USER MOD reduce.3.24.130724 H: found=0, std=0, add=1240, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1241 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 49 LYS NZ :NH3+ 168:sc= -1.71! (180deg=-1.46) USER MOD Set 1.2: A 161 CYS SG : rot 149:sc= 0.202 USER MOD Set 2.1: A 153 SER OG : rot 180:sc= 0.415 USER MOD Set 2.2: A 154 LYS NZ :NH3+ -158:sc= 0.432 (180deg=-0.132) USER MOD Set 3.1: A 115 CYS SG : rot 68:sc= 0.55 USER MOD Set 3.2: A 119 THR OG1 : rot -146:sc= 0.296 USER MOD Set 4.1: A 99 SER OG : rot 83:sc= 0.546 USER MOD Set 4.2: A 102 ASN : amide:sc= 0.498 K(o=-0.38,f=-0.96!) USER MOD Set 4.3: A 126 HIS : no HD1:sc= -1.43 K(o=-0.38,f=1.4) USER MOD Set 5.1: A 52 CYS SG : rot 66:sc= 0.885 USER MOD Set 5.2: A 54 HIS : no HD1:sc= 0.82 K(o=0.86,f=-8!) USER MOD Set 5.3: A 61 MET CE :methyl -156:sc= -0.292 (180deg=-1.64) USER MOD Set 5.4: A 63 GLN : amide:sc= 0.96 K(o=0.86,f=-5.7!) USER MOD Set 5.5: A 111 GLN : amide:sc= -1.51! C(o=0.86!,f=-3.2!) USER MOD Set 6.1: A 62 CYS SG : rot -100:sc= -2.32 USER MOD Set 6.2: A 142 MET CE :methyl -144:sc= -1.7 (180deg=-1.81) USER MOD Single : A 3 ASN : amide:sc= -2.16! K(o=-2.2!,f=-0.4) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 16:sc= -0.327 USER MOD Single : A 28 LYS NZ :NH3+ 158:sc= 0.334 (180deg=-0.0479) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -4.1! C(o=-4.1!,f=-9.4!) USER MOD Single : A 40 SER OG : rot 69:sc= 1.13 USER MOD Single : A 41 THR OG1 : rot -154:sc= -2.1! USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 150:sc= -1.09 USER MOD Single : A 51 SER OG : rot 170:sc= -0.178 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 THR OG1 : rot 150:sc= -0.252 USER MOD Single : A 76 LYS NZ :NH3+ -125:sc= 0 (180deg=-1.91!) USER MOD Single : A 77 SER OG : rot -4:sc= 0.323 USER MOD Single : A 79 TYR OH : rot -177:sc= 0.67 USER MOD Single : A 82 LYS NZ :NH3+ 131:sc= 1.22 (180deg=0.0898) USER MOD Single : A 87 ASN : amide:sc= -0.0731 X(o=-0.073,f=-0.55!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 HIS : no HE2:sc= -0.7 K(o=-0.7,f=-1.8) USER MOD Single : A 93 THR OG1 : rot -25:sc= 0.138 USER MOD Single : A 100 MET CE :methyl 176:sc= -0.0354 (180deg=-0.0696) USER MOD Single : A 106 ASN : amide:sc= -0.0483 K(o=-0.048,f=-0.78) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc=-0.00302 K(o=-0.003,f=-0.78) USER MOD Single : A 110 SER OG : rot 35:sc= 0.26 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -173:sc= -0.0182 (180deg=-0.107) USER MOD Single : A 125 LYS NZ :NH3+ -138:sc= 1.22 (180deg=0.3) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ -168:sc= 0.473 (180deg=0.402) USER MOD Single : A 136 MET CE :methyl -152:sc= -0.149 (180deg=-1.85) USER MOD Single : A 137 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 SER OG : rot 87:sc= 0.189 USER MOD Single : A 149 ASN : amide:sc= 0.0836 K(o=0.084,f=-6.3!) USER MOD Single : A 151 LYS NZ :NH3+ 170:sc= -0.0194 (180deg=-0.161) USER MOD Single : A 152 THR OG1 : rot 28:sc= 0.128 USER MOD Single : A 155 LYS NZ :NH3+ 173:sc=-0.00445 (180deg=-0.0972) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 163 GLN : amide:sc= -1.61 K(o=-1.6,f=-3.6!) USER MOD Single : B 221 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 36 N ASN A 3 -7.133 -2.841 17.116 1.00 1.01 N ATOM 37 CA ASN A 3 -6.727 -2.731 15.697 1.00 24.35 C ATOM 38 C ASN A 3 -5.231 -3.092 15.498 1.00 64.35 C ATOM 39 O ASN A 3 -4.365 -2.451 16.113 1.00 34.12 O ATOM 40 CB ASN A 3 -6.987 -1.294 15.157 1.00 43.33 C ATOM 41 CG ASN A 3 -8.465 -0.927 15.075 1.00 71.41 C ATOM 42 OD1 ASN A 3 -9.035 -0.357 16.003 1.00 73.15 O ATOM 43 ND2 ASN A 3 -9.099 -1.283 13.976 1.00 23.22 N ATOM 0 HA ASN A 3 -7.332 -3.444 15.137 1.00 24.35 H new ATOM 0 HB2 ASN A 3 -6.479 -0.576 15.801 1.00 43.33 H new ATOM 0 HB3 ASN A 3 -6.544 -1.202 14.165 1.00 43.33 H new ATOM 0 HD21 ASN A 3 -10.095 -1.087 13.876 1.00 23.22 H new ATOM 0 HD22 ASN A 3 -8.594 -1.755 13.226 1.00 23.22 H new ATOM 50 N PRO A 4 -4.914 -4.134 14.654 1.00 2.44 N ATOM 51 CA PRO A 4 -3.518 -4.534 14.374 1.00 53.12 C ATOM 52 C PRO A 4 -2.772 -3.422 13.624 1.00 25.44 C ATOM 53 O PRO A 4 -3.316 -2.830 12.699 1.00 61.45 O ATOM 54 CB PRO A 4 -3.673 -5.810 13.510 1.00 73.31 C ATOM 55 CG PRO A 4 -5.028 -5.693 12.882 1.00 45.41 C ATOM 56 CD PRO A 4 -5.888 -4.988 13.910 1.00 33.14 C ATOM 0 HA PRO A 4 -2.932 -4.714 15.275 1.00 53.12 H new ATOM 0 HB2 PRO A 4 -2.891 -5.871 12.753 1.00 73.31 H new ATOM 0 HB3 PRO A 4 -3.597 -6.711 14.119 1.00 73.31 H new ATOM 0 HG2 PRO A 4 -4.983 -5.126 11.952 1.00 45.41 H new ATOM 0 HG3 PRO A 4 -5.434 -6.675 12.637 1.00 45.41 H new ATOM 0 HD2 PRO A 4 -6.668 -4.390 13.439 1.00 33.14 H new ATOM 0 HD3 PRO A 4 -6.386 -5.697 14.571 1.00 33.14 H new ATOM 64 N THR A 5 -1.539 -3.127 14.039 1.00 63.01 N ATOM 65 CA THR A 5 -0.774 -1.996 13.520 1.00 40.41 C ATOM 66 C THR A 5 0.552 -2.508 12.928 1.00 0.25 C ATOM 67 O THR A 5 1.339 -3.151 13.626 1.00 33.13 O ATOM 68 CB THR A 5 -0.541 -0.962 14.666 1.00 12.01 C ATOM 69 OG1 THR A 5 -1.811 -0.581 15.227 1.00 32.33 O ATOM 70 CG2 THR A 5 0.206 0.290 14.191 1.00 71.22 C ATOM 0 H THR A 5 -1.043 -3.668 14.747 1.00 63.01 H new ATOM 0 HA THR A 5 -1.324 -1.494 12.724 1.00 40.41 H new ATOM 0 HB THR A 5 0.084 -1.443 15.418 1.00 12.01 H new ATOM 0 HG1 THR A 5 -1.669 0.067 15.948 1.00 32.33 H new ATOM 0 HG21 THR A 5 0.340 0.974 15.029 1.00 71.22 H new ATOM 0 HG22 THR A 5 1.181 0.004 13.796 1.00 71.22 H new ATOM 0 HG23 THR A 5 -0.371 0.783 13.409 1.00 71.22 H new ATOM 78 N VAL A 6 0.789 -2.197 11.636 1.00 12.15 N ATOM 79 CA VAL A 6 1.958 -2.671 10.877 1.00 11.11 C ATOM 80 C VAL A 6 2.994 -1.552 10.797 1.00 14.22 C ATOM 81 O VAL A 6 2.648 -0.403 10.559 1.00 43.12 O ATOM 82 CB VAL A 6 1.580 -3.176 9.432 1.00 74.23 C ATOM 83 CG1 VAL A 6 0.801 -4.508 9.497 1.00 24.34 C ATOM 84 CG2 VAL A 6 0.792 -2.106 8.639 1.00 65.44 C ATOM 0 H VAL A 6 0.166 -1.604 11.088 1.00 12.15 H new ATOM 0 HA VAL A 6 2.373 -3.529 11.406 1.00 11.11 H new ATOM 0 HB VAL A 6 2.511 -3.356 8.895 1.00 74.23 H new ATOM 0 HG11 VAL A 6 0.553 -4.834 8.487 1.00 24.34 H new ATOM 0 HG12 VAL A 6 1.416 -5.266 9.982 1.00 24.34 H new ATOM 0 HG13 VAL A 6 -0.116 -4.365 10.068 1.00 24.34 H new ATOM 0 HG21 VAL A 6 0.550 -2.492 7.649 1.00 65.44 H new ATOM 0 HG22 VAL A 6 -0.129 -1.865 9.170 1.00 65.44 H new ATOM 0 HG23 VAL A 6 1.399 -1.206 8.539 1.00 65.44 H new ATOM 94 N PHE A 7 4.263 -1.903 11.008 1.00 41.23 N ATOM 95 CA PHE A 7 5.368 -0.944 11.060 1.00 73.10 C ATOM 96 C PHE A 7 6.450 -1.353 10.067 1.00 24.15 C ATOM 97 O PHE A 7 6.801 -2.536 9.968 1.00 44.02 O ATOM 98 CB PHE A 7 5.942 -0.872 12.497 1.00 55.10 C ATOM 99 CG PHE A 7 7.166 0.028 12.641 1.00 54.52 C ATOM 100 CD1 PHE A 7 7.034 1.410 12.627 1.00 42.44 C ATOM 101 CD2 PHE A 7 8.448 -0.510 12.775 1.00 64.43 C ATOM 102 CE1 PHE A 7 8.137 2.229 12.748 1.00 3.21 C ATOM 103 CE2 PHE A 7 9.549 0.309 12.893 1.00 42.14 C ATOM 104 CZ PHE A 7 9.395 1.675 12.881 1.00 34.44 C ATOM 0 H PHE A 7 4.556 -2.870 11.149 1.00 41.23 H new ATOM 0 HA PHE A 7 5.001 0.046 10.788 1.00 73.10 H new ATOM 0 HB2 PHE A 7 5.162 -0.515 13.170 1.00 55.10 H new ATOM 0 HB3 PHE A 7 6.206 -1.879 12.821 1.00 55.10 H new ATOM 0 HD1 PHE A 7 6.054 1.850 12.520 1.00 42.44 H new ATOM 0 HD2 PHE A 7 8.578 -1.582 12.786 1.00 64.43 H new ATOM 0 HE1 PHE A 7 8.017 3.302 12.739 1.00 3.21 H new ATOM 0 HE2 PHE A 7 10.534 -0.122 12.995 1.00 42.14 H new ATOM 0 HZ PHE A 7 10.259 2.316 12.976 1.00 34.44 H new ATOM 114 N PHE A 8 6.968 -0.346 9.354 1.00 13.14 N ATOM 115 CA PHE A 8 8.055 -0.482 8.384 1.00 1.23 C ATOM 116 C PHE A 8 9.023 0.699 8.531 1.00 63.14 C ATOM 117 O PHE A 8 8.712 1.712 9.166 1.00 43.04 O ATOM 118 CB PHE A 8 7.525 -0.506 6.921 1.00 40.32 C ATOM 119 CG PHE A 8 6.471 -1.568 6.640 1.00 42.45 C ATOM 120 CD1 PHE A 8 6.779 -2.923 6.711 1.00 50.12 C ATOM 121 CD2 PHE A 8 5.179 -1.206 6.300 1.00 61.21 C ATOM 122 CE1 PHE A 8 5.823 -3.881 6.450 1.00 1.54 C ATOM 123 CE2 PHE A 8 4.222 -2.159 6.041 1.00 70.21 C ATOM 124 CZ PHE A 8 4.543 -3.497 6.113 1.00 30.54 C ATOM 0 H PHE A 8 6.631 0.613 9.440 1.00 13.14 H new ATOM 0 HA PHE A 8 8.559 -1.427 8.586 1.00 1.23 H new ATOM 0 HB2 PHE A 8 7.106 0.472 6.685 1.00 40.32 H new ATOM 0 HB3 PHE A 8 8.367 -0.663 6.247 1.00 40.32 H new ATOM 0 HD1 PHE A 8 7.781 -3.228 6.974 1.00 50.12 H new ATOM 0 HD2 PHE A 8 4.919 -0.160 6.237 1.00 61.21 H new ATOM 0 HE1 PHE A 8 6.076 -4.929 6.509 1.00 1.54 H new ATOM 0 HE2 PHE A 8 3.218 -1.858 5.781 1.00 70.21 H new ATOM 0 HZ PHE A 8 3.792 -4.245 5.905 1.00 30.54 H new ATOM 134 N ASP A 9 10.184 0.532 7.919 1.00 15.31 N ATOM 135 CA ASP A 9 11.179 1.584 7.710 1.00 64.22 C ATOM 136 C ASP A 9 11.212 1.853 6.209 1.00 52.02 C ATOM 137 O ASP A 9 11.465 0.937 5.425 1.00 51.25 O ATOM 138 CB ASP A 9 12.566 1.125 8.235 1.00 71.04 C ATOM 139 CG ASP A 9 12.629 1.113 9.770 1.00 73.54 C ATOM 140 OD1 ASP A 9 12.784 2.201 10.366 1.00 24.41 O ATOM 141 OD2 ASP A 9 12.490 0.038 10.389 1.00 51.55 O ATOM 0 H ASP A 9 10.474 -0.369 7.539 1.00 15.31 H new ATOM 0 HA ASP A 9 10.924 2.493 8.255 1.00 64.22 H new ATOM 0 HB2 ASP A 9 12.784 0.127 7.856 1.00 71.04 H new ATOM 0 HB3 ASP A 9 13.338 1.789 7.846 1.00 71.04 H new ATOM 146 N ILE A 10 10.874 3.080 5.817 1.00 4.41 N ATOM 147 CA ILE A 10 10.883 3.501 4.411 1.00 23.33 C ATOM 148 C ILE A 10 12.304 3.953 4.028 1.00 11.12 C ATOM 149 O ILE A 10 12.910 4.766 4.733 1.00 32.32 O ATOM 150 CB ILE A 10 9.842 4.654 4.166 1.00 13.23 C ATOM 151 CG1 ILE A 10 8.390 4.157 4.487 1.00 21.52 C ATOM 152 CG2 ILE A 10 9.945 5.229 2.729 1.00 3.12 C ATOM 153 CD1 ILE A 10 7.921 2.947 3.689 1.00 52.53 C ATOM 0 H ILE A 10 10.585 3.814 6.464 1.00 4.41 H new ATOM 0 HA ILE A 10 10.593 2.660 3.782 1.00 23.33 H new ATOM 0 HB ILE A 10 10.080 5.471 4.847 1.00 13.23 H new ATOM 0 HG12 ILE A 10 8.334 3.915 5.548 1.00 21.52 H new ATOM 0 HG13 ILE A 10 7.696 4.979 4.310 1.00 21.52 H new ATOM 0 HG21 ILE A 10 9.209 6.023 2.601 1.00 3.12 H new ATOM 0 HG22 ILE A 10 10.945 5.632 2.569 1.00 3.12 H new ATOM 0 HG23 ILE A 10 9.753 4.437 2.005 1.00 3.12 H new ATOM 0 HD11 ILE A 10 6.906 2.686 3.987 1.00 52.53 H new ATOM 0 HD12 ILE A 10 7.937 3.184 2.625 1.00 52.53 H new ATOM 0 HD13 ILE A 10 8.584 2.104 3.883 1.00 52.53 H new ATOM 165 N ALA A 11 12.821 3.416 2.911 1.00 52.35 N ATOM 166 CA ALA A 11 14.185 3.683 2.434 1.00 65.00 C ATOM 167 C ALA A 11 14.157 4.206 1.004 1.00 63.24 C ATOM 168 O ALA A 11 13.572 3.580 0.140 1.00 21.33 O ATOM 169 CB ALA A 11 15.023 2.405 2.500 1.00 13.13 C ATOM 0 H ALA A 11 12.298 2.779 2.310 1.00 52.35 H new ATOM 0 HA ALA A 11 14.634 4.441 3.076 1.00 65.00 H new ATOM 0 HB1 ALA A 11 16.032 2.613 2.144 1.00 13.13 H new ATOM 0 HB2 ALA A 11 15.067 2.051 3.530 1.00 13.13 H new ATOM 0 HB3 ALA A 11 14.568 1.639 1.872 1.00 13.13 H new ATOM 175 N VAL A 12 14.801 5.349 0.775 1.00 22.02 N ATOM 176 CA VAL A 12 14.993 5.920 -0.558 1.00 30.14 C ATOM 177 C VAL A 12 16.389 5.493 -1.063 1.00 35.52 C ATOM 178 O VAL A 12 17.411 5.798 -0.429 1.00 35.54 O ATOM 179 CB VAL A 12 14.822 7.486 -0.508 1.00 1.44 C ATOM 180 CG1 VAL A 12 15.130 8.148 -1.865 1.00 23.54 C ATOM 181 CG2 VAL A 12 13.391 7.848 -0.042 1.00 41.14 C ATOM 0 H VAL A 12 15.210 5.913 1.520 1.00 22.02 H new ATOM 0 HA VAL A 12 14.241 5.550 -1.255 1.00 30.14 H new ATOM 0 HB VAL A 12 15.545 7.874 0.210 1.00 1.44 H new ATOM 0 HG11 VAL A 12 14.999 9.227 -1.782 1.00 23.54 H new ATOM 0 HG12 VAL A 12 16.158 7.929 -2.152 1.00 23.54 H new ATOM 0 HG13 VAL A 12 14.451 7.757 -2.623 1.00 23.54 H new ATOM 0 HG21 VAL A 12 13.282 8.932 -0.010 1.00 41.14 H new ATOM 0 HG22 VAL A 12 12.665 7.430 -0.739 1.00 41.14 H new ATOM 0 HG23 VAL A 12 13.217 7.437 0.952 1.00 41.14 H new ATOM 191 N ASP A 13 16.385 4.706 -2.163 1.00 44.44 N ATOM 192 CA ASP A 13 17.588 4.116 -2.810 1.00 74.13 C ATOM 193 C ASP A 13 18.326 3.134 -1.875 1.00 52.15 C ATOM 194 O ASP A 13 19.525 2.873 -2.046 1.00 13.11 O ATOM 195 CB ASP A 13 18.553 5.214 -3.346 1.00 23.43 C ATOM 196 CG ASP A 13 17.871 6.195 -4.311 1.00 73.25 C ATOM 197 OD1 ASP A 13 17.523 5.792 -5.444 1.00 21.53 O ATOM 198 OD2 ASP A 13 17.667 7.364 -3.938 1.00 1.51 O ATOM 0 H ASP A 13 15.521 4.454 -2.642 1.00 44.44 H new ATOM 0 HA ASP A 13 17.232 3.543 -3.666 1.00 74.13 H new ATOM 0 HB2 ASP A 13 18.966 5.769 -2.504 1.00 23.43 H new ATOM 0 HB3 ASP A 13 19.391 4.737 -3.854 1.00 23.43 H new ATOM 203 N GLY A 14 17.592 2.568 -0.898 1.00 75.12 N ATOM 204 CA GLY A 14 18.160 1.630 0.075 1.00 33.50 C ATOM 205 C GLY A 14 18.539 2.295 1.394 1.00 44.11 C ATOM 206 O GLY A 14 18.699 1.606 2.410 1.00 63.21 O ATOM 0 H GLY A 14 16.597 2.749 -0.766 1.00 75.12 H new ATOM 0 HA2 GLY A 14 17.439 0.836 0.269 1.00 33.50 H new ATOM 0 HA3 GLY A 14 19.044 1.160 -0.356 1.00 33.50 H new ATOM 210 N GLU A 15 18.666 3.636 1.388 1.00 1.32 N ATOM 211 CA GLU A 15 19.019 4.413 2.585 1.00 51.41 C ATOM 212 C GLU A 15 17.734 4.916 3.279 1.00 1.43 C ATOM 213 O GLU A 15 16.921 5.562 2.616 1.00 3.42 O ATOM 214 CB GLU A 15 19.931 5.608 2.193 1.00 51.13 C ATOM 215 CG GLU A 15 21.269 5.200 1.545 1.00 41.51 C ATOM 216 CD GLU A 15 22.117 4.279 2.449 1.00 13.13 C ATOM 217 OE1 GLU A 15 22.671 4.772 3.462 1.00 43.13 O ATOM 218 OE2 GLU A 15 22.213 3.063 2.170 1.00 10.14 O ATOM 0 H GLU A 15 18.527 4.207 0.554 1.00 1.32 H new ATOM 0 HA GLU A 15 19.565 3.775 3.280 1.00 51.41 H new ATOM 0 HB2 GLU A 15 19.388 6.253 1.502 1.00 51.13 H new ATOM 0 HB3 GLU A 15 20.138 6.199 3.085 1.00 51.13 H new ATOM 0 HG2 GLU A 15 21.070 4.692 0.601 1.00 41.51 H new ATOM 0 HG3 GLU A 15 21.842 6.097 1.309 1.00 41.51 H new ATOM 225 N PRO A 16 17.522 4.614 4.610 1.00 34.01 N ATOM 226 CA PRO A 16 16.280 4.985 5.343 1.00 10.25 C ATOM 227 C PRO A 16 15.975 6.506 5.294 1.00 74.21 C ATOM 228 O PRO A 16 16.777 7.336 5.736 1.00 30.22 O ATOM 229 CB PRO A 16 16.537 4.485 6.803 1.00 62.44 C ATOM 230 CG PRO A 16 18.027 4.282 6.888 1.00 54.33 C ATOM 231 CD PRO A 16 18.462 3.876 5.497 1.00 21.22 C ATOM 0 HA PRO A 16 15.397 4.532 4.892 1.00 10.25 H new ATOM 0 HB2 PRO A 16 16.196 5.216 7.536 1.00 62.44 H new ATOM 0 HB3 PRO A 16 16.000 3.558 7.003 1.00 62.44 H new ATOM 