 1.00 0.00 C ATOM 1107 C THR A 70 -6.660 11.903 -11.468 1.00 0.00 C ATOM 1108 O THR A 70 -6.601 13.123 -11.320 1.00 0.00 O ATOM 1109 CB THR A 70 -6.423 9.866 -12.899 1.00 0.00 C ATOM 1110 OG1 THR A 70 -6.180 8.880 -11.913 1.00 0.00 O ATOM 1111 CG2 THR A 70 -5.917 9.331 -14.221 1.00 0.00 C ATOM 0 H THR A 70 -3.980 10.139 -12.372 1.00 0.00 H new ATOM 0 HA THR A 70 -5.710 11.845 -13.375 1.00 0.00 H new ATOM 0 HB THR A 70 -7.489 10.073 -12.995 1.00 0.00 H new ATOM 0 HG1 THR A 70 -5.276 8.518 -12.028 1.00 0.00 H new ATOM 0 HG21 THR A 70 -6.410 8.385 -14.443 1.00 0.00 H new ATOM 0 HG22 THR A 70 -6.135 10.049 -15.012 1.00 0.00 H new ATOM 0 HG23 THR A 70 -4.840 9.173 -14.162 1.00 0.00 H new ATOM 1119 N LYS A 71 -7.479 11.128 -10.766 1.00 0.00 N ATOM 1120 CA LYS A 71 -8.376 11.679 -9.756 1.00 0.00 C ATOM 1121 C LYS A 71 -7.606 12.101 -8.510 1.00 0.00 C ATOM 1122 O LYS A 71 -8.150 12.110 -7.406 1.00 0.00 O ATOM 1123 CB LYS A 71 -9.450 10.656 -9.384 1.00 0.00 C ATOM 1124 CG LYS A 71 -10.045 9.936 -10.583 1.00 0.00 C ATOM 1125 CD LYS A 71 -10.590 10.916 -11.608 1.00 0.00 C ATOM 1126 CE LYS A 71 -11.782 10.336 -12.352 1.00 0.00 C ATOM 1127 NZ LYS A 71 -13.061 10.972 -11.936 1.00 0.00 N ATOM 0 H LYS A 71 -7.541 10.116 -10.877 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.855 12.562 -10.179 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -9.019 9.920 -8.705 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -10.249 11.161 -8.841 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -9.283 9.309 -11.047 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -10.844 9.273 -10.251 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -10.885 11.840 -11.110 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -9.806 11.174 -12.320 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -11.641 10.472 -13.424 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -11.835 9.262 -12.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -13.848 10.548 -12.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -13.209 10.821 -10.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -13.021 11.993 -12.132 1.00 0.00 H new ATOM 1141 N HIS A 72 -6.340 12.453 -8.694 1.00 0.00 N ATOM 1142 CA HIS A 72 -5.499 12.879 -7.584 1.00 0.00 C ATOM 1143 C HIS A 72 -5.336 11.759 -6.561 1.00 0.00 C ATOM 1144 O HIS A 72 -4.420 10.944 -6.663 1.00 0.00 O ATOM 1145 CB HIS A 72 -6.094 14.119 -6.912 1.00 0.00 C ATOM 1146 CG HIS A 72 -5.865 15.384 -7.680 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -5.084 16.420 -7.208 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -6.323 15.783 -8.891 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -5.072 17.399 -8.096 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -5.814 17.037 -9.125 1.00 0.00 N ATOM 0 H HIS A 72 -5.874 12.452 -9.601 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.515 13.127 -7.982 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -7.166 13.972 -6.781 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -5.663 14.225 -5.916 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -6.968 15.220 -9.549 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -4.544 18.336 -7.996 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -5.983 17.598 -9.960 1.00 0.00 H new ATOM 1159 N PHE A 73 -6.232 11.726 -5.577 1.00 0.00 N ATOM 1160 CA PHE A 73 -6.191 10.709 -4.531 1.00 0.00 C ATOM 1161 C PHE A 73 -7.011 11.151 -3.324 1.00 0.00 C ATOM 1162 O PHE A 73 -7.253 12.341 -3.128 1.00 0.00 O ATOM 1163 CB PHE A 73 -4.744 10.433 -4.105 1.00 0.00 C ATOM 1164 CG PHE A 73 -4.222 11.393 -3.072 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -4.506 12.746 -3.161 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -3.451 10.941 -2.014 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -4.030 13.631 -2.212 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -2.972 11.822 -1.063 1.00 0.00 C ATOM 1169 CZ PHE A 73 -3.262 13.169 -1.161 1.00 0.00 C ATOM 0 H PHE A 73 -6.997 12.394 -5.483 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.621 9.791 -4.932 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.678 9.419 -3.711 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.102 10.476 -4.985 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -5.106 13.113 -3.981 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -3.222 9.889 -1.931 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -4.259 14.683 -2.292 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -2.371 11.457 -0.243 1.00 0.00 H new ATOM 0 HZ PHE A 73 -2.889 13.859 -0.418 1.00 0.00 H new ATOM 1179 N ILE A 74 -7.430 10.187 -2.512 1.00 0.00 N ATOM 1180 CA ILE A 74 -8.215 10.487 -1.325 1.00 0.00 C ATOM 1181 C ILE A 74 -7.606 9.849 -0.083 1.00 0.00 C ATOM 1182 O ILE A 74 -7.225 8.679 -0.093 1.00 0.00 O ATOM 1183 CB ILE A 74 -9.665 9.999 -1.463 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -10.519 10.594 -0.326 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -9.694 8.474 -1.470 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -11.743 9.783 0.053 1.00 0.00 C ATOM 0 H ILE A 74 -7.239 9.195 -2.655 1.00 0.00 H new ATOM 0 HA ILE A 74 -8.210 11.572 -1.221 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.091 10.339 -2.407 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.891 10.708 0.557 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -10.841 11.593 -0.620 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -10.724 8.130 -1.568 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.106 8.103 -2.309 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.273 8.098 -0.538 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -12.276 10.285 0.861 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -12.400 9.689 -0.812 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -11.434 8.791 0.383 1.00 0.00 H new ATOM 1198 N TYR A 75 -7.527 10.627 0.989 1.00 0.00 N ATOM 1199 CA TYR A 75 -6.979 10.148 2.250 1.00 0.00 C ATOM 1200 C TYR A 75 -7.986 10.357 3.373 1.00 0.00 C ATOM 1201 O TYR A 75 -8.648 11.392 3.437 1.00 0.00 O ATOM 1202 CB TYR A 75 -5.674 10.878 2.571 1.00 0.00 C ATOM 1203 CG TYR A 75 -4.748 10.098 3.476 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -4.654 8.715 3.379 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -3.967 10.744 4.426 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -3.809 7.998 4.205 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -3.120 10.034 5.255 1.00 0.00 C ATOM 1208 CZ TYR A 75 -3.044 8.663 5.140 1.00 0.00 C ATOM 1209 OH TYR A 75 -2.202 7.952 5.964 1.00 0.00 O ATOM 0 H TYR A 75 -7.838 11.598 1.009 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.771 9.082 2.158 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -5.154 11.101 1.639 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -5.908 11.833 3.042 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -5.251 8.192 2.646 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.023 11.819 4.518 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.748 6.923 4.119 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -2.520 10.551 5.990 1.00 0.00 H new ATOM 0 HH TYR A 75 -2.535 7.035 6.060 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.105 9.373 4.256 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.043 9.463 5.368 1.00 0.00 C ATOM 1221 C PHE A 76 -8.720 8.430 6.441 1.00 0.00 C ATOM 1222 O PHE A 76 -7.972 7.483 6.201 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.475 9.267 4.871 1.00 0.00 C ATOM 1224 CG PHE A 76 -10.612 8.181 3.843 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -10.052 8.325 2.584 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -11.300 7.015 4.137 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -10.178 7.326 1.636 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -11.429 6.013 3.195 1.00 0.00 C ATOM 1229 CZ PHE A 76 -10.867 6.169 1.942 1.00 0.00 C ATOM 0 H PHE A 76 -7.566 8.507 4.224 1.00 0.00 H new ATOM 0 HA PHE A 76 -8.950 10.456 5.808 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -11.117 9.034 5.721 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -10.835 10.204 4.447 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -9.511 9.227 2.340 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -11.741 6.888 5.115 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -9.738 7.451 0.658 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -11.968 5.109 3.437 1.00 0.00 H new ATOM 0 HZ PHE A 76 -10.967 5.387 1.203 1.00 0.00 H new ATOM 1239 N TYR A 77 -9.291 8.621 7.626 1.00 0.00 N ATOM 1240 CA TYR A 77 -9.063 7.705 8.736 1.00 0.00 C ATOM 1241 C TYR A 77 -10.383 7.221 9.328 1.00 0.00 C ATOM 1242 O TYR A 77 -10.966 7.877 10.192 1.00 0.00 O ATOM 1243 CB TYR A 77 -8.226 8.382 9.822 1.00 0.00 C ATOM 1244 CG TYR A 77 -7.864 7.463 10.966 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -6.773 6.608 10.878 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -8.615 7.450 12.135 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -6.440 5.765 11.921 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -8.288 6.610 13.183 1.00 0.00 C ATOM 1249 CZ TYR A 77 -7.200 5.770 13.071 1.00 0.00 C ATOM 1250 OH TYR A 77 -6.870 4.932 14.112 1.00 0.00 O ATOM 0 H TYR A 77 -9.913 9.400 7.841 1.00 0.00 H new ATOM 0 HA TYR A 77 -8.520 6.842 8.351 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.311 8.770 9.375 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.777 9.237 10.214 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.175 6.602 9.979 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -9.468 8.107 12.226 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -5.589 5.106 11.836 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -8.882 6.612 14.085 1.00 0.00 H new ATOM 0 HH TYR A 77 -7.504 5.059 14.848 1.00 0.00 H new ATOM 1260 N LEU A 78 -10.847 6.065 8.862 1.00 0.00 N ATOM 1261 CA LEU A 78 -12.094 5.489 9.348 1.00 0.00 C ATOM 1262 C LEU A 78 -12.181 5.586 10.868 1.00 0.00 C ATOM 1263 O LEU A 78 -11.166 5.718 11.550 1.00 0.00 O ATOM 1264 CB LEU A 78 -12.204 4.027 8.910 1.00 0.00 C ATOM 1265 CG LEU A 78 -12.749 3.813 7.497 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -14.244 4.083 7.453 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -12.016 4.700 6.501 1.00 0.00 C ATOM 0 H LEU A 78 -10.377 5.509 8.148 1.00 0.00 H new ATOM 0 HA LEU A 78 -12.922 6.054 8.919 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.217 3.569 8.975 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.847 3.500 9.615 1.00 0.00 H new ATOM 0 HG LEU A 78 -12.581 2.773 7.219 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.613 3.925 6.439 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.756 3.405 8.135 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.437 5.113 7.753 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.418 4.534 5.501 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.151 5.746 6.777 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -10.954 4.457 6.510 1.00 0.00 H new ATOM 1279 N GLY A 79 -13.401 5.523 11.392 1.00 0.00 N ATOM 1280 CA GLY A 79 -13.598 5.607 12.828 1.00 0.00 C ATOM 1281 C GLY A 79 -12.454 4.989 13.612 1.00 0.00 C ATOM 1282 O GLY A 79 -12.169 5.403 14.736 1.00 0.00 O ATOM 0 H GLY A 79 -14.257 5.415 10.848 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -13.707 6.653 13.115 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.528 5.105 13.093 1.00 0.00 H new ATOM 1286 N GLN A 80 -11.796 3.997 13.019 1.00 0.00 N ATOM 1287 CA GLN A 80 -10.677 3.323 13.671 1.00 0.00 C ATOM 1288 C GLN A 80 -9.713 2.745 12.640 1.00 0.00 C ATOM 1289 O GLN A 80 -9.105 1.697 12.860 1.00 0.00 O ATOM 1290 CB GLN A 80 -11.190 2.208 14.585 1.00 0.00 C ATOM 1291 CG GLN A 80 -11.847 1.062 13.834 1.00 0.00 C ATOM 1292 CD GLN A 80 -12.335 -0.038 14.756 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -13.534 -0.307 14.840 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -11.407 -0.680 15.455 1.00 0.00 N ATOM 0 H GLN A 80 -12.018 3.642 12.089 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.141 4.060 14.270 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -10.358 1.818 15.171 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -11.907 2.628 15.290 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -12.688 1.446 13.257 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -11.135 0.644 13.122 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -10.425 -0.424 15.354 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -11.676 -1.429 16.093 1.00 0.00 H new ATOM 1303 N VAL A 81 -9.580 3.433 11.511 1.00 0.00 N ATOM 1304 CA VAL A 81 -8.694 2.988 10.443 1.00 0.00 C ATOM 1305 C VAL A 81 -8.272 4.161 9.560 1.00 0.00 C ATOM 1306 O VAL A 81 -8.801 5.263 9.688 1.00 0.00 O ATOM 1307 CB VAL A 81 -9.376 1.913 9.576 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -8.526 1.565 8.363 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -9.665 0.671 10.405 1.00 0.00 C ATOM 0 H VAL A 81 -10.076 4.302 11.312 1.00 0.00 H new ATOM 0 HA VAL A 81 -7.808 2.559 10.910 1.00 0.00 H new ATOM 0 HB VAL A 81 -10.321 2.318 9.214 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -9.033 0.804 7.770 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -8.376 2.458 7.756 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.560 1.184 8.693 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -10.147 -0.080 9.779 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.731 0.270 10.798 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -10.325 0.931 11.233 1.00 0.00 H new ATOM 1319 N ALA A 82 -7.319 3.917 8.667 1.00 0.00 N ATOM 1320 CA ALA A 82 -6.830 4.954 7.766 1.00 0.00 C ATOM 1321 C ALA A 82 -6.671 4.412 6.350 1.00 0.00 C ATOM 1322 O ALA A 82 -5.902 3.479 6.118 1.00 0.00 O ATOM 1323 CB ALA A 82 -5.509 5.514 8.271 1.00 0.00 C ATOM 0 H ALA A 82 -6.869 3.009 8.548 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.565 5.759 7.742 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.157 6.287 7.588 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.651 5.943 9.263 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.771 4.713 8.325 1.00 0.00 H new ATOM 1329 N ILE A 83 -7.404 4.994 5.408 1.00 0.00 N ATOM 1330 CA ILE A 83 -7.341 4.555 4.019 1.00 0.00 C ATOM 1331 C ILE A 83 -6.694 5.608 3.126 1.00 0.00 C ATOM 1332 O ILE A 83 -7.081 6.777 3.141 1.00 0.00 O ATOM 1333 CB ILE A 83 -8.740 4.223 3.462 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -9.732 3.979 4.604 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.668 3.009 2.547 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.479 2.696 5.366 1.00 0.00 C ATOM 0 H ILE A 83 -8.046 5.768 5.579 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.730 3.653 4.012 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.093 5.075 2.881 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.687 4.818 5.298 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -10.743 3.956 4.197 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.662 2.785 2.160 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.994 3.219 1.716 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.296 2.152 3.108 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.220 2.591 6.158 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.553 1.848 4.685 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.481 2.724 5.804 1.00 0.00 H new ATOM 1348 N LEU A 84 -5.712 5.176 2.345 1.00 0.00 N ATOM 1349 CA LEU A 84 -5.004 6.064 1.432 1.00 0.00 C ATOM 1350 C LEU A 84 -5.239 5.634 -0.012 1.00 0.00 C ATOM 1351 O LEU A 84 -4.509 4.798 -0.546 1.00 0.00 O ATOM 1352 CB LEU A 84 -3.505 6.059 1.744 1.00 0.00 C ATOM 1353 CG LEU A 84 -2.597 6.443 0.574 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -2.286 7.930 0.611 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -1.315 5.622 0.603 1.00 0.00 C ATOM 0 H LEU A 84 -5.386 4.210 2.326 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.387 7.076 1.564 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.319 6.747 2.569 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.225 5.064 2.090 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.119 6.226 -0.358 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.639 8.187 -0.228 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.214 8.498 0.541 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.782 8.173 1.546 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.681 5.908 -0.236 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.786 5.807 1.538 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.560 4.562 0.528 1.00 0.00 H new ATOM 1367 N LEU A 85 -6.261 6.204 -0.639 1.00 0.00 N ATOM 1368 CA LEU A 85 -6.587 5.870 -2.017 1.00 0.00 C ATOM 1369 C LEU A 85 -5.906 6.828 -2.987 1.00 0.00 C ATOM 1370 O LEU A 85 -5.910 8.040 -2.783 1.00 0.00 O ATOM 1371 CB LEU A 85 -8.100 5.908 -2.229 1.00 0.00 C ATOM 1372 CG LEU A 85 -8.772 4.541 -2.367 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -8.641 3.750 -1.076 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -10.235 4.704 -2.749 1.00 0.00 C ATOM 0 H LEU A 85 -6.876 6.898 -0.215 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.223 4.862 -2.213 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.555 6.436 -1.391 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.311 6.491 -3.126 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.269 3.988 -3.160 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.125 2.780 -1.193 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.586 3.604 -0.844 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.118 4.298 -0.264 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.698 3.722 -2.843 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -10.751 5.276 -1.978 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -10.306 5.231 -3.700 1.00 0.00 H new ATOM 1386 N PHE A 86 -5.325 6.276 -4.044 1.00 0.00 N ATOM 1387 CA PHE A 86 -4.648 7.088 -5.046 1.00 0.00 C ATOM 1388 C PHE A 86 -4.246 6.246 -6.254 1.00 0.00 C ATOM 1389 O PHE A 86 -3.503 5.273 -6.129 1.00 0.00 O ATOM 1390 CB PHE A 86 -3.424 7.781 -4.429 1.00 0.00 C ATOM 1391 CG PHE A 86 -2.128 7.043 -4.625 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -1.727 6.068 -3.727 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -1.313 7.328 -5.709 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -0.537 5.389 -3.907 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -0.122 6.652 -5.894 1.00 0.00 C ATOM 1396 CZ PHE A 86 0.266 5.682 -4.993 1.00 0.00 C ATOM 0 H PHE A 86 -5.309 5.273 -4.229 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.341 7.854 -5.393 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -3.330 8.777 -4.861 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -3.596 7.912 -3.361 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.351 5.836 -2.877 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -1.612 8.087 -6.417 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.235 4.630 -3.200 1.00 0.00 H new ATOM 0 HE2 PHE A 86 0.504 6.883 -6.743 1.00 0.00 H new ATOM 0 HZ PHE A 86 1.196 5.152 -5.136 1.00 0.00 H new ATOM 1406 N LYS A 87 -4.745 6.627 -7.425 1.00 0.00 N ATOM 1407 CA LYS A 87 -4.442 5.911 -8.658 1.00 0.00 C ATOM 1408 C LYS A 87 -3.438 6.687 -9.501 1.00 0.00 C ATOM 1409 O LYS A 87 -3.475 7.917 -9.554 1.00 0.00 O ATOM 1410 CB LYS A 87 -5.720 5.673 -9.457 1.00 0.00 C ATOM 1411 CG LYS A 87 -6.556 6.924 -9.658 1.00 0.00 C ATOM 1412 CD LYS A 87 -7.809 6.626 -10.460 1.00 0.00 C ATOM 1413 CE LYS A 87 -7.517 6.573 -11.952 1.00 0.00 C ATOM 1414 NZ LYS A 87 -8.457 7.421 -12.736 1.00 0.00 N ATOM 0 H LYS A 87 -5.363 7.430 -7.546 1.00 0.00 H new ATOM 0 HA LYS A 87 -4.002 4.949 -8.395 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -5.457 5.262 -10.432 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -6.323 4.922 -8.946 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -6.832 7.339 -8.689 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -5.964 7.681 -10.172 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -8.231 5.674 -10.137 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -8.559 7.391 -10.262 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.494 6.903 -12.133 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -7.585 5.542 -12.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -8.244 7.329 -13.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -9.434 7.112 -12.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -8.350 8.415 -12.448 1.00 0.00 H new ATOM 1428 N SER A 88 -2.542 5.963 -10.159 1.00 0.00 N ATOM 1429 CA SER A 88 -1.527 6.586 -10.998 1.00 0.00 C ATOM 1430 C SER A 88 -1.858 6.406 -12.469 1.00 0.00 C ATOM 1431 O SER A 88 -1.007 6.579 -13.342 1.00 0.00 O ATOM 1432 CB SER A 88 -0.152 6.000 -10.695 1.00 0.00 C ATOM 1433 OG SER A 88 0.538 6.781 -9.736 1.00 0.00 O ATOM 0 H SER A 88 -2.497 4.944 -10.128 1.00 0.00 H new ATOM 0 HA SER A 88 -1.512 7.653 -10.775 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.262 4.980 -10.326 1.00 0.00 H new ATOM 0 HB3 SER A 88 0.433 5.946 -11.613 1.00 0.00 H new ATOM 0 HG SER A 88 1.011 6.191 -9.113 1.00 0.00 H new ATOM 1490 N ARG B 4 21.029 -2.110 6.827 1.00 0.00 N ATOM 1491 CA ARG B 4 19.858 -2.637 6.137 1.00 0.00 C ATOM 1492 C ARG B 4 18.682 -2.761 7.097 1.00 0.00 C ATOM 1493 O ARG B 4 17.632 -3.299 6.747 1.00 0.00 O ATOM 1494 CB ARG B 4 20.173 -3.999 5.513 1.00 0.00 C ATOM 1495 CG ARG B 4 18.968 -4.670 4.873 1.00 0.00 C ATOM 1496 CD ARG B 4 18.720 -4.150 3.466 1.00 0.00 C ATOM 1497 NE ARG B 4 17.625 -4.855 2.806 1.00 0.00 N ATOM 1498 CZ ARG B 4 17.622 -6.164 2.580 1.00 0.00 C ATOM 1499 NH1 ARG B 4 18.652 -6.908 2.963 1.00 0.00 N ATOM 1500 NH2 ARG B 4 16.588 -6.732 1.974 1.00 0.00 N ATOM 0 HA ARG B 4 19.588 -1.941 5.343 1.00 0.00 H new ATOM 0 HB2 ARG B 4 20.950 -3.873 4.760 1.00 0.00 H new ATOM 0 HB3 ARG B 4 20.578 -4.656 6.282 1.00 0.00 H new ATOM 0 HG2 ARG B 4 19.126 -5.748 4.841 1.00 0.00 H new ATOM 0 HG3 ARG B 4 18.085 -4.495 5.487 1.00 0.00 H new ATOM 0 HD2 ARG B 4 18.492 -3.085 3.508 1.00 0.00 H new ATOM 0 HD3 ARG B 4 19.629 -4.258 2.874 1.00 0.00 H new ATOM 0 HE ARG B 4 16.817 -4.312 2.501 1.00 0.00 H new ATOM 0 HH11 ARG B 4 19.448 -6.475 3.432 1.00 0.00 H new ATOM 0 HH12 ARG B 4 18.648 -7.913 2.789 1.00 0.00 H new ATOM 0 HH21 ARG B 4 15.793 -6.164 1.681 1.00 0.00 H new ATOM 0 HH22 ARG B 4 16.587 -7.737 1.801 1.00 0.00 H new ATOM 1514 N LYS B 5 18.868 -2.256 8.313 1.00 0.00 N ATOM 1515 CA LYS B 5 17.828 -2.305 9.333 1.00 0.00 C ATOM 1516 C LYS B 5 16.441 -2.256 8.700 1.00 0.00 C ATOM 1517 O LYS B 5 16.040 -1.236 8.140 1.00 0.00 O ATOM 1518 CB LYS B 5 17.995 -1.142 10.314 1.00 0.00 C ATOM 1519 CG LYS B 5 16.851 -1.011 11.304 1.00 0.00 C ATOM 1520 CD LYS B 5 17.347 -0.568 12.671 1.00 0.00 C ATOM 1521 CE LYS B 5 16.360 -0.937 13.767 1.00 0.00 C ATOM 1522 NZ LYS B 5 16.380 0.045 14.886 1.00 0.00 N ATOM 0 H LYS B 5 19.732 -1.807 8.616 1.00 0.00 H new ATOM 0 HA LYS B 5 17.927 -3.246 9.873 1.00 0.00 H new ATOM 0 HB2 LYS B 5 18.927 -1.273 10.864 1.00 0.00 H new ATOM 0 HB3 LYS B 5 18.085 -0.213 9.751 1.00 0.00 H new ATOM 0 HG2 LYS B 5 16.124 -0.291 10.929 1.00 0.00 H new ATOM 0 HG3 LYS B 5 16.335 -1.967 11.395 1.00 0.00 H new ATOM 0 HD2 LYS B 5 18.312 -1.032 12.877 1.00 0.00 H new ATOM 0 HD3 LYS B 5 17.505 0.510 12.670 1.00 0.00 H new ATOM 0 HE2 LYS B 5 15.355 -0.989 13.348 1.00 0.00 H new ATOM 0 HE3 LYS B 5 16.598 -1.929 14.150 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 15.693 -0.242 15.612 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 17.332 0.077 15.303 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 16.128 0.987 14.525 1.00 0.00 H new ATOM 1536 N ALA B 6 15.718 -3.369 8.795 1.00 0.00 N ATOM 1537 CA ALA B 6 14.374 -3.474 8.237 1.00 0.00 C ATOM 1538 C ALA B 6 13.972 -4.934 8.061 1.00 0.00 C ATOM 1539 O ALA B 6 14.679 -5.841 8.502 1.00 0.00 O ATOM 1540 CB ALA B 6 14.288 -2.744 6.906 1.00 0.00 C ATOM 0 H ALA B 6 16.045 -4.217 9.258 1.00 0.00 H new ATOM 0 HA ALA B 6 13.682 -3.007 8.938 1.00 0.00 H new ATOM 0 HB1 ALA B 6 13.278 -2.834 6.506 1.00 0.00 H new ATOM 0 HB2 ALA B 6 14.528 -1.691 7.052 1.00 0.00 H new ATOM 0 HB3 ALA B 6 14.997 -3.183 6.204 1.00 0.00 H new ATOM 1546 N VAL B 7 12.835 -5.155 7.412 1.00 0.00 N ATOM 1547 CA VAL B 7 12.340 -6.504 7.172 1.00 0.00 C ATOM 1548 C VAL B 7 11.522 -6.560 5.888 1.00 0.00 C ATOM 1549 O VAL B 7 10.299 -6.692 5.924 1.00 0.00 O ATOM 1550 CB VAL B 7 11.477 -7.006 8.344 1.00 0.00 C ATOM 1551 CG1 VAL B 7 11.017 -8.435 8.095 1.00 0.00 C ATOM 1552 CG2 VAL B 7 12.247 -6.909 9.653 1.00 0.00 C ATOM 0 H VAL B 7 12.238 -4.415 7.042 1.00 0.00 H new ATOM 0 HA VAL B 7 13.211 -7.152 7.076 1.00 0.00 H new ATOM 0 HB VAL B 7 10.594 -6.371 8.419 1.00 0.00 H new ATOM 0 HG11 VAL B 7 10.408 -8.773 8.934 1.00 0.00 H new ATOM 0 HG12 VAL B 7 10.426 -8.473 7.180 1.00 0.00 H new ATOM 0 HG13 VAL B 7 11.886 -9.085 7.993 1.00 0.00 H new ATOM 0 HG21 VAL B 7 11.622 -7.268 10.470 1.00 0.00 H new ATOM 0 HG22 VAL B 7 13.148 -7.519 9.591 1.00 0.00 H new ATOM 0 HG23 VAL B 7 12.523 -5.871 9.837 1.00 0.00 H new ATOM 1562 N ILE B 8 12.207 -6.454 4.754 1.00 0.00 N ATOM 1563 CA ILE B 8 11.546 -6.488 3.456 1.00 0.00 C ATOM 1564 C ILE B 8 10.511 -7.609 3.399 1.00 0.00 C ATOM 1565 O ILE B 8 10.719 -8.693 3.945 1.00 0.00 O ATOM 1566 CB ILE B 8 12.583 -6.640 2.304 1.00 0.00 C ATOM 1567 CG1 ILE B 8 12.931 -5.265 1.731 1.00 0.00 C ATOM 1568 CG2 ILE B 8 12.082 -7.559 1.192 1.00 0.00 C ATOM 1569 CD1 ILE B 8 14.195 -4.669 2.308 1.00 0.00 C ATOM 0 H ILE B 8 13.220 -6.344 4.709 1.00 0.00 H new ATOM 0 HA ILE B 8 11.027 -5.539 3.322 1.00 0.00 H new ATOM 0 HB ILE B 8 13.476 -7.100 2.727 1.00 0.00 H new ATOM 0 HG12 ILE B 8 13.040 -5.349 0.650 1.00 0.00 H new ATOM 0 HG13 ILE B 8 12.101 -4.583 1.916 1.00 0.00 H new ATOM 0 HG21 ILE B 8 12.840 -7.633 0.412 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.884 -8.550 1.601 1.00 0.00 H new ATOM 0 HG23 ILE B 8 11.164 -7.151 0.768 1.00 0.00 H new ATOM 0 HD11 ILE B 8 14.378 -3.695 1.855 1.00 0.00 H new ATOM 0 HD12 ILE B 8 14.083 -4.552 3.386 1.00 0.00 H new ATOM 0 HD13 ILE B 8 15.037 -5.330 2.100 1.00 0.00 H new ATOM 1581 N LYS B 9 9.405 -7.336 2.721 1.00 0.00 N ATOM 1582 CA LYS B 9 8.336 -8.314 2.569 1.00 0.00 C ATOM 1583 C LYS B 9 8.240 -8.756 1.115 1.00 0.00 C ATOM 1584 O LYS B 9 7.829 -9.878 0.817 1.00 0.00 O ATOM 1585 CB LYS B 9 6.999 -7.727 3.027 1.00 0.00 C ATOM 1586 CG LYS B 9 7.098 -6.922 4.312 1.00 0.00 C ATOM 1587 CD LYS B 9 6.972 -7.814 5.536 1.00 0.00 C ATOM 1588 CE LYS B 9 8.224 -8.652 5.740 1.00 0.00 C ATOM 1589 NZ LYS B 9 8.163 -9.447 6.997 1.00 0.00 N ATOM 0 H LYS B 9 9.224 -6.441 2.266 1.00 0.00 H new ATOM 0 HA LYS B 9 8.565 -9.178 3.192 1.00 0.00 H new ATOM 0 HB2 LYS B 9 6.602 -7.089 2.238 1.00 0.00 H new ATOM 0 HB3 LYS B 9 6.285 -8.538 3.170 1.00 0.00 H new ATOM 0 HG2 LYS B 9 8.052 -6.395 4.341 1.00 0.00 H new ATOM 0 HG3 LYS B 9 6.315 -6.164 4.330 1.00 0.00 H new ATOM 0 HD2 LYS B 9 6.795 -7.200 6.419 1.00 0.00 H new ATOM 0 HD3 LYS B 9 6.108 -8.469 5.424 1.00 0.00 H new ATOM 0 HE2 LYS B 9 8.353 -9.324 4.892 1.00 0.00 H new ATOM 0 HE3 LYS B 9 9.097 -8.000 5.765 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 8.978 -10.091 7.040 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 8.185 -8.805 7.815 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 7.283 -10.001 7.015 1.00 0.00 H new ATOM 1603 N ASN B 10 8.632 -7.860 0.216 1.00 0.00 N ATOM 1604 CA ASN B 10 8.607 -8.139 -1.215 1.00 0.00 C ATOM 1605 C ASN B 10 9.582 -7.226 -1.947 1.00 0.00 C ATOM 1606 O ASN B 10 10.763 -7.546 -2.084 1.00 0.00 O ATOM 1607 CB ASN B 10 7.195 -7.953 -1.772 1.00 0.00 C ATOM 1608 CG ASN B 10 6.918 -8.865 -2.950 1.00 0.00 C ATOM 1609 OD1 ASN B 10 7.818 -8.859 -3.927 1.00 0.00 O flip ATOM 1610 ND2 ASN B 10 5.907 -9.569 -2.983 1.00 0.00 N flip ATOM 0 H ASN B 10 8.973 -6.929 0.455 1.00 0.00 H new ATOM 0 HA ASN B 10 8.909 -9.175 -1.370 1.00 0.00 H new ATOM 0 HB2 ASN B 10 6.467 -8.149 -0.985 1.00 0.00 H new ATOM 0 HB3 ASN B 10 7.061 -6.916 -2.079 1.00 0.00 H new ATOM 0 HD21 ASN B 10 5.242 -9.542 -2.210 1.00 0.00 H new ATOM 0 HD22 ASN B 10 5.736 -10.178 -3.783 1.00 0.00 H new ATOM 1617 N ALA B 11 9.086 -6.080 -2.397 1.00 0.00 N ATOM 1618 CA ALA B 11 9.920 -5.111 -3.094 1.00 0.00 C ATOM 1619 C ALA B 11 10.167 -5.507 -4.546 1.00 0.00 C ATOM 1620 O ALA B 11 11.062 -6.298 -4.839 1.00 0.00 O ATOM 1621 CB ALA B 11 11.244 -4.951 -2.366 1.00 0.00 C ATOM 0 H ALA B 11 8.111 -5.800 -2.291 1.00 0.00 H new ATOM 0 HA ALA B 11 9.386 -4.161 -3.101 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.863 -4.225 -2.893 1.00 0.00 H new ATOM 0 HB2 ALA B 11 11.061 -4.602 -1.350 1.00 0.00 H new ATOM 0 HB3 ALA B 11 11.759 -5.911 -2.333 1.00 0.00 H new ATOM 1627 N ASP B 12 9.385 -4.933 -5.454 1.00 0.00 N ATOM 1628 CA ASP B 12 9.539 -5.209 -6.875 1.00 0.00 C ATOM 1629 C ASP B 12 10.511 -4.214 -7.496 1.00 0.00 C ATOM 1630 O ASP B 12 10.407 -3.872 -8.673 1.00 0.00 O ATOM 1631 CB ASP B 12 8.187 -5.142 -7.588 1.00 0.00 C ATOM 1632 CG ASP B 12 8.027 -6.239 -8.622 1.00 0.00 C ATOM 1633 OD1 ASP B 12 8.390 -7.396 -8.322 1.00 0.00 O ATOM 1634 OD2 ASP B 12 7.540 -5.942 -9.734 1.00 0.00 O ATOM 0 H ASP B 12 8.639 -4.274 -5.230 1.00 0.00 H new ATOM 0 HA ASP B 12 9.938 -6.217 -6.991 1.00 0.00 H new ATOM 0 HB2 ASP B 12 7.387 -5.220 -6.852 1.00 0.00 H new ATOM 0 HB3 ASP B 12 8.082 -4.171 -8.072 1.00 0.00 H new ATOM 1639 N MET B 13 11.455 -3.751 -6.682 1.00 0.00 N ATOM 1640 CA MET B 13 12.454 -2.788 -7.125 1.00 0.00 C ATOM 1641 C MET B 13 13.854 -3.397 -7.060 1.00 0.00 C ATOM 1642 O MET B 13 14.113 -4.302 -6.266 1.00 0.00 O ATOM 1643 CB MET B 13 12.367 -1.522 -6.259 1.00 0.00 C ATOM 1644 CG MET B 13 13.692 -0.802 -6.059 1.00 0.00 C ATOM 1645 SD MET B 13 14.059 -0.505 -4.319 1.00 0.00 S ATOM 1646 CE MET B 13 13.031 0.926 -3.997 1.00 0.00 C ATOM 0 H MET B 13 11.548 -4.031 -5.705 1.00 0.00 H new ATOM 0 HA MET B 13 12.256 -2.519 -8.163 1.00 0.00 H new ATOM 0 HB2 MET B 13 11.658 -0.832 -6.717 1.00 0.00 H new ATOM 0 HB3 MET B 13 11.964 -1.792 -5.283 1.00 0.00 H new ATOM 0 HG2 MET B 13 14.494 -1.394 -6.500 1.00 0.00 H new ATOM 0 HG3 MET B 13 13.669 0.150 -6.590 1.00 0.00 H new ATOM 0 HE1 MET B 13 13.135 1.221 -2.953 1.00 0.00 H new ATOM 0 HE2 MET B 13 13.343 1.750 -4.639 1.00 0.00 H new ATOM 0 HE3 MET B 13 11.989 0.679 -4.203 1.00 0.00 H new ATOM 1656 N SER B 14 14.753 -2.896 -7.902 1.00 0.00 N ATOM 1657 CA SER B 14 16.124 -3.391 -7.941 1.00 0.00 C ATOM 1658 C SER B 14 16.618 -3.736 -6.539 1.00 0.00 C ATOM 1659 O SER B 14 16.133 -3.190 -5.548 1.00 0.00 O ATOM 1660 CB SER B 14 17.048 -2.352 -8.577 1.00 0.00 C ATOM 1661 OG SER B 14 16.355 -1.145 -8.843 1.00 0.00 O ATOM 0 H SER B 14 14.556 -2.147 -8.566 1.00 0.00 H new ATOM 0 HA SER B 14 16.138 -4.297 -8.546 1.00 0.00 H new ATOM 0 HB2 SER B 14 17.888 -2.153 -7.912 1.00 0.00 H new ATOM 0 HB3 SER B 14 17.462 -2.749 -9.504 1.00 0.00 H new ATOM 0 HG SER B 14 16.846 -0.627 -9.514 1.00 0.00 H new ATOM 1667 N GLU B 15 17.588 -4.642 -6.464 1.00 0.00 N ATOM 1668 CA GLU B 15 18.148 -5.057 -5.184 1.00 0.00 C ATOM 1669 C GLU B 15 18.797 -3.877 -4.469 1.00 0.00 C ATOM 1670 O GLU B 15 18.309 -3.418 -3.437 1.00 0.00 O ATOM 1671 CB GLU B 15 19.175 -6.173 -5.389 1.00 0.00 C ATOM 1672 CG GLU B 15 18.836 -7.455 -4.645 1.00 0.00 C ATOM 1673 CD GLU B 15 20.025 -8.028 -3.899 1.00 0.00 C ATOM 1674 OE1 GLU B 15 21.024 -7.299 -3.725 1.00 0.00 O ATOM 1675 OE2 GLU B 15 19.957 -9.206 -3.489 1.00 0.00 O ATOM 0 H GLU B 15 18.002 -5.102 -7.275 1.00 0.00 H new ATOM 0 HA GLU B 15 17.334 -5.433 -4.564 1.00 0.00 H new ATOM 0 HB2 GLU B 15 19.255 -6.391 -6.454 1.00 0.00 H new ATOM 0 HB3 GLU B 15 20.153 -5.820 -5.062 1.00 0.00 H new ATOM 0 HG2 GLU B 15 18.029 -7.258 -3.939 1.00 0.00 H new ATOM 0 HG3 GLU B 15 18.466 -8.195 -5.354 1.00 0.00 H new ATOM 1682 N GLU B 16 19.899 -3.386 -5.024 1.00 0.00 N ATOM 1683 CA GLU B 16 20.609 -2.257 -4.436 1.00 0.00 C ATOM 1684 C GLU B 16 19.639 -1.128 -4.097 1.00 0.00 C ATOM 1685 O GLU B 16 19.912 -0.302 -3.226 1.00 0.00 O ATOM 1686 CB GLU B 16 21.688 -1.750 -5.394 1.00 0.00 C ATOM 1687 CG GLU B 16 22.951 -2.598 -5.392 1.00 0.00 C ATOM 1688 CD GLU B 16 22.748 -3.945 -6.056 1.00 0.00 C ATOM 1689 OE1 GLU B 16 22.518 -3.973 -7.284 1.00 0.00 O ATOM 1690 OE2 GLU B 16 22.818 -4.973 -5.349 1.00 0.00 O ATOM 0 H GLU B 16 20.319 -3.751 -5.879 1.00 0.00 H new ATOM 0 HA GLU B 16 21.084 -2.595 -3.515 1.00 0.00 H new ATOM 0 HB2 GLU B 16 21.281 -1.722 -6.405 1.00 0.00 H new ATOM 0 HB3 GLU B 16 21.948 -0.726 -5.126 1.00 0.00 H new ATOM 0 HG2 GLU B 16 23.747 -2.059 -5.906 1.00 0.00 H new ATOM 0 HG3 GLU B 16 23.281 -2.749 -4.364 1.00 0.00 H new ATOM 1697 N MET B 17 18.503 -1.103 -4.789 1.00 0.00 N ATOM 1698 CA MET B 17 17.491 -0.078 -4.559 1.00 0.00 C ATOM 1699 C MET B 17 16.700 -0.371 -3.288 1.00 0.00 C ATOM 1700 O MET B 17 16.427 0.530 -2.494 1.00 0.00 O ATOM 1701 CB MET B 17 16.546 0.015 -5.757 1.00 0.00 C ATOM 1702 CG MET B 17 17.034 0.964 -6.839 1.00 0.00 C ATOM 1703 SD MET B 17 15.934 2.373 -7.076 1.00 0.00 S ATOM 1704 CE MET B 17 16.068 3.181 -5.481 1.00 0.00 C ATOM 0 H MET B 17 18.261 -1.780 -5.512 1.00 0.00 H new ATOM 0 HA MET B 17 17.999 0.878 -4.435 1.00 0.00 H new ATOM 0 HB2 MET B 17 16.417 -0.978 -6.187 1.00 0.00 H new ATOM 0 HB3 MET B 17 15.565 0.343 -5.412 1.00 0.00 H new ATOM 0 HG2 MET B 17 18.029 1.325 -6.578 1.00 0.00 H new ATOM 0 HG3 MET B 17 17.128 0.420 -7.779 1.00 0.00 H new ATOM 0 HE1 MET B 17 15.768 4.225 -5.576 1.00 0.00 H new ATOM 0 HE2 MET B 17 15.418 2.680 -4.764 1.00 0.00 H new ATOM 0 HE3 MET B 17 17.100 3.130 -5.133 1.00 0.00 H new ATOM 1714 N GLN B 18 16.340 -1.637 -3.093 1.00 0.00 N ATOM 1715 CA GLN B 18 15.590 -2.039 -1.909 1.00 0.00 C ATOM 1716 C GLN B 18 16.435 -1.839 -0.656 1.00 0.00 C ATOM 1717 O GLN B 18 15.912 -1.578 0.427 1.00 0.00 O ATOM 1718 CB GLN B 18 15.151 -3.502 -2.017 1.00 0.00 C ATOM 1719 CG GLN B 18 15.833 -4.265 -3.139 1.00 0.00 C ATOM 1720 CD GLN B 18 14.859 -5.080 -3.967 1.00 0.00 C ATOM 1721 OE1 GLN B 18 13.602 -4.653 -3.990 1.00 0.00 O flip ATOM 1722 NE2 GLN B 18 15.232 -6.080 -4.580 1.00 0.00 N flip ATOM 0 H GLN B 18 16.555 -2.398 -3.737 1.00 0.00 H new ATOM 0 HA GLN B 18 14.699 -1.414 -1.840 1.00 0.00 H new ATOM 0 HB2 GLN B 18 15.356 -4.004 -1.072 1.00 0.00 H new ATOM 0 HB3 GLN B 18 14.072 -3.538 -2.169 1.00 0.00 H new ATOM 0 HG2 GLN B 18 16.355 -3.561 -3.787 1.00 0.00 H new ATOM 0 HG3 GLN B 18 16.588 -4.928 -2.716 1.00 0.00 H new ATOM 0 HE21 GLN B 18 16.208 -6.372 -4.534 1.00 0.00 H new ATOM 0 HE22 GLN B 18 14.565 -6.617 -5.134 1.00 0.00 H new ATOM 1731 N GLN B 19 17.750 -1.947 -0.817 1.00 0.00 N ATOM 1732 CA GLN B 19 18.669 -1.761 0.293 1.00 0.00 C ATOM 1733 C GLN B 19 18.830 -0.278 0.578 1.00 0.00 C ATOM 1734 O GLN B 19 18.811 0.158 1.731 1.00 0.00 O ATOM 1735 CB GLN B 19 20.028 -2.389 -0.028 1.00 0.00 C ATOM 1736 CG GLN B 19 19.927 -3.718 -0.760 1.00 0.00 C ATOM 1737 CD GLN B 19 19.701 -4.886 0.180 1.00 0.00 C ATOM 1738 OE1 GLN B 19 18.693 -5.587 0.085 1.00 0.00 O ATOM 1739 NE2 GLN B 19 20.639 -5.104 1.095 1.00 0.00 N ATOM 0 H GLN B 19 18.200 -2.162 -1.707 1.00 0.00 H new ATOM 0 HA GLN B 19 18.263 -2.254 1.176 1.00 0.00 H new ATOM 0 HB2 GLN B 19 20.606 -1.692 -0.635 1.00 0.00 H new ATOM 0 HB3 GLN B 19 20.579 -2.536 0.901 1.00 0.00 H new ATOM 0 HG2 GLN B 19 19.109 -3.671 -1.479 1.00 0.00 H new ATOM 0 HG3 GLN B 19 20.842 -3.886 -1.329 1.00 0.00 H new ATOM 0 HE21 GLN B 19 21.459 -4.499 1.139 1.00 0.00 H new ATOM 0 HE22 GLN B 19 20.539 -5.877 1.753 1.00 0.00 H new ATOM 1748 N ASP B 20 18.967 0.497 -0.493 1.00 0.00 N ATOM 1749 CA ASP B 20 19.106 1.936 -0.374 1.00 0.00 C ATOM 1750 C ASP B 20 17.788 2.542 0.088 1.00 0.00 C ATOM 1751 O ASP B 20 17.761 3.585 0.741 1.00 0.00 O ATOM 1752 CB ASP B 20 19.532 2.549 -1.709 1.00 0.00 C ATOM 1753 CG ASP B 20 21.024 2.808 -1.777 1.00 0.00 C ATOM 1754 OD1 ASP B 20 21.514 3.666 -1.011 1.00 0.00 O ATOM 1755 OD2 ASP B 20 21.705 2.153 -2.595 1.00 0.00 O ATOM 0 H ASP B 20 18.984 0.148 -1.451 1.00 0.00 H new ATOM 0 HA ASP B 20 19.879 2.155 0.363 1.00 0.00 H new ATOM 0 HB2 ASP B 20 19.245 1.880 -2.521 1.00 0.00 H new ATOM 0 HB3 ASP B 20 18.996 3.486 -1.863 1.00 0.00 H new ATOM 1760 N SER B 21 16.695 1.862 -0.246 1.00 0.00 N ATOM 1761 CA SER B 21 15.367 2.309 0.143 1.00 0.00 C ATOM 1762 C SER B 21 15.201 2.191 1.652 1.00 0.00 C ATOM 1763 O SER B 21 14.784 3.138 2.317 1.00 0.00 O ATOM 1764 CB SER B 21 14.293 1.486 -0.568 1.00 0.00 C ATOM 1765 OG SER B 21 13.076 1.503 0.158 1.00 0.00 O ATOM 0 H SER B 21 16.706 0.997 -0.787 1.00 0.00 H new ATOM 0 HA SER B 21 15.252 3.353 -0.149 1.00 0.00 H new ATOM 0 HB2 SER B 21 14.129 1.884 -1.569 1.00 0.00 H new ATOM 0 HB3 SER B 21 14.636 0.458 -0.686 1.00 0.00 H new ATOM 0 HG SER B 21 13.075 0.773 0.812 1.00 0.00 H new ATOM 1771 N VAL B 22 15.545 1.023 2.188 1.00 0.00 N ATOM 1772 CA VAL B 22 15.448 0.793 3.621 1.00 0.00 C ATOM 1773 C VAL B 22 16.245 1.848 4.377 1.00 0.00 C ATOM 1774 O VAL B 22 15.758 2.434 5.344 1.00 0.00 O ATOM 1775 CB VAL B 22 15.966 -0.603 4.014 1.00 0.00 C ATOM 1776 CG1 VAL B 22 15.982 -0.752 5.527 1.00 0.00 C ATOM 1777 CG2 VAL B 22 15.118 -1.691 3.371 1.00 0.00 C ATOM 0 H VAL B 22 15.891 0.227 1.653 1.00 0.00 H new ATOM 0 HA VAL B 22 14.393 0.856 3.887 1.00 0.00 H new ATOM 0 HB VAL B 22 16.987 -0.711 3.647 1.00 0.00 