0 HG2 PRO A 16 18.530 5.196 7.205 1.00 54.33 H new ATOM 0 HG3 PRO A 16 18.277 3.511 7.617 1.00 54.33 H new ATOM 0 HD2 PRO A 16 19.498 4.154 5.303 1.00 21.22 H new ATOM 0 HD3 PRO A 16 18.388 2.798 5.352 1.00 21.22 H new ATOM 239 N LEU A 17 14.819 6.837 4.693 1.00 72.23 N ATOM 240 CA LEU A 17 14.242 8.196 4.693 1.00 10.41 C ATOM 241 C LEU A 17 13.568 8.464 6.046 1.00 31.54 C ATOM 242 O LEU A 17 13.632 9.572 6.598 1.00 34.35 O ATOM 243 CB LEU A 17 13.185 8.314 3.559 1.00 73.41 C ATOM 244 CG LEU A 17 12.462 9.702 3.417 1.00 34.13 C ATOM 245 CD1 LEU A 17 13.433 10.799 2.936 1.00 33.24 C ATOM 246 CD2 LEU A 17 11.216 9.608 2.510 1.00 25.01 C ATOM 0 H LEU A 17 14.250 6.159 4.186 1.00 72.23 H new ATOM 0 HA LEU A 17 15.035 8.926 4.528 1.00 10.41 H new ATOM 0 HB2 LEU A 17 13.674 8.085 2.612 1.00 73.41 H new ATOM 0 HB3 LEU A 17 12.426 7.548 3.719 1.00 73.41 H new ATOM 0 HG LEU A 17 12.115 9.988 4.410 1.00 34.13 H new ATOM 0 HD11 LEU A 17 12.899 11.745 2.849 1.00 33.24 H new ATOM 0 HD12 LEU A 17 14.246 10.906 3.654 1.00 33.24 H new ATOM 0 HD13 LEU A 17 13.842 10.523 1.964 1.00 33.24 H new ATOM 0 HD21 LEU A 17 10.744 10.588 2.437 1.00 25.01 H new ATOM 0 HD22 LEU A 17 11.514 9.274 1.516 1.00 25.01 H new ATOM 0 HD23 LEU A 17 10.509 8.896 2.936 1.00 25.01 H new ATOM 258 N GLY A 18 12.924 7.417 6.554 1.00 41.24 N ATOM 259 CA GLY A 18 12.144 7.485 7.773 1.00 63.11 C ATOM 260 C GLY A 18 11.483 6.157 8.059 1.00 1.02 C ATOM 261 O GLY A 18 11.914 5.116 7.549 1.00 21.21 O ATOM 0 H GLY A 18 12.933 6.493 6.123 1.00 41.24 H new ATOM 0 HA2 GLY A 18 12.788 7.764 8.607 1.00 63.11 H new ATOM 0 HA3 GLY A 18 11.385 8.262 7.682 1.00 63.11 H new ATOM 265 N ARG A 19 10.445 6.193 8.888 1.00 51.34 N ATOM 266 CA ARG A 19 9.671 5.010 9.284 1.00 13.15 C ATOM 267 C ARG A 19 8.184 5.361 9.336 1.00 44.35 C ATOM 268 O ARG A 19 7.821 6.504 9.639 1.00 1.34 O ATOM 269 CB ARG A 19 10.187 4.459 10.641 1.00 43.23 C ATOM 270 CG ARG A 19 10.520 5.530 11.712 1.00 72.14 C ATOM 271 CD ARG A 19 11.123 4.921 12.996 1.00 63.34 C ATOM 272 NE ARG A 19 12.195 3.945 12.690 1.00 15.14 N ATOM 273 CZ ARG A 19 12.925 3.262 13.585 1.00 64.14 C ATOM 274 NH1 ARG A 19 12.753 3.428 14.891 1.00 23.14 N ATOM 275 NH2 ARG A 19 13.806 2.374 13.148 1.00 11.02 N ATOM 0 H ARG A 19 10.108 7.057 9.313 1.00 51.34 H new ATOM 0 HA ARG A 19 9.802 4.221 8.544 1.00 13.15 H new ATOM 0 HB2 ARG A 19 9.435 3.784 11.049 1.00 43.23 H new ATOM 0 HB3 ARG A 19 11.082 3.865 10.456 1.00 43.23 H new ATOM 0 HG2 ARG A 19 11.221 6.251 11.293 1.00 72.14 H new ATOM 0 HG3 ARG A 19 9.613 6.078 11.966 1.00 72.14 H new ATOM 0 HD2 ARG A 19 11.524 5.718 13.623 1.00 63.34 H new ATOM 0 HD3 ARG A 19 10.337 4.430 13.569 1.00 63.34 H new ATOM 0 HE ARG A 19 12.397 3.776 11.705 1.00 15.14 H new ATOM 0 HH11 ARG A 19 12.053 4.087 15.234 1.00 23.14 H new ATOM 0 HH12 ARG A 19 13.320 2.897 15.552 1.00 23.14 H new ATOM 0 HH21 ARG A 19 13.920 2.219 12.146 1.00 11.02 H new ATOM 0 HH22 ARG A 19 14.370 1.845 13.813 1.00 11.02 H new ATOM 289 N VAL A 20 7.330 4.374 9.006 1.00 43.10 N ATOM 290 CA VAL A 20 5.871 4.546 8.899 1.00 21.13 C ATOM 291 C VAL A 20 5.161 3.347 9.551 1.00 10.34 C ATOM 292 O VAL A 20 5.508 2.196 9.271 1.00 30.23 O ATOM 293 CB VAL A 20 5.405 4.649 7.397 1.00 22.44 C ATOM 294 CG1 VAL A 20 3.871 4.772 7.292 1.00 51.11 C ATOM 295 CG2 VAL A 20 6.091 5.817 6.657 1.00 64.21 C ATOM 0 H VAL A 20 7.639 3.423 8.804 1.00 43.10 H new ATOM 0 HA VAL A 20 5.611 5.474 9.409 1.00 21.13 H new ATOM 0 HB VAL A 20 5.710 3.723 6.910 1.00 22.44 H new ATOM 0 HG11 VAL A 20 3.582 4.841 6.243 1.00 51.11 H new ATOM 0 HG12 VAL A 20 3.404 3.895 7.740 1.00 51.11 H new ATOM 0 HG13 VAL A 20 3.541 5.667 7.819 1.00 51.11 H new ATOM 0 HG21 VAL A 20 5.740 5.850 5.625 1.00 64.21 H new ATOM 0 HG22 VAL A 20 5.847 6.756 7.154 1.00 64.21 H new ATOM 0 HG23 VAL A 20 7.171 5.671 6.668 1.00 64.21 H new ATOM 305 N SER A 21 4.156 3.627 10.398 1.00 64.13 N ATOM 306 CA SER A 21 3.282 2.604 10.976 1.00 64.43 C ATOM 307 C SER A 21 1.821 2.895 10.558 1.00 3.03 C ATOM 308 O SER A 21 1.303 3.992 10.802 1.00 64.41 O ATOM 309 CB SER A 21 3.431 2.579 12.515 1.00 71.30 C ATOM 310 OG SER A 21 2.891 1.397 13.072 1.00 34.25 O ATOM 0 H SER A 21 3.930 4.575 10.699 1.00 64.13 H new ATOM 0 HA SER A 21 3.566 1.620 10.603 1.00 64.43 H new ATOM 0 HB2 SER A 21 4.485 2.658 12.780 1.00 71.30 H new ATOM 0 HB3 SER A 21 2.929 3.446 12.944 1.00 71.30 H new ATOM 0 HG SER A 21 2.761 0.732 12.364 1.00 34.25 H new ATOM 316 N PHE A 22 1.179 1.915 9.900 1.00 64.51 N ATOM 317 CA PHE A 22 -0.237 1.986 9.489 1.00 60.23 C ATOM 318 C PHE A 22 -1.084 1.196 10.494 1.00 64.14 C ATOM 319 O PHE A 22 -0.595 0.242 11.090 1.00 40.15 O ATOM 320 CB PHE A 22 -0.450 1.365 8.076 1.00 33.33 C ATOM 321 CG PHE A 22 0.574 1.764 7.019 1.00 15.03 C ATOM 322 CD1 PHE A 22 1.791 1.081 6.909 1.00 24.03 C ATOM 323 CD2 PHE A 22 0.316 2.797 6.124 1.00 71.42 C ATOM 324 CE1 PHE A 22 2.708 1.424 5.943 1.00 31.10 C ATOM 325 CE2 PHE A 22 1.236 3.135 5.158 1.00 3.43 C ATOM 326 CZ PHE A 22 2.432 2.446 5.070 1.00 22.32 C ATOM 0 H PHE A 22 1.632 1.041 9.635 1.00 64.51 H new ATOM 0 HA PHE A 22 -0.532 3.035 9.460 1.00 60.23 H new ATOM 0 HB2 PHE A 22 -0.443 0.279 8.171 1.00 33.33 H new ATOM 0 HB3 PHE A 22 -1.441 1.647 7.721 1.00 33.33 H new ATOM 0 HD1 PHE A 22 2.013 0.274 7.592 1.00 24.03 H new ATOM 0 HD2 PHE A 22 -0.616 3.339 6.188 1.00 71.42 H new ATOM 0 HE1 PHE A 22 3.644 0.890 5.872 1.00 31.10 H new ATOM 0 HE2 PHE A 22 1.024 3.939 4.468 1.00 3.43 H new ATOM 0 HZ PHE A 22 3.152 2.714 4.311 1.00 22.32 H new ATOM 336 N GLU A 23 -2.350 1.581 10.650 1.00 61.11 N ATOM 337 CA GLU A 23 -3.312 0.867 11.502 1.00 41.45 C ATOM 338 C GLU A 23 -4.377 0.189 10.620 1.00 21.51 C ATOM 339 O GLU A 23 -5.087 0.860 9.861 1.00 32.22 O ATOM 340 CB GLU A 23 -3.969 1.836 12.502 1.00 61.34 C ATOM 341 CG GLU A 23 -4.813 1.129 13.577 1.00 70.21 C ATOM 342 CD GLU A 23 -5.465 2.106 14.553 1.00 41.43 C ATOM 343 OE1 GLU A 23 -6.553 2.630 14.232 1.00 2.50 O ATOM 344 OE2 GLU A 23 -4.884 2.372 15.632 1.00 53.34 O ATOM 0 H GLU A 23 -2.743 2.401 10.188 1.00 61.11 H new ATOM 0 HA GLU A 23 -2.786 0.102 12.072 1.00 41.45 H new ATOM 0 HB2 GLU A 23 -3.192 2.424 12.990 1.00 61.34 H new ATOM 0 HB3 GLU A 23 -4.602 2.535 11.956 1.00 61.34 H new ATOM 0 HG2 GLU A 23 -5.588 0.535 13.092 1.00 70.21 H new ATOM 0 HG3 GLU A 23 -4.181 0.436 14.132 1.00 70.21 H new ATOM 351 N LEU A 24 -4.445 -1.146 10.712 1.00 43.11 N ATOM 352 CA LEU A 24 -5.365 -1.989 9.931 1.00 4.12 C ATOM 353 C LEU A 24 -6.684 -2.185 10.702 1.00 4.22 C ATOM 354 O LEU A 24 -6.692 -2.594 11.871 1.00 72.40 O ATOM 355 CB LEU A 24 -4.708 -3.369 9.631 1.00 73.05 C ATOM 356 CG LEU A 24 -3.231 -3.347 9.117 1.00 13.51 C ATOM 357 CD1 LEU A 24 -2.765 -4.764 8.736 1.00 71.24 C ATOM 358 CD2 LEU A 24 -3.035 -2.347 7.952 1.00 2.24 C ATOM 0 H LEU A 24 -3.851 -1.683 11.344 1.00 43.11 H new ATOM 0 HA LEU A 24 -5.580 -1.492 8.985 1.00 4.12 H new ATOM 0 HB2 LEU A 24 -4.743 -3.967 10.541 1.00 73.05 H new ATOM 0 HB3 LEU A 24 -5.319 -3.883 8.889 1.00 73.05 H new ATOM 0 HG LEU A 24 -2.603 -2.995 9.936 1.00 13.51 H new ATOM 0 HD11 LEU A 24 -1.735 -4.725 8.381 1.00 71.24 H new ATOM 0 HD12 LEU A 24 -2.824 -5.413 9.609 1.00 71.24 H new ATOM 0 HD13 LEU A 24 -3.406 -5.158 7.947 1.00 71.24 H new ATOM 0 HD21 LEU A 24 -1.995 -2.366 7.628 1.00 2.24 H new ATOM 0 HD22 LEU A 24 -3.680 -2.628 7.119 1.00 2.24 H new ATOM 0 HD23 LEU A 24 -3.292 -1.342 8.288 1.00 2.24 H new ATOM 370 N PHE A 25 -7.794 -1.901 10.030 1.00 23.04 N ATOM 371 CA PHE A 25 -9.136 -1.995 10.601 1.00 14.34 C ATOM 372 C PHE A 25 -9.704 -3.408 10.400 1.00 1.44 C ATOM 373 O PHE A 25 -10.599 -3.631 9.581 1.00 40.01 O ATOM 374 CB PHE A 25 -10.040 -0.904 9.985 1.00 20.21 C ATOM 375 CG PHE A 25 -9.503 0.512 10.195 1.00 21.31 C ATOM 376 CD1 PHE A 25 -9.804 1.226 11.356 1.00 64.35 C ATOM 377 CD2 PHE A 25 -8.679 1.124 9.243 1.00 33.31 C ATOM 378 CE1 PHE A 25 -9.300 2.501 11.557 1.00 21.52 C ATOM 379 CE2 PHE A 25 -8.179 2.398 9.443 1.00 51.43 C ATOM 380 CZ PHE A 25 -8.490 3.084 10.600 1.00 22.42 C ATOM 0 H PHE A 25 -7.788 -1.594 9.057 1.00 23.04 H new ATOM 0 HA PHE A 25 -9.093 -1.820 11.676 1.00 14.34 H new ATOM 0 HB2 PHE A 25 -10.147 -1.090 8.916 1.00 20.21 H new ATOM 0 HB3 PHE A 25 -11.036 -0.977 10.422 1.00 20.21 H new ATOM 0 HD1 PHE A 25 -10.438 0.779 12.107 1.00 64.35 H new ATOM 0 HD2 PHE A 25 -8.429 0.592 8.337 1.00 33.31 H new ATOM 0 HE1 PHE A 25 -9.540 3.040 12.462 1.00 21.52 H new ATOM 0 HE2 PHE A 25 -7.547 2.855 8.696 1.00 51.43 H new ATOM 0 HZ PHE A 25 -8.100 4.079 10.758 1.00 22.42 H new ATOM 390 N ALA A 26 -9.145 -4.370 11.162 1.00 43.13 N ATOM 391 CA ALA A 26 -9.593 -5.782 11.148 1.00 63.35 C ATOM 392 C ALA A 26 -11.013 -5.949 11.725 1.00 53.50 C ATOM 393 O ALA A 26 -11.643 -6.988 11.536 1.00 45.23 O ATOM 394 CB ALA A 26 -8.594 -6.673 11.905 1.00 4.11 C ATOM 0 H ALA A 26 -8.372 -4.193 11.804 1.00 43.13 H new ATOM 0 HA ALA A 26 -9.630 -6.098 10.105 1.00 63.35 H new ATOM 0 HB1 ALA A 26 -8.940 -7.706 11.884 1.00 4.11 H new ATOM 0 HB2 ALA A 26 -7.615 -6.608 11.429 1.00 4.11 H new ATOM 0 HB3 ALA A 26 -8.518 -6.337 12.939 1.00 4.11 H new ATOM 400 N ASP A 27 -11.506 -4.922 12.434 1.00 21.40 N ATOM 401 CA ASP A 27 -12.873 -4.902 12.994 1.00 41.44 C ATOM 402 C ASP A 27 -13.927 -4.616 11.887 1.00 42.43 C ATOM 403 O ASP A 27 -15.124 -4.866 12.071 1.00 4.12 O ATOM 404 CB ASP A 27 -12.969 -3.831 14.114 1.00 23.34 C ATOM 405 CG ASP A 27 -12.875 -2.376 13.594 1.00 64.34 C ATOM 406 OD1 ASP A 27 -11.834 -2.006 12.997 1.00 35.24 O ATOM 407 OD2 ASP A 27 -13.844 -1.597 13.761 1.00 43.04 O ATOM 0 H ASP A 27 -10.970 -4.079 12.638 1.00 21.40 H new ATOM 0 HA ASP A 27 -13.085 -5.884 13.416 1.00 41.44 H new ATOM 0 HB2 ASP A 27 -13.912 -3.957 14.645 1.00 23.34 H new ATOM 0 HB3 ASP A 27 -12.171 -4.001 14.837 1.00 23.34 H new ATOM 412 N LYS A 28 -13.461 -4.061 10.750 1.00 11.31 N ATOM 413 CA LYS A 28 -14.319 -3.689 9.599 1.00 20.21 C ATOM 414 C LYS A 28 -14.116 -4.678 8.438 1.00 33.42 C ATOM 415 O LYS A 28 -15.083 -5.158 7.831 1.00 45.55 O ATOM 416 CB LYS A 28 -13.971 -2.247 9.145 1.00 65.13 C ATOM 417 CG LYS A 28 -14.167 -1.181 10.245 1.00 53.32 C ATOM 418 CD LYS A 28 -13.626 0.206 9.852 1.00 34.42 C ATOM 419 CE LYS A 28 -13.750 1.240 10.986 1.00 23.31 C ATOM 420 NZ LYS A 28 -13.111 0.771 12.245 1.00 75.34 N ATOM 0 H LYS A 28 -12.473 -3.856 10.600 1.00 11.31 H new ATOM 0 HA LYS A 28 -15.365 -3.729 9.902 1.00 20.21 H new ATOM 0 HB2 LYS A 28 -12.934 -2.222 8.809 1.00 65.13 H new ATOM 0 HB3 LYS A 28 -14.590 -1.987 8.286 1.00 65.13 H new ATOM 0 HG2 LYS A 28 -15.229 -1.097 10.475 1.00 53.32 H new ATOM 0 HG3 LYS A 28 -13.669 -1.513 11.156 1.00 53.32 H new ATOM 0 HD2 LYS A 28 -12.579 0.114 9.564 1.00 34.42 H new ATOM 0 HD3 LYS A 28 -14.167 0.567 8.977 1.00 34.42 H new ATOM 0 HE2 LYS A 28 -13.289 2.177 10.673 1.00 23.31 H new ATOM 0 HE3 LYS A 28 -14.804 1.449 11.171 1.00 23.31 H new ATOM 0 HZ1 LYS A 28 -12.882 1.590 12.844 1.00 75.34 H new ATOM 0 HZ2 LYS A 28 -13.765 0.142 12.753 1.00 75.34 H new ATOM 0 HZ3 LYS A 28 -12.238 0.253 12.019 1.00 75.34 H new ATOM 434 N VAL A 29 -12.837 -4.980 8.153 1.00 10.12 N ATOM 435 CA VAL A 29 -12.413 -5.835 7.023 1.00 61.53 C ATOM 436 C VAL A 29 -11.335 -6.858 7.505 1.00 22.32 C ATOM 437 O VAL A 29 -10.153 -6.747 7.142 1.00 2.34 O ATOM 438 CB VAL A 29 -11.880 -4.954 5.811 1.00 13.24 C ATOM 439 CG1 VAL A 29 -13.034 -4.278 5.034 1.00 62.50 C ATOM 440 CG2 VAL A 29 -10.884 -3.885 6.311 1.00 62.13 C ATOM 0 H VAL A 29 -12.055 -4.633 8.708 1.00 10.12 H new ATOM 0 HA VAL A 29 -13.276 -6.393 6.660 1.00 61.53 H new ATOM 0 HB VAL A 29 -11.368 -5.629 5.126 1.00 13.24 H new ATOM 0 HG11 VAL A 29 -12.624 -3.687 4.215 1.00 62.50 H new ATOM 0 HG12 VAL A 29 -13.699 -5.043 4.632 1.00 62.50 H new ATOM 0 HG13 VAL A 29 -13.594 -3.628 5.706 1.00 62.50 H new ATOM 0 HG21 VAL A 29 -10.531 -3.293 5.466 1.00 62.13 H new ATOM 0 HG22 VAL A 29 -11.381 -3.233 7.029 1.00 62.13 H new ATOM 0 HG23 VAL A 29 -10.036 -4.374 6.791 1.00 62.13 H new ATOM 450 N PRO A 30 -11.732 -7.878 8.349 1.00 51.30 N ATOM 451 CA PRO A 30 -10.776 -8.848 8.960 1.00 51.42 C ATOM 452 C PRO A 30 -9.952 -9.649 7.931 1.00 41.02 C ATOM 453 O PRO A 30 -8.825 -10.028 8.219 1.00 35.44 O ATOM 454 CB PRO A 30 -11.680 -9.783 9.818 1.00 64.51 C ATOM 455 CG PRO A 30 -13.068 -9.592 9.279 1.00 61.34 C ATOM 456 CD PRO A 30 -13.129 -8.158 8.792 1.00 2.22 C ATOM 0 HA PRO A 30 -10.016 -8.328 9.542 1.00 51.42 H new ATOM 0 HB2 PRO A 30 -11.364 -10.823 9.733 1.00 64.51 H new ATOM 0 HB3 PRO A 30 -11.628 -9.520 10.874 1.00 64.51 H new ATOM 0 HG2 PRO A 30 -13.271 -10.290 8.467 1.00 61.34 H new ATOM 0 HG3 PRO A 30 -13.816 -9.775 10.051 1.00 61.34 H new ATOM 0 HD2 PRO A 30 -13.840 -8.042 7.974 1.00 2.22 H new ATOM 0 HD3 PRO A 30 -13.442 -7.478 9.585 1.00 2.22 H new ATOM 464 N LYS A 31 -10.528 -9.881 6.741 1.00 23.33 N ATOM 465 CA LYS A 31 -9.878 -10.638 5.649 1.00 12.22 C ATOM 466 C LYS A 31 -8.752 -9.819 4.998 1.00 34.41 C ATOM 467 O LYS A 31 -7.585 -10.235 4.969 1.00 2.42 O ATOM 468 CB LYS A 31 -10.955 -11.004 4.611 1.00 63.30 C ATOM 469 CG LYS A 31 -10.496 -11.815 3.380 1.00 70.23 C ATOM 470 CD LYS A 31 -11.682 -12.140 2.441 1.00 74.52 C ATOM 471 CE LYS A 31 -12.808 -12.923 3.158 1.00 64.13 C ATOM 472 NZ LYS A 31 -14.044 -12.995 2.349 1.00 40.32 N ATOM 0 H LYS A 31 -11.463 -9.549 6.504 1.00 23.33 H new ATOM 0 HA LYS A 31 -9.423 -11.543 6.052 1.00 12.22 H new ATOM 0 HB2 LYS A 31 -11.735 -11.571 5.118 1.00 63.30 H new ATOM 0 HB3 LYS A 31 -11.412 -10.080 4.257 1.00 63.30 H new ATOM 0 HG2 LYS A 31 -9.741 -11.251 2.832 1.00 70.23 H new ATOM 0 HG3 LYS A 31 -10.026 -12.742 3.708 1.00 70.23 H new ATOM 0 HD2 LYS A 31 -12.088 -11.212 2.039 1.00 74.52 H new ATOM 0 HD3 LYS A 31 -11.321 -12.723 1.594 1.00 74.52 H new ATOM 0 HE2 LYS A 31 -12.462 -13.933 3.379 1.00 64.13 H new ATOM 0 HE3 LYS A 31 -13.029 -12.446 4.113 1.00 64.13 H new ATOM 0 HZ1 LYS A 31 -14.769 -13.528 2.870 1.00 40.32 H new ATOM 0 HZ2 LYS A 31 -14.391 -12.033 2.159 1.00 40.32 H new ATOM 0 HZ3 LYS A 31 -13.842 -13.474 1.448 1.00 40.32 H new ATOM 486 N THR A 32 -9.127 -8.624 4.506 1.00 43.45 N ATOM 487 CA THR A 32 -8.243 -7.747 3.722 1.00 32.32 C ATOM 488 C THR A 32 -7.109 -7.154 4.612 1.00 44.22 C ATOM 489 O THR A 32 -6.022 -6.830 4.113 1.00 50.23 O ATOM 490 CB THR A 32 -9.097 -6.616 3.036 1.00 44.44 C ATOM 491 OG1 THR A 32 -10.287 -7.198 2.460 1.00 52.50 O ATOM 492 CG2 THR A 32 -8.326 -5.869 1.926 1.00 20.10 C ATOM 0 H THR A 32 -10.061 -8.238 4.644 1.00 43.45 H new ATOM 0 HA THR A 32 -7.758 -8.334 2.942 1.00 32.32 H new ATOM 0 HB THR A 32 -9.345 -5.891 3.811 1.00 44.44 H new ATOM 0 HG1 THR A 32 -10.821 -6.496 2.034 1.00 52.50 H new ATOM 0 HG21 THR A 32 -8.967 -5.102 1.491 1.00 20.10 H new ATOM 0 HG22 THR A 32 -7.438 -5.402 2.351 1.00 20.10 H new ATOM 0 HG23 THR A 32 -8.028 -6.575 1.151 1.00 20.10 H new ATOM 500 N ALA A 33 -7.375 -7.055 5.935 1.00 52.22 N ATOM 501 CA ALA A 33 -6.400 -6.573 6.933 1.00 1.22 C ATOM 502 C ALA A 33 -5.446 -7.710 7.374 1.00 50.22 C ATOM 503 O ALA A 33 -4.227 -7.488 7.487 1.00 63.42 O ATOM 504 CB ALA A 33 -7.139 -5.972 8.142 1.00 42.13 C ATOM 0 H ALA A 33 -8.277 -7.309 6.339 1.00 52.22 H new ATOM 0 HA ALA A 33 -5.791 -5.794 6.475 1.00 1.22 H new ATOM 0 HB1 ALA A 33 -6.412 -5.619 8.874 1.00 42.13 H new ATOM 0 HB2 ALA A 33 -7.757 -5.137 7.812 1.00 42.13 H new ATOM 0 HB3 ALA A 33 -7.771 -6.734 8.597 1.00 42.13 H new ATOM 510 N GLU A 34 -6.019 -8.933 7.599 1.00 25.23 N ATOM 511 CA GLU A 34 -5.245 -10.154 7.970 1.00 21.14 C ATOM 512 C GLU A 34 -4.166 -10.442 6.929 1.00 52.42 C ATOM 513 O GLU A 34 -3.047 -10.839 7.276 1.00 22.53 O ATOM 514 CB GLU A 34 -6.168 -11.404 8.088 1.00 12.42 C ATOM 515 CG GLU A 34 -5.428 -12.730 8.402 1.00 21.32 C ATOM 516 CD GLU A 34 -6.351 -13.955 8.437 1.00 35.03 C ATOM 517 OE1 GLU A 34 -6.618 -14.548 7.365 1.00 42.33 O ATOM 518 OE2 GLU A 34 -6.823 -14.334 9.533 1.00 40.51 O ATOM 0 H GLU A 34 -7.023 -9.096 7.528 1.00 25.23 H new ATOM 0 HA GLU A 34 -4.787 -9.958 8.939 1.00 21.14 H new ATOM 0 HB2 GLU A 34 -6.905 -11.222 8.870 1.00 12.42 H new ATOM 0 HB3 GLU A 34 -6.717 -11.523 7.154 1.00 12.42 H new ATOM 0 HG2 GLU A 34 -4.653 -12.890 7.652 1.00 21.32 H new ATOM 0 HG3 GLU A 34 -4.925 -12.637 9.365 1.00 21.32 H new ATOM 525 N ASN A 35 -4.552 -10.226 5.657 1.00 72.54 N ATOM 526 CA ASN A 35 -3.698 -10.427 4.490 1.00 11.32 C ATOM 527 C ASN A 35 -2.348 -9.710 4.657 1.00 51.22 C ATOM 528 O ASN A 35 -1.318 -10.357 4.839 1.00 3.11 O ATOM 529 CB ASN A 35 -4.427 -9.937 3.209 1.00 74.22 C ATOM 530 CG ASN A 35 -3.576 -10.110 1.953 1.00 34.20 C ATOM 531 OD1 ASN A 35 -2.795 -11.039 1.851 1.00 53.32 O ATOM 532 ND2 ASN A 35 -3.705 -9.212 1.002 1.00 22.52 N ATOM 0 H ASN A 35 -5.488 -9.900 5.416 1.00 72.54 H new ATOM 0 HA ASN A 35 -3.493 -11.493 4.394 1.00 11.32 H new ATOM 0 HB2 ASN A 35 -5.360 -10.489 3.091 1.00 74.22 H new ATOM 0 HB3 ASN A 35 -4.691 -8.886 3.324 1.00 74.22 H new ATOM 0 HD21 ASN A 35 -3.144 -9.284 0.153 1.00 22.52 H new ATOM 0 HD22 ASN A 35 -4.367 -8.444 1.113 1.00 22.52 H new ATOM 539 N PHE A 36 -2.405 -8.372 4.673 1.00 63.42 N ATOM 540 CA PHE A 36 -1.220 -7.506 4.687 1.00 75.44 C ATOM 541 C PHE A 36 -0.406 -7.692 5.985 1.00 5.12 C ATOM 542 O PHE A 36 0.823 -7.652 5.954 1.00 71.44 O ATOM 543 CB PHE A 36 -1.667 -6.044 4.515 1.00 30.35 C ATOM 544 CG PHE A 36 -0.534 -5.040 4.303 1.00 3.11 C ATOM 545 CD1 PHE A 36 0.036 -4.873 3.038 1.00 43.43 C ATOM 546 CD2 PHE A 36 -0.048 -4.256 5.353 1.00 75.10 C ATOM 547 CE1 PHE A 36 1.052 -3.961 2.834 1.00 53.55 C ATOM 548 CE2 PHE A 36 0.968 -3.347 5.141 1.00 42.54 C ATOM 549 CZ PHE A 36 1.516 -3.198 3.883 1.00 34.22 C ATOM 0 H PHE A 36 -3.285 -7.855 4.677 1.00 63.42 H new ATOM 0 HA PHE A 36 -0.565 -7.781 3.861 1.00 75.44 H new ATOM 0 HB2 PHE A 36 -2.347 -5.986 3.665 1.00 30.35 H new ATOM 0 HB3 PHE A 36 -2.234 -5.747 5.397 1.00 30.35 H new ATOM 0 HD1 PHE A 36 -0.323 -5.465 2.209 1.00 43.43 H new ATOM 0 HD2 PHE A 36 -0.472 -4.363 6.340 1.00 75.10 H new ATOM 0 HE1 PHE A 36 1.484 -3.845 1.851 1.00 53.55 H new ATOM 0 HE2 PHE A 36 1.336 -2.750 5.962 1.00 42.54 H new ATOM 0 HZ PHE A 36 2.309 -2.483 3.721 1.00 34.22 H new ATOM 559 N ARG A 37 -1.126 -7.914 7.102 1.00 43.21 N ATOM 560 CA ARG A 37 -0.527 -8.139 8.434 1.00 72.41 C ATOM 561 C ARG A 37 0.379 -9.393 8.431 1.00 75.43 C ATOM 562 O ARG A 37 1.523 -9.360 8.910 1.00 71.14 O ATOM 563 CB ARG A 37 -1.663 -8.310 9.473 1.00 11.30 C ATOM 564 CG ARG A 37 -1.212 -8.400 10.948 1.00 10.20 C ATOM 565 CD ARG A 37 -2.376 -8.774 11.876 1.00 30.10 C ATOM 566 NE ARG A 37 -2.030 -8.718 13.306 1.00 42.11 N ATOM 567 CZ ARG A 37 -2.697 -9.358 14.283 1.00 63.02 C ATOM 568 NH1 ARG A 37 -3.748 -10.124 14.016 1.00 61.22 N ATOM 569 NH2 ARG A 37 -2.323 -9.180 15.535 1.00 23.21 N ATOM 0 H ARG A 37 -2.146 -7.943 7.106 1.00 43.21 H new ATOM 0 HA ARG A 37 0.091 -7.280 8.694 1.00 72.41 H new ATOM 0 HB2 ARG A 37 -2.352 -7.471 9.373 1.00 11.30 H new ATOM 0 HB3 ARG A 37 -2.223 -9.213 9.227 1.00 11.30 H new ATOM 0 HG2 ARG A 37 -0.419 -9.142 11.041 1.00 10.20 H new ATOM 0 HG3 ARG A 37 -0.792 -7.444 11.259 1.00 10.20 H new ATOM 0 HD2 ARG A 37 -3.212 -8.101 11.686 1.00 30.10 H new ATOM 0 HD3 ARG A 37 -2.716 -9.781 11.632 1.00 30.10 H new ATOM 0 HE ARG A 37 -1.225 -8.152 13.576 1.00 42.11 H new ATOM 0 HH11 ARG A 37 -4.065 -10.237 13.053 1.00 61.22 H new ATOM 0 HH12 ARG A 37 -4.238 -10.600 14.774 1.00 61.22 H new ATOM 0 HH21 ARG A 37 -1.539 -8.564 15.750 1.00 23.21 H new ATOM 0 HH22 ARG A 37 -2.818 -9.658 16.288 1.00 23.21 H new ATOM 583 N ALA A 38 -0.159 -10.488 7.854 1.00 63.23 N ATOM 584 CA ALA A 38 0.519 -11.797 7.798 1.00 21.13 C ATOM 585 C ALA A 38 1.598 -11.832 6.700 1.00 73.12 C ATOM 586 O ALA A 38 2.478 -12.699 6.726 1.00 61.04 O ATOM 587 CB ALA A 38 -0.506 -12.923 7.601 1.00 52.24 C ATOM 0 H ALA A 38 -1.079 -10.487 7.413 1.00 63.23 H new ATOM 0 HA ALA A 38 1.025 -11.953 8.751 1.00 21.13 H new ATOM 0 HB1 ALA A 38 0.010 -13.882 7.562 1.00 52.24 H new ATOM 0 HB2 ALA A 38 -1.210 -12.924 8.433 1.00 52.24 H new ATOM 0 HB3 ALA A 38 -1.047 -12.764 6.668 1.00 52.24 H new ATOM 593 N LEU A 39 1.499 -10.904 5.719 1.00 22.10 N ATOM 594 CA LEU A 39 2.556 -10.680 4.706 1.00 55.11 C ATOM 595 C LEU A 39 3.751 -9.945 5.348 1.00 51.42 C ATOM 596 O LEU A 39 4.906 -10.234 5.025 1.00 34.44 O ATOM 597 CB LEU A 39 2.011 -9.854 3.500 1.00 30.51 C ATOM 598 CG LEU A 39 0.920 -10.537 2.614 1.00 64.05 C ATOM 599 CD1 LEU A 39 0.409 -9.585 1.511 1.00 64.05 C ATOM 600 CD2 LEU A 39 1.425 -11.867 2.019 1.00 74.32 C ATOM 0 H LEU A 39 0.689 -10.293 5.608 1.00 22.10 H new ATOM 0 HA LEU A 39 2.884 -11.651 4.334 1.00 55.11 H new ATOM 0 HB2 LEU A 39 1.600 -8.921 3.885 1.00 30.51 H new ATOM 0 HB3 LEU A 39 2.853 -9.591 2.860 1.00 30.51 H new ATOM 0 HG LEU A 39 0.075 -10.769 3.262 1.00 64.05 H new ATOM 0 HD11 LEU A 39 -0.348 -10.093 0.914 1.00 64.05 H new ATOM 0 HD12 LEU A 39 -0.026 -8.697 1.970 1.00 64.05 H new ATOM 0 HD13 LEU A 39 1.240 -9.292 0.869 1.00 64.05 H new ATOM 0 HD21 LEU A 39 0.640 -12.314 1.409 1.00 74.32 H new ATOM 0 HD22 LEU A 39 2.303 -11.679 1.401 1.00 74.32 H new ATOM 0 HD23 LEU A 39 1.690 -12.550 2.827 1.00 74.32 H new ATOM 612 N SER A 40 3.441 -8.999 6.266 1.00 42.43 N ATOM 613 CA SER A 40 4.448 -8.170 6.965 1.00 32.51 C ATOM 614 C SER A 40 5.301 -9.032 7.921 1.00 75.50 C ATOM 615 O SER A 40 6.537 -8.958 7.909 1.00 4.02 O ATOM 616 CB SER A 40 3.745 -7.029 7.748 1.00 4.34 C ATOM 617 OG SER A 40 2.997 -6.192 6.879 1.00 12.11 O ATOM 0 H SER A 40 2.482 -8.790 6.542 1.00 42.43 H new ATOM 0 HA SER A 40 5.112 -7.732 6.220 1.00 32.51 H new ATOM 0 HB2 SER A 40 3.085 -7.456 8.503 1.00 4.34 H new ATOM 0 HB3 SER A 40 4.490 -6.435 8.276 1.00 4.34 H new ATOM 0 HG SER A 40 2.222 -6.685 6.536 1.00 12.11 H new ATOM 623 N THR A 41 4.612 -9.840 8.748 1.00 21.03 N ATOM 624 CA THR A 41 5.252 -10.763 9.707 1.00 43.11 C ATOM 625 C THR A 41 5.812 -12.010 9.005 1.00 72.13 C ATOM 626 O THR A 41 6.858 -12.537 9.402 1.00 63.41 O ATOM 627 CB THR A 41 4.210 -11.218 10.778 1.00 61.31 C ATOM 628 OG1 THR A 41 2.968 -11.522 10.117 1.00 1.05 O ATOM 629 CG2 THR A 41 3.976 -10.165 11.859 1.00 65.02 C ATOM 0 H THR A 41 3.593 -9.872 8.771 1.00 21.03 H new ATOM 0 HA THR A 41 6.076 -10.228 10.178 1.00 43.11 H new ATOM 0 HB THR A 41 4.610 -12.100 11.279 1.00 61.31 H new ATOM 0 HG1 THR A 41 2.225 -11.404 10.746 1.00 1.05 H new ATOM 0 HG21 THR A 41 3.243 -10.536 12.575 1.00 65.02 H new ATOM 0 HG22 THR A 41 4.914 -9.958 12.374 1.00 65.02 H new ATOM 0 HG23 THR A 41 3.604 -9.249 11.400 1.00 65.02 H new ATOM 637 N GLY A 42 5.123 -12.453 7.945 1.00 44.41 N ATOM 638 CA GLY A 42 5.449 -13.711 7.287 1.00 31.02 C ATOM 639 C GLY A 42 4.953 -14.919 8.067 1.00 62.33 C ATOM 640 O GLY A 42 5.637 -15.946 8.116 1.00 74.34 O ATOM 0 H GLY A 42 4.337 -11.953 7.530 1.00 44.41 H new ATOM 0 HA2 GLY A 42 5.010 -13.721 6.290 1.00 31.02 H new ATOM 0 HA3 GLY A 42 6.529 -13.782 7.160 1.00 31.02 H new ATOM 644 N GLU A 43 3.745 -14.789 8.678 1.00 74.33 N ATOM 645 CA GLU A 43 3.061 -15.910 9.373 1.00 30.10 C ATOM 646 C GLU A 43 2.672 -17.034 8.391 1.00 63.53 C ATOM 647 O GLU A 43 2.419 -18.172 8.795 1.00 73.15 O ATOM 648 CB GLU A 43 1.783 -15.407 10.107 1.00 70.31 C ATOM 649 CG GLU A 43 2.029 -14.350 11.199 1.00 20.41 C ATOM 650 CD GLU A 43 2.997 -14.816 12.311 1.00 72.51 C ATOM 651 OE1 GLU A 43 2.560 -15.534 13.240 1.00 12.45 O ATOM 652 OE2 GLU A 43 4.198 -14.474 12.260 1.00 71.43 O ATOM 0 H GLU A 43 3.223 -13.913 8.702 1.00 74.33 H new ATOM 0 HA GLU A 43 3.766 -16.311 10.101 1.00 30.10 H new ATOM 0 HB2 GLU A 43 1.099 -14.990 9.368 1.00 70.31 H new ATOM 0 HB3 GLU A 43 1.282 -16.263 10.558 1.00 70.31 H new ATOM 0 HG2 GLU A 43 2.430 -13.449 10.735 1.00 20.41 H new ATOM 0 HG3 GLU A 43 1.075 -14.079 11.651 1.00 20.41 H new ATOM 659 N LYS A 44 2.591 -16.673 7.096 1.00 11.54 N ATOM 660 CA LYS A 44 2.244 -17.594 5.996 1.00 74.11 C ATOM 661 C LYS A 44 3.500 -17.926 5.150 1.00 5.31 C ATOM 662 O LYS A 44 3.388 -18.450 4.034 1.00 43.14 O ATOM 663 CB LYS A 44 1.137 -16.940 5.123 1.00 24.21 C ATOM 664 CG LYS A 44 -0.029 -16.308 5.917 1.00 42.02 C ATOM 665 CD LYS A 44 -0.823 -17.302 6.797 1.00 43.14 C ATOM 666 CE LYS A 44 -1.942 -16.602 7.597 1.00 14.14 C ATOM 667 NZ LYS A 44 -2.671 -17.551 8.472 1.00 70.42 N ATOM 0 H LYS A 44 2.767 -15.719 6.780 1.00 11.54 H new ATOM 0 HA LYS A 44 1.868 -18.532 6.405 1.00 74.11 H new ATOM 0 HB2 LYS A 44 1.593 -16.170 4.501 1.00 24.21 H new ATOM 0 HB3 LYS A 44 0.732 -17.695 4.450 1.00 24.21 H new ATOM 0 HG2 LYS A 44 0.369 -15.517 6.553 1.00 42.02 H new ATOM 0 HG3 LYS A 44 -0.716 -15.836 5.214 1.00 42.02 H new ATOM 0 HD2 LYS A 44 -1.259 -18.076 6.166 1.00 43.14 H new ATOM 0 HD3 LYS A 44 -0.141 -17.800 7.487 1.00 43.14 H new ATOM 0 HE2 LYS A 44 -1.511 -15.806 8.204 1.00 14.14 H new ATOM 0 HE3 LYS A 44 -2.643 -16.133 6.907 1.00 14.14 H new ATOM 0 HZ1 LYS A 44 -3.414 -17.043 8.992 1.00 70.42 H new ATOM 0 HZ2 LYS A 44 -3.104 -18.297 7.891 1.00 70.42 H new ATOM 0 HZ3 LYS A 44 -2.007 -17.980 9.148 1.00 70.42 H new ATOM 681 N GLY A 45 4.692 -17.614 5.707 1.00 31.12 N ATOM 682 CA GLY A 45 5.976 -17.910 5.066 1.00 53.44 C ATOM 683 C GLY A 45 6.252 -17.091 3.812 1.00 30.01 C ATOM 684 O GLY A 45 6.802 -17.619 2.841 1.00 73.03 O ATOM 0 H GLY A 45 4.782 -17.151 6.611 1.00 31.12 H new ATOM 0 HA2 GLY A 45 6.777 -17.735 5.784 1.00 53.44 H new ATOM 0 HA3 GLY A 45 6.005 -18.969 4.808 1.00 53.44 H new ATOM 688 N PHE A 46 5.862 -15.798 3.815 1.00 63.03 N ATOM 689 CA PHE A 46 6.058 -14.895 2.648 1.00 53.13 C ATOM 690 C PHE A 46 6.987 -13.725 3.017 1.00 0.55 C ATOM 691 O PHE A 46 7.942 -13.440 2.279 1.00 43.02 O ATOM 692 CB PHE A 46 4.689 -14.378 2.128 1.00 12.52 C ATOM 693 CG PHE A 46 3.738 -15.486 1.657 1.00 2.24 C ATOM 694 CD1 PHE A 46 4.214 -16.586 0.937 1.00 12.32 C ATOM 695 CD2 PHE A 46 2.373 -15.426 1.926 1.00 42.11 C ATOM 696 CE1 PHE A 46 3.361 -17.581 0.512 1.00 63.34 C ATOM 697 CE2 PHE A 46 1.522 -16.430 1.494 1.00 2.31 C ATOM 698 CZ PHE A 46 2.016 -17.504 0.792 1.00 50.33 C ATOM 0 H PHE A 46 5.408 -15.351 4.612 1.00 63.03 H new ATOM 0 HA PHE A 46 6.534 -15.461 1.847 1.00 53.13 H new ATOM 0 HB2 PHE A 46 4.203 -13.810 2.921 1.00 12.52 H new ATOM 0 HB3 PHE A 46 4.863 -13.688 1.302 1.00 12.52 H new ATOM 0 HD1 PHE A 46 5.268 -16.657 0.710 1.00 12.32 H new ATOM 0 HD2 PHE A 46 1.974 -14.588 2.477 1.00 42.11 H new ATOM 0 HE1 PHE A 46 3.749 -18.423 -0.042 1.00 63.34 H new ATOM 0 HE2 PHE A 46 0.466 -16.369 1.710 1.00 2.31 H new ATOM 0 HZ PHE A 46 1.349 -18.286 0.461 1.00 50.33 H new ATOM 708 N GLY A 47 6.688 -13.075 4.169 1.00 23.32 N ATOM 709 CA GLY A 47 7.589 -12.109 4.827 1.00 65.32 C ATOM 710 C GLY A 47 8.176 -11.052 3.893 1.00 33.45 C ATOM 711 O GLY A 47 9.398 -10.989 3.734 1.00 33.33 O ATOM 0 H GLY A 47 5.808 -13.211 4.667 1.00 23.32 H new ATOM 0 HA2 GLY A 47 7.042 -11.607 5.625 1.00 65.32 H new ATOM 0 HA3 GLY A 47 8.407 -12.656 5.296 1.00 65.32 H new ATOM 715 N TYR A 48 7.303 -10.232 3.280 1.00 4.25 N ATOM 716 CA TYR A 48 7.702 -9.241 2.260 1.00 23.43 C ATOM 717 C TYR A 48 8.604 -8.132 2.841 1.00 70.11 C ATOM 718 O TYR A 48 8.131 -7.139 3.404 1.00 14.24 O ATOM 719 CB TYR A 48 6.453 -8.671 1.523 1.00 75.15 C ATOM 720 CG TYR A 48 5.868 -9.676 0.521 1.00 23.44 C ATOM 721 CD1 TYR A 48 6.412 -9.795 -0.760 1.00 40.40 C ATOM 722 CD2 TYR A 48 4.809 -10.525 0.854 1.00 62.23 C ATOM 723 CE1 TYR A 48 5.925 -10.720 -1.658 1.00 54.12 C ATOM 724 CE2 TYR A 48 4.322 -11.445 -0.056 1.00 60.35 C ATOM 725 CZ TYR A 48 4.884 -11.533 -1.306 1.00 13.42 C ATOM 726 OH TYR A 48 4.414 -12.455 -2.206 1.00 44.43 O ATOM 0 H TYR A 48 6.302 -10.236 3.476 1.00 4.25 H new ATOM 0 HA TYR A 48 8.311 -9.758 1.518 1.00 23.43 H new ATOM 0 HB2 TYR A 48 5.691 -8.404 2.255 1.00 75.15 H new ATOM 0 HB3 TYR A 48 6.728 -7.755 1.000 1.00 75.15 H new ATOM 0 HD1 TYR A 48 7.228 -9.151 -1.052 1.00 40.40 H new ATOM 0 HD2 TYR A 48 4.365 -10.462 1.836 1.00 62.23 H new ATOM 0 HE1 TYR A 48 6.366 -10.803 -2.640 1.00 54.12 H new ATOM 0 HE2 TYR A 48 3.502 -12.093 0.216 1.00 60.35 H new ATOM 0 HH TYR A 48 4.057 -13.230 -1.724 1.00 44.43 H new ATOM 736 N LYS A 49 9.915 -8.381 2.728 1.00 22.22 N ATOM 737 