H new ATOM 0 HG11 VAL B 22 16.350 -1.743 5.791 1.00 0.00 H new ATOM 0 HG12 VAL B 22 16.636 0.005 5.960 1.00 0.00 H new ATOM 0 HG13 VAL B 22 14.972 -0.625 5.916 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.501 -2.670 3.661 1.00 0.00 H new ATOM 0 HG22 VAL B 22 14.085 -1.592 3.704 1.00 0.00 H new ATOM 0 HG23 VAL B 22 15.160 -1.592 2.286 1.00 0.00 H new ATOM 1787 N GLU B 23 17.470 2.093 3.920 1.00 0.00 N ATOM 1788 CA GLU B 23 18.328 3.091 4.545 1.00 0.00 C ATOM 1789 C GLU B 23 17.659 4.458 4.496 1.00 0.00 C ATOM 1790 O GLU B 23 17.705 5.221 5.461 1.00 0.00 O ATOM 1791 CB GLU B 23 19.685 3.149 3.840 1.00 0.00 C ATOM 1792 CG GLU B 23 20.557 1.931 4.097 1.00 0.00 C ATOM 1793 CD GLU B 23 21.985 2.300 4.445 1.00 0.00 C ATOM 1794 OE1 GLU B 23 22.810 2.427 3.515 1.00 0.00 O ATOM 1795 OE2 GLU B 23 22.279 2.464 5.647 1.00 0.00 O ATOM 0 H GLU B 23 17.888 1.615 3.122 1.00 0.00 H new ATOM 0 HA GLU B 23 18.488 2.808 5.585 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.523 3.250 2.767 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.217 4.042 4.167 1.00 0.00 H new ATOM 0 HG2 GLU B 23 20.128 1.347 4.911 1.00 0.00 H new ATOM 0 HG3 GLU B 23 20.555 1.294 3.212 1.00 0.00 H new ATOM 1802 N CYS B 24 17.021 4.751 3.367 1.00 0.00 N ATOM 1803 CA CYS B 24 16.321 6.016 3.192 1.00 0.00 C ATOM 1804 C CYS B 24 15.127 6.078 4.134 1.00 0.00 C ATOM 1805 O CYS B 24 14.791 7.137 4.668 1.00 0.00 O ATOM 1806 CB CYS B 24 15.861 6.177 1.742 1.00 0.00 C ATOM 1807 SG CYS B 24 17.025 7.082 0.695 1.00 0.00 S ATOM 0 H CYS B 24 16.975 4.128 2.560 1.00 0.00 H new ATOM 0 HA CYS B 24 17.004 6.832 3.428 1.00 0.00 H new ATOM 0 HB2 CYS B 24 15.695 5.189 1.313 1.00 0.00 H new ATOM 0 HB3 CYS B 24 14.902 6.694 1.732 1.00 0.00 H new ATOM 0 HG CYS B 24 16.658 6.983 -0.548 1.00 0.00 H new ATOM 1813 N ALA B 25 14.512 4.921 4.363 1.00 0.00 N ATOM 1814 CA ALA B 25 13.383 4.829 5.270 1.00 0.00 C ATOM 1815 C ALA B 25 13.898 5.000 6.682 1.00 0.00 C ATOM 1816 O ALA B 25 13.231 5.556 7.555 1.00 0.00 O ATOM 1817 CB ALA B 25 12.675 3.491 5.109 1.00 0.00 C ATOM 0 H ALA B 25 14.780 4.037 3.931 1.00 0.00 H new ATOM 0 HA ALA B 25 12.657 5.610 5.045 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.831 3.441 5.797 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.315 3.391 4.085 1.00 0.00 H new ATOM 0 HB3 ALA B 25 13.372 2.682 5.329 1.00 0.00 H new ATOM 1823 N THR B 26 15.121 4.530 6.873 1.00 0.00 N ATOM 1824 CA THR B 26 15.797 4.625 8.148 1.00 0.00 C ATOM 1825 C THR B 26 16.182 6.070 8.422 1.00 0.00 C ATOM 1826 O THR B 26 16.040 6.562 9.541 1.00 0.00 O ATOM 1827 CB THR B 26 17.046 3.749 8.133 1.00 0.00 C ATOM 1828 OG1 THR B 26 16.750 2.461 7.623 1.00 0.00 O ATOM 1829 CG2 THR B 26 17.662 3.574 9.495 1.00 0.00 C ATOM 0 H THR B 26 15.669 4.072 6.145 1.00 0.00 H new ATOM 0 HA THR B 26 15.127 4.281 8.936 1.00 0.00 H new ATOM 0 HB THR B 26 17.759 4.269 7.493 1.00 0.00 H new ATOM 0 HG1 THR B 26 16.624 2.514 6.653 1.00 0.00 H new ATOM 0 HG21 THR B 26 18.546 2.941 9.416 1.00 0.00 H new ATOM 0 HG22 THR B 26 17.947 4.548 9.893 1.00 0.00 H new ATOM 0 HG23 THR B 26 16.939 3.106 10.164 1.00 0.00 H new ATOM 1837 N GLN B 27 16.657 6.750 7.382 1.00 0.00 N ATOM 1838 CA GLN B 27 17.048 8.145 7.501 1.00 0.00 C ATOM 1839 C GLN B 27 15.883 8.961 8.035 1.00 0.00 C ATOM 1840 O GLN B 27 16.035 9.757 8.960 1.00 0.00 O ATOM 1841 CB GLN B 27 17.498 8.694 6.145 1.00 0.00 C ATOM 1842 CG GLN B 27 18.826 8.128 5.670 1.00 0.00 C ATOM 1843 CD GLN B 27 20.011 8.947 6.143 1.00 0.00 C ATOM 1844 OE1 GLN B 27 19.771 10.222 6.432 1.00 0.00 O flip ATOM 1845 NE2 GLN B 27 21.128 8.443 6.247 1.00 0.00 N flip ATOM 0 H GLN B 27 16.779 6.355 6.450 1.00 0.00 H new ATOM 0 HA GLN B 27 17.885 8.217 8.196 1.00 0.00 H new ATOM 0 HB2 GLN B 27 16.732 8.474 5.401 1.00 0.00 H new ATOM 0 HB3 GLN B 27 17.577 9.779 6.210 1.00 0.00 H new ATOM 0 HG2 GLN B 27 18.930 7.104 6.029 1.00 0.00 H new ATOM 0 HG3 GLN B 27 18.830 8.085 4.581 1.00 0.00 H new ATOM 0 HE21 GLN B 27 21.268 7.460 6.014 1.00 0.00 H new ATOM 0 HE22 GLN B 27 21.915 9.008 6.566 1.00 0.00 H new ATOM 1854 N ALA B 28 14.711 8.739 7.451 1.00 0.00 N ATOM 1855 CA ALA B 28 13.505 9.440 7.874 1.00 0.00 C ATOM 1856 C ALA B 28 13.129 9.040 9.295 1.00 0.00 C ATOM 1857 O ALA B 28 12.615 9.849 10.068 1.00 0.00 O ATOM 1858 CB ALA B 28 12.358 9.139 6.921 1.00 0.00 C ATOM 0 H ALA B 28 14.571 8.080 6.685 1.00 0.00 H new ATOM 0 HA ALA B 28 13.702 10.512 7.856 1.00 0.00 H new ATOM 0 HB1 ALA B 28 11.464 9.669 7.249 1.00 0.00 H new ATOM 0 HB2 ALA B 28 12.625 9.465 5.916 1.00 0.00 H new ATOM 0 HB3 ALA B 28 12.162 8.067 6.914 1.00 0.00 H new ATOM 1864 N LEU B 29 13.388 7.782 9.630 1.00 0.00 N ATOM 1865 CA LEU B 29 13.081 7.259 10.955 1.00 0.00 C ATOM 1866 C LEU B 29 13.940 7.927 12.023 1.00 0.00 C ATOM 1867 O LEU B 29 13.430 8.399 13.040 1.00 0.00 O ATOM 1868 CB LEU B 29 13.297 5.750 10.986 1.00 0.00 C ATOM 1869 CG LEU B 29 12.169 4.934 10.361 1.00 0.00 C ATOM 1870 CD1 LEU B 29 12.736 3.832 9.489 1.00 0.00 C ATOM 1871 CD2 LEU B 29 11.270 4.356 11.440 1.00 0.00 C ATOM 0 H LEU B 29 13.812 7.102 8.999 1.00 0.00 H new ATOM 0 HA LEU B 29 12.035 7.479 11.170 1.00 0.00 H new ATOM 0 HB2 LEU B 29 14.227 5.518 10.466 1.00 0.00 H new ATOM 0 HB3 LEU B 29 13.424 5.436 12.022 1.00 0.00 H new ATOM 0 HG LEU B 29 11.569 5.594 9.734 1.00 0.00 H new ATOM 0 HD11 LEU B 29 11.919 3.259 9.050 1.00 0.00 H new ATOM 0 HD12 LEU B 29 13.339 4.271 8.694 1.00 0.00 H new ATOM 0 HD13 LEU B 29 13.358 3.173 10.094 1.00 0.00 H new ATOM 0 HD21 LEU B 29 10.471 3.777 10.976 1.00 0.00 H new ATOM 0 HD22 LEU B 29 11.855 3.709 12.093 1.00 0.00 H new ATOM 0 HD23 LEU B 29 10.837 5.167 12.026 1.00 0.00 H new ATOM 1883 N GLU B 30 15.247 7.958 11.786 1.00 0.00 N ATOM 1884 CA GLU B 30 16.185 8.562 12.724 1.00 0.00 C ATOM 1885 C GLU B 30 15.973 10.070 12.815 1.00 0.00 C ATOM 1886 O GLU B 30 16.261 10.686 13.840 1.00 0.00 O ATOM 1887 CB GLU B 30 17.622 8.260 12.298 1.00 0.00 C ATOM 1888 CG GLU B 30 17.909 8.607 10.846 1.00 0.00 C ATOM 1889 CD GLU B 30 18.967 9.683 10.702 1.00 0.00 C ATOM 1890 OE1 GLU B 30 19.621 10.011 11.715 1.00 0.00 O ATOM 1891 OE2 GLU B 30 19.140 10.198 9.579 1.00 0.00 O ATOM 0 H GLU B 30 15.682 7.570 10.949 1.00 0.00 H new ATOM 0 HA GLU B 30 16.005 8.132 13.709 1.00 0.00 H new ATOM 0 HB2 GLU B 30 18.307 8.816 12.938 1.00 0.00 H new ATOM 0 HB3 GLU B 30 17.825 7.201 12.457 1.00 0.00 H new ATOM 0 HG2 GLU B 30 18.234 7.710 10.319 1.00 0.00 H new ATOM 0 HG3 GLU B 30 16.989 8.941 10.367 1.00 0.00 H new ATOM 1898 N LYS B 31 15.468 10.658 11.735 1.00 0.00 N ATOM 1899 CA LYS B 31 15.218 12.094 11.697 1.00 0.00 C ATOM 1900 C LYS B 31 13.848 12.423 12.280 1.00 0.00 C ATOM 1901 O LYS B 31 13.627 13.521 12.791 1.00 0.00 O ATOM 1902 CB LYS B 31 15.314 12.611 10.260 1.00 0.00 C ATOM 1903 CG LYS B 31 16.643 12.304 9.590 1.00 0.00 C ATOM 1904 CD LYS B 31 17.800 12.970 10.318 1.00 0.00 C ATOM 1905 CE LYS B 31 19.022 13.098 9.422 1.00 0.00 C ATOM 1906 NZ LYS B 31 18.696 13.756 8.127 1.00 0.00 N ATOM 0 H LYS B 31 15.225 10.163 10.877 1.00 0.00 H new ATOM 0 HA LYS B 31 15.978 12.587 12.304 1.00 0.00 H new ATOM 0 HB2 LYS B 31 14.509 12.172 9.670 1.00 0.00 H new ATOM 0 HB3 LYS B 31 15.157 13.690 10.260 1.00 0.00 H new ATOM 0 HG2 LYS B 31 16.799 11.226 9.566 1.00 0.00 H new ATOM 0 HG3 LYS B 31 16.618 12.646 8.555 1.00 0.00 H new ATOM 0 HD2 LYS B 31 17.494 13.958 10.662 1.00 0.00 H new ATOM 0 HD3 LYS B 31 18.056 12.389 11.204 1.00 0.00 H new ATOM 0 HE2 LYS B 31 19.791 13.673 9.938 1.00 0.00 H new ATOM 0 HE3 LYS B 31 19.438 12.108 9.232 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 19.544 14.230 7.756 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 18.373 13.040 7.445 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 17.943 14.458 8.274 1.00 0.00 H new ATOM 1920 N TYR B 32 12.932 11.464 12.201 1.00 0.00 N ATOM 1921 CA TYR B 32 11.584 11.653 12.721 1.00 0.00 C ATOM 1922 C TYR B 32 10.928 10.309 13.022 1.00 0.00 C ATOM 1923 O TYR B 32 11.247 9.298 12.396 1.00 0.00 O ATOM 1924 CB TYR B 32 10.729 12.441 11.724 1.00 0.00 C ATOM 1925 CG TYR B 32 11.524 13.062 10.597 1.00 0.00 C ATOM 1926 CD1 TYR B 32 11.902 12.312 9.491 1.00 0.00 C ATOM 1927 CD2 TYR B 32 11.897 14.400 10.641 1.00 0.00 C ATOM 1928 CE1 TYR B 32 12.630 12.875 8.460 1.00 0.00 C ATOM 1929 CE2 TYR B 32 12.624 14.970 9.613 1.00 0.00 C ATOM 1930 CZ TYR B 32 12.988 14.204 8.526 1.00 0.00 C ATOM 1931 OH TYR B 32 13.712 14.769 7.501 1.00 0.00 O ATOM 0 H TYR B 32 13.099 10.549 11.782 1.00 0.00 H new ATOM 0 HA TYR B 32 11.656 12.221 13.649 1.00 0.00 H new ATOM 0 HB2 TYR B 32 9.975 11.777 11.302 1.00 0.00 H new ATOM 0 HB3 TYR B 32 10.197 13.228 12.258 1.00 0.00 H new ATOM 0 HD1 TYR B 32 11.622 11.270 9.436 1.00 0.00 H new ATOM 0 HD2 TYR B 32 11.615 15.003 11.491 1.00 0.00 H new ATOM 0 HE1 TYR B 32 12.917 12.277 7.608 1.00 0.00 H new ATOM 0 HE2 TYR B 32 12.906 16.011 9.661 1.00 0.00 H new ATOM 0 HH TYR B 32 13.881 15.713 7.702 1.00 0.00 H new ATOM 1941 N ASN B 33 10.013 10.307 13.985 1.00 0.00 N ATOM 1942 CA ASN B 33 9.312 9.088 14.372 1.00 0.00 C ATOM 1943 C ASN B 33 7.831 9.177 14.020 1.00 0.00 C ATOM 1944 O ASN B 33 6.977 8.679 14.753 1.00 0.00 O ATOM 1945 CB ASN B 33 9.478 8.838 15.871 1.00 0.00 C ATOM 1946 CG ASN B 33 9.543 10.128 16.667 1.00 0.00 C ATOM 1947 OD1 ASN B 33 8.664 10.983 16.556 1.00 0.00 O ATOM 1948 ND2 ASN B 33 10.586 10.274 17.475 1.00 0.00 N ATOM 0 H ASN B 33 9.739 11.136 14.512 1.00 0.00 H new ATOM 0 HA ASN B 33 9.747 8.255 13.820 1.00 0.00 H new ATOM 0 HB2 ASN B 33 8.645 8.234 16.231 1.00 0.00 H new ATOM 0 HB3 ASN B 33 10.387 8.262 16.042 1.00 0.00 H new ATOM 0 HD21 ASN B 33 10.682 11.121 18.035 1.00 0.00 H new ATOM 0 HD22 ASN B 33 11.291 9.539 17.536 1.00 0.00 H new ATOM 1955 N ILE B 34 7.534 9.813 12.891 1.00 0.00 N ATOM 1956 CA ILE B 34 6.158 9.968 12.438 1.00 0.00 C ATOM 1957 C ILE B 34 5.954 9.295 11.086 1.00 0.00 C ATOM 1958 O ILE B 34 6.450 9.773 10.068 1.00 0.00 O ATOM 1959 CB ILE B 34 5.771 11.456 12.322 1.00 0.00 C ATOM 1960 CG1 ILE B 34 6.498 12.282 13.383 1.00 0.00 C ATOM 1961 CG2 ILE B 34 4.265 11.628 12.444 1.00 0.00 C ATOM 1962 CD1 ILE B 34 6.324 11.751 14.786 1.00 0.00 C ATOM 0 H ILE B 34 8.230 10.230 12.273 1.00 0.00 H new ATOM 0 HA ILE B 34 5.519 9.492 13.182 1.00 0.00 H new ATOM 0 HB ILE B 34 6.076 11.816 11.340 1.00 0.00 H new ATOM 0 HG12 ILE B 34 7.561 12.311 13.144 1.00 0.00 H new ATOM 0 HG13 ILE B 34 6.134 13.309 13.344 1.00 0.00 H new ATOM 0 HG21 ILE B 34 4.011 12.685 12.360 1.00 0.00 H new ATOM 0 HG22 ILE B 34 3.770 11.071 11.648 1.00 0.00 H new ATOM 0 HG23 ILE B 34 3.933 11.251 13.411 1.00 0.00 H new ATOM 0 HD11 ILE B 34 6.867 12.387 15.486 1.00 0.00 H new ATOM 0 HD12 ILE B 34 5.265 11.748 15.045 1.00 0.00 H new ATOM 0 HD13 ILE B 34 6.714 10.735 14.841 1.00 0.00 H new ATOM 1974 N GLU B 35 5.228 8.180 11.084 1.00 0.00 N ATOM 1975 CA GLU B 35 4.967 7.439 9.853 1.00 0.00 C ATOM 1976 C GLU B 35 4.941 8.373 8.647 1.00 0.00 C ATOM 1977 O GLU B 35 5.853 8.360 7.822 1.00 0.00 O ATOM 1978 CB GLU B 35 3.643 6.683 9.958 1.00 0.00 C ATOM 1979 CG GLU B 35 3.621 5.649 11.073 1.00 0.00 C ATOM 1980 CD GLU B 35 4.768 4.662 10.976 1.00 0.00 C ATOM 1981 OE1 GLU B 35 5.464 4.659 9.939 1.00 0.00 O ATOM 1982 OE2 GLU B 35 4.969 3.892 11.939 1.00 0.00 O ATOM 0 H GLU B 35 4.811 7.770 11.920 1.00 0.00 H new ATOM 0 HA GLU B 35 5.776 6.722 9.714 1.00 0.00 H new ATOM 0 HB2 GLU B 35 2.837 7.399 10.121 1.00 0.00 H new ATOM 0 HB3 GLU B 35 3.441 6.186 9.009 1.00 0.00 H new ATOM 0 HG2 GLU B 35 3.665 6.158 12.036 1.00 0.00 H new ATOM 0 HG3 GLU B 35 2.676 5.106 11.042 1.00 0.00 H new ATOM 1989 N LYS B 36 3.896 9.188 8.554 1.00 0.00 N ATOM 1990 CA LYS B 36 3.766 10.129 7.449 1.00 0.00 C ATOM 1991 C LYS B 36 5.080 10.869 7.215 1.00 0.00 C ATOM 1992 O LYS B 36 5.535 11.005 6.080 1.00 0.00 O ATOM 1993 CB LYS B 36 2.644 11.134 7.722 1.00 0.00 C ATOM 1994 CG LYS B 36 1.860 10.853 8.994 1.00 0.00 C ATOM 1995 CD LYS B 36 0.641 11.755 9.104 1.00 0.00 C ATOM 1996 CE LYS B 36 -0.014 11.643 10.472 1.00 0.00 C ATOM 1997 NZ LYS B 36 -0.906 12.800 10.759 1.00 0.00 N ATOM 0 H LYS B 36 3.130 9.216 9.227 1.00 0.00 H new ATOM 0 HA LYS B 36 3.517 9.562 6.552 1.00 0.00 H new ATOM 0 HB2 LYS B 36 3.073 12.134 7.785 1.00 0.00 H new ATOM 0 HB3 LYS B 36 1.957 11.135 6.876 1.00 0.00 H new ATOM 0 HG2 LYS B 36 1.545 9.810 9.006 1.00 0.00 H new ATOM 0 HG3 LYS B 36 2.504 11.002 9.861 1.00 0.00 H new ATOM 0 HD2 LYS B 36 0.935 12.789 8.924 1.00 0.00 H new ATOM 0 HD3 LYS B 36 -0.080 11.489 8.331 1.00 0.00 H new ATOM 0 HE2 LYS B 36 -0.590 10.719 10.524 1.00 0.00 H new ATOM 0 HE3 LYS B 36 0.757 11.581 11.239 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -1.332 12.685 11.701 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 -0.352 13.680 10.735 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 -1.658 12.845 10.042 1.00 0.00 H new ATOM 2011 N ASP B 37 5.686 11.344 8.300 1.00 0.00 N ATOM 2012 CA ASP B 37 6.949 12.068 8.211 1.00 0.00 C ATOM 2013 C ASP B 37 8.026 11.203 7.566 1.00 0.00 C ATOM 2014 O ASP B 37 8.560 11.543 6.511 1.00 0.00 O ATOM 2015 CB ASP B 37 7.404 12.518 9.601 1.00 0.00 C ATOM 2016 CG ASP B 37 8.276 13.757 9.552 1.00 0.00 C ATOM 2017 OD1 ASP B 37 8.274 14.444 8.509 1.00 0.00 O ATOM 2018 OD2 ASP B 37 8.961 14.040 10.557 1.00 0.00 O ATOM 0 H ASP B 37 5.324 11.241 9.248 1.00 0.00 H new ATOM 0 HA ASP B 37 6.791 12.948 7.587 1.00 0.00 H new ATOM 0 HB2 ASP B 37 6.529 12.717 10.220 1.00 0.00 H new ATOM 0 HB3 ASP B 37 7.955 11.708 10.080 1.00 0.00 H new ATOM 2023 N ILE B 38 8.337 10.080 8.206 1.00 0.00 N ATOM 2024 CA ILE B 38 9.346 9.164 7.693 1.00 0.00 C ATOM 2025 C ILE B 38 9.180 8.961 6.191 1.00 0.00 C ATOM 2026 O ILE B 38 10.145 9.048 5.432 1.00 0.00 O ATOM 2027 CB ILE B 38 9.277 7.797 8.400 1.00 0.00 C ATOM 2028 CG1 ILE B 38 9.035 7.985 9.898 1.00 0.00 C ATOM 2029 CG2 ILE B 38 10.557 7.010 8.159 1.00 0.00 C ATOM 2030 CD1 ILE B 38 8.063 6.984 10.484 1.00 0.00 C ATOM 0 H ILE B 38 7.904 9.784 9.081 1.00 0.00 H new ATOM 0 HA ILE B 38 10.319 9.614 7.893 1.00 0.00 H new ATOM 0 HB ILE B 38 8.443 7.232 7.985 1.00 0.00 H new ATOM 0 HG12 ILE B 38 9.986 7.906 10.424 1.00 0.00 H new ATOM 0 HG13 ILE B 38 8.656 8.992 10.073 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.493 6.047 8.665 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.690 6.850 7.089 1.00 0.00 H new ATOM 0 HG23 ILE B 38 11.407 7.569 8.550 1.00 0.00 H new ATOM 0 HD11 ILE B 38 7.940 7.177 11.550 1.00 0.00 H new ATOM 0 HD12 ILE B 38 7.099 7.078 9.984 1.00 0.00 H new ATOM 0 HD13 ILE B 38 8.449 5.975 10.341 1.00 0.00 H new ATOM 2042 N ALA B 39 7.946 8.701 5.768 1.00 0.00 N ATOM 2043 CA ALA B 39 7.655 8.497 4.355 1.00 0.00 C ATOM 2044 C ALA B 39 8.092 9.708 3.539 1.00 0.00 C ATOM 2045 O ALA B 39 8.932 9.596 2.646 1.00 0.00 O ATOM 2046 CB ALA B 39 6.171 8.224 4.153 1.00 0.00 C ATOM 0 H ALA B 39 7.135 8.627 6.382 1.00 0.00 H new ATOM 0 HA ALA B 39 8.216 7.629 4.008 1.00 0.00 H new ATOM 0 HB1 ALA B 39 5.970 8.074 3.092 1.00 0.00 H new ATOM 0 HB2 ALA B 39 5.887 7.329 4.707 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.592 9.074 4.515 1.00 0.00 H new ATOM 2052 N ALA B 40 7.527 10.868 3.862 1.00 0.00 N ATOM 2053 CA ALA B 40 7.871 12.102 3.166 1.00 0.00 C ATOM 2054 C ALA B 40 9.380 12.220 3.014 1.00 0.00 C ATOM 2055 O ALA B 40 9.905 12.253 1.901 1.00 0.00 O ATOM 2056 CB ALA B 40 7.318 13.303 3.916 1.00 0.00 C ATOM 0 H ALA B 40 6.831 10.978 4.599 1.00 0.00 H new ATOM 0 HA ALA B 40 7.423 12.078 2.172 1.00 0.00 H new ATOM 0 HB1 ALA B 40 7.583 14.217 3.385 1.00 0.00 H new ATOM 0 HB2 ALA B 40 6.233 13.223 3.982 1.00 0.00 H new ATOM 0 HB3 ALA B 40 7.741 13.331 4.920 1.00 0.00 H new ATOM 2062 N HIS B 41 10.072 12.272 4.146 1.00 0.00 N ATOM 2063 CA HIS B 41 11.524 12.372 4.153 1.00 0.00 C ATOM 2064 C HIS B 41 12.122 11.456 3.089 1.00 0.00 C ATOM 2065 O HIS B 41 12.966 11.873 2.296 1.00 0.00 O ATOM 2066 CB HIS B 41 12.067 12.009 5.540 1.00 0.00 C ATOM 2067 CG HIS B 41 13.502 11.577 5.544 1.00 0.00 C ATOM 2068 ND1 HIS B 41 14.472 12.198 6.304 1.00 0.00 N ATOM 2069 CD2 HIS B 41 14.131 10.577 4.881 1.00 0.00 C ATOM 2070 CE1 HIS B 41 15.633 11.599 6.107 1.00 0.00 C ATOM 2071 NE2 HIS B 41 15.453 10.613 5.249 1.00 0.00 N ATOM 0 H HIS B 41 9.648 12.246 5.073 1.00 0.00 H new ATOM 0 HA HIS B 41 11.809 13.399 3.923 1.00 0.00 H new ATOM 0 HB2 HIS B 41 11.957 12.871 6.198 1.00 0.00 H new ATOM 0 HB3 HIS B 41 11.457 11.208 5.959 1.00 0.00 H new ATOM 0 HD1 HIS B 41 14.317 12.995 6.921 1.00 0.00 H new ATOM 0 HD2 HIS B 41 13.677 9.881 4.191 1.00 0.00 H new ATOM 0 HE1 HIS B 41 16.570 11.870 6.570 1.00 0.00 H new ATOM 2080 N ILE B 42 11.673 10.204 3.080 1.00 0.00 N ATOM 2081 CA ILE B 42 12.155 9.226 2.113 1.00 0.00 C ATOM 2082 C ILE B 42 11.831 9.664 0.689 1.00 0.00 C ATOM 2083 O ILE B 42 12.725 10.002 -0.087 1.00 0.00 O ATOM 2084 CB ILE B 42 11.537 7.837 2.365 1.00 0.00 C ATOM 2085 CG1 ILE B 42 11.803 7.386 3.804 1.00 0.00 C ATOM 2086 CG2 ILE B 42 12.092 6.825 1.374 1.00 0.00 C ATOM 2087 CD1 ILE B 42 10.759 6.431 4.343 1.00 0.00 C ATOM 0 H ILE B 42 10.976 9.844 3.732 1.00 0.00 H new ATOM 0 HA ILE B 42 13.236 9.161 2.235 1.00 0.00 H new ATOM 0 HB ILE B 42 10.459 7.904 2.222 1.00 0.00 H new ATOM 0 HG12 ILE B 42 12.781 6.906 3.851 1.00 0.00 H new ATOM 0 HG13 ILE B 42 11.848 8.264 4.449 1.00 0.00 H new ATOM 0 HG21 ILE B 42 11.647 5.848 1.564 1.00 0.00 H new ATOM 0 HG22 ILE B 42 11.853 7.142 0.359 1.00 0.00 H new ATOM 0 HG23 ILE B 42 13.174 6.759 1.489 1.00 0.00 H new ATOM 0 HD11 ILE B 42 11.013 6.155 5.366 1.00 0.00 H new ATOM 0 HD12 ILE B 42 9.782 6.914 4.329 1.00 0.00 H new ATOM 0 HD13 ILE B 42 10.730 5.536 3.722 1.00 0.00 H new ATOM 2099 N LYS B 43 10.545 9.657 0.352 1.00 0.00 N ATOM 2100 CA LYS B 43 10.098 10.055 -0.977 1.00 0.00 C ATOM 2101 C LYS B 43 10.893 11.256 -1.481 1.00 0.00 C ATOM 2102 O LYS B 43 11.057 11.443 -2.688 1.00 0.00 O ATOM 2103 CB LYS B 43 8.602 10.383 -0.953 1.00 0.00 C ATOM 2104 CG LYS B 43 8.141 11.256 -2.112 1.00 0.00 C ATOM 2105 CD LYS B 43 8.524 10.654 -3.453 1.00 0.00 C ATOM 2106 CE LYS B 43 8.774 11.731 -4.497 1.00 0.00 C ATOM 2107 NZ LYS B 43 7.890 12.913 -4.300 1.00 0.00 N ATOM 0 H LYS B 43 9.793 9.379 0.983 1.00 0.00 H new ATOM 0 HA LYS B 43 10.268 9.223 -1.660 1.00 0.00 H new ATOM 0 HB2 LYS B 43 8.036 9.452 -0.966 1.00 0.00 H new ATOM 0 HB3 LYS B 43 8.366 10.887 -0.016 1.00 0.00 H new ATOM 0 HG2 LYS B 43 7.059 11.383 -2.065 1.00 0.00 H new ATOM 0 HG3 LYS B 43 8.582 12.248 -2.019 1.00 0.00 H new ATOM 0 HD2 LYS B 43 9.420 10.044 -3.336 1.00 0.00 H new ATOM 0 HD3 LYS B 43 7.729 9.991 -3.796 1.00 0.00 H new ATOM 0 HE2 LYS B 43 9.816 12.046 -4.451 1.00 0.00 H new ATOM 0 HE3 LYS B 43 8.610 11.317 -5.492 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 7.823 13.448 -5.189 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 6.942 12.594 -4.016 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 8.287 13.523 -3.557 1.00 0.00 H new ATOM 2121 N LYS B 44 11.385 12.067 -0.552 1.00 0.00 N ATOM 2122 CA LYS B 44 12.163 13.249 -0.903 1.00 0.00 C ATOM 2123 C LYS B 44 13.575 12.863 -1.327 1.00 0.00 C ATOM 2124 O LYS B 44 13.994 13.131 -2.451 1.00 0.00 O ATOM 2125 CB LYS B 44 12.219 14.220 0.277 1.00 0.00 C ATOM 2126 CG LYS B 44 13.234 15.338 0.100 1.00 0.00 C ATOM 2127 CD LYS B 44 12.556 16.657 -0.234 1.00 0.00 C ATOM 2128 CE LYS B 44 12.361 16.820 -1.732 1.00 0.00 C ATOM 2129 NZ LYS B 44 13.657 16.958 -2.449 1.00 0.00 N ATOM 0 H LYS B 44 11.259 11.928 0.451 1.00 0.00 H new ATOM 0 HA LYS B 44 11.672 13.740 -1.743 1.00 0.00 H new ATOM 0 HB2 LYS B 44 11.231 14.657 0.423 1.00 0.00 H new ATOM 0 HB3 LYS B 44 12.459 13.664 1.183 1.00 0.00 H new ATOM 0 HG2 LYS B 44 13.818 15.449 1.014 1.00 0.00 H new ATOM 0 HG3 LYS B 44 13.932 15.075 -0.695 1.00 0.00 H new ATOM 0 HD2 LYS B 44 11.589 16.707 0.267 1.00 0.00 H new ATOM 0 HD3 LYS B 44 13.157 17.483 0.148 1.00 0.00 H new ATOM 0 HE2 LYS B 44 11.820 15.959 -2.123 1.00 0.00 H new ATOM 0 HE3 LYS B 44 11.745 17.698 -1.924 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 13.504 17.456 -3.349 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 14.323 17.500 -1.862 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 14.051 16.014 -2.638 1.00 0.00 H new ATOM 2143 N GLU B 45 14.300 12.230 -0.415 1.00 0.00 N ATOM 2144 CA GLU B 45 15.667 11.802 -0.685 1.00 0.00 C ATOM 2145 C GLU B 45 15.713 10.820 -1.850 1.00 0.00 C ATOM 2146 O GLU B 45 16.727 10.706 -2.537 1.00 0.00 O ATOM 2147 CB GLU B 45 16.277 11.159 0.561 1.00 0.00 C ATOM 2148 CG GLU B 45 15.625 11.613 1.857 1.00 0.00 C ATOM 2149 CD GLU B 45 16.462 12.629 2.609 1.00 0.00 C ATOM 2150 OE1 GLU B 45 17.407 13.181 2.008 1.00 0.00 O ATOM 2151 OE2 GLU B 45 16.172 12.871 3.800 1.00 0.00 O ATOM 0 H GLU B 45 13.964 12.001 0.520 1.00 0.00 H new ATOM 0 HA GLU B 45 16.249 12.684 -0.955 1.00 0.00 H new ATOM 0 HB2 GLU B 45 16.191 10.075 0.480 1.00 0.00 H new ATOM 0 HB3 GLU B 45 17.341 11.393 0.597 1.00 0.00 H new ATOM 0 HG2 GLU B 45 14.649 12.045 1.636 1.00 0.00 H new ATOM 0 HG3 GLU B 45 15.453 10.746 2.495 1.00 0.00 H new ATOM 2158 N PHE B 46 14.608 10.116 -2.071 1.00 0.00 N ATOM 2159 CA PHE B 46 14.530 9.150 -3.161 1.00 0.00 C ATOM 2160 C PHE B 46 14.342 9.865 -4.492 1.00 0.00 C ATOM 2161 O PHE B 46 15.043 9.584 -5.465 1.00 0.00 O ATOM 2162 CB PHE B 46 13.383 8.166 -2.925 1.00 0.00 C ATOM 2163 CG PHE B 46 13.848 6.773 -2.613 1.00 0.00 C ATOM 2164 CD1 PHE B 46 14.442 6.483 -1.394 1.00 0.00 C ATOM 2165 CD2 PHE B 46 13.694 5.754 -3.538 1.00 0.00 C ATOM 2166 CE1 PHE B 46 14.872 5.201 -1.106 1.00 0.00 C ATOM 2167 CE2 PHE B 46 14.121 4.471 -3.255 1.00 0.00 C ATOM 2168 CZ PHE B 46 14.713 4.194 -2.038 1.00 0.00 C ATOM 0 H PHE B 46 13.758 10.195 -1.513 1.00 0.00 H new ATOM 0 HA PHE B 46 15.466 8.592 -3.192 1.00 0.00 H new ATOM 0 HB2 PHE B 46 12.767 8.528 -2.102 1.00 0.00 H new ATOM 0 HB3 PHE B 46 12.749 8.140 -3.811 1.00 0.00 H new ATOM 0 HD1 PHE B 46 14.570 7.267 -0.662 1.00 0.00 H new ATOM 0 HD2 PHE B 46 13.234 5.965 -4.492 1.00 0.00 H new ATOM 0 HE1 PHE B 46 15.332 4.987 -0.153 1.00 0.00 H new ATOM 0 HE2 PHE B 46 13.992 3.685 -3.985 1.00 0.00 H new ATOM 0 HZ PHE B 46 15.051 3.193 -1.816 1.00 0.00 H new ATOM 2178 N ASP B 47 13.399 10.800 -4.528 1.00 0.00 N ATOM 2179 CA ASP B 47 13.132 11.562 -5.739 1.00 0.00 C ATOM 2180 C ASP B 47 14.345 12.408 -6.109 1.00 0.00 C ATOM 2181 O ASP B 47 14.561 12.729 -7.277 1.00 0.00 O ATOM 2182 CB ASP B 47 11.907 12.459 -5.545 1.00 0.00 C ATOM 2183 CG ASP B 47 12.136 13.536 -4.502 1.00 0.00 C ATOM 2184 OD1 ASP B 47 13.141 14.269 -4.615 1.00 0.00 O ATOM 2185 OD2 ASP B 47 11.310 13.646 -3.571 1.00 0.00 O ATOM 0 H ASP B 47 12.809 11.047 -3.734 1.00 0.00 H new ATOM 0 HA ASP B 47 12.929 10.863 -6.550 1.00 0.00 H new ATOM 0 HB2 ASP B 47 11.649 12.927 -6.495 1.00 0.00 H new ATOM 0 HB3 ASP B 47 11.055 11.847 -5.249 1.00 0.00 H new ATOM 2190 N LYS B 48 15.134 12.767 -5.103 1.00 0.00 N ATOM 2191 CA LYS B 48 16.325 13.577 -5.320 1.00 0.00 C ATOM 2192 C LYS B 48 17.546 12.697 -5.584 1.00 0.00 C ATOM 2193 O LYS B 48 18.365 13.001 -6.451 1.00 0.00 O ATOM 2194 CB LYS B 48 16.557 14.505 -4.110 1.00 0.00 C ATOM 2195 CG LYS B 48 17.921 14.363 -3.440 1.00 0.00 C ATOM 2196 CD LYS B 48 18.758 15.621 -3.611 1.00 0.00 C ATOM 2197 CE LYS B 48 19.889 15.407 -4.605 1.00 0.00 C ATOM 2198 NZ LYS B 48 20.825 16.565 -4.639 1.00 0.00 N ATOM 0 H LYS B 48 14.970 12.510 -4.130 1.00 0.00 H new ATOM 0 HA LYS B 48 16.172 14.194 -6.205 1.00 0.00 H new ATOM 0 HB2 LYS B 48 16.434 15.538 -4.435 1.00 0.00 H new ATOM 0 HB3 LYS B 48 15.783 14.310 -3.368 1.00 0.00 H new ATOM 0 HG2 LYS B 48 17.787 14.155 -2.378 1.00 0.00 H new ATOM 0 HG3 LYS B 48 18.451 13.511 -3.867 1.00 0.00 H new ATOM 0 HD2 LYS B 48 18.123 16.439 -3.952 1.00 0.00 H new ATOM 0 HD3 LYS B 48 19.171 15.918 -2.647 1.00 0.00 H new ATOM 0 HE2 LYS B 48 20.439 14.504 -4.341 1.00 0.00 H new ATOM 0 HE3 LYS B 48 19.473 15.247 -5.600 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 21.581 16.380 -5.328 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 20.306 17.423 -4.916 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 21.242 16.702 -3.696 1.00 0.00 H new ATOM 2212 N LYS B 49 17.662 11.613 -4.827 1.00 0.00 N ATOM 2213 CA LYS B 49 18.785 10.695 -4.973 1.00 0.00 C ATOM 2214 C LYS B 49 18.584 9.770 -6.167 1.00 0.00 C ATOM 2215 O LYS B 49 19.539 9.187 -6.681 1.00 0.00 O ATOM 2216 CB LYS B 49 18.966 9.870 -3.698 1.00 0.00 C ATOM 2217 CG LYS B 49 20.415 9.517 -3.405 1.00 0.00 C ATOM 2218 CD LYS B 49 20.825 8.227 -4.095 1.00 0.00 C ATOM 2219 CE LYS B 49 20.643 7.026 -3.183 1.00 0.00 C ATOM 2220 NZ LYS B 49 21.917 6.634 -2.521 1.00 0.00 N ATOM 0 H LYS B 49 16.992 11.348 -4.105 1.00 0.00 H new ATOM 0 HA LYS B 49 19.684 11.287 -5.145 1.00 0.00 H new ATOM 0 HB2 LYS B 49 18.558 10.426 -2.854 1.00 0.00 H new ATOM 0 HB3 LYS B 49 18.387 8.951 -3.784 1.00 0.00 H new ATOM 0 HG2 LYS B 49 21.062 10.329 -3.736 1.00 0.00 H new ATOM 0 HG3 LYS B 49 20.555 9.416 -2.329 1.00 0.00 H new