CA LYS A 49 10.986 -7.455 3.105 1.00 2.25 C ATOM 738 C LYS A 49 11.605 -6.874 1.827 1.00 4.23 C ATOM 739 O LYS A 49 11.859 -7.619 0.874 1.00 33.33 O ATOM 740 CB LYS A 49 12.069 -8.220 3.912 1.00 32.54 C ATOM 741 CG LYS A 49 13.263 -7.345 4.376 1.00 12.34 C ATOM 742 CD LYS A 49 12.901 -6.324 5.490 1.00 43.03 C ATOM 743 CE LYS A 49 12.946 -6.925 6.910 1.00 22.22 C ATOM 744 NZ LYS A 49 12.010 -8.063 7.101 1.00 63.01 N ATOM 0 H LYS A 49 10.269 -9.263 2.359 1.00 22.22 H new ATOM 0 HA LYS A 49 10.586 -6.649 3.721 1.00 2.25 H new ATOM 0 HB2 LYS A 49 11.602 -8.669 4.788 1.00 32.54 H new ATOM 0 HB3 LYS A 49 12.450 -9.038 3.300 1.00 32.54 H new ATOM 0 HG2 LYS A 49 14.058 -7.996 4.738 1.00 12.34 H new ATOM 0 HG3 LYS A 49 13.660 -6.805 3.517 1.00 12.34 H new ATOM 0 HD2 LYS A 49 13.590 -5.481 5.438 1.00 43.03 H new ATOM 0 HD3 LYS A 49 11.902 -5.931 5.301 1.00 43.03 H new ATOM 0 HE2 LYS A 49 13.961 -7.260 7.122 1.00 22.22 H new ATOM 0 HE3 LYS A 49 12.710 -6.145 7.634 1.00 22.22 H new ATOM 0 HZ1 LYS A 49 12.230 -8.547 7.995 1.00 63.01 H new ATOM 0 HZ2 LYS A 49 11.033 -7.708 7.131 1.00 63.01 H new ATOM 0 HZ3 LYS A 49 12.111 -8.732 6.311 1.00 63.01 H new ATOM 758 N GLY A 50 11.848 -5.555 1.807 1.00 11.51 N ATOM 759 CA GLY A 50 12.487 -4.903 0.661 1.00 40.31 C ATOM 760 C GLY A 50 11.540 -4.665 -0.504 1.00 55.32 C ATOM 761 O GLY A 50 11.992 -4.533 -1.647 1.00 11.52 O ATOM 0 H GLY A 50 11.611 -4.922 2.571 1.00 11.51 H new ATOM 0 HA2 GLY A 50 12.904 -3.948 0.982 1.00 40.31 H new ATOM 0 HA3 GLY A 50 13.321 -5.517 0.322 1.00 40.31 H new ATOM 765 N SER A 51 10.220 -4.642 -0.209 1.00 52.33 N ATOM 766 CA SER A 51 9.165 -4.404 -1.210 1.00 4.02 C ATOM 767 C SER A 51 9.392 -3.052 -1.918 1.00 53.24 C ATOM 768 O SER A 51 9.333 -1.989 -1.280 1.00 30.22 O ATOM 769 CB SER A 51 7.780 -4.445 -0.533 1.00 3.22 C ATOM 770 OG SER A 51 7.614 -5.633 0.224 1.00 53.22 O ATOM 0 H SER A 51 9.860 -4.789 0.734 1.00 52.33 H new ATOM 0 HA SER A 51 9.205 -5.190 -1.964 1.00 4.02 H new ATOM 0 HB2 SER A 51 7.664 -3.578 0.117 1.00 3.22 H new ATOM 0 HB3 SER A 51 7.000 -4.382 -1.291 1.00 3.22 H new ATOM 0 HG SER A 51 6.802 -5.563 0.769 1.00 53.22 H new ATOM 776 N CYS A 52 9.661 -3.133 -3.231 1.00 63.32 N ATOM 777 CA CYS A 52 10.052 -2.001 -4.067 1.00 71.34 C ATOM 778 C CYS A 52 8.829 -1.182 -4.513 1.00 52.51 C ATOM 779 O CYS A 52 7.943 -1.685 -5.215 1.00 22.24 O ATOM 780 CB CYS A 52 10.849 -2.521 -5.294 1.00 5.55 C ATOM 781 SG CYS A 52 9.972 -3.752 -6.299 1.00 63.31 S ATOM 0 H CYS A 52 9.610 -4.011 -3.747 1.00 63.32 H new ATOM 0 HA CYS A 52 10.686 -1.335 -3.481 1.00 71.34 H new ATOM 0 HB2 CYS A 52 11.109 -1.673 -5.927 1.00 5.55 H new ATOM 0 HB3 CYS A 52 11.785 -2.957 -4.944 1.00 5.55 H new ATOM 0 HG CYS A 52 8.938 -3.198 -6.860 1.00 63.31 H new ATOM 787 N PHE A 53 8.766 0.064 -4.037 1.00 61.41 N ATOM 788 CA PHE A 53 7.884 1.101 -4.577 1.00 74.41 C ATOM 789 C PHE A 53 8.337 1.441 -6.008 1.00 22.33 C ATOM 790 O PHE A 53 9.262 2.230 -6.212 1.00 42.14 O ATOM 791 CB PHE A 53 7.890 2.358 -3.662 1.00 71.01 C ATOM 792 CG PHE A 53 7.327 2.128 -2.257 1.00 3.15 C ATOM 793 CD1 PHE A 53 8.053 1.422 -1.293 1.00 53.13 C ATOM 794 CD2 PHE A 53 6.068 2.620 -1.899 1.00 63.31 C ATOM 795 CE1 PHE A 53 7.544 1.213 -0.028 1.00 23.41 C ATOM 796 CE2 PHE A 53 5.560 2.408 -0.632 1.00 60.52 C ATOM 797 CZ PHE A 53 6.298 1.706 0.303 1.00 12.35 C ATOM 0 H PHE A 53 9.335 0.385 -3.254 1.00 61.41 H new ATOM 0 HA PHE A 53 6.858 0.735 -4.608 1.00 74.41 H new ATOM 0 HB2 PHE A 53 8.914 2.722 -3.574 1.00 71.01 H new ATOM 0 HB3 PHE A 53 7.313 3.146 -4.146 1.00 71.01 H new ATOM 0 HD1 PHE A 53 9.029 1.034 -1.543 1.00 53.13 H new ATOM 0 HD2 PHE A 53 5.486 3.172 -2.622 1.00 63.31 H new ATOM 0 HE1 PHE A 53 8.120 0.664 0.703 1.00 23.41 H new ATOM 0 HE2 PHE A 53 4.585 2.791 -0.371 1.00 60.52 H new ATOM 0 HZ PHE A 53 5.899 1.543 1.293 1.00 12.35 H new ATOM 807 N HIS A 54 7.718 0.759 -6.985 1.00 3.33 N ATOM 808 CA HIS A 54 8.060 0.884 -8.418 1.00 3.44 C ATOM 809 C HIS A 54 6.963 1.634 -9.198 1.00 4.14 C ATOM 810 O HIS A 54 7.088 1.825 -10.414 1.00 51.02 O ATOM 811 CB HIS A 54 8.338 -0.518 -9.035 1.00 21.30 C ATOM 812 CG HIS A 54 7.253 -1.551 -8.823 1.00 53.44 C ATOM 813 ND1 HIS A 54 7.294 -2.490 -7.812 1.00 72.11 N ATOM 814 CD2 HIS A 54 6.109 -1.806 -9.510 1.00 12.23 C ATOM 815 CE1 HIS A 54 6.238 -3.273 -7.893 1.00 1.32 C ATOM 816 NE2 HIS A 54 5.506 -2.880 -8.913 1.00 73.14 N ATOM 0 H HIS A 54 6.961 0.100 -6.805 1.00 3.33 H new ATOM 0 HA HIS A 54 8.971 1.478 -8.497 1.00 3.44 H new ATOM 0 HB2 HIS A 54 8.497 -0.399 -10.107 1.00 21.30 H new ATOM 0 HB3 HIS A 54 9.268 -0.902 -8.616 1.00 21.30 H new ATOM 0 HD2 HIS A 54 5.743 -1.262 -10.368 1.00 12.23 H new ATOM 0 HE1 HIS A 54 6.011 -4.098 -7.234 1.00 1.32 H new ATOM 0 HE2 HIS A 54 4.629 -3.307 -9.211 1.00 73.14 H new ATOM 825 N ARG A 55 5.888 2.047 -8.497 1.00 50.11 N ATOM 826 CA ARG A 55 4.835 2.885 -9.083 1.00 33.31 C ATOM 827 C ARG A 55 4.427 3.966 -8.071 1.00 24.22 C ATOM 828 O ARG A 55 3.699 3.688 -7.145 1.00 42.24 O ATOM 829 CB ARG A 55 3.601 2.035 -9.510 1.00 0.44 C ATOM 830 CG ARG A 55 2.495 2.869 -10.200 1.00 23.44 C ATOM 831 CD ARG A 55 1.252 2.055 -10.593 1.00 15.02 C ATOM 832 NE ARG A 55 0.289 2.892 -11.331 1.00 11.31 N ATOM 833 CZ ARG A 55 -0.911 3.294 -10.889 1.00 33.01 C ATOM 834 NH1 ARG A 55 -1.359 2.938 -9.693 1.00 44.31 N ATOM 835 NH2 ARG A 55 -1.664 4.049 -11.667 1.00 1.34 N ATOM 0 H ARG A 55 5.730 1.809 -7.518 1.00 50.11 H new ATOM 0 HA ARG A 55 5.226 3.359 -9.983 1.00 33.31 H new ATOM 0 HB2 ARG A 55 3.928 1.246 -10.188 1.00 0.44 H new ATOM 0 HB3 ARG A 55 3.183 1.546 -8.630 1.00 0.44 H new ATOM 0 HG2 ARG A 55 2.192 3.675 -9.532 1.00 23.44 H new ATOM 0 HG3 ARG A 55 2.910 3.334 -11.094 1.00 23.44 H new ATOM 0 HD2 ARG A 55 1.548 1.205 -11.208 1.00 15.02 H new ATOM 0 HD3 ARG A 55 0.778 1.651 -9.698 1.00 15.02 H new ATOM 0 HE ARG A 55 0.561 3.194 -12.266 1.00 11.31 H new ATOM 0 HH11 ARG A 55 -0.787 2.347 -9.089 1.00 44.31 H new ATOM 0 HH12 ARG A 55 -2.275 3.255 -9.376 1.00 44.31 H new ATOM 0 HH21 ARG A 55 -1.331 4.320 -12.592 1.00 1.34 H new ATOM 0 HH22 ARG A 55 -2.579 4.362 -11.343 1.00 1.34 H new ATOM 849 N ILE A 56 4.939 5.191 -8.224 1.00 23.43 N ATOM 850 CA ILE A 56 4.553 6.332 -7.368 1.00 43.21 C ATOM 851 C ILE A 56 4.214 7.545 -8.248 1.00 21.40 C ATOM 852 O ILE A 56 4.953 7.862 -9.185 1.00 53.43 O ATOM 853 CB ILE A 56 5.685 6.714 -6.342 1.00 24.42 C ATOM 854 CG1 ILE A 56 5.995 5.538 -5.351 1.00 20.05 C ATOM 855 CG2 ILE A 56 5.314 7.991 -5.570 1.00 41.11 C ATOM 856 CD1 ILE A 56 7.034 5.861 -4.281 1.00 41.14 C ATOM 0 H ILE A 56 5.629 5.425 -8.938 1.00 23.43 H new ATOM 0 HA ILE A 56 3.678 6.033 -6.791 1.00 43.21 H new ATOM 0 HB ILE A 56 6.592 6.906 -6.915 1.00 24.42 H new ATOM 0 HG12 ILE A 56 5.068 5.241 -4.860 1.00 20.05 H new ATOM 0 HG13 ILE A 56 6.341 4.679 -5.926 1.00 20.05 H new ATOM 0 HG21 ILE A 56 6.110 8.236 -4.867 1.00 41.11 H new ATOM 0 HG22 ILE A 56 5.183 8.815 -6.271 1.00 41.11 H new ATOM 0 HG23 ILE A 56 4.385 7.829 -5.023 1.00 41.11 H new ATOM 0 HD11 ILE A 56 7.183 4.990 -3.643 1.00 41.14 H new ATOM 0 HD12 ILE A 56 7.977 6.127 -4.758 1.00 41.14 H new ATOM 0 HD13 ILE A 56 6.685 6.698 -3.676 1.00 41.14 H new ATOM 868 N ILE A 57 3.085 8.211 -7.922 1.00 61.41 N ATOM 869 CA ILE A 57 2.600 9.421 -8.604 1.00 44.32 C ATOM 870 C ILE A 57 2.304 10.510 -7.537 1.00 60.22 C ATOM 871 O ILE A 57 1.391 10.331 -6.720 1.00 4.54 O ATOM 872 CB ILE A 57 1.316 9.109 -9.477 1.00 0.24 C ATOM 873 CG1 ILE A 57 1.647 7.985 -10.522 1.00 22.34 C ATOM 874 CG2 ILE A 57 0.782 10.395 -10.171 1.00 23.20 C ATOM 875 CD1 ILE A 57 0.513 7.548 -11.413 1.00 34.45 C ATOM 0 H ILE A 57 2.476 7.912 -7.161 1.00 61.41 H new ATOM 0 HA ILE A 57 3.367 9.784 -9.288 1.00 44.32 H new ATOM 0 HB ILE A 57 0.523 8.749 -8.822 1.00 0.24 H new ATOM 0 HG12 ILE A 57 2.463 8.335 -11.154 1.00 22.34 H new ATOM 0 HG13 ILE A 57 2.014 7.112 -9.981 1.00 22.34 H new ATOM 0 HG21 ILE A 57 -0.100 10.150 -10.763 1.00 23.20 H new ATOM 0 HG22 ILE A 57 0.517 11.133 -9.414 1.00 23.20 H new ATOM 0 HG23 ILE A 57 1.554 10.804 -10.822 1.00 23.20 H new ATOM 0 HD11 ILE A 57 0.862 6.769 -12.091 1.00 34.45 H new ATOM 0 HD12 ILE A 57 -0.301 7.158 -10.801 1.00 34.45 H new ATOM 0 HD13 ILE A 57 0.156 8.400 -11.992 1.00 34.45 H new ATOM 887 N PRO A 58 3.092 11.650 -7.520 1.00 72.21 N ATOM 888 CA PRO A 58 2.943 12.734 -6.512 1.00 73.02 C ATOM 889 C PRO A 58 1.586 13.446 -6.623 1.00 32.20 C ATOM 890 O PRO A 58 1.057 13.633 -7.734 1.00 55.54 O ATOM 891 CB PRO A 58 4.128 13.696 -6.819 1.00 41.42 C ATOM 892 CG PRO A 58 4.456 13.435 -8.258 1.00 23.44 C ATOM 893 CD PRO A 58 4.181 11.962 -8.478 1.00 14.35 C ATOM 0 HA PRO A 58 2.967 12.354 -5.491 1.00 73.02 H new ATOM 0 HB2 PRO A 58 3.847 14.737 -6.658 1.00 41.42 H new ATOM 0 HB3 PRO A 58 4.982 13.493 -6.173 1.00 41.42 H new ATOM 0 HG2 PRO A 58 3.844 14.051 -8.917 1.00 23.44 H new ATOM 0 HG3 PRO A 58 5.497 13.676 -8.473 1.00 23.44 H new ATOM 0 HD2 PRO A 58 3.877 11.762 -9.506 1.00 14.35 H new ATOM 0 HD3 PRO A 58 5.067 11.358 -8.285 1.00 14.35 H new ATOM 901 N GLY A 59 1.032 13.830 -5.460 1.00 13.00 N ATOM 902 CA GLY A 59 -0.285 14.460 -5.378 1.00 50.10 C ATOM 903 C GLY A 59 -1.417 13.472 -5.643 1.00 22.21 C ATOM 904 O GLY A 59 -2.497 13.862 -6.113 1.00 33.41 O ATOM 0 H GLY A 59 1.488 13.710 -4.556 1.00 13.00 H new ATOM 0 HA2 GLY A 59 -0.414 14.900 -4.389 1.00 50.10 H new ATOM 0 HA3 GLY A 59 -0.341 15.275 -6.099 1.00 50.10 H new ATOM 908 N PHE A 60 -1.159 12.185 -5.342 1.00 75.03 N ATOM 909 CA PHE A 60 -2.115 11.093 -5.560 1.00 12.50 C ATOM 910 C PHE A 60 -1.830 9.948 -4.566 1.00 54.45 C ATOM 911 O PHE A 60 -2.512 9.826 -3.536 1.00 44.00 O ATOM 912 CB PHE A 60 -2.068 10.598 -7.052 1.00 0.11 C ATOM 913 CG PHE A 60 -2.834 9.298 -7.330 1.00 35.33 C ATOM 914 CD1 PHE A 60 -4.179 9.176 -6.987 1.00 21.34 C ATOM 915 CD2 PHE A 60 -2.204 8.191 -7.904 1.00 74.40 C ATOM 916 CE1 PHE A 60 -4.865 7.996 -7.197 1.00 12.31 C ATOM 917 CE2 PHE A 60 -2.899 7.011 -8.121 1.00 45.13 C ATOM 918 CZ PHE A 60 -4.226 6.914 -7.761 1.00 51.04 C ATOM 0 H PHE A 60 -0.275 11.876 -4.938 1.00 75.03 H new ATOM 0 HA PHE A 60 -3.126 11.458 -5.378 1.00 12.50 H new ATOM 0 HB2 PHE A 60 -2.471 11.383 -7.692 1.00 0.11 H new ATOM 0 HB3 PHE A 60 -1.026 10.456 -7.339 1.00 0.11 H new ATOM 0 HD1 PHE A 60 -4.694 10.019 -6.549 1.00 21.34 H new ATOM 0 HD2 PHE A 60 -1.162 8.255 -8.182 1.00 74.40 H new ATOM 0 HE1 PHE A 60 -5.906 7.921 -6.918 1.00 12.31 H new ATOM 0 HE2 PHE A 60 -2.400 6.167 -8.573 1.00 45.13 H new ATOM 0 HZ PHE A 60 -4.764 5.991 -7.921 1.00 51.04 H new ATOM 928 N MET A 61 -0.781 9.150 -4.854 1.00 72.12 N ATOM 929 CA MET A 61 -0.580 7.834 -4.219 1.00 11.04 C ATOM 930 C MET A 61 0.836 7.276 -4.501 1.00 52.43 C ATOM 931 O MET A 61 1.343 7.372 -5.622 1.00 32.41 O ATOM 932 CB MET A 61 -1.688 6.858 -4.710 1.00 42.11 C ATOM 933 CG MET A 61 -1.537 5.400 -4.299 1.00 12.31 C ATOM 934 SD MET A 61 -0.234 4.528 -5.200 1.00 53.21 S ATOM 935 CE MET A 61 -0.840 4.521 -6.883 1.00 53.32 C ATOM 0 H MET A 61 -0.056 9.398 -5.527 1.00 72.12 H new ATOM 0 HA MET A 61 -0.657 7.945 -3.137 1.00 11.04 H new ATOM 0 HB2 MET A 61 -2.649 7.219 -4.342 1.00 42.11 H new ATOM 0 HB3 MET A 61 -1.726 6.904 -5.798 1.00 42.11 H new ATOM 0 HG2 MET A 61 -1.324 5.352 -3.231 1.00 12.31 H new ATOM 0 HG3 MET A 61 -2.485 4.886 -4.458 1.00 12.31 H new ATOM 0 HE1 MET A 61 -0.389 3.692 -7.429 1.00 53.32 H new ATOM 0 HE2 MET A 61 -1.924 4.406 -6.879 1.00 53.32 H new ATOM 0 HE3 MET A 61 -0.577 5.461 -7.368 1.00 53.32 H new ATOM 945 N CYS A 62 1.451 6.700 -3.450 1.00 31.34 N ATOM 946 CA CYS A 62 2.726 5.963 -3.522 1.00 35.12 C ATOM 947 C CYS A 62 2.466 4.440 -3.370 1.00 63.41 C ATOM 948 O CYS A 62 2.038 3.974 -2.305 1.00 14.23 O ATOM 949 CB CYS A 62 3.661 6.500 -2.414 1.00 14.04 C ATOM 950 SG CYS A 62 2.865 6.686 -0.811 1.00 22.43 S ATOM 0 H CYS A 62 1.066 6.735 -2.506 1.00 31.34 H new ATOM 0 HA CYS A 62 3.205 6.113 -4.490 1.00 35.12 H new ATOM 0 HB2 CYS A 62 4.510 5.824 -2.310 1.00 14.04 H new ATOM 0 HB3 CYS A 62 4.059 7.466 -2.725 1.00 14.04 H new ATOM 0 HG CYS A 62 2.547 7.933 -0.627 1.00 22.43 H new ATOM 956 N GLN A 63 2.726 3.675 -4.455 1.00 5.03 N ATOM 957 CA GLN A 63 2.433 2.220 -4.540 1.00 74.10 C ATOM 958 C GLN A 63 3.725 1.391 -4.490 1.00 24.12 C ATOM 959 O GLN A 63 4.627 1.556 -5.331 1.00 24.43 O ATOM 960 CB GLN A 63 1.637 1.894 -5.842 1.00 71.31 C ATOM 961 CG GLN A 63 1.369 0.397 -6.114 1.00 72.32 C ATOM 962 CD GLN A 63 0.496 0.154 -7.348 1.00 62.25 C ATOM 963 OE1 GLN A 63 -0.373 0.962 -7.693 1.00 71.43 O ATOM 964 NE2 GLN A 63 0.729 -0.949 -8.035 1.00 4.11 N ATOM 0 H GLN A 63 3.148 4.050 -5.304 1.00 5.03 H new ATOM 0 HA GLN A 63 1.821 1.954 -3.678 1.00 74.10 H new ATOM 0 HB2 GLN A 63 0.679 2.412 -5.798 1.00 71.31 H new ATOM 0 HB3 GLN A 63 2.183 2.305 -6.691 1.00 71.31 H new ATOM 0 HG2 GLN A 63 2.321 -0.118 -6.243 1.00 72.32 H new ATOM 0 HG3 GLN A 63 0.885 -0.043 -5.242 1.00 72.32 H new ATOM 0 HE21 GLN A 63 1.453 -1.598 -7.727 1.00 4.11 H new ATOM 0 HE22 GLN A 63 0.185 -1.152 -8.874 1.00 4.11 H new ATOM 973 N GLY A 64 3.784 0.505 -3.486 1.00 54.22 N ATOM 974 CA GLY A 64 4.842 -0.479 -3.345 1.00 42.42 C ATOM 975 C GLY A 64 4.435 -1.832 -3.891 1.00 73.31 C ATOM 976 O GLY A 64 3.266 -2.054 -4.226 1.00 14.41 O ATOM 0 H GLY A 64 3.085 0.459 -2.745 1.00 54.22 H new ATOM 0 HA2 GLY A 64 5.733 -0.131 -3.867 1.00 42.42 H new ATOM 0 HA3 GLY A 64 5.107 -0.578 -2.292 1.00 42.42 H new ATOM 980 N GLY A 65 5.404 -2.737 -3.974 1.00 74.22 N ATOM 981 CA GLY A 65 5.161 -4.088 -4.452 1.00 2.33 C ATOM 982 C GLY A 65 6.438 -4.895 -4.526 1.00 1.11 C ATOM 983 O GLY A 65 7.518 -4.392 -4.247 1.00 72.23 O ATOM 0 H GLY A 65 6.373 -2.554 -3.713 1.00 74.22 H new ATOM 0 HA2 GLY A 65 4.454 -4.587 -3.789 1.00 2.33 H new ATOM 0 HA3 GLY A 65 4.699 -4.047 -5.438 1.00 2.33 H new ATOM 987 N ASP A 66 6.302 -6.144 -4.942 1.00 31.44 N ATOM 988 CA ASP A 66 7.390 -7.136 -4.965 1.00 13.20 C ATOM 989 C ASP A 66 7.925 -7.317 -6.404 1.00 34.45 C ATOM 990 O ASP A 66 7.198 -7.094 -7.383 1.00 33.21 O ATOM 991 CB ASP A 66 6.829 -8.449 -4.354 1.00 53.23 C ATOM 992 CG ASP A 66 7.683 -9.715 -4.526 1.00 72.50 C ATOM 993 OD1 ASP A 66 8.910 -9.654 -4.319 1.00 63.35 O ATOM 994 OD2 ASP A 66 7.110 -10.789 -4.827 1.00 71.24 O ATOM 0 H ASP A 66 5.415 -6.515 -5.283 1.00 31.44 H new ATOM 0 HA ASP A 66 8.245 -6.809 -4.373 1.00 13.20 H new ATOM 0 HB2 ASP A 66 6.673 -8.287 -3.287 1.00 53.23 H new ATOM 0 HB3 ASP A 66 5.850 -8.637 -4.795 1.00 53.23 H new ATOM 999 N PHE A 67 9.213 -7.688 -6.494 1.00 4.24 N ATOM 1000 CA PHE A 67 9.945 -7.887 -7.762 1.00 12.11 C ATOM 1001 C PHE A 67 9.654 -9.290 -8.339 1.00 24.13 C ATOM 1002 O PHE A 67 9.669 -9.493 -9.565 1.00 0.25 O ATOM 1003 CB PHE A 67 11.466 -7.682 -7.502 1.00 2.23 C ATOM 1004 CG PHE A 67 12.351 -7.691 -8.749 1.00 10.12 C ATOM 1005 CD1 PHE A 67 12.335 -6.614 -9.638 1.00 72.34 C ATOM 1006 CD2 PHE A 67 13.207 -8.763 -9.029 1.00 55.32 C ATOM 1007 CE1 PHE A 67 13.138 -6.611 -10.764 1.00 54.42 C ATOM 1008 CE2 PHE A 67 14.007 -8.757 -10.155 1.00 11.32 C ATOM 1009 CZ PHE A 67 13.972 -7.681 -11.022 1.00 33.42 C ATOM 0 H PHE A 67 9.789 -7.862 -5.671 1.00 4.24 H new ATOM 0 HA PHE A 67 9.612 -7.159 -8.501 1.00 12.11 H new ATOM 0 HB2 PHE A 67 11.604 -6.732 -6.986 1.00 2.23 H new ATOM 0 HB3 PHE A 67 11.811 -8.465 -6.827 1.00 2.23 H new ATOM 0 HD1 PHE A 67 11.687 -5.772 -9.444 1.00 72.34 H new ATOM 0 HD2 PHE A 67 13.242 -9.606 -8.355 1.00 55.32 H new ATOM 0 HE1 PHE A 67 13.113 -5.771 -11.442 1.00 54.42 H new ATOM 0 HE2 PHE A 67 14.660 -9.593 -10.358 1.00 11.32 H new ATOM 0 HZ PHE A 67 14.598 -7.677 -11.902 1.00 33.42 H new ATOM 1019 N THR A 68 9.392 -10.253 -7.432 1.00 23.11 N ATOM 1020 CA THR A 68 9.031 -11.639 -7.791 1.00 52.51 C ATOM 1021 C THR A 68 7.568 -11.677 -8.299 1.00 2.34 C ATOM 1022 O THR A 68 6.724 -10.934 -7.787 1.00 61.43 O ATOM 1023 CB THR A 68 9.175 -12.590 -6.544 1.00 52.05 C ATOM 1024 OG1 THR A 68 10.407 -12.319 -5.861 1.00 22.01 O ATOM 1025 CG2 THR A 68 9.122 -14.080 -6.918 1.00 54.42 C ATOM 0 H THR A 68 9.425 -10.090 -6.426 1.00 23.11 H new ATOM 0 HA THR A 68 9.706 -11.983 -8.575 1.00 52.51 H new ATOM 0 HB THR A 68 8.324 -12.385 -5.895 1.00 52.05 H new ATOM 0 HG1 THR A 68 10.489 -12.913 -5.086 1.00 22.01 H new ATOM 0 HG21 THR A 68 9.226 -14.685 -6.017 1.00 54.42 H new ATOM 0 HG22 THR A 68 8.167 -14.302 -7.395 1.00 54.42 H new ATOM 0 HG23 THR A 68 9.934 -14.311 -7.607 1.00 54.42 H new ATOM 1033 N ARG A 69 7.298 -12.532 -9.316 1.00 63.51 N ATOM 1034 CA ARG A 69 5.938 -12.778 -9.876 1.00 4.01 C ATOM 1035 C ARG A 69 5.315 -11.489 -10.457 1.00 10.11 C ATOM 1036 O ARG A 69 4.086 -11.388 -10.576 1.00 73.15 O ATOM 1037 CB ARG A 69 5.016 -13.412 -8.783 1.00 65.42 C ATOM 1038 CG ARG A 69 5.588 -14.706 -8.164 1.00 54.24 C ATOM 1039 CD ARG A 69 4.728 -15.292 -7.033 1.00 72.22 C ATOM 1040 NE ARG A 69 5.407 -16.444 -6.397 1.00 21.51 N ATOM 1041 CZ ARG A 69 4.826 -17.594 -6.036 1.00 63.33 C ATOM 1042 NH1 ARG A 69 3.526 -17.791 -6.229 1.00 4.21 N ATOM 1043 NH2 ARG A 69 5.555 -18.546 -5.465 1.00 24.21 N ATOM 0 H ARG A 69 8.024 -13.079 -9.779 1.00 63.51 H new ATOM 0 HA ARG A 69 6.034 -13.481 -10.703 1.00 4.01 H new ATOM 0 HB2 ARG A 69 4.852 -12.682 -7.990 1.00 65.42 H new ATOM 0 HB3 ARG A 69 4.043 -13.629 -9.223 1.00 65.42 H new ATOM 0 HG2 ARG A 69 5.697 -15.455 -8.949 1.00 54.24 H new ATOM 0 HG3 ARG A 69 6.587 -14.501 -7.778 1.00 54.24 H new ATOM 0 HD2 ARG A 69 4.530 -14.524 -6.286 1.00 72.22 H new ATOM 0 HD3 ARG A 69 3.763 -15.607 -7.430 1.00 72.22 H new ATOM 0 HE ARG A 69 6.407 -16.353 -6.218 1.00 21.51 H new ATOM 0 HH11 ARG A 69 2.958 -17.060 -6.657 1.00 4.21 H new ATOM 0 HH12 ARG A 69 3.097 -18.673 -5.949 1.00 4.21 H new ATOM 0 HH21 ARG A 69 6.551 -18.398 -5.304 1.00 24.21 H new ATOM 0 HH22 ARG A 69 5.119 -19.425 -5.187 1.00 24.21 H new ATOM 1057 N HIS A 70 6.200 -10.555 -10.875 1.00 21.52 N ATOM 1058 CA HIS A 70 5.858 -9.154 -11.179 1.00 4.14 C ATOM 1059 C HIS A 70 4.794 -9.014 -12.285 1.00 15.14 C ATOM 1060 O HIS A 70 3.892 -8.168 -12.178 1.00 23.24 O ATOM 1061 CB HIS A 70 7.146 -8.381 -11.538 1.00 44.23 C ATOM 1062 CG HIS A 70 6.941 -6.910 -11.775 1.00 51.34 C ATOM 1063 ND1 HIS A 70 7.296 -6.279 -12.943 1.00 54.31 N ATOM 1064 CD2 HIS A 70 6.409 -5.946 -10.980 1.00 2.13 C ATOM 1065 CE1 HIS A 70 6.997 -5.003 -12.859 1.00 11.13 C ATOM 1066 NE2 HIS A 70 6.454 -4.772 -11.681 1.00 32.13 N ATOM 0 H HIS A 70 7.189 -10.762 -11.012 1.00 21.52 H new ATOM 0 HA HIS A 70 5.407 -8.722 -10.285 1.00 4.14 H new ATOM 0 HB2 HIS A 70 7.869 -8.510 -10.733 1.00 44.23 H new ATOM 0 HB3 HIS A 70 7.584 -8.824 -12.433 1.00 44.23 H new ATOM 0 HD2 HIS A 70 6.022 -6.081 -9.981 1.00 2.13 H new ATOM 0 HE1 HIS A 70 7.168 -4.265 -13.629 1.00 11.13 H new ATOM 0 HE2 HIS A 70 6.122 -3.867 -11.347 1.00 32.13 H new ATOM 1075 N ASN A 71 4.903 -9.848 -13.335 1.00 25.41 N ATOM 1076 CA ASN A 71 3.933 -9.865 -14.445 1.00 53.41 C ATOM 1077 C ASN A 71 2.569 -10.377 -13.945 1.00 1.24 C ATOM 1078 O ASN A 71 2.407 -11.569 -13.663 1.00 10.14 O ATOM 1079 CB ASN A 71 4.448 -10.730 -15.632 1.00 32.20 C ATOM 1080 CG ASN A 71 5.605 -10.070 -16.390 1.00 41.30 C ATOM 1081 OD1 ASN A 71 5.388 -9.317 -17.342 1.00 75.22 O ATOM 1082 ND2 ASN A 71 6.838 -10.338 -15.978 1.00 3.21 N ATOM 0 H ASN A 71 5.660 -10.524 -13.438 1.00 25.41 H new ATOM 0 HA ASN A 71 3.813 -8.845 -14.811 1.00 53.41 H new ATOM 0 HB2 ASN A 71 4.773 -11.700 -15.255 1.00 32.20 H new ATOM 0 HB3 ASN A 71 3.626 -10.916 -16.323 1.00 32.20 H new ATOM 0 HD21 ASN A 71 7.637 -9.917 -16.452 1.00 3.21 H new ATOM 0 HD22 ASN A 71 6.987 -10.965 -15.187 1.00 3.21 H new ATOM 1089 N GLY A 72 1.626 -9.436 -13.761 1.00 22.41 N ATOM 1090 CA GLY A 72 0.232 -9.751 -13.415 1.00 31.11 C ATOM 1091 C GLY A 72 -0.046 -9.846 -11.912 1.00 15.11 C ATOM 1092 O GLY A 72 -1.216 -9.949 -11.512 1.00 20.23 O ATOM 0 H GLY A 72 1.811 -8.437 -13.848 1.00 22.41 H new ATOM 0 HA2 GLY A 72 -0.416 -8.987 -13.843 1.00 31.11 H new ATOM 0 HA3 GLY A 72 -0.039 -10.698 -13.882 1.00 31.11 H new ATOM 1096 N THR A 73 1.007 -9.801 -11.072 1.00 41.12 N ATOM 1097 CA THR A 73 0.862 -9.909 -9.605 1.00 34.02 C ATOM 1098 C THR A 73 1.907 -9.003 -8.891 1.00 63.11 C ATOM 1099 O THR A 73 1.617 -7.825 -8.623 1.00 5.01 O ATOM 1100 CB THR A 73 0.967 -11.412 -9.135 1.00 74.50 C ATOM 1101 OG1 THR A 73 0.107 -12.236 -9.936 1.00 42.25 O ATOM 1102 CG2 THR A 73 0.575 -11.589 -7.660 1.00 33.45 C ATOM 0 H THR A 73 1.971 -9.690 -11.385 1.00 41.12 H new ATOM 0 HA THR A 73 -0.131 -9.556 -9.325 1.00 34.02 H new ATOM 0 HB THR A 73 2.009 -11.710 -9.253 1.00 74.50 H new ATOM 0 HG1 THR A 73 0.487 -13.137 -10.004 1.00 42.25 H new ATOM 0 HG21 THR A 73 0.663 -12.640 -7.384 1.00 33.45 H new ATOM 0 HG22 THR A 73 1.238 -10.992 -7.033 1.00 33.45 H new ATOM 0 HG23 THR A 73 -0.454 -11.261 -7.515 1.00 33.45 H new ATOM 1110 N GLY A 74 3.124 -9.550 -8.620 1.00 65.14 N ATOM 1111 CA GLY A 74 4.218 -8.790 -8.011 1.00 63.45 C ATOM 1112 C GLY A 74 3.933 -8.343 -6.586 1.00 13.12 C ATOM 1113 O GLY A 74 3.914 -7.146 -6.319 1.00 24.11 O ATOM 0 H GLY A 74 3.359 -10.522 -8.821 1.00 65.14 H new ATOM 0 HA2 GLY A 74 5.120 -9.401 -8.017 1.00 63.45 H new ATOM 0 HA3 GLY A 74 4.424 -7.912 -8.623 1.00 63.45 H new ATOM 1117 N GLY A 75 3.723 -9.300 -5.654 1.00 1.42 N ATOM 1118 CA GLY A 75 3.311 -8.961 -4.275 1.00 13.34 C ATOM 1119 C GLY A 75 1.999 -9.604 -3.911 1.00 43.33 C ATOM 1120 O GLY A 75 1.063 -8.922 -3.476 1.00 22.23 O ATOM 0 H GLY A 75 3.830 -10.299 -5.829 1.00 1.42 H new ATOM 0 HA2 GLY A 75 4.081 -9.285 -3.575 1.00 13.34 H new ATOM 0 HA3 GLY A 75 3.225 -7.879 -4.177 1.00 13.34 H new ATOM 1124 N LYS A 76 1.939 -10.926 -4.126 1.00 21.35 N ATOM 1125 CA LYS A 76 0.724 -11.733 -3.930 1.00 42.23 C ATOM 1126 C LYS A 76 0.218 -11.696 -2.468 1.00 24.23 C ATOM 1127 O LYS A 76 0.926 -11.262 -1.548 1.00 52.42 O ATOM 1128 CB LYS A 76 0.997 -13.201 -4.355 1.00 20.33 C ATOM 1129 CG LYS A 76 2.015 -13.940 -3.465 1.00 60.04 C ATOM 1130 CD LYS A 76 2.140 -15.437 -3.802 1.00 62.31 C ATOM 1131 CE LYS A 76 3.109 -16.167 -2.858 1.00 23.44 C ATOM 1132 NZ LYS A 76 3.138 -17.629 -3.109 1.00 73.14 N ATOM 0 H LYS A 76 2.740 -11.471 -4.444 1.00 21.35 H new ATOM 0 HA LYS A 76 -0.058 -11.300 -4.554 1.00 42.23 H new ATOM 0 HB2 LYS A 76 0.056 -13.751 -4.344 1.00 20.33 H new ATOM 0 HB3 LYS A 76 1.359 -13.208 -5.383 1.00 20.33 H new ATOM 0 HG2 LYS A 76 2.991 -13.467 -3.571 1.00 60.04 H new ATOM 0 HG3 LYS A 76 1.721 -13.832 -2.421 1.00 60.04 H new ATOM 0 HD2 LYS A 76 1.157 -15.904 -3.743 1.00 62.31 H new ATOM 0 HD3 LYS A 76 2.484 -15.548 -4.830 1.00 62.31 H new ATOM 0 HE2 LYS A 76 4.112 -15.758 -2.982 1.00 23.44 H new ATOM 0 HE3 LYS A 76 2.815 -15.983 -1.825 1.00 23.44 H new ATOM 0 HZ1 LYS A 76 2.929 -18.137 -2.226 1.00 73.14 H new ATOM 0 HZ2 LYS A 76 2.425 -17.872 -3.826 1.00 73.14 H new ATOM 0 HZ3 LYS A 76 4.081 -17.904 -3.451 1.00 73.14 H new ATOM 1146 N SER A 77 -0.996 -12.213 -2.278 1.00 62.10 N ATOM 1147 CA SER A 77 -1.681 -12.233 -0.984 1.00 53.54 C ATOM 1148 C SER A 77 -1.367 -13.537 -0.224 1.00 30.31 C ATOM 1149 O SER A 77 -0.673 -14.428 -0.734 1.00 31.23 O ATOM 1150 CB SER A 77 -3.205 -12.090 -1.231 1.00 53.43 C ATOM 1151 OG SER A 77 -3.716 -13.150 -2.025 1.00 0.43 O ATOM 0 H SER A 77 -1.540 -12.636 -3.030 1.00 62.10 H new ATOM 0 HA SER A 77 -1.332 -11.404 -0.368 1.00 53.54 H new ATOM 0 HB2 SER A 77 -3.727 -12.069 -0.274 1.00 53.43 H new ATOM 0 HB3 SER A 77 -3.405 -11.139 -1.724 1.00 53.43 H new ATOM 0 HG SER A 77 -2.978 -13.727 -2.315 1.00 0.43 H new ATOM 1157 N ILE A 78 -1.879 -13.633 1.017 1.00 74.41 N ATOM 1158 CA ILE A 78 -1.822 -14.865 1.816 1.00 13.11 C ATOM 1159 C ILE A 78 -2.838 -15.889 1.279 1.00 64.44 C ATOM 1160 O ILE A 78 -2.735 -17.089 1.541 1.00 62.54 O ATOM 1161 CB ILE A 78 -2.071 -14.598 3.347 1.00 75.45 C ATOM 1162 CG1 ILE A 78 -3.550 -14.195 3.653 1.00 62.33 C ATOM 1163 CG2 ILE A 78 -1.095 -13.524 3.879 1.00 65.21 C ATOM 1164 CD1 ILE A 78 -3.873 -14.050 5.137 1.00 1.50 C ATOM 0 H ILE A 78 -2.343 -12.858 1.491 1.00 74.41 H new ATOM 0 HA ILE A 78 -0.814 -15.268 1.722 1.00 13.11 H new ATOM 0 HB ILE A 78 -1.883 -15.538 3.866 1.00 75.45 H new ATOM 0 HG12 ILE A 78 -3.767 -13.251 3.153 1.00 62.33 H new ATOM 0 HG13 ILE A 78 -4.214 -14.944 3.221 1.00 62.33 H new ATOM 0 HG21 ILE A 78 -1.284 -13.354 4.939 1.00 65.21 H new ATOM 0 HG22 ILE A 78 -0.069 -13.866 3.743 1.00 65.21 H new ATOM 0 HG23 ILE A 78 -1.243 -12.594 3.330 1.00 65.21 H new ATOM 0 HD11 ILE A 78 -4.919 -13.769 5.256 1.00 1.50 H new ATOM 0 HD12 ILE A 78 -3.692 -14.998 5.643 1.00 1.50 H new ATOM 0 HD13 ILE A 78 -3.238 -13.279 5.574 1.00 1.50 H new ATOM 1176 N TYR A 79 -3.811 -15.372 0.504 1.00 31.21 N ATOM 1177 CA TYR A 79 -4.874 -16.152 -0.133 1.00 50.31 C ATOM 1178 C TYR A 79 -4.436 -16.639 -1.531 1.00 21.35 C ATOM 1179 O TYR A 79 -5.263 -17.135 -2.305 1.00 14.13 O ATOM 1180 CB TYR A 79 -6.147 -15.266 -0.221 1.00 20.21 C ATOM 1181 CG TYR A 79 -6.580 -14.684 1.137 1.00 50.13 C ATOM 1182 CD1 TYR A 79 -7.048 -15.519 2.154 1.00 54.11 C ATOM 1183 CD2 TYR A 79 -6.503 -13.310 1.411 1.00 45.11 C ATOM 1184 CE1 TYR A 79 -7.417 -15.012 3.384 1.00 32.50 C ATOM 1185 CE2 TYR A 79 -6.878 -12.802 2.641 1.00 71.32 C ATOM 1186 CZ TYR A 79 -7.331 -13.657 3.623 1.00 63.33 C ATOM 1187 OH TYR A 79 -7.691 -13.160 4.857 1.00 4.42 O ATOM 0 H TYR A 79 -3.875 -14.374 0.302 1.00 31.21 H new ATOM 0 HA TYR A 79 -5.088 -17.040 0.461 1.00 50.31 H new ATOM 0 HB2 TYR A 79 -5.964 -14.448 -0.917 1.00 20.21 H new ATOM 0 HB3 TYR A 79 -6.965 -15.857 -0.632 1.00 20.21 H new ATOM 0 HD1 TYR A 79 -7.123 -16.581 1.975 1.00 54.11 H new ATOM 0 HD2 TYR A 79 -6.144 -12.637 0.647 1.00 45.11 H new ATOM 0 HE1 TYR A 79 -7.773 -15.676 4.158 1.00 32.50 H new ATOM 0 HE2 TYR A 79 -6.816 -11.741 2.832 1.00 71.32 H new ATOM 0 HH TYR A 79 -7.618 -12.183 4.850 1.00 4.42 H new ATOM 1197 N GLY A 80 -3.128 -16.496 -1.838 1.00 43.25 N ATOM 1198 CA GLY A 80 -2.554 -16.902 -3.118 1.00 22.15 C ATOM 1199 C GLY A 80 -2.163 -15.692 -3.941 1.00 72.25 C ATOM 1200 O GLY A 80 -1.570 -14.763 -3.404 1.00 72.41 O ATOM 0 H GLY A 80 -2.447 -16.093 -1.195 1.00 43.25 H new ATOM 0 HA2 GLY A 80 -1.679 -17.529 -2.947 1.00 22.15 H new ATOM 0 HA3 GLY A 80 -3.275 -17.505 -3.670 1.00 22.15 H new ATOM 1204 N GLU A 81 -2.527 -15.697 -5.230 1.00 64.30 N ATOM 1205 CA GLU A 81 -2.216 -14.607 -6.178 1.00 1.04 C ATOM 1206 C GLU A 81 -2.935 -13.303 -5.780 1.00 0.20 C ATOM 1207 O GLU A 81 -2.344 -12.218 -5.804 1.00 0.20 O ATOM 1208 CB GLU A 81 -2.640 -15.048 -7.612 1.00 24.43 C ATOM 1209 CG GLU A 81 -2.386 -14.018 -8.733 1.00 55.20 C ATOM 1210 CD GLU A 81 -2.795 -14.535 -10.125 1.00 65.03 C ATOM 1211 OE1 GLU A 81 -2.052 -15.356 -10.706 1.00 32.25 O ATOM 1212 OE2 GLU A 81 -3.874 -14.162 -10.628 1.00 31.44 O ATOM 0 H GLU A 81 -3.051 -16.463 -5.653 1.00 64.30 H new ATOM 0 HA GLU A 81 -1.144 -14.410 -6.155 1.00 1.04 H new ATOM 0 HB2 GLU A 81 -2.109 -15.967 -7.861 1.00 24.43 H new ATOM 0 HB3 GLU A 81 -3.703 -15.288 -7.599 1.00 24.43 H new ATOM 0 HG2 GLU A 81 -2.939 -13.105 -8.513 1.00 55.20 H new ATOM 0 HG3 GLU A 81 -1.328 -13.755 -8.745 1.00 55.20 H new ATOM 1219 N LYS A 82 -4.201 -13.457 -5.359 1.00 13.03 N ATOM 1220 CA LYS A 82 -5.164 -12.353 -5.218 1.00 61.21 C ATOM 1221 C LYS A 82 -6.422 -12.847 -4.469 1.00 54.02 C ATOM 1222 O LYS A 82 -6.513 -14.024 -4.097 1.00 75.25 O ATOM 1223 CB LYS A 82 -5.537 -11.838 -6.639 1.00 51.15 C ATOM 1224 CG LYS A 82 -6.167 -12.926 -7.547 1.00 14.12 C ATOM 1225 CD LYS A 82 -6.337 -12.481 -9.013 1.00 53.23 C ATOM 1226 CE LYS A 82 -7.067 -13.529 -9.861 1.00 12.23 C ATOM 1227 NZ LYS A 82 -8.448 -13.785 -9.371 1.00 64.44 N ATOM 0 H LYS A 82 -4.590 -14.365 -5.103 1.00 13.03 H new ATOM 0 HA LYS A 82 -4.724 -11.539 -4.641 1.00 61.21 H new ATOM 0 HB2 LYS A 82 -6.236 -11.007 -6.544 1.00 51.15 H new ATOM 0 HB3 LYS A 82 -4.641 -11.448 -7.122 1.00 51.15 H new ATOM 0 HG2 LYS A 82 -5.543 -13.819 -7.517 1.00 14.12 H new ATOM 0 HG3 LYS A 82 -7.141 -13.204 -7.145 1.00 14.12 H new ATOM 0 HD2 LYS A 82 -6.891 -11.543 -9.043 1.00 53.23 H new ATOM 0 HD3 LYS A 82 -5.356 -12.286 -9.447 1.00 53.23 H new ATOM 0 HE2 LYS A 82 -7.107 -13.192 -10.897 1.00 12.23 H new ATOM 