ATOM 0 HD2 LYS B 49 20.231 8.092 -4.999 1.00 0.00 H new ATOM 0 HD3 LYS B 49 21.868 8.295 -4.406 1.00 0.00 H new ATOM 0 HE2 LYS B 49 19.895 7.256 -2.424 1.00 0.00 H new ATOM 0 HE3 LYS B 49 20.261 6.185 -3.762 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 21.793 5.718 -2.044 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 22.669 6.554 -3.235 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 22.181 7.356 -1.820 1.00 0.00 H new ATOM 2234 N TYR B 50 17.337 9.636 -6.606 1.00 0.00 N ATOM 2235 CA TYR B 50 17.021 8.777 -7.739 1.00 0.00 C ATOM 2236 C TYR B 50 16.193 9.517 -8.787 1.00 0.00 C ATOM 2237 O TYR B 50 16.682 9.806 -9.879 1.00 0.00 O ATOM 2238 CB TYR B 50 16.264 7.534 -7.267 1.00 0.00 C ATOM 2239 CG TYR B 50 16.836 6.913 -6.012 1.00 0.00 C ATOM 2240 CD1 TYR B 50 16.422 7.335 -4.755 1.00 0.00 C ATOM 2241 CD2 TYR B 50 17.790 5.906 -6.084 1.00 0.00 C ATOM 2242 CE1 TYR B 50 16.942 6.771 -3.606 1.00 0.00 C ATOM 2243 CE2 TYR B 50 18.314 5.336 -4.940 1.00 0.00 C ATOM 2244 CZ TYR B 50 17.887 5.772 -3.703 1.00 0.00 C ATOM 2245 OH TYR B 50 18.407 5.208 -2.561 1.00 0.00 O ATOM 0 H TYR B 50 16.532 10.110 -6.196 1.00 0.00 H new ATOM 0 HA TYR B 50 17.963 8.476 -8.198 1.00 0.00 H new ATOM 0 HB2 TYR B 50 15.222 7.800 -7.088 1.00 0.00 H new ATOM 0 HB3 TYR B 50 16.270 6.791 -8.065 1.00 0.00 H new ATOM 0 HD1 TYR B 50 15.681 8.117 -4.675 1.00 0.00 H new ATOM 0 HD2 TYR B 50 18.128 5.563 -7.051 1.00 0.00 H new ATOM 0 HE1 TYR B 50 16.610 7.111 -2.636 1.00 0.00 H new ATOM 0 HE2 TYR B 50 19.054 4.553 -5.014 1.00 0.00 H new ATOM 0 HH TYR B 50 17.736 5.238 -1.847 1.00 0.00 H new ATOM 2255 N ASN B 51 14.937 9.809 -8.445 1.00 0.00 N ATOM 2256 CA ASN B 51 14.024 10.504 -9.351 1.00 0.00 C ATOM 2257 C ASN B 51 12.571 10.220 -8.968 1.00 0.00 C ATOM 2258 O ASN B 51 12.129 9.072 -9.006 1.00 0.00 O ATOM 2259 CB ASN B 51 14.268 10.063 -10.798 1.00 0.00 C ATOM 2260 CG ASN B 51 13.315 10.717 -11.780 1.00 0.00 C ATOM 2261 OD1 ASN B 51 12.659 11.785 -11.346 1.00 0.00 O flip ATOM 2262 ND2 ASN B 51 13.174 10.269 -12.918 1.00 0.00 N flip ATOM 0 H ASN B 51 14.528 9.573 -7.541 1.00 0.00 H new ATOM 0 HA ASN B 51 14.212 11.574 -9.267 1.00 0.00 H new ATOM 0 HB2 ASN B 51 15.293 10.304 -11.078 1.00 0.00 H new ATOM 0 HB3 ASN B 51 14.165 8.980 -10.865 1.00 0.00 H new ATOM 0 HD21 ASN B 51 13.699 9.445 -13.210 1.00 0.00 H new ATOM 0 HD22 ASN B 51 12.532 10.722 -13.569 1.00 0.00 H new ATOM 2269 N PRO B 52 11.805 11.260 -8.587 1.00 0.00 N ATOM 2270 CA PRO B 52 10.399 11.099 -8.196 1.00 0.00 C ATOM 2271 C PRO B 52 9.526 10.581 -9.344 1.00 0.00 C ATOM 2272 O PRO B 52 9.980 10.522 -10.487 1.00 0.00 O ATOM 2273 CB PRO B 52 9.967 12.515 -7.796 1.00 0.00 C ATOM 2274 CG PRO B 52 10.942 13.419 -8.470 1.00 0.00 C ATOM 2275 CD PRO B 52 12.239 12.665 -8.504 1.00 0.00 C ATOM 0 HA PRO B 52 10.287 10.364 -7.399 1.00 0.00 H new ATOM 0 HB2 PRO B 52 8.947 12.723 -8.119 1.00 0.00 H new ATOM 0 HB3 PRO B 52 9.991 12.644 -6.714 1.00 0.00 H new ATOM 0 HG2 PRO B 52 10.610 13.672 -9.477 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.048 14.357 -7.924 1.00 0.00 H new ATOM 0 HD2 PRO B 52 12.849 12.950 -9.361 1.00 0.00 H new ATOM 0 HD3 PRO B 52 12.837 12.850 -7.612 1.00 0.00 H new ATOM 2283 N THR B 53 8.270 10.203 -9.050 1.00 0.00 N ATOM 2284 CA THR B 53 7.718 10.269 -7.696 1.00 0.00 C ATOM 2285 C THR B 53 7.672 8.883 -7.070 1.00 0.00 C ATOM 2286 O THR B 53 7.223 7.922 -7.694 1.00 0.00 O ATOM 2287 CB THR B 53 6.319 10.883 -7.716 1.00 0.00 C ATOM 2288 OG1 THR B 53 5.633 10.607 -6.508 1.00 0.00 O ATOM 2289 CG2 THR B 53 5.464 10.378 -8.854 1.00 0.00 C ATOM 0 H THR B 53 7.615 9.845 -9.745 1.00 0.00 H new ATOM 0 HA THR B 53 8.369 10.903 -7.093 1.00 0.00 H new ATOM 0 HB THR B 53 6.474 11.954 -7.845 1.00 0.00 H new ATOM 0 HG1 THR B 53 5.825 11.312 -5.855 1.00 0.00 H new ATOM 0 HG21 THR B 53 4.484 10.853 -8.811 1.00 0.00 H new ATOM 0 HG22 THR B 53 5.943 10.619 -9.803 1.00 0.00 H new ATOM 0 HG23 THR B 53 5.348 9.297 -8.770 1.00 0.00 H new ATOM 2297 N TRP B 54 8.147 8.784 -5.836 1.00 0.00 N ATOM 2298 CA TRP B 54 8.168 7.512 -5.130 1.00 0.00 C ATOM 2299 C TRP B 54 7.029 7.411 -4.124 1.00 0.00 C ATOM 2300 O TRP B 54 7.086 8.007 -3.048 1.00 0.00 O ATOM 2301 CB TRP B 54 9.506 7.330 -4.411 1.00 0.00 C ATOM 2302 CG TRP B 54 10.678 7.297 -5.341 1.00 0.00 C ATOM 2303 CD1 TRP B 54 11.188 8.344 -6.054 1.00 0.00 C ATOM 2304 CD2 TRP B 54 11.487 6.160 -5.660 1.00 0.00 C ATOM 2305 NE1 TRP B 54 12.264 7.927 -6.798 1.00 0.00 N ATOM 2306 CE2 TRP B 54 12.469 6.589 -6.573 1.00 0.00 C ATOM 2307 CE3 TRP B 54 11.477 4.820 -5.262 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 13.430 5.726 -7.094 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 12.431 3.965 -5.779 1.00 0.00 C ATOM 2310 CH2 TRP B 54 13.397 4.420 -6.685 1.00 0.00 C ATOM 0 H TRP B 54 8.523 9.569 -5.304 1.00 0.00 H new ATOM 0 HA TRP B 54 8.039 6.722 -5.870 1.00 0.00 H new ATOM 0 HB2 TRP B 54 9.640 8.143 -3.697 1.00 0.00 H new ATOM 0 HB3 TRP B 54 9.480 6.403 -3.838 1.00 0.00 H new ATOM 0 HD1 TRP B 54 10.802 9.352 -6.035 1.00 0.00 H new ATOM 0 HE1 TRP B 54 12.821 8.516 -7.417 1.00 0.00 H new ATOM 0 HE3 TRP B 54 10.737 4.460 -4.563 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 14.174 6.074 -7.795 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 12.432 2.927 -5.479 1.00 0.00 H new ATOM 0 HH2 TRP B 54 14.131 3.727 -7.069 1.00 0.00 H new ATOM 2321 N HIS B 55 6.006 6.635 -4.467 1.00 0.00 N ATOM 2322 CA HIS B 55 4.873 6.442 -3.572 1.00 0.00 C ATOM 2323 C HIS B 55 5.318 5.621 -2.371 1.00 0.00 C ATOM 2324 O HIS B 55 5.294 4.390 -2.403 1.00 0.00 O ATOM 2325 CB HIS B 55 3.726 5.734 -4.300 1.00 0.00 C ATOM 2326 CG HIS B 55 3.473 6.266 -5.677 1.00 0.00 C ATOM 2327 ND1 HIS B 55 3.040 7.553 -5.920 1.00 0.00 N ATOM 2328 CD2 HIS B 55 3.591 5.676 -6.890 1.00 0.00 C ATOM 2329 CE1 HIS B 55 2.902 7.732 -7.222 1.00 0.00 C ATOM 2330 NE2 HIS B 55 3.232 6.609 -7.832 1.00 0.00 N ATOM 0 H HIS B 55 5.939 6.133 -5.352 1.00 0.00 H new ATOM 0 HA HIS B 55 4.513 7.415 -3.236 1.00 0.00 H new ATOM 0 HB2 HIS B 55 3.950 4.669 -4.366 1.00 0.00 H new ATOM 0 HB3 HIS B 55 2.816 5.832 -3.709 1.00 0.00 H new ATOM 0 HD1 HIS B 55 2.855 8.257 -5.206 1.00 0.00 H new ATOM 0 HD2 HIS B 55 3.908 4.661 -7.081 1.00 0.00 H new ATOM 0 HE1 HIS B 55 2.575 8.641 -7.704 1.00 0.00 H new ATOM 2339 N CYS B 56 5.762 6.308 -1.325 1.00 0.00 N ATOM 2340 CA CYS B 56 6.256 5.636 -0.130 1.00 0.00 C ATOM 2341 C CYS B 56 5.269 5.701 1.031 1.00 0.00 C ATOM 2342 O CYS B 56 4.874 6.781 1.470 1.00 0.00 O ATOM 2343 CB CYS B 56 7.590 6.250 0.297 1.00 0.00 C ATOM 2344 SG CYS B 56 7.522 8.033 0.584 1.00 0.00 S ATOM 0 H CYS B 56 5.790 7.327 -1.280 1.00 0.00 H new ATOM 0 HA CYS B 56 6.388 4.585 -0.386 1.00 0.00 H new ATOM 0 HB2 CYS B 56 7.929 5.758 1.209 1.00 0.00 H new ATOM 0 HB3 CYS B 56 8.335 6.044 -0.472 1.00 0.00 H new ATOM 0 HG CYS B 56 8.285 8.340 1.591 1.00 0.00 H new ATOM 2350 N ILE B 57 4.905 4.528 1.541 1.00 0.00 N ATOM 2351 CA ILE B 57 3.992 4.429 2.677 1.00 0.00 C ATOM 2352 C ILE B 57 4.693 3.761 3.856 1.00 0.00 C ATOM 2353 O ILE B 57 4.956 2.559 3.829 1.00 0.00 O ATOM 2354 CB ILE B 57 2.723 3.620 2.338 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.092 4.112 1.032 1.00 0.00 C ATOM 2356 CG2 ILE B 57 1.723 3.700 3.485 1.00 0.00 C ATOM 2357 CD1 ILE B 57 1.912 5.613 0.963 1.00 0.00 C ATOM 0 H ILE B 57 5.229 3.629 1.184 1.00 0.00 H new ATOM 0 HA ILE B 57 3.694 5.446 2.932 1.00 0.00 H new ATOM 0 HB ILE B 57 3.008 2.577 2.199 1.00 0.00 H new ATOM 0 HG12 ILE B 57 2.715 3.792 0.196 1.00 0.00 H new ATOM 0 HG13 ILE B 57 1.121 3.634 0.907 1.00 0.00 H new ATOM 0 HG21 ILE B 57 0.832 3.125 3.232 1.00 0.00 H new ATOM 0 HG22 ILE B 57 2.174 3.292 4.390 1.00 0.00 H new ATOM 0 HG23 ILE B 57 1.447 4.741 3.655 1.00 0.00 H new ATOM 0 HD11 ILE B 57 1.460 5.882 0.008 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.264 5.939 1.776 1.00 0.00 H new ATOM 0 HD13 ILE B 57 2.883 6.100 1.055 1.00 0.00 H new ATOM 2369 N VAL B 58 5.003 4.541 4.887 1.00 0.00 N ATOM 2370 CA VAL B 58 5.682 4.009 6.063 1.00 0.00 C ATOM 2371 C VAL B 58 4.764 4.002 7.278 1.00 0.00 C ATOM 2372 O VAL B 58 4.269 5.047 7.702 1.00 0.00 O ATOM 2373 CB VAL B 58 6.954 4.812 6.396 1.00 0.00 C ATOM 2374 CG1 VAL B 58 6.660 6.301 6.382 1.00 0.00 C ATOM 2375 CG2 VAL B 58 7.524 4.385 7.741 1.00 0.00 C ATOM 0 H VAL B 58 4.796 5.539 4.932 1.00 0.00 H new ATOM 0 HA VAL B 58 5.964 2.984 5.822 1.00 0.00 H new ATOM 0 HB VAL B 58 7.703 4.604 5.632 1.00 0.00 H new ATOM 0 HG11 VAL B 58 7.569 6.854 6.619 1.00 0.00 H new ATOM 0 HG12 VAL B 58 6.306 6.593 5.393 1.00 0.00 H new ATOM 0 HG13 VAL B 58 5.894 6.528 7.123 1.00 0.00 H new ATOM 0 HG21 VAL B 58 8.422 4.965 7.956 1.00 0.00 H new ATOM 0 HG22 VAL B 58 6.784 4.559 8.522 1.00 0.00 H new ATOM 0 HG23 VAL B 58 7.776 3.325 7.710 1.00 0.00 H new ATOM 2385 N GLY B 59 4.548 2.818 7.838 1.00 0.00 N ATOM 2386 CA GLY B 59 3.697 2.689 9.001 1.00 0.00 C ATOM 2387 C GLY B 59 4.290 1.762 10.039 1.00 0.00 C ATOM 2388 O GLY B 59 5.482 1.838 10.337 1.00 0.00 O ATOM 0 H GLY B 59 4.950 1.942 7.504 1.00 0.00 H new ATOM 0 HA2 GLY B 59 3.536 3.672 9.443 1.00 0.00 H new ATOM 0 HA3 GLY B 59 2.720 2.313 8.695 1.00 0.00 H new ATOM 2392 N ARG B 60 3.461 0.891 10.598 1.00 0.00 N ATOM 2393 CA ARG B 60 3.915 -0.040 11.611 1.00 0.00 C ATOM 2394 C ARG B 60 2.926 -1.189 11.785 1.00 0.00 C ATOM 2395 O ARG B 60 3.085 -2.031 12.669 1.00 0.00 O ATOM 2396 CB ARG B 60 4.099 0.703 12.927 1.00 0.00 C ATOM 2397 CG ARG B 60 3.022 1.746 13.186 1.00 0.00 C ATOM 2398 CD ARG B 60 3.494 2.807 14.166 1.00 0.00 C ATOM 2399 NE ARG B 60 2.983 2.572 15.514 1.00 0.00 N ATOM 2400 CZ ARG B 60 2.627 3.545 16.348 1.00 0.00 C ATOM 2401 NH1 ARG B 60 2.714 4.812 15.968 1.00 0.00 N ATOM 2402 NH2 ARG B 60 2.181 3.249 17.560 1.00 0.00 N ATOM 0 H ARG B 60 2.471 0.813 10.364 1.00 0.00 H new ATOM 0 HA ARG B 60 4.867 -0.468 11.295 1.00 0.00 H new ATOM 0 HB2 ARG B 60 4.102 -0.017 13.745 1.00 0.00 H new ATOM 0 HB3 ARG B 60 5.074 1.190 12.928 1.00 0.00 H new ATOM 0 HG2 ARG B 60 2.739 2.219 12.246 1.00 0.00 H new ATOM 0 HG3 ARG B 60 2.130 1.258 13.579 1.00 0.00 H new ATOM 0 HD2 ARG B 60 4.584 2.821 14.189 1.00 0.00 H new ATOM 0 HD3 ARG B 60 3.170 3.789 13.821 1.00 0.00 H new ATOM 0 HE ARG B 60 2.894 1.607 15.834 1.00 0.00 H new ATOM 0 HH11 ARG B 60 3.054 5.042 15.034 1.00 0.00 H new ATOM 0 HH12 ARG B 60 2.440 5.557 16.609 1.00 0.00 H new ATOM 0 HH21 ARG B 60 2.111 2.275 17.854 1.00 0.00 H new ATOM 0 HH22 ARG B 60 1.908 3.995 18.199 1.00 0.00 H new ATOM 2416 N ASN B 61 1.906 -1.220 10.933 1.00 0.00 N ATOM 2417 CA ASN B 61 0.891 -2.267 10.991 1.00 0.00 C ATOM 2418 C ASN B 61 -0.271 -1.952 10.056 1.00 0.00 C ATOM 2419 O ASN B 61 -1.417 -2.309 10.332 1.00 0.00 O ATOM 2420 CB ASN B 61 0.377 -2.431 12.422 1.00 0.00 C ATOM 2421 CG ASN B 61 0.804 -3.746 13.045 1.00 0.00 C ATOM 2422 OD1 ASN B 61 -0.151 -4.648 13.237 1.00 0.00 O flip ATOM 2423 ND2 ASN B 61 1.979 -3.949 13.352 1.00 0.00 N flip ATOM 0 H ASN B 61 1.760 -0.532 10.194 1.00 0.00 H new ATOM 0 HA ASN B 61 1.351 -3.201 10.668 1.00 0.00 H new ATOM 0 HB2 ASN B 61 0.744 -1.607 13.033 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -0.711 -2.368 12.423 1.00 0.00 H new ATOM 0 HD21 ASN B 61 2.681 -3.228 13.187 1.00 0.00 H new ATOM 0 HD22 ASN B 61 2.250 -4.838 13.771 1.00 0.00 H new ATOM 2430 N PHE B 62 0.030 -1.279 8.949 1.00 0.00 N ATOM 2431 CA PHE B 62 -0.990 -0.914 7.976 1.00 0.00 C ATOM 2432 C PHE B 62 -1.169 -2.012 6.933 1.00 0.00 C ATOM 2433 O PHE B 62 -0.627 -3.108 7.068 1.00 0.00 O ATOM 2434 CB PHE B 62 -0.605 0.391 7.287 1.00 0.00 C ATOM 2435 CG PHE B 62 0.494 0.225 6.278 1.00 0.00 C ATOM 2436 CD1 PHE B 62 1.585 -0.586 6.548 1.00 0.00 C ATOM 2437 CD2 PHE B 62 0.435 0.876 5.058 1.00 0.00 C ATOM 2438 CE1 PHE B 62 2.596 -0.743 5.618 1.00 0.00 C ATOM 2439 CE2 PHE B 62 1.441 0.723 4.123 1.00 0.00 C ATOM 2440 CZ PHE B 62 2.524 -0.087 4.404 1.00 0.00 C ATOM 0 H PHE B 62 0.973 -0.976 8.705 1.00 0.00 H new ATOM 0 HA PHE B 62 -1.934 -0.784 8.504 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -1.483 0.806 6.793 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -0.292 1.114 8.041 1.00 0.00 H new ATOM 0 HD1 PHE B 62 1.646 -1.101 7.495 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -0.409 1.512 4.834 1.00 0.00 H new ATOM 0 HE1 PHE B 62 3.441 -1.378 5.840 1.00 0.00 H new ATOM 0 HE2 PHE B 62 1.381 1.236 3.174 1.00 0.00 H new ATOM 0 HZ PHE B 62 3.313 -0.207 3.676 1.00 0.00 H new ATOM 2450 N GLY B 63 -1.928 -1.700 5.891 1.00 0.00 N ATOM 2451 CA GLY B 63 -2.168 -2.656 4.828 1.00 0.00 C ATOM 2452 C GLY B 63 -2.133 -2.007 3.460 1.00 0.00 C ATOM 2453 O GLY B 63 -3.177 -1.756 2.857 1.00 0.00 O ATOM 0 H GLY B 63 -2.384 -0.797 5.763 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -1.417 -3.445 4.874 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.138 -3.130 4.979 1.00 0.00 H new ATOM 2457 N SER B 64 -0.930 -1.724 2.972 1.00 0.00 N ATOM 2458 CA SER B 64 -0.764 -1.088 1.670 1.00 0.00 C ATOM 2459 C SER B 64 -1.145 -2.038 0.540 1.00 0.00 C ATOM 2460 O SER B 64 -0.808 -3.223 0.566 1.00 0.00 O ATOM 2461 CB SER B 64 0.679 -0.613 1.489 1.00 0.00 C ATOM 2462 OG SER B 64 1.600 -1.617 1.882 1.00 0.00 O ATOM 0 H SER B 64 -0.056 -1.925 3.458 1.00 0.00 H new ATOM 0 HA SER B 64 -1.431 -0.227 1.632 1.00 0.00 H new ATOM 0 HB2 SER B 64 0.849 -0.347 0.446 1.00 0.00 H new ATOM 0 HB3 SER B 64 0.845 0.288 2.079 1.00 0.00 H new ATOM 0 HG SER B 64 1.913 -1.436 2.793 1.00 0.00 H new ATOM 2468 N TYR B 65 -1.847 -1.504 -0.452 1.00 0.00 N ATOM 2469 CA TYR B 65 -2.279 -2.290 -1.599 1.00 0.00 C ATOM 2470 C TYR B 65 -2.283 -1.431 -2.859 1.00 0.00 C ATOM 2471 O TYR B 65 -3.294 -0.814 -3.200 1.00 0.00 O ATOM 2472 CB TYR B 65 -3.674 -2.867 -1.353 1.00 0.00 C ATOM 2473 CG TYR B 65 -4.137 -3.824 -2.428 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -3.730 -5.153 -2.425 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -4.982 -3.400 -3.447 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -4.152 -6.031 -3.405 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -5.409 -4.272 -4.430 1.00 0.00 C ATOM 2478 CZ TYR B 65 -4.991 -5.586 -4.405 1.00 0.00 C ATOM 2479 OH TYR B 65 -5.413 -6.457 -5.384 1.00 0.00 O ATOM 0 H TYR B 65 -2.130 -0.525 -0.484 1.00 0.00 H new ATOM 0 HA TYR B 65 -1.578 -3.113 -1.738 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -3.679 -3.383 -0.393 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -4.388 -2.047 -1.278 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -3.073 -5.505 -1.644 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -5.310 -2.371 -3.471 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -3.826 -7.061 -3.388 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -6.067 -3.926 -5.214 1.00 0.00 H new ATOM 0 HH TYR B 65 -6.000 -5.985 -6.011 1.00 0.00 H new ATOM 2489 N VAL B 66 -1.144 -1.387 -3.540 1.00 0.00 N ATOM 2490 CA VAL B 66 -1.011 -0.595 -4.756 1.00 0.00 C ATOM 2491 C VAL B 66 -0.512 -1.443 -5.918 1.00 0.00 C ATOM 2492 O VAL B 66 0.286 -2.363 -5.733 1.00 0.00 O ATOM 2493 CB VAL B 66 -0.045 0.586 -4.548 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -0.435 1.383 -3.313 1.00 0.00 C ATOM 2495 CG2 VAL B 66 1.389 0.090 -4.441 1.00 0.00 C ATOM 0 H VAL B 66 -0.299 -1.891 -3.270 1.00 0.00 H new ATOM 0 HA VAL B 66 -2.004 -0.212 -4.993 1.00 0.00 H new ATOM 0 HB VAL B 66 -0.113 1.245 -5.414 1.00 0.00 H new ATOM 0 HG11 VAL B 66 0.259 2.213 -3.182 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -1.446 1.771 -3.435 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.397 0.737 -2.436 1.00 0.00 H new ATOM 0 HG21 VAL B 66 2.057 0.938 -4.294 1.00 0.00 H new ATOM 0 HG22 VAL B 66 1.476 -0.591 -3.595 1.00 0.00 H new ATOM 0 HG23 VAL B 66 1.662 -0.433 -5.357 1.00 0.00 H new ATOM 2505 N THR B 67 -0.986 -1.125 -7.117 1.00 0.00 N ATOM 2506 CA THR B 67 -0.587 -1.853 -8.315 1.00 0.00 C ATOM 2507 C THR B 67 0.773 -1.373 -8.807 1.00 0.00 C ATOM 2508 O THR B 67 0.874 -0.719 -9.846 1.00 0.00 O ATOM 2509 CB THR B 67 -1.634 -1.677 -9.412 1.00 0.00 C ATOM 2510 OG1 THR B 67 -1.067 -1.904 -10.690 1.00 0.00 O ATOM 2511 CG2 THR B 67 -2.254 -0.298 -9.422 1.00 0.00 C ATOM 0 H THR B 67 -1.648 -0.367 -7.285 1.00 0.00 H new ATOM 0 HA THR B 67 -0.511 -2.911 -8.065 1.00 0.00 H new ATOM 0 HB THR B 67 -2.411 -2.409 -9.193 1.00 0.00 H new ATOM 0 HG1 THR B 67 -0.348 -1.258 -10.848 1.00 0.00 H new ATOM 0 HG21 THR B 67 -2.990 -0.236 -10.224 1.00 0.00 H new ATOM 0 HG22 THR B 67 -2.743 -0.112 -8.466 1.00 0.00 H new ATOM 0 HG23 THR B 67 -1.477 0.449 -9.584 1.00 0.00 H new ATOM 2519 N HIS B 68 1.816 -1.696 -8.051 1.00 0.00 N ATOM 2520 CA HIS B 68 3.171 -1.294 -8.405 1.00 0.00 C ATOM 2521 C HIS B 68 3.499 -1.675 -9.845 1.00 0.00 C ATOM 2522 O HIS B 68 2.840 -2.530 -10.437 1.00 0.00 O ATOM 2523 CB HIS B 68 4.184 -1.935 -7.453 1.00 0.00 C ATOM 2524 CG HIS B 68 4.256 -3.426 -7.570 1.00 0.00 C ATOM 2525 ND1 HIS B 68 5.309 -4.273 -7.475 1.00 0.00 N flip ATOM 2526 CD2 HIS B 68 3.152 -4.218 -7.812 1.00 0.00 C flip ATOM 2527 CE1 HIS B 68 4.826 -5.544 -7.658 1.00 0.00 C flip ATOM 2528 NE2 HIS B 68 3.522 -5.485 -7.859 1.00 0.00 N flip ATOM 0 H HIS B 68 1.748 -2.236 -7.188 1.00 0.00 H new ATOM 0 HA HIS B 68 3.232 -0.210 -8.314 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.171 -1.515 -7.649 1.00 0.00 H new ATOM 0 HB3 HIS B 68 3.924 -1.671 -6.428 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.142 -3.858 -7.943 1.00 0.00 H new ATOM 0 HE1 HIS B 68 5.417 -6.448 -7.641 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.906 -6.281 -8.023 1.00 0.00 H new ATOM 2537 N GLU B 69 4.521 -1.032 -10.399 1.00 0.00 N ATOM 2538 CA GLU B 69 4.940 -1.299 -11.770 1.00 0.00 C ATOM 2539 C GLU B 69 6.399 -0.902 -11.977 1.00 0.00 C ATOM 2540 O GLU B 69 7.226 -1.042 -11.076 1.00 0.00 O ATOM 2541 CB GLU B 69 4.049 -0.539 -12.754 1.00 0.00 C ATOM 2542 CG GLU B 69 3.420 0.711 -12.164 1.00 0.00 C ATOM 2543 CD GLU B 69 2.648 1.516 -13.191 1.00 0.00 C ATOM 2544 OE1 GLU B 69 1.544 1.080 -13.579 1.00 0.00 O ATOM 2545 OE2 GLU B 69 3.149 2.582 -13.607 1.00 0.00 O ATOM 0 H GLU B 69 5.075 -0.322 -9.920 1.00 0.00 H new ATOM 0 HA GLU B 69 4.842 -2.369 -11.954 1.00 0.00 H new ATOM 0 HB2 GLU B 69 4.640 -0.261 -13.626 1.00 0.00 H new ATOM 0 HB3 GLU B 69 3.258 -1.203 -13.103 1.00 0.00 H new ATOM 0 HG2 GLU B 69 2.750 0.428 -11.352 1.00 0.00 H new ATOM 0 HG3 GLU B 69 4.201 1.336 -11.730 1.00 0.00 H new ATOM 2552 N THR B 70 6.707 -0.403 -13.171 1.00 0.00 N ATOM 2553 CA THR B 70 8.066 0.016 -13.496 1.00 0.00 C ATOM 2554 C THR B 70 9.087 -0.960 -12.920 1.00 0.00 C ATOM 2555 O THR B 70 9.464 -1.935 -13.570 1.00 0.00 O ATOM 2556 CB THR B 70 8.330 1.424 -12.962 1.00 0.00 C ATOM 2557 OG1 THR B 70 9.681 1.563 -12.559 1.00 0.00 O ATOM 2558 CG2 THR B 70 7.458 1.788 -11.778 1.00 0.00 C ATOM 0 H THR B 70 6.035 -0.279 -13.928 1.00 0.00 H new ATOM 0 HA THR B 70 8.168 0.023 -14.581 1.00 0.00 H new ATOM 0 HB THR B 70 8.093 2.095 -13.788 1.00 0.00 H new ATOM 0 HG1 THR B 70 9.772 2.354 -11.988 1.00 0.00 H new ATOM 0 HG21 THR B 70 7.696 2.799 -11.448 1.00 0.00 H new ATOM 0 HG22 THR B 70 6.409 1.739 -12.070 1.00 0.00 H new ATOM 0 HG23 THR B 70 7.641 1.088 -10.963 1.00 0.00 H new ATOM 2566 N LYS B 71 9.531 -0.690 -11.697 1.00 0.00 N ATOM 2567 CA LYS B 71 10.508 -1.543 -11.029 1.00 0.00 C ATOM 2568 C LYS B 71 11.148 -0.817 -9.851 1.00 0.00 C ATOM 2569 O LYS B 71 12.236 -1.176 -9.403 1.00 0.00 O ATOM 2570 CB LYS B 71 11.589 -1.987 -12.015 1.00 0.00 C ATOM 2571 CG LYS B 71 12.184 -0.845 -12.822 1.00 0.00 C ATOM 2572 CD LYS B 71 13.670 -1.048 -13.061 1.00 0.00 C ATOM 2573 CE LYS B 71 14.379 0.273 -13.308 1.00 0.00 C ATOM 2574 NZ LYS B 71 14.406 0.624 -14.755 1.00 0.00 N ATOM 0 H LYS B 71 9.229 0.114 -11.147 1.00 0.00 H new ATOM 0 HA LYS B 71 9.986 -2.423 -10.652 1.00 0.00 H new ATOM 0 HB2 LYS B 71 12.387 -2.487 -11.465 1.00 0.00 H new ATOM 0 HB3 LYS B 71 11.165 -2.722 -12.699 1.00 0.00 H new ATOM 0 HG2 LYS B 71 11.668 -0.767 -13.779 1.00 0.00 H new ATOM 0 HG3 LYS B 71 12.024 0.096 -12.296 1.00 0.00 H new ATOM 0 HD2 LYS B 71 14.114 -1.545 -12.198 1.00 0.00 H new ATOM 0 HD3 LYS B 71 13.815 -1.706 -13.918 1.00 0.00 H new ATOM 0 HE2 LYS B 71 13.877 1.064 -12.751 1.00 0.00 H new ATOM 0 HE3 LYS B 71 15.399 0.214 -12.929 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 14.898 1.531 -14.883 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 14.907 -0.119 -15.283 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 13.432 0.705 -15.111 1.00 0.00 H new ATOM 2588 N HIS B 72 10.465 0.208 -9.352 1.00 0.00 N ATOM 2589 CA HIS B 72 10.966 0.986 -8.225 1.00 0.00 C ATOM 2590 C HIS B 72 10.047 0.842 -7.018 1.00 0.00 C ATOM 2591 O HIS B 72 9.612 1.835 -6.436 1.00 0.00 O ATOM 2592 CB HIS B 72 11.090 2.460 -8.613 1.00 0.00 C ATOM 2593 CG HIS B 72 12.154 2.723 -9.633 1.00 0.00 C ATOM 2594 ND1 HIS B 72 11.890 3.255 -10.877 1.00 0.00 N ATOM 2595 CD2 HIS B 72 13.492 2.522 -9.587 1.00 0.00 C ATOM 2596 CE1 HIS B 72 13.018 3.369 -11.554 1.00 0.00 C ATOM 2597 NE2 HIS B 72 14.005 2.932 -10.794 1.00 0.00 N ATOM 0 H HIS B 72 9.562 0.519 -9.711 1.00 0.00 H new ATOM 0 HA HIS B 72 11.951 0.604 -7.958 1.00 0.00 H new ATOM 0 HB2 HIS B 72 10.132 2.807 -9.001 1.00 0.00 H new ATOM 0 HB3 HIS B 72 11.303 3.046 -7.719 1.00 0.00 H new ATOM 0 HD2 HIS B 72 14.051 2.116 -8.757 1.00 0.00 H new ATOM 0 HE1 HIS B 72 13.116 3.754 -12.558 1.00 0.00 H new ATOM 0 HE2 HIS B 72 14.989 2.903 -11.060 1.00 0.00 H new ATOM 2606 N PHE B 73 9.756 -0.401 -6.648 1.00 0.00 N ATOM 2607 CA PHE B 73 8.887 -0.672 -5.510 1.00 0.00 C ATOM 2608 C PHE B 73 9.565 -1.629 -4.536 1.00 0.00 C ATOM 2609 O PHE B 73 9.969 -2.728 -4.913 1.00 0.00 O ATOM 2610 CB PHE B 73 7.555 -1.257 -5.995 1.00 0.00 C ATOM 2611 CG PHE B 73 6.820 -2.055 -4.953 1.00 0.00 C ATOM 2612 CD1 PHE B 73 6.191 -1.423 -3.893 1.00 0.00 C ATOM 2613 CD2 PHE B 73 6.761 -3.438 -5.036 1.00 0.00 C ATOM 2614 CE1 PHE B 73 5.514 -2.155 -2.935 1.00 0.00 C ATOM 2615 CE2 PHE B 73 6.085 -4.175 -4.081 1.00 0.00 C ATOM 2616 CZ PHE B 73 5.462 -3.532 -3.029 1.00 0.00 C ATOM 0 H PHE B 73 10.109 -1.234 -7.119 1.00 0.00 H new ATOM 0 HA PHE B 73 8.691 0.265 -4.988 1.00 0.00 H new ATOM 0 HB2 PHE B 73 6.914 -0.443 -6.333 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.743 -1.894 -6.859 1.00 0.00 H new ATOM 0 HD1 PHE B 73 6.230 -0.347 -3.814 1.00 0.00 H new ATOM 0 HD2 PHE B 73 7.248 -3.945 -5.856 1.00 0.00 H new ATOM 0 HE1 PHE B 73 5.026 -1.650 -2.114 1.00 0.00 H new ATOM 0 HE2 PHE B 73 6.044 -5.252 -4.157 1.00 0.00 H new ATOM 0 HZ PHE B 73 4.935 -4.105 -2.281 1.00 0.00 H new ATOM 2626 N ILE B 74 9.686 -1.208 -3.282 1.00 0.00 N ATOM 2627 CA ILE B 74 10.314 -2.037 -2.264 1.00 0.00 C ATOM 2628 C ILE B 74 9.515 -2.032 -0.968 1.00 0.00 C ATOM 2629 O ILE B 74 9.363 -0.994 -0.323 1.00 0.00 O ATOM 2630 CB ILE B 74 11.747 -1.575 -1.950 1.00 0.00 C ATOM 2631 CG1 ILE B 74 12.420 -2.609 -1.019 1.00 0.00 C ATOM 2632 CG2 ILE B 74 11.716 -0.173 -1.347 1.00 0.00 C ATOM 2633 CD1 ILE B 74 13.355 -2.038 0.033 1.00 0.00 C ATOM 0 H ILE B 74 9.359 -0.301 -2.948 1.00 0.00 H new ATOM 0 HA ILE B 74 10.342 -3.046 -2.675 1.00 0.00 H new ATOM 0 HB ILE B 74 12.341 -1.516 -2.862 1.00 0.00 H new ATOM 0 HG12 ILE B 74 11.639 -3.178 -0.514 1.00 0.00 H new ATOM 0 HG13 ILE B 74 12.981 -3.313 -1.634 1.00 0.00 H new ATOM 0 HG21 ILE B 74 12.733 0.151 -1.126 1.00 0.00 H new ATOM 0 HG22 ILE B 74 11.261 0.518 -2.057 1.00 0.00 H new ATOM 0 HG23 ILE B 74 11.131 -0.185 -0.427 1.00 0.00 H new ATOM 0 HD11 ILE B 74 13.771 -2.850 0.629 1.00 0.00 H new ATOM 0 HD12 ILE B 74 14.164 -1.495 -0.456 1.00 0.00 H new ATOM 0 HD13 ILE B 74 12.802 -1.358 0.681 1.00 0.00 H new ATOM 2645 N TYR B 75 9.022 -3.202 -0.582 1.00 0.00 N ATOM 2646 CA TYR B 75 8.259 -3.338 0.649 1.00 0.00 C ATOM 2647 C TYR B 75 9.123 -3.974 1.730 1.00 0.00 C ATOM 2648 O TYR B 75 9.824 -4.954 1.480 1.00 0.00 O ATOM 2649 CB TYR B 75 7.004 -4.183 0.413 1.00 0.00 C ATOM 2650 CG TYR B 75 5.854 -3.831 1.331 1.00 0.00 C ATOM 2651 CD1 TYR B 75 6.081 -3.445 2.647 1.00 0.00 C ATOM 2652 CD2 TYR B 75 4.540 -3.884 0.881 1.00 0.00 C ATOM 2653 CE1 TYR B 75 5.031 -3.123 3.487 1.00 0.00 C ATOM 2654 CE2 TYR B 75 3.486 -3.563 1.715 1.00 0.00 C ATOM 2655 CZ TYR B 75 3.736 -3.183 3.017 1.00 0.00 C ATOM 2656 OH TYR B 75 2.689 -2.863 3.850 1.00 0.00 O ATOM 0 H TYR B 75 9.138 -4.070 -1.105 1.00 0.00 H new ATOM 0 HA TYR B 75 7.951 -2.346 0.978 1.00 0.00 H new ATOM 0 HB2 TYR B 75 6.683 -4.060 -0.621 1.00 0.00 H new ATOM 0 HB3 TYR B 75 7.255 -5.235 0.546 1.00 0.00 H new ATOM 0 HD1 TYR B 75 7.094 -3.396 3.019 1.00 0.00 H new ATOM 0 HD2 TYR B 75 4.339 -4.181 -0.138 1.00 0.00 H new ATOM 0 HE1 TYR B 75 5.224 -2.826 4.507 1.00 0.00 H new ATOM 0 HE2 TYR B 75 2.471 -3.609 1.349 1.00 0.00 H new ATOM 0 HH TYR B 75 2.905 -2.047 4.349 1.00 0.00 H new ATOM 2666 N PHE B 76 9.074 -3.409 2.929 1.00 0.00 N ATOM 2667 CA PHE B 76 9.857 -3.921 4.046 1.00 0.00 C ATOM 2668 C PHE B 76 9.321 -3.395 5.372 1.00 0.00 C ATOM 2669 O PHE B 76 