0 HE3 LYS A 82 -6.501 -14.461 -9.851 1.00 12.23 H new ATOM 0 HZ1 LYS A 82 -9.114 -13.739 -10.169 1.00 64.44 H new ATOM 0 HZ2 LYS A 82 -8.493 -14.729 -8.937 1.00 64.44 H new ATOM 0 HZ3 LYS A 82 -8.704 -13.066 -8.664 1.00 64.44 H new ATOM 1241 N PHE A 83 -7.376 -11.931 -4.238 1.00 74.11 N ATOM 1242 CA PHE A 83 -8.688 -12.254 -3.646 1.00 13.41 C ATOM 1243 C PHE A 83 -9.717 -11.162 -4.004 1.00 71.20 C ATOM 1244 O PHE A 83 -9.370 -10.129 -4.598 1.00 33.22 O ATOM 1245 CB PHE A 83 -8.582 -12.471 -2.099 1.00 10.25 C ATOM 1246 CG PHE A 83 -8.082 -11.269 -1.293 1.00 52.54 C ATOM 1247 CD1 PHE A 83 -6.733 -10.938 -1.278 1.00 12.31 C ATOM 1248 CD2 PHE A 83 -8.956 -10.480 -0.543 1.00 61.43 C ATOM 1249 CE1 PHE A 83 -6.277 -9.863 -0.553 1.00 73.35 C ATOM 1250 CE2 PHE A 83 -8.494 -9.401 0.184 1.00 70.35 C ATOM 1251 CZ PHE A 83 -7.151 -9.094 0.177 1.00 54.42 C ATOM 0 H PHE A 83 -7.260 -10.941 -4.457 1.00 74.11 H new ATOM 0 HA PHE A 83 -9.035 -13.196 -4.070 1.00 13.41 H new ATOM 0 HB2 PHE A 83 -9.565 -12.754 -1.722 1.00 10.25 H new ATOM 0 HB3 PHE A 83 -7.915 -13.313 -1.914 1.00 10.25 H new ATOM 0 HD1 PHE A 83 -6.032 -11.534 -1.844 1.00 12.31 H new ATOM 0 HD2 PHE A 83 -10.010 -10.717 -0.531 1.00 61.43 H new ATOM 0 HE1 PHE A 83 -5.224 -9.621 -0.557 1.00 73.35 H new ATOM 0 HE2 PHE A 83 -9.184 -8.799 0.757 1.00 70.35 H new ATOM 0 HZ PHE A 83 -6.786 -8.251 0.744 1.00 54.42 H new ATOM 1261 N GLU A 84 -10.990 -11.418 -3.674 1.00 22.34 N ATOM 1262 CA GLU A 84 -12.085 -10.446 -3.862 1.00 10.32 C ATOM 1263 C GLU A 84 -12.303 -9.648 -2.565 1.00 72.02 C ATOM 1264 O GLU A 84 -11.873 -10.068 -1.483 1.00 72.54 O ATOM 1265 CB GLU A 84 -13.381 -11.172 -4.308 1.00 2.00 C ATOM 1266 CG GLU A 84 -13.877 -12.232 -3.314 1.00 15.05 C ATOM 1267 CD GLU A 84 -15.155 -12.946 -3.766 1.00 73.14 C ATOM 1268 OE1 GLU A 84 -15.064 -13.937 -4.527 1.00 74.53 O ATOM 1269 OE2 GLU A 84 -16.260 -12.511 -3.382 1.00 14.04 O ATOM 0 H GLU A 84 -11.294 -12.303 -3.269 1.00 22.34 H new ATOM 0 HA GLU A 84 -11.813 -9.744 -4.650 1.00 10.32 H new ATOM 0 HB2 GLU A 84 -14.167 -10.432 -4.456 1.00 2.00 H new ATOM 0 HB3 GLU A 84 -13.205 -11.648 -5.273 1.00 2.00 H new ATOM 0 HG2 GLU A 84 -13.091 -12.972 -3.163 1.00 15.05 H new ATOM 0 HG3 GLU A 84 -14.058 -11.757 -2.350 1.00 15.05 H new ATOM 1276 N ASP A 85 -12.997 -8.510 -2.692 1.00 13.44 N ATOM 1277 CA ASP A 85 -13.172 -7.528 -1.605 1.00 44.21 C ATOM 1278 C ASP A 85 -14.047 -8.057 -0.474 1.00 64.42 C ATOM 1279 O ASP A 85 -14.968 -8.850 -0.708 1.00 42.03 O ATOM 1280 CB ASP A 85 -13.777 -6.219 -2.163 1.00 74.54 C ATOM 1281 CG ASP A 85 -12.847 -5.551 -3.172 1.00 45.12 C ATOM 1282 OD1 ASP A 85 -11.694 -5.270 -2.803 1.00 34.12 O ATOM 1283 OD2 ASP A 85 -13.261 -5.305 -4.331 1.00 32.05 O ATOM 0 H ASP A 85 -13.459 -8.239 -3.560 1.00 13.44 H new ATOM 0 HA ASP A 85 -12.183 -7.334 -1.189 1.00 44.21 H new ATOM 0 HB2 ASP A 85 -14.734 -6.434 -2.638 1.00 74.54 H new ATOM 0 HB3 ASP A 85 -13.976 -5.531 -1.341 1.00 74.54 H new ATOM 1288 N GLU A 86 -13.746 -7.596 0.754 1.00 61.44 N ATOM 1289 CA GLU A 86 -14.500 -7.987 1.954 1.00 24.55 C ATOM 1290 C GLU A 86 -15.874 -7.283 1.970 1.00 60.42 C ATOM 1291 O GLU A 86 -16.915 -7.945 1.860 1.00 74.11 O ATOM 1292 CB GLU A 86 -13.694 -7.624 3.234 1.00 65.33 C ATOM 1293 CG GLU A 86 -14.394 -7.973 4.578 1.00 23.33 C ATOM 1294 CD GLU A 86 -14.357 -9.468 4.936 1.00 11.53 C ATOM 1295 OE1 GLU A 86 -15.036 -10.281 4.268 1.00 45.10 O ATOM 1296 OE2 GLU A 86 -13.638 -9.840 5.890 1.00 65.31 O ATOM 0 H GLU A 86 -12.980 -6.948 0.939 1.00 61.44 H new ATOM 0 HA GLU A 86 -14.659 -9.065 1.935 1.00 24.55 H new ATOM 0 HB2 GLU A 86 -12.734 -8.139 3.198 1.00 65.33 H new ATOM 0 HB3 GLU A 86 -13.482 -6.555 3.220 1.00 65.33 H new ATOM 0 HG2 GLU A 86 -13.920 -7.407 5.380 1.00 23.33 H new ATOM 0 HG3 GLU A 86 -15.433 -7.648 4.529 1.00 23.33 H new ATOM 1303 N ASN A 87 -15.841 -5.935 2.041 1.00 35.23 N ATOM 1304 CA ASN A 87 -17.044 -5.072 2.121 1.00 32.12 C ATOM 1305 C ASN A 87 -16.627 -3.587 2.063 1.00 13.32 C ATOM 1306 O ASN A 87 -15.537 -3.222 2.522 1.00 54.32 O ATOM 1307 CB ASN A 87 -17.897 -5.371 3.401 1.00 23.13 C ATOM 1308 CG ASN A 87 -17.122 -5.330 4.732 1.00 60.43 C ATOM 1309 OD1 ASN A 87 -16.149 -4.603 4.889 1.00 51.12 O ATOM 1310 ND2 ASN A 87 -17.549 -6.129 5.705 1.00 24.20 N ATOM 0 H ASN A 87 -14.968 -5.407 2.045 1.00 35.23 H new ATOM 0 HA ASN A 87 -17.679 -5.296 1.264 1.00 32.12 H new ATOM 0 HB2 ASN A 87 -18.712 -4.649 3.451 1.00 23.13 H new ATOM 0 HB3 ASN A 87 -18.350 -6.356 3.294 1.00 23.13 H new ATOM 0 HD21 ASN A 87 -17.064 -6.144 6.602 1.00 24.20 H new ATOM 0 HD22 ASN A 87 -18.361 -6.727 5.554 1.00 24.20 H new ATOM 1317 N PHE A 88 -17.516 -2.728 1.524 1.00 63.22 N ATOM 1318 CA PHE A 88 -17.211 -1.309 1.219 1.00 25.51 C ATOM 1319 C PHE A 88 -17.533 -0.398 2.423 1.00 10.42 C ATOM 1320 O PHE A 88 -18.342 0.535 2.331 1.00 41.11 O ATOM 1321 CB PHE A 88 -18.009 -0.855 -0.042 1.00 21.01 C ATOM 1322 CG PHE A 88 -17.682 -1.637 -1.315 1.00 45.14 C ATOM 1323 CD1 PHE A 88 -18.358 -2.819 -1.633 1.00 20.52 C ATOM 1324 CD2 PHE A 88 -16.700 -1.187 -2.197 1.00 44.03 C ATOM 1325 CE1 PHE A 88 -18.061 -3.520 -2.787 1.00 30.21 C ATOM 1326 CE2 PHE A 88 -16.407 -1.894 -3.351 1.00 13.15 C ATOM 1327 CZ PHE A 88 -17.085 -3.056 -3.643 1.00 3.04 C ATOM 0 H PHE A 88 -18.471 -2.997 1.286 1.00 63.22 H new ATOM 0 HA PHE A 88 -16.144 -1.222 1.015 1.00 25.51 H new ATOM 0 HB2 PHE A 88 -19.075 -0.951 0.164 1.00 21.01 H new ATOM 0 HB3 PHE A 88 -17.812 0.202 -0.220 1.00 21.01 H new ATOM 0 HD1 PHE A 88 -19.123 -3.190 -0.967 1.00 20.52 H new ATOM 0 HD2 PHE A 88 -16.162 -0.277 -1.978 1.00 44.03 H new ATOM 0 HE1 PHE A 88 -18.593 -4.431 -3.018 1.00 30.21 H new ATOM 0 HE2 PHE A 88 -15.644 -1.533 -4.024 1.00 13.15 H new ATOM 0 HZ PHE A 88 -16.852 -3.605 -4.544 1.00 3.04 H new ATOM 1337 N ILE A 89 -16.904 -0.700 3.562 1.00 43.42 N ATOM 1338 CA ILE A 89 -17.012 0.116 4.785 1.00 54.04 C ATOM 1339 C ILE A 89 -16.035 1.302 4.696 1.00 54.40 C ATOM 1340 O ILE A 89 -16.430 2.468 4.825 1.00 20.34 O ATOM 1341 CB ILE A 89 -16.719 -0.749 6.070 1.00 42.13 C ATOM 1342 CG1 ILE A 89 -17.762 -1.908 6.185 1.00 24.52 C ATOM 1343 CG2 ILE A 89 -16.695 0.120 7.357 1.00 4.42 C ATOM 1344 CD1 ILE A 89 -17.553 -2.844 7.363 1.00 3.14 C ATOM 0 H ILE A 89 -16.303 -1.518 3.667 1.00 43.42 H new ATOM 0 HA ILE A 89 -18.031 0.494 4.867 1.00 54.04 H new ATOM 0 HB ILE A 89 -15.725 -1.184 5.967 1.00 42.13 H new ATOM 0 HG12 ILE A 89 -18.759 -1.474 6.258 1.00 24.52 H new ATOM 0 HG13 ILE A 89 -17.735 -2.493 5.266 1.00 24.52 H new ATOM 0 HG21 ILE A 89 -16.490 -0.514 8.220 1.00 4.42 H new ATOM 0 HG22 ILE A 89 -15.916 0.878 7.270 1.00 4.42 H new ATOM 0 HG23 ILE A 89 -17.662 0.607 7.486 1.00 4.42 H new ATOM 0 HD11 ILE A 89 -18.325 -3.614 7.358 1.00 3.14 H new ATOM 0 HD12 ILE A 89 -16.572 -3.313 7.285 1.00 3.14 H new ATOM 0 HD13 ILE A 89 -17.612 -2.278 8.293 1.00 3.14 H new ATOM 1356 N LEU A 90 -14.758 0.973 4.441 1.00 33.53 N ATOM 1357 CA LEU A 90 -13.672 1.951 4.352 1.00 13.21 C ATOM 1358 C LEU A 90 -13.605 2.569 2.942 1.00 2.34 C ATOM 1359 O LEU A 90 -13.249 1.897 1.967 1.00 12.01 O ATOM 1360 CB LEU A 90 -12.332 1.276 4.734 1.00 52.34 C ATOM 1361 CG LEU A 90 -12.161 0.902 6.234 1.00 72.41 C ATOM 1362 CD1 LEU A 90 -10.873 0.086 6.458 1.00 63.25 C ATOM 1363 CD2 LEU A 90 -12.188 2.172 7.120 1.00 33.42 C ATOM 0 H LEU A 90 -14.452 0.012 4.290 1.00 33.53 H new ATOM 0 HA LEU A 90 -13.865 2.763 5.053 1.00 13.21 H new ATOM 0 HB2 LEU A 90 -12.222 0.369 4.139 1.00 52.34 H new ATOM 0 HB3 LEU A 90 -11.518 1.944 4.451 1.00 52.34 H new ATOM 0 HG LEU A 90 -13.001 0.272 6.527 1.00 72.41 H new ATOM 0 HD11 LEU A 90 -10.779 -0.162 7.515 1.00 63.25 H new ATOM 0 HD12 LEU A 90 -10.918 -0.832 5.873 1.00 63.25 H new ATOM 0 HD13 LEU A 90 -10.010 0.674 6.145 1.00 63.25 H new ATOM 0 HD21 LEU A 90 -12.067 1.889 8.166 1.00 33.42 H new ATOM 0 HD22 LEU A 90 -11.375 2.837 6.828 1.00 33.42 H new ATOM 0 HD23 LEU A 90 -13.141 2.685 6.991 1.00 33.42 H new ATOM 1375 N LYS A 91 -13.974 3.852 2.864 1.00 21.40 N ATOM 1376 CA LYS A 91 -13.899 4.666 1.639 1.00 64.54 C ATOM 1377 C LYS A 91 -12.675 5.594 1.702 1.00 4.01 C ATOM 1378 O LYS A 91 -12.017 5.705 2.741 1.00 21.23 O ATOM 1379 CB LYS A 91 -15.211 5.475 1.435 1.00 45.23 C ATOM 1380 CG LYS A 91 -15.566 6.445 2.582 1.00 3.12 C ATOM 1381 CD LYS A 91 -16.875 7.233 2.331 1.00 53.13 C ATOM 1382 CE LYS A 91 -18.097 6.316 2.137 1.00 43.22 C ATOM 1383 NZ LYS A 91 -19.361 7.083 2.007 1.00 42.30 N ATOM 0 H LYS A 91 -14.341 4.367 3.665 1.00 21.40 H new ATOM 0 HA LYS A 91 -13.785 4.004 0.780 1.00 64.54 H new ATOM 0 HB2 LYS A 91 -15.128 6.045 0.510 1.00 45.23 H new ATOM 0 HB3 LYS A 91 -16.035 4.774 1.304 1.00 45.23 H new ATOM 0 HG2 LYS A 91 -15.661 5.881 3.510 1.00 3.12 H new ATOM 0 HG3 LYS A 91 -14.746 7.150 2.720 1.00 3.12 H new ATOM 0 HD2 LYS A 91 -17.058 7.901 3.172 1.00 53.13 H new ATOM 0 HD3 LYS A 91 -16.753 7.859 1.447 1.00 53.13 H new ATOM 0 HE2 LYS A 91 -17.952 5.705 1.246 1.00 43.22 H new ATOM 0 HE3 LYS A 91 -18.174 5.633 2.983 1.00 43.22 H new ATOM 0 HZ1 LYS A 91 -20.155 6.424 1.878 1.00 42.30 H new ATOM 0 HZ2 LYS A 91 -19.515 7.647 2.867 1.00 42.30 H new ATOM 0 HZ3 LYS A 91 -19.300 7.716 1.184 1.00 42.30 H new ATOM 1397 N HIS A 92 -12.382 6.259 0.581 1.00 2.41 N ATOM 1398 CA HIS A 92 -11.192 7.113 0.409 1.00 42.13 C ATOM 1399 C HIS A 92 -11.510 8.570 0.836 1.00 53.21 C ATOM 1400 O HIS A 92 -11.200 9.530 0.119 1.00 25.10 O ATOM 1401 CB HIS A 92 -10.738 7.041 -1.075 1.00 73.31 C ATOM 1402 CG HIS A 92 -10.440 5.650 -1.584 1.00 31.31 C ATOM 1403 ND1 HIS A 92 -11.425 4.702 -1.805 1.00 53.22 N ATOM 1404 CD2 HIS A 92 -9.268 5.038 -1.888 1.00 63.35 C ATOM 1405 CE1 HIS A 92 -10.871 3.581 -2.221 1.00 75.44 C ATOM 1406 NE2 HIS A 92 -9.565 3.758 -2.286 1.00 62.04 N ATOM 0 H HIS A 92 -12.972 6.222 -0.250 1.00 2.41 H new ATOM 0 HA HIS A 92 -10.380 6.759 1.044 1.00 42.13 H new ATOM 0 HB2 HIS A 92 -11.516 7.481 -1.699 1.00 73.31 H new ATOM 0 HB3 HIS A 92 -9.846 7.655 -1.197 1.00 73.31 H new ATOM 0 HD1 HIS A 92 -12.425 4.849 -1.667 1.00 53.22 H new ATOM 0 HD2 HIS A 92 -8.283 5.477 -1.828 1.00 63.35 H new ATOM 0 HE1 HIS A 92 -11.397 2.671 -2.467 1.00 75.44 H new ATOM 1415 N THR A 93 -12.125 8.719 2.025 1.00 21.13 N ATOM 1416 CA THR A 93 -12.516 10.034 2.583 1.00 14.24 C ATOM 1417 C THR A 93 -11.402 10.610 3.480 1.00 33.10 C ATOM 1418 O THR A 93 -11.414 11.805 3.798 1.00 60.13 O ATOM 1419 CB THR A 93 -13.864 9.937 3.387 1.00 61.33 C ATOM 1420 OG1 THR A 93 -14.300 11.245 3.823 1.00 71.23 O ATOM 1421 CG2 THR A 93 -13.752 9.001 4.603 1.00 2.21 C ATOM 0 H THR A 93 -12.366 7.933 2.628 1.00 21.13 H new ATOM 0 HA THR A 93 -12.668 10.710 1.742 1.00 14.24 H new ATOM 0 HB THR A 93 -14.603 9.516 2.705 1.00 61.33 H new ATOM 0 HG1 THR A 93 -13.526 11.843 3.889 1.00 71.23 H new ATOM 0 HG21 THR A 93 -14.708 8.967 5.126 1.00 2.21 H new ATOM 0 HG22 THR A 93 -13.486 7.999 4.267 1.00 2.21 H new ATOM 0 HG23 THR A 93 -12.982 9.373 5.279 1.00 2.21 H new ATOM 1429 N GLY A 94 -10.456 9.749 3.890 1.00 45.42 N ATOM 1430 CA GLY A 94 -9.322 10.156 4.717 1.00 41.13 C ATOM 1431 C GLY A 94 -8.023 10.236 3.918 1.00 10.22 C ATOM 1432 O GLY A 94 -7.928 9.631 2.847 1.00 64.32 O ATOM 0 H GLY A 94 -10.461 8.756 3.655 1.00 45.42 H new ATOM 0 HA2 GLY A 94 -9.531 11.128 5.165 1.00 41.13 H new ATOM 0 HA3 GLY A 94 -9.199 9.447 5.536 1.00 41.13 H new ATOM 1436 N PRO A 95 -7.014 11.021 4.390 1.00 54.44 N ATOM 1437 CA PRO A 95 -5.650 10.988 3.822 1.00 13.13 C ATOM 1438 C PRO A 95 -4.835 9.798 4.379 1.00 24.22 C ATOM 1439 O PRO A 95 -5.070 9.354 5.510 1.00 31.22 O ATOM 1440 CB PRO A 95 -5.069 12.351 4.271 1.00 12.20 C ATOM 1441 CG PRO A 95 -5.767 12.678 5.563 1.00 64.01 C ATOM 1442 CD PRO A 95 -7.140 12.028 5.484 1.00 13.31 C ATOM 0 HA PRO A 95 -5.629 10.849 2.741 1.00 13.13 H new ATOM 0 HB2 PRO A 95 -3.990 12.291 4.412 1.00 12.20 H new ATOM 0 HB3 PRO A 95 -5.250 13.121 3.521 1.00 12.20 H new ATOM 0 HG2 PRO A 95 -5.205 12.297 6.416 1.00 64.01 H new ATOM 0 HG3 PRO A 95 -5.855 13.756 5.695 1.00 64.01 H new ATOM 0 HD2 PRO A 95 -7.411 11.556 6.429 1.00 13.31 H new ATOM 0 HD3 PRO A 95 -7.914 12.762 5.261 1.00 13.31 H new ATOM 1450 N GLY A 96 -3.886 9.286 3.577 1.00 63.34 N ATOM 1451 CA GLY A 96 -3.000 8.198 4.011 1.00 41.31 C ATOM 1452 C GLY A 96 -3.596 6.802 3.840 1.00 4.34 C ATOM 1453 O GLY A 96 -3.175 5.859 4.525 1.00 25.34 O ATOM 0 H GLY A 96 -3.715 9.610 2.625 1.00 63.34 H new ATOM 0 HA2 GLY A 96 -2.069 8.255 3.447 1.00 41.31 H new ATOM 0 HA3 GLY A 96 -2.747 8.347 5.061 1.00 41.31 H new ATOM 1457 N ILE A 97 -4.572 6.688 2.927 1.00 11.13 N ATOM 1458 CA ILE A 97 -5.354 5.460 2.685 1.00 24.44 C ATOM 1459 C ILE A 97 -4.467 4.294 2.184 1.00 13.25 C ATOM 1460 O ILE A 97 -3.889 4.365 1.103 1.00 24.24 O ATOM 1461 CB ILE A 97 -6.511 5.773 1.639 1.00 71.32 C ATOM 1462 CG1 ILE A 97 -7.673 6.569 2.312 1.00 72.31 C ATOM 1463 CG2 ILE A 97 -7.050 4.512 0.921 1.00 12.02 C ATOM 1464 CD1 ILE A 97 -8.393 5.833 3.434 1.00 75.22 C ATOM 0 H ILE A 97 -4.848 7.462 2.322 1.00 11.13 H new ATOM 0 HA ILE A 97 -5.789 5.140 3.632 1.00 24.44 H new ATOM 0 HB ILE A 97 -6.059 6.394 0.866 1.00 71.32 H new ATOM 0 HG12 ILE A 97 -7.272 7.502 2.709 1.00 72.31 H new ATOM 0 HG13 ILE A 97 -8.402 6.835 1.546 1.00 72.31 H new ATOM 0 HG21 ILE A 97 -7.836 4.799 0.223 1.00 12.02 H new ATOM 0 HG22 ILE A 97 -6.239 4.029 0.376 1.00 12.02 H new ATOM 0 HG23 ILE A 97 -7.455 3.819 1.658 1.00 12.02 H new ATOM 0 HD11 ILE A 97 -9.182 6.467 3.837 1.00 75.22 H new ATOM 0 HD12 ILE A 97 -8.830 4.914 3.044 1.00 75.22 H new ATOM 0 HD13 ILE A 97 -7.683 5.591 4.225 1.00 75.22 H new ATOM 1476 N LEU A 98 -4.377 3.225 2.996 1.00 52.42 N ATOM 1477 CA LEU A 98 -3.654 1.995 2.634 1.00 63.45 C ATOM 1478 C LEU A 98 -4.652 0.936 2.102 1.00 44.41 C ATOM 1479 O LEU A 98 -5.529 0.432 2.835 1.00 34.40 O ATOM 1480 CB LEU A 98 -2.851 1.445 3.842 1.00 12.01 C ATOM 1481 CG LEU A 98 -1.989 0.169 3.558 1.00 71.14 C ATOM 1482 CD1 LEU A 98 -0.891 0.427 2.503 1.00 43.34 C ATOM 1483 CD2 LEU A 98 -1.401 -0.414 4.857 1.00 11.43 C ATOM 0 H LEU A 98 -4.804 3.191 3.922 1.00 52.42 H new ATOM 0 HA LEU A 98 -2.939 2.229 1.845 1.00 63.45 H new ATOM 0 HB2 LEU A 98 -2.192 2.233 4.206 1.00 12.01 H new ATOM 0 HB3 LEU A 98 -3.550 1.217 4.647 1.00 12.01 H new ATOM 0 HG LEU A 98 -2.660 -0.578 3.135 1.00 71.14 H new ATOM 0 HD11 LEU A 98 -0.320 -0.487 2.341 1.00 43.34 H new ATOM 0 HD12 LEU A 98 -1.353 0.738 1.566 1.00 43.34 H new ATOM 0 HD13 LEU A 98 -0.224 1.213 2.857 1.00 43.34 H new ATOM 0 HD21 LEU A 98 -0.808 -1.299 4.623 1.00 11.43 H new ATOM 0 HD22 LEU A 98 -0.766 0.332 5.336 1.00 11.43 H new ATOM 0 HD23 LEU A 98 -2.211 -0.688 5.532 1.00 11.43 H new ATOM 1495 N SER A 99 -4.499 0.617 0.813 1.00 70.51 N ATOM 1496 CA SER A 99 -5.312 -0.374 0.092 1.00 50.13 C ATOM 1497 C SER A 99 -4.387 -1.123 -0.893 1.00 15.14 C ATOM 1498 O SER A 99 -3.477 -0.512 -1.443 1.00 2.45 O ATOM 1499 CB SER A 99 -6.474 0.339 -0.638 1.00 34.34 C ATOM 1500 OG SER A 99 -7.335 -0.587 -1.271 1.00 30.52 O ATOM 0 H SER A 99 -3.788 1.051 0.224 1.00 70.51 H new ATOM 0 HA SER A 99 -5.756 -1.095 0.779 1.00 50.13 H new ATOM 0 HB2 SER A 99 -7.042 0.936 0.076 1.00 34.34 H new ATOM 0 HB3 SER A 99 -6.071 1.028 -1.380 1.00 34.34 H new ATOM 0 HG SER A 99 -7.973 -0.941 -0.617 1.00 30.52 H new ATOM 1506 N MET A 100 -4.595 -2.444 -1.096 1.00 2.25 N ATOM 1507 CA MET A 100 -3.709 -3.273 -1.964 1.00 32.22 C ATOM 1508 C MET A 100 -4.125 -3.168 -3.436 1.00 14.33 C ATOM 1509 O MET A 100 -5.313 -3.154 -3.725 1.00 42.11 O ATOM 1510 CB MET A 100 -3.702 -4.754 -1.505 1.00 73.35 C ATOM 1511 CG MET A 100 -3.110 -4.958 -0.105 1.00 44.42 C ATOM 1512 SD MET A 100 -2.828 -6.686 0.323 1.00 44.41 S ATOM 1513 CE MET A 100 -1.398 -7.095 -0.676 1.00 23.51 C ATOM 0 H MET A 100 -5.365 -2.963 -0.674 1.00 2.25 H new ATOM 0 HA MET A 100 -2.696 -2.883 -1.867 1.00 32.22 H new ATOM 0 HB2 MET A 100 -4.723 -5.135 -1.518 1.00 73.35 H new ATOM 0 HB3 MET A 100 -3.132 -5.345 -2.222 1.00 73.35 H new ATOM 0 HG2 MET A 100 -2.165 -4.418 -0.038 1.00 44.42 H new ATOM 0 HG3 MET A 100 -3.782 -4.516 0.631 1.00 44.42 H new ATOM 0 HE1 MET A 100 -1.077 -8.113 -0.453 1.00 23.51 H new ATOM 0 HE2 MET A 100 -1.658 -7.020 -1.732 1.00 23.51 H new ATOM 0 HE3 MET A 100 -0.587 -6.402 -0.452 1.00 23.51 H new ATOM 1523 N ALA A 101 -3.142 -3.137 -4.362 1.00 11.22 N ATOM 1524 CA ALA A 101 -3.399 -2.854 -5.796 1.00 61.32 C ATOM 1525 C ALA A 101 -4.075 -4.046 -6.505 1.00 64.43 C ATOM 1526 O ALA A 101 -4.212 -5.142 -5.931 1.00 23.44 O ATOM 1527 CB ALA A 101 -2.096 -2.433 -6.504 1.00 13.44 C ATOM 0 H ALA A 101 -2.160 -3.305 -4.144 1.00 11.22 H new ATOM 0 HA ALA A 101 -4.100 -2.021 -5.853 1.00 61.32 H new ATOM 0 HB1 ALA A 101 -2.302 -2.229 -7.555 1.00 13.44 H new ATOM 0 HB2 ALA A 101 -1.699 -1.535 -6.031 1.00 13.44 H new ATOM 0 HB3 ALA A 101 -1.364 -3.237 -6.427 1.00 13.44 H new ATOM 1533 N ASN A 102 -4.505 -3.808 -7.756 1.00 52.41 N ATOM 1534 CA ASN A 102 -5.294 -4.776 -8.536 1.00 64.34 C ATOM 1535 C ASN A 102 -5.393 -4.354 -10.010 1.00 62.21 C ATOM 1536 O ASN A 102 -5.074 -3.216 -10.368 1.00 62.44 O ATOM 1537 CB ASN A 102 -6.728 -4.898 -7.943 1.00 42.33 C ATOM 1538 CG ASN A 102 -7.565 -3.616 -8.032 1.00 72.35 C ATOM 1539 OD1 ASN A 102 -7.046 -2.496 -8.017 1.00 22.25 O ATOM 1540 ND2 ASN A 102 -8.879 -3.771 -8.098 1.00 65.41 N ATOM 0 H ASN A 102 -4.315 -2.939 -8.255 1.00 52.41 H new ATOM 0 HA ASN A 102 -4.787 -5.739 -8.481 1.00 64.34 H new ATOM 0 HB2 ASN A 102 -7.255 -5.698 -8.463 1.00 42.33 H new ATOM 0 HB3 ASN A 102 -6.651 -5.194 -6.897 1.00 42.33 H new ATOM 0 HD21 ASN A 102 -9.488 -2.953 -8.138 1.00 65.41 H new ATOM 0 HD22 ASN A 102 -9.282 -4.708 -8.109 1.00 65.41 H new ATOM 1547 N ALA A 103 -5.856 -5.289 -10.849 1.00 61.53 N ATOM 1548 CA ALA A 103 -6.244 -5.027 -12.250 1.00 43.43 C ATOM 1549 C ALA A 103 -7.784 -5.038 -12.398 1.00 62.32 C ATOM 1550 O ALA A 103 -8.303 -4.931 -13.514 1.00 14.24 O ATOM 1551 CB ALA A 103 -5.586 -6.065 -13.178 1.00 45.21 C ATOM 0 H ALA A 103 -5.975 -6.264 -10.575 1.00 61.53 H new ATOM 0 HA ALA A 103 -5.892 -4.037 -12.539 1.00 43.43 H new ATOM 0 HB1 ALA A 103 -5.876 -5.866 -14.210 1.00 45.21 H new ATOM 0 HB2 ALA A 103 -4.502 -5.999 -13.087 1.00 45.21 H new ATOM 0 HB3 ALA A 103 -5.914 -7.065 -12.895 1.00 45.21 H new ATOM 1557 N GLY A 104 -8.501 -5.145 -11.255 1.00 32.33 N ATOM 1558 CA GLY A 104 -9.972 -5.162 -11.233 1.00 32.03 C ATOM 1559 C GLY A 104 -10.522 -5.920 -10.025 1.00 50.33 C ATOM 1560 O GLY A 104 -9.737 -6.315 -9.148 1.00 1.34 O ATOM 0 H GLY A 104 -8.075 -5.221 -10.332 1.00 32.33 H new ATOM 0 HA2 GLY A 104 -10.345 -4.138 -11.218 1.00 32.03 H new ATOM 0 HA3 GLY A 104 -10.342 -5.623 -12.149 1.00 32.03 H new ATOM 1564 N PRO A 105 -11.876 -6.117 -9.917 1.00 24.15 N ATOM 1565 CA PRO A 105 -12.491 -6.968 -8.861 1.00 62.20 C ATOM 1566 C PRO A 105 -11.979 -8.422 -8.922 1.00 70.21 C ATOM 1567 O PRO A 105 -11.626 -8.913 -10.005 1.00 34.52 O ATOM 1568 CB PRO A 105 -14.014 -6.889 -9.159 1.00 61.42 C ATOM 1569 CG PRO A 105 -14.174 -5.621 -9.942 1.00 62.45 C ATOM 1570 CD PRO A 105 -12.918 -5.507 -10.786 1.00 61.43 C ATOM 0 HA PRO A 105 -12.240 -6.626 -7.857 1.00 62.20 H new ATOM 0 HB2 PRO A 105 -14.353 -7.754 -9.729 1.00 61.42 H new ATOM 0 HB3 PRO A 105 -14.598 -6.865 -8.239 1.00 61.42 H new ATOM 0 HG2 PRO A 105 -15.066 -5.656 -10.568 1.00 62.45 H new ATOM 0 HG3 PRO A 105 -14.282 -4.762 -9.280 1.00 62.45 H new ATOM 0 HD2 PRO A 105 -13.017 -6.039 -11.732 1.00 61.43 H new ATOM 0 HD3 PRO A 105 -12.686 -4.470 -11.027 1.00 61.43 H new ATOM 1578 N ASN A 106 -11.901 -9.069 -7.738 1.00 31.42 N ATOM 1579 CA ASN A 106 -11.381 -10.446 -7.555 1.00 33.13 C ATOM 1580 C ASN A 106 -9.858 -10.509 -7.831 1.00 12.31 C ATOM 1581 O ASN A 106 -9.266 -11.587 -7.853 1.00 51.24 O ATOM 1582 CB ASN A 106 -12.189 -11.468 -8.425 1.00 44.43 C ATOM 1583 CG ASN A 106 -11.963 -12.945 -8.068 1.00 61.30 C ATOM 1584 OD1 ASN A 106 -11.720 -13.290 -6.913 1.00 64.52 O ATOM 1585 ND2 ASN A 106 -12.067 -13.829 -9.055 1.00 41.20 N ATOM 0 H ASN A 106 -12.204 -8.641 -6.863 1.00 31.42 H new ATOM 0 HA ASN A 106 -11.523 -10.732 -6.513 1.00 33.13 H new ATOM 0 HB2 ASN A 106 -13.251 -11.245 -8.328 1.00 44.43 H new ATOM 0 HB3 ASN A 106 -11.926 -11.318 -9.472 1.00 44.43 H new ATOM 0 HD21 ASN A 106 -11.944 -14.823 -8.864 1.00 41.20 H new ATOM 0 HD22 ASN A 106 -12.269 -13.513 -10.003 1.00 41.20 H new ATOM 1592 N THR A 107 -9.218 -9.326 -7.986 1.00 5.23 N ATOM 1593 CA THR A 107 -7.776 -9.203 -8.277 1.00 64.31 C ATOM 1594 C THR A 107 -7.068 -8.371 -7.177 1.00 32.52 C ATOM 1595 O THR A 107 -5.851 -8.152 -7.227 1.00 12.45 O ATOM 1596 CB THR A 107 -7.553 -8.573 -9.704 1.00 15.31 C ATOM 1597 OG1 THR A 107 -8.469 -9.165 -10.649 1.00 32.23 O ATOM 1598 CG2 THR A 107 -6.117 -8.774 -10.235 1.00 44.44 C ATOM 0 H THR A 107 -9.693 -8.427 -7.912 1.00 5.23 H new ATOM 0 HA THR A 107 -7.334 -10.199 -8.278 1.00 64.31 H new ATOM 0 HB THR A 107 -7.728 -7.502 -9.598 1.00 15.31 H new ATOM 0 HG1 THR A 107 -8.327 -8.769 -11.534 1.00 32.23 H new ATOM 0 HG21 THR A 107 -6.027 -8.318 -11.221 1.00 44.44 H new ATOM 0 HG22 THR A 107 -5.408 -8.306 -9.552 1.00 44.44 H new ATOM 0 HG23 THR A 107 -5.902 -9.840 -10.307 1.00 44.44 H new ATOM 1606 N ASN A 108 -7.842 -7.942 -6.158 1.00 24.15 N ATOM 1607 CA ASN A 108 -7.336 -7.139 -5.025 1.00 32.41 C ATOM 1608 C ASN A 108 -6.418 -8.004 -4.147 1.00 50.54 C ATOM 1609 O ASN A 108 -6.773 -9.134 -3.820 1.00 65.01 O ATOM 1610 CB ASN A 108 -8.536 -6.579 -4.201 1.00 13.10 C ATOM 1611 CG ASN A 108 -8.131 -5.714 -2.990 1.00 45.43 C ATOM 1612 OD1 ASN A 108 -7.091 -5.073 -2.982 1.00 71.32 O ATOM 1613 ND2 ASN A 108 -8.974 -5.665 -1.971 1.00 72.00 N ATOM 0 H ASN A 108 -8.840 -8.144 -6.098 1.00 24.15 H new ATOM 0 HA ASN A 108 -6.756 -6.296 -5.401 1.00 32.41 H new ATOM 0 HB2 ASN A 108 -9.168 -5.985 -4.861 1.00 13.10 H new ATOM 0 HB3 ASN A 108 -9.140 -7.415 -3.849 1.00 13.10 H new ATOM 0 HD21 ASN A 108 -8.760 -5.085 -1.160 1.00 72.00 H new ATOM 0 HD22 ASN A 108 -9.837 -6.208 -1.997 1.00 72.00 H new ATOM 1620 N GLY A 109 -5.242 -7.472 -3.784 1.00 12.23 N ATOM 1621 CA GLY A 109 -4.271 -8.206 -2.956 1.00 34.10 C ATOM 1622 C GLY A 109 -2.987 -8.575 -3.686 1.00 42.44 C ATOM 1623 O GLY A 109 -2.224 -9.424 -3.214 1.00 43.44 O ATOM 0 H GLY A 109 -4.939 -6.535 -4.051 1.00 12.23 H new ATOM 0 HA2 GLY A 109 -4.020 -7.600 -2.085 1.00 34.10 H new ATOM 0 HA3 GLY A 109 -4.741 -9.117 -2.586 1.00 34.10 H new ATOM 1627 N SER A 110 -2.756 -7.940 -4.846 1.00 73.33 N ATOM 1628 CA SER A 110 -1.463 -7.978 -5.542 1.00 0.10 C ATOM 1629 C SER A 110 -0.862 -6.558 -5.489 1.00 22.12 C ATOM 1630 O SER A 110 -1.477 -5.630 -6.011 1.00 33.31 O ATOM 1631 CB SER A 110 -1.668 -8.458 -7.003 1.00 31.42 C ATOM 1632 OG SER A 110 -2.669 -7.696 -7.681 1.00 13.52 O ATOM 0 H SER A 110 -3.463 -7.385 -5.328 1.00 73.33 H new ATOM 0 HA SER A 110 -0.778 -8.679 -5.065 1.00 0.10 H new ATOM 0 HB2 SER A 110 -0.725 -8.382 -7.545 1.00 31.42 H new ATOM 0 HB3 SER A 110 -1.952 -9.510 -7.002 1.00 31.42 H new ATOM 0 HG SER A 110 -2.633 -6.765 -7.377 1.00 13.52 H new ATOM 1638 N GLN A 111 0.338 -6.410 -4.863 1.00 73.21 N ATOM 1639 CA GLN A 111 0.960 -5.091 -4.525 1.00 51.33 C ATOM 1640 C GLN A 111 0.124 -4.336 -3.461 1.00 14.34 C ATOM 1641 O GLN A 111 -0.928 -4.810 -3.033 1.00 74.15 O ATOM 1642 CB GLN A 111 1.166 -4.196 -5.784 1.00 51.30 C ATOM 1643 CG GLN A 111 2.086 -4.798 -6.854 1.00 21.30 C ATOM 1644 CD GLN A 111 1.976 -4.086 -8.193 1.00 72.42 C ATOM 1645 OE1 GLN A 111 2.692 -3.123 -8.467 1.00 12.44 O ATOM 1646 NE2 GLN A 111 1.079 -4.555 -9.040 1.00 33.41 N ATOM 0 H GLN A 111 0.908 -7.206 -4.575 1.00 73.21 H new ATOM 0 HA GLN A 111 1.944 -5.307 -4.110 1.00 51.33 H new ATOM 0 HB2 GLN A 111 0.193 -3.994 -6.232 1.00 51.30 H new ATOM 0 HB3 GLN A 111 1.577 -3.237 -5.468 1.00 51.30 H new ATOM 0 HG2 GLN A 111 3.118 -4.752 -6.507 1.00 21.30 H new ATOM 0 HG3 GLN A 111 1.841 -5.852 -6.987 1.00 21.30 H new ATOM 0 HE21 GLN A 111 0.502 -5.355 -8.781 1.00 33.41 H new ATOM 0 HE22 GLN A 111 0.963 -4.117 -9.954 1.00 33.41 H new ATOM 1655 N PHE A 112 0.606 -3.153 -3.050 1.00 72.02 N ATOM 1656 CA PHE A 112 -0.084 -2.280 -2.074 1.00 41.23 C ATOM 1657 C PHE A 112 0.175 -0.823 -2.443 1.00 31.03 C ATOM 1658 O PHE A 112 1.200 -0.521 -3.048 1.00 42.31 O ATOM 1659 CB PHE A 112 0.384 -2.574 -0.617 1.00 30.44 C ATOM 1660 CG PHE A 112 1.888 -2.371 -0.370 1.00 14.42 C ATOM 1661 CD1 PHE A 112 2.805 -3.385 -0.670 1.00 22.30 C ATOM 1662 CD2 PHE A 112 2.384 -1.168 0.153 1.00 13.55 C ATOM 1663 CE1 PHE A 112 4.158 -3.203 -0.457 1.00 53.02 C ATOM 1664 CE2 PHE A 112 3.738 -0.993 0.361 1.00 60.10 C ATOM 1665 CZ PHE A 112 4.622 -2.009 0.057 1.00 53.14 C ATOM 0 H PHE A 112 1.490 -2.769 -3.384 1.00 72.02 H new ATOM 0 HA PHE A 112 -1.154 -2.482 -2.112 1.00 41.23 H new ATOM 0 HB2 PHE A 112 -0.172 -1.931 0.065 1.00 30.44 H new ATOM 0 HB3 PHE A 112 0.125 -3.603 -0.368 1.00 30.44 H new ATOM 0 HD1 PHE A 112 2.450 -4.322 -1.073 1.00 22.30 H new ATOM 0 HD2 PHE A 112 1.699 -0.369 0.396 1.00 13.55 H new ATOM 0 HE1 PHE A 112 4.853 -3.995 -0.693 1.00 53.02 H new ATOM 0 HE2 PHE A 112 4.106 -0.060 0.762 1.00 60.10 H new ATOM 0 HZ PHE A 112 5.680 -1.869 0.222 1.00 53.14 H new ATOM 1675 N PHE A 113 -0.734 0.076 -2.054 1.00 34.10 N ATOM 1676 CA PHE A 113 -0.596 1.508 -2.332 1.00 1.04 C ATOM 1677 C PHE A 113 -1.145 2.358 -1.190 1.00 63.13 C ATOM 1678 O PHE A 113 -2.028 1.920 -0.441 1.00 50.44 O ATOM 1679 CB PHE A 113 -1.255 1.896 -3.679 1.00 20.22 C ATOM 1680 CG PHE A 113 -2.767 1.730 -3.805 1.00 32.11 C ATOM 1681 CD1 PHE A 113 -3.646 2.746 -3.411 1.00 5.03 C ATOM 1682 CD2 PHE A 113 -3.308 0.569 -4.332 1.00 54.21 C ATOM 1683 CE1 PHE A 113 -5.006 2.602 -3.541 1.00 45.24 C ATOM 1684 CE2 PHE A 113 -4.668 0.430 -4.465 1.00 11.45 C ATOM 1685 CZ PHE A 113 -5.517 1.446 -4.069 1.00 43.31 C ATOM 0 H PHE A 113 -1.581 -0.167 -1.541 1.00 34.10 H new ATOM 0 HA PHE A 113 0.471 1.714 -2.415 1.00 1.04 H new ATOM 0 HB2 PHE A 113 -1.015 2.940 -3.881 1.00 20.22 H new ATOM 0 HB3 PHE A 113 -0.786 1.303 -4.464 1.00 20.22 H new ATOM 0 HD1 PHE A 113 -3.247 3.660 -2.997 1.00 5.03 H new ATOM 0 HD2 PHE A 113 -2.655 -0.234 -4.641 1.00 54.21 H new ATOM 0 HE1 PHE A 113 -5.668 3.396 -3.229 1.00 45.24 H new ATOM 0 HE2 PHE A 113 -5.076 -0.479 -4.882 1.00 11.45 H new ATOM 0 HZ PHE A 113 -6.585 1.328 -4.176 1.00 43.31 H new ATOM 1695 N ILE A 114 -0.617 3.591 -1.079 1.00 3.32 N ATOM 1696 CA ILE A 114 -0.916 4.516 0.016 1.00 31.40 C ATOM 1697 C ILE A 114 -1.291 5.889 -0.582 1.00 12.32 C ATOM 1698 O ILE A 114 -0.402 6.635 -1.021 1.00 34.40 O ATOM 1699 CB ILE A 114 0.327 4.700 0.973 1.00 22.20 C ATOM 1700 CG1 ILE A 114 1.085 3.350 1.216 1.00 65.41 C ATOM 1701 CG2 ILE A 114 -0.134 5.324 2.317 1.00 25.04 C ATOM 1702 CD1 ILE A 114 2.481 3.504 1.790 1.00 64.34 C ATOM 0 H ILE A 114 0.039 3.973 -1.761 1.00 3.32 H new ATOM 0 HA ILE A 114 -1.740 4.104 0.599 1.00 31.40 H new ATOM 0 HB ILE A 114 1.031 5.375 0.486 1.00 22.20 H new ATOM 0 HG12 ILE A 114 0.494 2.733 1.893 1.00 65.41 H new ATOM 0 HG13 ILE A 114 1.152 2.811 0.271 1.00 65.41 H new ATOM 0 HG21 ILE A 114 0.727 5.449 2.974 1.00 25.04 H new ATOM 0 HG22 ILE A 114 -0.592 6.295 2.129 1.00 25.04 H new ATOM 0 HG23 ILE A 114 -0.861 4.666 2.793 1.00 25.04 H new ATOM 0 HD11 ILE A 114 2.930 2.520 1.925 1.00 64.34 H new ATOM 0 HD12 ILE A 114 3.093 4.091 1.105 1.00 64.34 H new ATOM 0 HD13 ILE A 114 2.425 4.012 2.753 1.00 64.34 H new ATOM 1714 N CYS A 115 -2.590 6.205 -0.636 1.00 22.30 N ATOM 1715 CA CYS A 115 -3.092 7.491 -1.141 1.00 51.35 C ATOM 1716 C CYS A 115 -2.964 8.564 -0.046 1.00 23.21 C ATOM 1717 O CYS A 115 -3.752 8.559 0.899 1.00 72.12 O ATOM 1718 CB CYS A 115 -4.565 7.340 -1.577 1.00 53.21 C ATOM 1719 SG CYS A 115 -4.828 6.060 -2.823 1.00 13.34 S ATOM 0 H CYS A 115 -3.329 5.572 -0.329 1.00 22.30 H new ATOM 0 HA CYS A 115 -2.501 7.798 -2.004 1.00 51.35 H new ATOM 0 HB2 CYS A 115 -5.172 7.111 -0.701 1.00 53.21 H new ATOM 0 HB3 CYS A 115 -4.918 8.294 -1.969 1.00 53.21 H new ATOM 0 HG CYS A 115 -4.601 4.892 -2.300 1.00 13.34 H new ATOM 1725 N THR A 116 -1.973 9.475 -0.174 1.00 1.31 N ATOM 1726 CA THR A 116 -1.727 10.543 0.832 1.00 44.41 C ATOM 1727 C