8.482 -2.494 5.403 1.00 0.00 O ATOM 2670 CB PHE B 76 11.333 -3.544 3.892 1.00 0.00 C ATOM 2671 CG PHE B 76 11.556 -2.136 3.416 1.00 0.00 C ATOM 2672 CD1 PHE B 76 11.142 -1.740 2.154 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.184 -1.208 4.233 1.00 0.00 C ATOM 2674 CE1 PHE B 76 11.349 -0.445 1.716 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.393 0.087 3.801 1.00 0.00 C ATOM 2676 CZ PHE B 76 11.976 0.470 2.541 1.00 0.00 C ATOM 0 H PHE B 76 8.500 -2.596 3.153 1.00 0.00 H new ATOM 0 HA PHE B 76 9.771 -5.008 4.043 1.00 0.00 H new ATOM 0 HB2 PHE B 76 11.834 -3.676 4.851 1.00 0.00 H new ATOM 0 HB3 PHE B 76 11.802 -4.233 3.190 1.00 0.00 H new ATOM 0 HD1 PHE B 76 10.652 -2.451 1.505 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.514 -1.501 5.219 1.00 0.00 H new ATOM 0 HE1 PHE B 76 11.021 -0.149 0.731 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.882 0.800 4.448 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.139 1.482 2.201 1.00 0.00 H new ATOM 2686 N TYR B 77 9.810 -3.966 6.466 1.00 0.00 N ATOM 2687 CA TYR B 77 9.380 -3.561 7.796 1.00 0.00 C ATOM 2688 C TYR B 77 10.577 -3.415 8.730 1.00 0.00 C ATOM 2689 O TYR B 77 11.273 -4.388 9.023 1.00 0.00 O ATOM 2690 CB TYR B 77 8.385 -4.579 8.359 1.00 0.00 C ATOM 2691 CG TYR B 77 8.095 -4.405 9.833 1.00 0.00 C ATOM 2692 CD1 TYR B 77 7.117 -3.519 10.267 1.00 0.00 C ATOM 2693 CD2 TYR B 77 8.794 -5.130 10.789 1.00 0.00 C ATOM 2694 CE1 TYR B 77 6.847 -3.357 11.613 1.00 0.00 C ATOM 2695 CE2 TYR B 77 8.528 -4.975 12.137 1.00 0.00 C ATOM 2696 CZ TYR B 77 7.555 -4.088 12.543 1.00 0.00 C ATOM 2697 OH TYR B 77 7.288 -3.931 13.884 1.00 0.00 O ATOM 0 H TYR B 77 10.506 -4.712 6.457 1.00 0.00 H new ATOM 0 HA TYR B 77 8.888 -2.591 7.720 1.00 0.00 H new ATOM 0 HB2 TYR B 77 7.450 -4.503 7.804 1.00 0.00 H new ATOM 0 HB3 TYR B 77 8.775 -5.583 8.192 1.00 0.00 H new ATOM 0 HD1 TYR B 77 6.558 -2.947 9.541 1.00 0.00 H new ATOM 0 HD2 TYR B 77 9.558 -5.826 10.475 1.00 0.00 H new ATOM 0 HE1 TYR B 77 6.086 -2.662 11.934 1.00 0.00 H new ATOM 0 HE2 TYR B 77 9.080 -5.547 12.868 1.00 0.00 H new ATOM 0 HH TYR B 77 7.873 -4.519 14.405 1.00 0.00 H new ATOM 2707 N LEU B 78 10.813 -2.192 9.191 1.00 0.00 N ATOM 2708 CA LEU B 78 11.927 -1.909 10.088 1.00 0.00 C ATOM 2709 C LEU B 78 11.696 -2.546 11.455 1.00 0.00 C ATOM 2710 O LEU B 78 10.607 -3.040 11.746 1.00 0.00 O ATOM 2711 CB LEU B 78 12.105 -0.392 10.243 1.00 0.00 C ATOM 2712 CG LEU B 78 12.773 0.340 9.066 1.00 0.00 C ATOM 2713 CD1 LEU B 78 14.282 0.373 9.243 1.00 0.00 C ATOM 2714 CD2 LEU B 78 12.405 -0.297 7.729 1.00 0.00 C ATOM 0 H LEU B 78 10.245 -1.378 8.957 1.00 0.00 H new ATOM 0 HA LEU B 78 12.832 -2.335 9.656 1.00 0.00 H new ATOM 0 HB2 LEU B 78 11.124 0.052 10.410 1.00 0.00 H new ATOM 0 HB3 LEU B 78 12.695 -0.207 11.140 1.00 0.00 H new ATOM 0 HG LEU B 78 12.400 1.364 9.060 1.00 0.00 H new ATOM 0 HD11 LEU B 78 14.736 0.895 8.400 1.00 0.00 H new ATOM 0 HD12 LEU B 78 14.529 0.894 10.168 1.00 0.00 H new ATOM 0 HD13 LEU B 78 14.665 -0.646 9.288 1.00 0.00 H new ATOM 0 HD21 LEU B 78 12.895 0.246 6.920 1.00 0.00 H new ATOM 0 HD22 LEU B 78 12.733 -1.337 7.719 1.00 0.00 H new ATOM 0 HD23 LEU B 78 11.324 -0.256 7.592 1.00 0.00 H new ATOM 2726 N GLY B 79 12.730 -2.533 12.289 1.00 0.00 N ATOM 2727 CA GLY B 79 12.621 -3.115 13.614 1.00 0.00 C ATOM 2728 C GLY B 79 11.245 -2.927 14.226 1.00 0.00 C ATOM 2729 O GLY B 79 10.754 -3.800 14.940 1.00 0.00 O ATOM 0 H GLY B 79 13.641 -2.130 12.071 1.00 0.00 H new ATOM 0 HA2 GLY B 79 12.847 -4.180 13.558 1.00 0.00 H new ATOM 0 HA3 GLY B 79 13.369 -2.665 14.267 1.00 0.00 H new ATOM 2733 N GLN B 80 10.624 -1.784 13.948 1.00 0.00 N ATOM 2734 CA GLN B 80 9.298 -1.489 14.482 1.00 0.00 C ATOM 2735 C GLN B 80 8.551 -0.504 13.587 1.00 0.00 C ATOM 2736 O GLN B 80 7.775 0.322 14.068 1.00 0.00 O ATOM 2737 CB GLN B 80 9.411 -0.923 15.898 1.00 0.00 C ATOM 2738 CG GLN B 80 10.441 0.187 16.025 1.00 0.00 C ATOM 2739 CD GLN B 80 11.159 0.161 17.361 1.00 0.00 C ATOM 2740 OE1 GLN B 80 12.342 0.490 17.449 1.00 0.00 O ATOM 2741 NE2 GLN B 80 10.445 -0.233 18.410 1.00 0.00 N ATOM 0 H GLN B 80 11.016 -1.050 13.358 1.00 0.00 H new ATOM 0 HA GLN B 80 8.733 -2.421 14.512 1.00 0.00 H new ATOM 0 HB2 GLN B 80 8.438 -0.542 16.208 1.00 0.00 H new ATOM 0 HB3 GLN B 80 9.671 -1.729 16.584 1.00 0.00 H new ATOM 0 HG2 GLN B 80 11.172 0.094 15.221 1.00 0.00 H new ATOM 0 HG3 GLN B 80 9.949 1.151 15.899 1.00 0.00 H new ATOM 0 HE21 GLN B 80 9.467 -0.497 18.291 1.00 0.00 H new ATOM 0 HE22 GLN B 80 10.875 -0.272 19.334 1.00 0.00 H new ATOM 2750 N VAL B 81 8.790 -0.600 12.284 1.00 0.00 N ATOM 2751 CA VAL B 81 8.143 0.279 11.317 1.00 0.00 C ATOM 2752 C VAL B 81 8.033 -0.405 9.960 1.00 0.00 C ATOM 2753 O VAL B 81 8.644 -1.449 9.734 1.00 0.00 O ATOM 2754 CB VAL B 81 8.915 1.605 11.165 1.00 0.00 C ATOM 2755 CG1 VAL B 81 8.388 2.408 9.984 1.00 0.00 C ATOM 2756 CG2 VAL B 81 8.832 2.418 12.448 1.00 0.00 C ATOM 0 H VAL B 81 9.429 -1.280 11.872 1.00 0.00 H new ATOM 0 HA VAL B 81 7.143 0.499 11.691 1.00 0.00 H new ATOM 0 HB VAL B 81 9.962 1.370 10.972 1.00 0.00 H new ATOM 0 HG11 VAL B 81 8.949 3.339 9.898 1.00 0.00 H new ATOM 0 HG12 VAL B 81 8.505 1.828 9.069 1.00 0.00 H new ATOM 0 HG13 VAL B 81 7.333 2.633 10.139 1.00 0.00 H new ATOM 0 HG21 VAL B 81 9.382 3.351 12.324 1.00 0.00 H new ATOM 0 HG22 VAL B 81 7.788 2.639 12.672 1.00 0.00 H new ATOM 0 HG23 VAL B 81 9.266 1.847 13.269 1.00 0.00 H new ATOM 2766 N ALA B 82 7.255 0.181 9.057 1.00 0.00 N ATOM 2767 CA ALA B 82 7.077 -0.386 7.726 1.00 0.00 C ATOM 2768 C ALA B 82 7.263 0.674 6.649 1.00 0.00 C ATOM 2769 O ALA B 82 7.032 1.861 6.885 1.00 0.00 O ATOM 2770 CB ALA B 82 5.707 -1.035 7.605 1.00 0.00 C ATOM 0 H ALA B 82 6.739 1.045 9.222 1.00 0.00 H new ATOM 0 HA ALA B 82 7.840 -1.151 7.579 1.00 0.00 H new ATOM 0 HB1 ALA B 82 5.590 -1.454 6.605 1.00 0.00 H new ATOM 0 HB2 ALA B 82 5.615 -1.830 8.345 1.00 0.00 H new ATOM 0 HB3 ALA B 82 4.933 -0.287 7.778 1.00 0.00 H new ATOM 2776 N ILE B 83 7.688 0.241 5.467 1.00 0.00 N ATOM 2777 CA ILE B 83 7.913 1.159 4.355 1.00 0.00 C ATOM 2778 C ILE B 83 7.483 0.541 3.027 1.00 0.00 C ATOM 2779 O ILE B 83 7.953 -0.534 2.648 1.00 0.00 O ATOM 2780 CB ILE B 83 9.394 1.581 4.257 1.00 0.00 C ATOM 2781 CG1 ILE B 83 10.139 1.244 5.554 1.00 0.00 C ATOM 2782 CG2 ILE B 83 9.502 3.068 3.950 1.00 0.00 C ATOM 2783 CD1 ILE B 83 9.741 2.112 6.728 1.00 0.00 C ATOM 0 H ILE B 83 7.883 -0.737 5.254 1.00 0.00 H new ATOM 0 HA ILE B 83 7.305 2.041 4.554 1.00 0.00 H new ATOM 0 HB ILE B 83 9.858 1.024 3.443 1.00 0.00 H new ATOM 0 HG12 ILE B 83 9.955 0.200 5.807 1.00 0.00 H new ATOM 0 HG13 ILE B 83 11.211 1.347 5.384 1.00 0.00 H new ATOM 0 HG21 ILE B 83 10.553 3.351 3.884 1.00 0.00 H new ATOM 0 HG22 ILE B 83 9.009 3.280 3.001 1.00 0.00 H new ATOM 0 HG23 ILE B 83 9.022 3.639 4.744 1.00 0.00 H new ATOM 0 HD11 ILE B 83 10.309 1.815 7.609 1.00 0.00 H new ATOM 0 HD12 ILE B 83 9.951 3.156 6.496 1.00 0.00 H new ATOM 0 HD13 ILE B 83 8.676 1.991 6.925 1.00 0.00 H new ATOM 2795 N LEU B 84 6.591 1.231 2.328 1.00 0.00 N ATOM 2796 CA LEU B 84 6.091 0.768 1.039 1.00 0.00 C ATOM 2797 C LEU B 84 6.457 1.760 -0.061 1.00 0.00 C ATOM 2798 O LEU B 84 5.708 2.695 -0.342 1.00 0.00 O ATOM 2799 CB LEU B 84 4.573 0.582 1.103 1.00 0.00 C ATOM 2800 CG LEU B 84 3.847 0.675 -0.240 1.00 0.00 C ATOM 2801 CD1 LEU B 84 3.612 -0.712 -0.814 1.00 0.00 C ATOM 2802 CD2 LEU B 84 2.530 1.418 -0.081 1.00 0.00 C ATOM 0 H LEU B 84 6.196 2.120 2.635 1.00 0.00 H new ATOM 0 HA LEU B 84 6.554 -0.191 0.807 1.00 0.00 H new ATOM 0 HB2 LEU B 84 4.361 -0.391 1.546 1.00 0.00 H new ATOM 0 HB3 LEU B 84 4.159 1.334 1.774 1.00 0.00 H new ATOM 0 HG LEU B 84 4.475 1.232 -0.935 1.00 0.00 H new ATOM 0 HD11 LEU B 84 3.094 -0.627 -1.770 1.00 0.00 H new ATOM 0 HD12 LEU B 84 4.569 -1.211 -0.963 1.00 0.00 H new ATOM 0 HD13 LEU B 84 3.003 -1.294 -0.122 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.026 1.475 -1.046 1.00 0.00 H new ATOM 0 HD22 LEU B 84 1.896 0.887 0.629 1.00 0.00 H new ATOM 0 HD23 LEU B 84 2.723 2.425 0.288 1.00 0.00 H new ATOM 2814 N LEU B 85 7.620 1.554 -0.674 1.00 0.00 N ATOM 2815 CA LEU B 85 8.094 2.436 -1.735 1.00 0.00 C ATOM 2816 C LEU B 85 7.722 1.905 -3.115 1.00 0.00 C ATOM 2817 O LEU B 85 7.959 0.740 -3.429 1.00 0.00 O ATOM 2818 CB LEU B 85 9.613 2.599 -1.645 1.00 0.00 C ATOM 2819 CG LEU B 85 10.094 4.013 -1.325 1.00 0.00 C ATOM 2820 CD1 LEU B 85 9.835 4.342 0.136 1.00 0.00 C ATOM 2821 CD2 LEU B 85 11.571 4.158 -1.653 1.00 0.00 C ATOM 0 H LEU B 85 8.251 0.784 -0.454 1.00 0.00 H new ATOM 0 HA LEU B 85 7.610 3.403 -1.599 1.00 0.00 H new ATOM 0 HB2 LEU B 85 9.991 1.921 -0.880 1.00 0.00 H new ATOM 0 HB3 LEU B 85 10.053 2.288 -2.592 1.00 0.00 H new ATOM 0 HG LEU B 85 9.535 4.718 -1.941 1.00 0.00 H new ATOM 0 HD11 LEU B 85 10.183 5.353 0.349 1.00 0.00 H new ATOM 0 HD12 LEU B 85 8.766 4.276 0.340 1.00 0.00 H new ATOM 0 HD13 LEU B 85 10.370 3.634 0.769 1.00 0.00 H new ATOM 0 HD21 LEU B 85 11.898 5.171 -1.419 1.00 0.00 H new ATOM 0 HD22 LEU B 85 12.147 3.446 -1.062 1.00 0.00 H new ATOM 0 HD23 LEU B 85 11.729 3.961 -2.713 1.00 0.00 H new ATOM 2833 N PHE B 86 7.149 2.774 -3.941 1.00 0.00 N ATOM 2834 CA PHE B 86 6.760 2.389 -5.295 1.00 0.00 C ATOM 2835 C PHE B 86 6.377 3.606 -6.134 1.00 0.00 C ATOM 2836 O PHE B 86 5.611 4.464 -5.693 1.00 0.00 O ATOM 2837 CB PHE B 86 5.605 1.387 -5.256 1.00 0.00 C ATOM 2838 CG PHE B 86 4.262 2.017 -5.025 1.00 0.00 C ATOM 2839 CD1 PHE B 86 3.791 2.221 -3.738 1.00 0.00 C ATOM 2840 CD2 PHE B 86 3.471 2.401 -6.094 1.00 0.00 C ATOM 2841 CE1 PHE B 86 2.553 2.797 -3.523 1.00 0.00 C ATOM 2842 CE2 PHE B 86 2.233 2.976 -5.885 1.00 0.00 C ATOM 2843 CZ PHE B 86 1.774 3.175 -4.598 1.00 0.00 C ATOM 0 H PHE B 86 6.944 3.744 -3.700 1.00 0.00 H new ATOM 0 HA PHE B 86 7.622 1.916 -5.765 1.00 0.00 H new ATOM 0 HB2 PHE B 86 5.581 0.838 -6.197 1.00 0.00 H new ATOM 0 HB3 PHE B 86 5.795 0.659 -4.467 1.00 0.00 H new ATOM 0 HD1 PHE B 86 4.397 1.927 -2.894 1.00 0.00 H new ATOM 0 HD2 PHE B 86 3.826 2.249 -7.103 1.00 0.00 H new ATOM 0 HE1 PHE B 86 2.196 2.951 -2.515 1.00 0.00 H new ATOM 0 HE2 PHE B 86 1.624 3.270 -6.727 1.00 0.00 H new ATOM 0 HZ PHE B 86 0.807 3.626 -4.433 1.00 0.00 H new ATOM 2853 N LYS B 87 6.918 3.668 -7.350 1.00 0.00 N ATOM 2854 CA LYS B 87 6.642 4.773 -8.267 1.00 0.00 C ATOM 2855 C LYS B 87 5.749 4.312 -9.415 1.00 0.00 C ATOM 2856 O LYS B 87 5.504 3.118 -9.582 1.00 0.00 O ATOM 2857 CB LYS B 87 7.949 5.340 -8.826 1.00 0.00 C ATOM 2858 CG LYS B 87 9.092 5.346 -7.822 1.00 0.00 C ATOM 2859 CD LYS B 87 10.437 5.513 -8.512 1.00 0.00 C ATOM 2860 CE LYS B 87 10.581 6.897 -9.124 1.00 0.00 C ATOM 2861 NZ LYS B 87 9.758 7.909 -8.407 1.00 0.00 N ATOM 0 H LYS B 87 7.553 2.963 -7.724 1.00 0.00 H new ATOM 0 HA LYS B 87 6.123 5.553 -7.710 1.00 0.00 H new ATOM 0 HB2 LYS B 87 8.245 4.755 -9.697 1.00 0.00 H new ATOM 0 HB3 LYS B 87 7.775 6.359 -9.171 1.00 0.00 H new ATOM 0 HG2 LYS B 87 8.946 6.155 -7.107 1.00 0.00 H new ATOM 0 HG3 LYS B 87 9.085 4.415 -7.255 1.00 0.00 H new ATOM 0 HD2 LYS B 87 11.239 5.347 -7.793 1.00 0.00 H new ATOM 0 HD3 LYS B 87 10.544 4.757 -9.290 1.00 0.00 H new ATOM 0 HE2 LYS B 87 11.628 7.198 -9.100 1.00 0.00 H new ATOM 0 HE3 LYS B 87 10.283 6.863 -10.172 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 10.112 8.862 -8.626 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 8.767 7.829 -8.711 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 9.820 7.744 -7.382 1.00 0.00 H new ATOM 2875 N SER B 88 5.267 5.266 -10.207 1.00 0.00 N ATOM 2876 CA SER B 88 4.403 4.954 -11.340 1.00 0.00 C ATOM 2877 C SER B 88 5.001 5.469 -12.639 1.00 0.00 C ATOM 2878 O SER B 88 4.305 5.642 -13.639 1.00 0.00 O ATOM 2879 CB SER B 88 3.018 5.560 -11.134 1.00 0.00 C ATOM 2880 OG SER B 88 2.011 4.565 -11.183 1.00 0.00 O ATOM 0 H SER B 88 5.460 6.260 -10.085 1.00 0.00 H new ATOM 0 HA SER B 88 4.314 3.870 -11.405 1.00 0.00 H new ATOM 0 HB2 SER B 88 2.981 6.071 -10.172 1.00 0.00 H new ATOM 0 HB3 SER B 88 2.829 6.311 -11.901 1.00 0.00 H new ATOM 0 HG SER B 88 2.234 3.908 -11.875 1.00 0.00 H new ATOM 2886 N GLY B 89 6.299 5.711 -12.609 1.00 0.00 N ATOM 2887 CA GLY B 89 6.996 6.208 -13.781 1.00 0.00 C ATOM 2888 C GLY B 89 6.857 5.285 -14.977 1.00 0.00 C ATOM 2889 O GLY B 89 7.050 4.062 -14.810 1.00 0.00 O ATOM 2890 OXT GLY B 89 6.556 5.785 -16.081 1.00 0.00 O ATOM 0 H GLY B 89 6.890 5.572 -11.789 1.00 0.00 H new ATOM 0 HA2 GLY B 89 6.608 7.193 -14.040 1.00 0.00 H new ATOM 0 HA3 GLY B 89 8.053 6.334 -13.545 1.00 0.00 H new