THR A 116 -2.857 11.581 0.829 1.00 54.40 C ATOM 1728 O THR A 116 -3.114 12.246 1.833 1.00 21.13 O ATOM 1729 CB THR A 116 -0.384 11.285 0.574 1.00 64.24 C ATOM 1730 OG1 THR A 116 -0.417 11.913 -0.719 1.00 62.42 O ATOM 1731 CG2 THR A 116 0.821 10.349 0.669 1.00 51.42 C ATOM 0 H THR A 116 -1.328 9.495 -0.964 1.00 1.31 H new ATOM 0 HA THR A 116 -1.683 10.044 1.800 1.00 44.41 H new ATOM 0 HB THR A 116 -0.271 12.041 1.351 1.00 64.24 H new ATOM 0 HG1 THR A 116 0.430 12.380 -0.877 1.00 62.42 H new ATOM 0 HG21 THR A 116 1.735 10.912 0.481 1.00 51.42 H new ATOM 0 HG22 THR A 116 0.863 9.910 1.666 1.00 51.42 H new ATOM 0 HG23 THR A 116 0.725 9.556 -0.073 1.00 51.42 H new ATOM 1739 N ALA A 117 -3.492 11.721 -0.326 1.00 4.45 N ATOM 1740 CA ALA A 117 -4.683 12.542 -0.496 1.00 4.11 C ATOM 1741 C ALA A 117 -5.914 11.639 -0.426 1.00 50.32 C ATOM 1742 O ALA A 117 -5.835 10.445 -0.752 1.00 61.03 O ATOM 1743 CB ALA A 117 -4.618 13.295 -1.831 1.00 31.04 C ATOM 0 H ALA A 117 -3.190 11.260 -1.185 1.00 4.45 H new ATOM 0 HA ALA A 117 -4.744 13.286 0.298 1.00 4.11 H new ATOM 0 HB1 ALA A 117 -5.513 13.906 -1.948 1.00 31.04 H new ATOM 0 HB2 ALA A 117 -3.737 13.936 -1.844 1.00 31.04 H new ATOM 0 HB3 ALA A 117 -4.558 12.579 -2.650 1.00 31.04 H new ATOM 1749 N LYS A 118 -7.036 12.209 0.027 1.00 72.31 N ATOM 1750 CA LYS A 118 -8.330 11.520 0.043 1.00 72.44 C ATOM 1751 C LYS A 118 -8.861 11.387 -1.409 1.00 34.24 C ATOM 1752 O LYS A 118 -9.586 12.255 -1.919 1.00 52.45 O ATOM 1753 CB LYS A 118 -9.334 12.250 0.988 1.00 2.32 C ATOM 1754 CG LYS A 118 -9.455 13.776 0.773 1.00 22.53 C ATOM 1755 CD LYS A 118 -10.583 14.419 1.604 1.00 31.42 C ATOM 1756 CE LYS A 118 -11.973 13.842 1.260 1.00 42.21 C ATOM 1757 NZ LYS A 118 -12.293 13.946 -0.190 1.00 64.44 N ATOM 0 H LYS A 118 -7.072 13.161 0.393 1.00 72.31 H new ATOM 0 HA LYS A 118 -8.208 10.514 0.445 1.00 72.44 H new ATOM 0 HB2 LYS A 118 -10.319 11.802 0.859 1.00 2.32 H new ATOM 0 HB3 LYS A 118 -9.034 12.068 2.020 1.00 2.32 H new ATOM 0 HG2 LYS A 118 -8.508 14.249 1.031 1.00 22.53 H new ATOM 0 HG3 LYS A 118 -9.633 13.974 -0.284 1.00 22.53 H new ATOM 0 HD2 LYS A 118 -10.382 14.265 2.664 1.00 31.42 H new ATOM 0 HD3 LYS A 118 -10.588 15.495 1.433 1.00 31.42 H new ATOM 0 HE2 LYS A 118 -12.013 12.796 1.563 1.00 42.21 H new ATOM 0 HE3 LYS A 118 -12.734 14.370 1.835 1.00 42.21 H new ATOM 0 HZ1 LYS A 118 -13.279 13.655 -0.350 1.00 64.44 H new ATOM 0 HZ2 LYS A 118 -12.167 14.930 -0.504 1.00 64.44 H new ATOM 0 HZ3 LYS A 118 -11.657 13.326 -0.731 1.00 64.44 H new ATOM 1771 N THR A 119 -8.432 10.298 -2.075 1.00 4.32 N ATOM 1772 CA THR A 119 -8.684 10.060 -3.500 1.00 24.22 C ATOM 1773 C THR A 119 -10.139 9.603 -3.732 1.00 63.52 C ATOM 1774 O THR A 119 -10.441 8.407 -3.813 1.00 70.23 O ATOM 1775 CB THR A 119 -7.651 9.016 -4.043 1.00 73.10 C ATOM 1776 OG1 THR A 119 -7.685 7.826 -3.228 1.00 23.22 O ATOM 1777 CG2 THR A 119 -6.220 9.587 -4.050 1.00 61.41 C ATOM 0 H THR A 119 -7.895 9.554 -1.630 1.00 4.32 H new ATOM 0 HA THR A 119 -8.554 10.991 -4.052 1.00 24.22 H new ATOM 0 HB THR A 119 -7.929 8.776 -5.069 1.00 73.10 H new ATOM 0 HG1 THR A 119 -6.786 7.439 -3.177 1.00 23.22 H new ATOM 0 HG21 THR A 119 -5.530 8.835 -4.433 1.00 61.41 H new ATOM 0 HG22 THR A 119 -6.184 10.471 -4.687 1.00 61.41 H new ATOM 0 HG23 THR A 119 -5.932 9.860 -3.035 1.00 61.41 H new ATOM 1785 N GLU A 120 -11.021 10.604 -3.880 1.00 74.42 N ATOM 1786 CA GLU A 120 -12.480 10.420 -3.945 1.00 74.54 C ATOM 1787 C GLU A 120 -12.904 9.630 -5.200 1.00 72.11 C ATOM 1788 O GLU A 120 -13.873 8.867 -5.170 1.00 4.00 O ATOM 1789 CB GLU A 120 -13.165 11.813 -3.898 1.00 11.02 C ATOM 1790 CG GLU A 120 -12.752 12.762 -5.041 1.00 5.02 C ATOM 1791 CD GLU A 120 -13.392 14.152 -4.949 1.00 5.25 C ATOM 1792 OE1 GLU A 120 -14.515 14.339 -5.459 1.00 41.13 O ATOM 1793 OE2 GLU A 120 -12.773 15.064 -4.354 1.00 44.21 O ATOM 0 H GLU A 120 -10.736 11.580 -3.959 1.00 74.42 H new ATOM 0 HA GLU A 120 -12.799 9.828 -3.087 1.00 74.54 H new ATOM 0 HB2 GLU A 120 -14.246 11.675 -3.929 1.00 11.02 H new ATOM 0 HB3 GLU A 120 -12.932 12.288 -2.945 1.00 11.02 H new ATOM 0 HG2 GLU A 120 -11.667 12.870 -5.038 1.00 5.02 H new ATOM 0 HG3 GLU A 120 -13.024 12.309 -5.994 1.00 5.02 H new ATOM 1800 N TRP A 121 -12.136 9.791 -6.287 1.00 45.50 N ATOM 1801 CA TRP A 121 -12.406 9.135 -7.580 1.00 21.53 C ATOM 1802 C TRP A 121 -12.135 7.618 -7.520 1.00 40.33 C ATOM 1803 O TRP A 121 -12.560 6.880 -8.410 1.00 30.20 O ATOM 1804 CB TRP A 121 -11.587 9.809 -8.719 1.00 55.31 C ATOM 1805 CG TRP A 121 -10.087 9.858 -8.490 1.00 54.20 C ATOM 1806 CD1 TRP A 121 -9.150 8.966 -8.942 1.00 62.13 C ATOM 1807 CD2 TRP A 121 -9.355 10.870 -7.771 1.00 12.35 C ATOM 1808 NE1 TRP A 121 -7.897 9.357 -8.543 1.00 12.34 N ATOM 1809 CE2 TRP A 121 -7.997 10.520 -7.826 1.00 64.12 C ATOM 1810 CE3 TRP A 121 -9.723 12.035 -7.083 1.00 45.40 C ATOM 1811 CZ2 TRP A 121 -7.006 11.298 -7.236 1.00 71.30 C ATOM 1812 CZ3 TRP A 121 -8.740 12.799 -6.490 1.00 62.11 C ATOM 1813 CH2 TRP A 121 -7.393 12.425 -6.570 1.00 13.11 C ATOM 0 H TRP A 121 -11.305 10.383 -6.297 1.00 45.50 H new ATOM 0 HA TRP A 121 -13.466 9.262 -7.800 1.00 21.53 H new ATOM 0 HB2 TRP A 121 -11.780 9.275 -9.649 1.00 55.31 H new ATOM 0 HB3 TRP A 121 -11.952 10.827 -8.855 1.00 55.31 H new ATOM 0 HD1 TRP A 121 -9.366 8.084 -9.527 1.00 62.13 H new ATOM 0 HE1 TRP A 121 -7.030 8.861 -8.748 1.00 12.34 H new ATOM 0 HE3 TRP A 121 -10.760 12.329 -7.018 1.00 45.40 H new ATOM 0 HZ2 TRP A 121 -5.965 11.019 -7.303 1.00 71.30 H new ATOM 0 HZ3 TRP A 121 -9.013 13.698 -5.957 1.00 62.11 H new ATOM 0 HH2 TRP A 121 -6.644 13.041 -6.095 1.00 13.11 H new ATOM 1824 N LEU A 122 -11.430 7.158 -6.463 1.00 44.54 N ATOM 1825 CA LEU A 122 -11.165 5.718 -6.240 1.00 74.52 C ATOM 1826 C LEU A 122 -12.298 5.042 -5.436 1.00 53.22 C ATOM 1827 O LEU A 122 -12.194 3.856 -5.099 1.00 63.21 O ATOM 1828 CB LEU A 122 -9.784 5.500 -5.553 1.00 43.45 C ATOM 1829 CG LEU A 122 -8.524 6.006 -6.334 1.00 33.51 C ATOM 1830 CD1 LEU A 122 -7.215 5.546 -5.648 1.00 23.01 C ATOM 1831 CD2 LEU A 122 -8.568 5.576 -7.818 1.00 4.34 C ATOM 0 H LEU A 122 -11.032 7.766 -5.747 1.00 44.54 H new ATOM 0 HA LEU A 122 -11.134 5.241 -7.220 1.00 74.52 H new ATOM 0 HB2 LEU A 122 -9.805 5.995 -4.582 1.00 43.45 H new ATOM 0 HB3 LEU A 122 -9.662 4.433 -5.364 1.00 43.45 H new ATOM 0 HG LEU A 122 -8.540 7.096 -6.312 1.00 33.51 H new ATOM 0 HD11 LEU A 122 -6.359 5.913 -6.214 1.00 23.01 H new ATOM 0 HD12 LEU A 122 -7.177 5.943 -4.634 1.00 23.01 H new ATOM 0 HD13 LEU A 122 -7.186 4.457 -5.612 1.00 23.01 H new ATOM 0 HD21 LEU A 122 -7.679 5.944 -8.330 1.00 4.34 H new ATOM 0 HD22 LEU A 122 -8.599 4.488 -7.881 1.00 4.34 H new ATOM 0 HD23 LEU A 122 -9.457 5.992 -8.291 1.00 4.34 H new ATOM 1843 N ASP A 123 -13.389 5.782 -5.153 1.00 14.45 N ATOM 1844 CA ASP A 123 -14.608 5.206 -4.538 1.00 4.34 C ATOM 1845 C ASP A 123 -15.464 4.508 -5.599 1.00 10.13 C ATOM 1846 O ASP A 123 -15.606 5.006 -6.723 1.00 2.25 O ATOM 1847 CB ASP A 123 -15.423 6.288 -3.788 1.00 61.01 C ATOM 1848 CG ASP A 123 -14.688 6.806 -2.545 1.00 24.35 C ATOM 1849 OD1 ASP A 123 -14.216 5.970 -1.750 1.00 14.02 O ATOM 1850 OD2 ASP A 123 -14.591 8.034 -2.351 1.00 32.53 O ATOM 0 H ASP A 123 -13.453 6.783 -5.340 1.00 14.45 H new ATOM 0 HA ASP A 123 -14.299 4.462 -3.804 1.00 4.34 H new ATOM 0 HB2 ASP A 123 -15.626 7.120 -4.462 1.00 61.01 H new ATOM 0 HB3 ASP A 123 -16.387 5.875 -3.492 1.00 61.01 H new ATOM 1855 N GLY A 124 -16.036 3.350 -5.216 1.00 43.32 N ATOM 1856 CA GLY A 124 -16.695 2.435 -6.157 1.00 61.54 C ATOM 1857 C GLY A 124 -15.754 1.338 -6.649 1.00 12.21 C ATOM 1858 O GLY A 124 -16.182 0.391 -7.323 1.00 71.11 O ATOM 0 H GLY A 124 -16.052 3.027 -4.249 1.00 43.32 H new ATOM 0 HA2 GLY A 124 -17.560 1.980 -5.674 1.00 61.54 H new ATOM 0 HA3 GLY A 124 -17.068 3.001 -7.010 1.00 61.54 H new ATOM 1862 N LYS A 125 -14.450 1.501 -6.346 1.00 64.00 N ATOM 1863 CA LYS A 125 -13.402 0.501 -6.609 1.00 14.01 C ATOM 1864 C LYS A 125 -13.187 -0.356 -5.359 1.00 65.13 C ATOM 1865 O LYS A 125 -13.964 -0.285 -4.405 1.00 63.30 O ATOM 1866 CB LYS A 125 -12.073 1.194 -7.089 1.00 11.04 C ATOM 1867 CG LYS A 125 -11.968 1.405 -8.621 1.00 71.01 C ATOM 1868 CD LYS A 125 -13.085 2.301 -9.214 1.00 70.40 C ATOM 1869 CE LYS A 125 -13.062 3.719 -8.634 1.00 64.11 C ATOM 1870 NZ LYS A 125 -14.149 4.570 -9.158 1.00 13.04 N ATOM 0 H LYS A 125 -14.092 2.348 -5.904 1.00 64.00 H new ATOM 0 HA LYS A 125 -13.722 -0.155 -7.418 1.00 14.01 H new ATOM 0 HB2 LYS A 125 -11.986 2.162 -6.596 1.00 11.04 H new ATOM 0 HB3 LYS A 125 -11.226 0.592 -6.760 1.00 11.04 H new ATOM 0 HG2 LYS A 125 -11.000 1.850 -8.850 1.00 71.01 H new ATOM 0 HG3 LYS A 125 -11.997 0.433 -9.114 1.00 71.01 H new ATOM 0 HD2 LYS A 125 -12.971 2.352 -10.297 1.00 70.40 H new ATOM 0 HD3 LYS A 125 -14.056 1.846 -9.017 1.00 70.40 H new ATOM 0 HE2 LYS A 125 -13.141 3.664 -7.548 1.00 64.11 H new ATOM 0 HE3 LYS A 125 -12.102 4.183 -8.860 1.00 64.11 H new ATOM 0 HZ1 LYS A 125 -13.778 5.519 -9.364 1.00 13.04 H new ATOM 0 HZ2 LYS A 125 -14.529 4.150 -10.030 1.00 13.04 H new ATOM 0 HZ3 LYS A 125 -14.907 4.641 -8.449 1.00 13.04 H new ATOM 1884 N HIS A 126 -12.105 -1.135 -5.376 1.00 51.32 N ATOM 1885 CA HIS A 126 -11.804 -2.148 -4.361 1.00 12.20 C ATOM 1886 C HIS A 126 -11.509 -1.495 -2.986 1.00 64.31 C ATOM 1887 O HIS A 126 -11.048 -0.340 -2.913 1.00 62.32 O ATOM 1888 CB HIS A 126 -10.590 -2.980 -4.834 1.00 52.43 C ATOM 1889 CG HIS A 126 -9.334 -2.171 -4.908 1.00 11.44 C ATOM 1890 ND1 HIS A 126 -8.399 -2.176 -3.920 1.00 41.31 N ATOM 1891 CD2 HIS A 126 -8.913 -1.261 -5.820 1.00 22.03 C ATOM 1892 CE1 HIS A 126 -7.464 -1.322 -4.215 1.00 33.30 C ATOM 1893 NE2 HIS A 126 -7.748 -0.744 -5.359 1.00 41.14 N ATOM 0 H HIS A 126 -11.399 -1.079 -6.110 1.00 51.32 H new ATOM 0 HA HIS A 126 -12.672 -2.795 -4.235 1.00 12.20 H new ATOM 0 HB2 HIS A 126 -10.439 -3.817 -4.152 1.00 52.43 H new ATOM 0 HB3 HIS A 126 -10.804 -3.403 -5.815 1.00 52.43 H new ATOM 0 HD2 HIS A 126 -9.412 -0.997 -6.741 1.00 22.03 H new ATOM 0 HE1 HIS A 126 -6.590 -1.120 -3.613 1.00 33.30 H new ATOM 0 HE2 HIS A 126 -7.188 -0.028 -5.822 1.00 41.14 H new ATOM 1902 N VAL A 127 -11.746 -2.273 -1.924 1.00 45.22 N ATOM 1903 CA VAL A 127 -11.879 -1.766 -0.545 1.00 70.22 C ATOM 1904 C VAL A 127 -10.522 -1.460 0.118 1.00 3.11 C ATOM 1905 O VAL A 127 -9.503 -2.113 -0.159 1.00 2.31 O ATOM 1906 CB VAL A 127 -12.706 -2.776 0.342 1.00 61.24 C ATOM 1907 CG1 VAL A 127 -14.071 -3.054 -0.319 1.00 45.23 C ATOM 1908 CG2 VAL A 127 -11.932 -4.102 0.617 1.00 72.03 C ATOM 0 H VAL A 127 -11.853 -3.285 -1.994 1.00 45.22 H new ATOM 0 HA VAL A 127 -12.417 -0.821 -0.614 1.00 70.22 H new ATOM 0 HB VAL A 127 -12.867 -2.310 1.314 1.00 61.24 H new ATOM 0 HG11 VAL A 127 -14.638 -3.752 0.297 1.00 45.23 H new ATOM 0 HG12 VAL A 127 -14.626 -2.121 -0.415 1.00 45.23 H new ATOM 0 HG13 VAL A 127 -13.915 -3.486 -1.307 1.00 45.23 H new ATOM 0 HG21 VAL A 127 -12.546 -4.761 1.231 1.00 72.03 H new ATOM 0 HG22 VAL A 127 -11.706 -4.594 -0.329 1.00 72.03 H new ATOM 0 HG23 VAL A 127 -11.003 -3.879 1.141 1.00 72.03 H new ATOM 1918 N VAL A 128 -10.553 -0.438 0.985 1.00 52.33 N ATOM 1919 CA VAL A 128 -9.443 -0.042 1.862 1.00 52.12 C ATOM 1920 C VAL A 128 -9.431 -0.975 3.089 1.00 25.34 C ATOM 1921 O VAL A 128 -10.488 -1.504 3.464 1.00 43.04 O ATOM 1922 CB VAL A 128 -9.628 1.456 2.319 1.00 22.10 C ATOM 1923 CG1 VAL A 128 -8.454 1.958 3.191 1.00 12.55 C ATOM 1924 CG2 VAL A 128 -9.874 2.381 1.103 1.00 24.21 C ATOM 0 H VAL A 128 -11.376 0.153 1.098 1.00 52.33 H new ATOM 0 HA VAL A 128 -8.497 -0.124 1.327 1.00 52.12 H new ATOM 0 HB VAL A 128 -10.515 1.490 2.951 1.00 22.10 H new ATOM 0 HG11 VAL A 128 -8.631 2.994 3.478 1.00 12.55 H new ATOM 0 HG12 VAL A 128 -8.376 1.341 4.086 1.00 12.55 H new ATOM 0 HG13 VAL A 128 -7.526 1.893 2.624 1.00 12.55 H new ATOM 0 HG21 VAL A 128 -9.998 3.408 1.446 1.00 24.21 H new ATOM 0 HG22 VAL A 128 -9.022 2.325 0.425 1.00 24.21 H new ATOM 0 HG23 VAL A 128 -10.775 2.062 0.580 1.00 24.21 H new ATOM 1934 N PHE A 129 -8.255 -1.183 3.714 1.00 60.20 N ATOM 1935 CA PHE A 129 -8.151 -2.050 4.912 1.00 24.44 C ATOM 1936 C PHE A 129 -7.389 -1.374 6.048 1.00 20.01 C ATOM 1937 O PHE A 129 -7.450 -1.837 7.189 1.00 73.41 O ATOM 1938 CB PHE A 129 -7.504 -3.408 4.561 1.00 61.31 C ATOM 1939 CG PHE A 129 -6.064 -3.305 4.081 1.00 23.21 C ATOM 1940 CD1 PHE A 129 -5.777 -3.055 2.748 1.00 61.15 C ATOM 1941 CD2 PHE A 129 -5.000 -3.436 4.970 1.00 54.42 C ATOM 1942 CE1 PHE A 129 -4.481 -2.941 2.321 1.00 70.44 C ATOM 1943 CE2 PHE A 129 -3.707 -3.316 4.532 1.00 55.11 C ATOM 1944 CZ PHE A 129 -3.446 -3.075 3.207 1.00 25.50 C ATOM 0 H PHE A 129 -7.372 -0.769 3.416 1.00 60.20 H new ATOM 0 HA PHE A 129 -9.168 -2.228 5.261 1.00 24.44 H new ATOM 0 HB2 PHE A 129 -7.537 -4.052 5.440 1.00 61.31 H new ATOM 0 HB3 PHE A 129 -8.100 -3.893 3.788 1.00 61.31 H new ATOM 0 HD1 PHE A 129 -6.584 -2.949 2.039 1.00 61.15 H new ATOM 0 HD2 PHE A 129 -5.196 -3.634 6.014 1.00 54.42 H new ATOM 0 HE1 PHE A 129 -4.274 -2.744 1.279 1.00 70.44 H new ATOM 0 HE2 PHE A 129 -2.891 -3.412 5.233 1.00 55.11 H new ATOM 0 HZ PHE A 129 -2.426 -2.991 2.863 1.00 25.50 H new ATOM 1954 N GLY A 130 -6.664 -0.300 5.731 1.00 53.13 N ATOM 1955 CA GLY A 130 -5.854 0.396 6.719 1.00 34.23 C ATOM 1956 C GLY A 130 -5.606 1.837 6.338 1.00 52.21 C ATOM 1957 O GLY A 130 -6.005 2.281 5.259 1.00 20.12 O ATOM 0 H GLY A 130 -6.624 0.103 4.795 1.00 53.13 H new ATOM 0 HA2 GLY A 130 -6.353 0.358 7.687 1.00 34.23 H new ATOM 0 HA3 GLY A 130 -4.899 -0.118 6.832 1.00 34.23 H new ATOM 1961 N LYS A 131 -4.951 2.559 7.234 1.00 53.31 N ATOM 1962 CA LYS A 131 -4.566 3.955 7.024 1.00 41.23 C ATOM 1963 C LYS A 131 -3.373 4.265 7.932 1.00 14.44 C ATOM 1964 O LYS A 131 -3.346 3.802 9.074 1.00 64.24 O ATOM 1965 CB LYS A 131 -5.745 4.906 7.366 1.00 44.12 C ATOM 1966 CG LYS A 131 -5.467 6.402 7.069 1.00 73.41 C ATOM 1967 CD LYS A 131 -6.459 7.357 7.764 1.00 63.12 C ATOM 1968 CE LYS A 131 -6.337 7.302 9.300 1.00 21.12 C ATOM 1969 NZ LYS A 131 -7.219 8.297 9.959 1.00 43.44 N ATOM 0 H LYS A 131 -4.666 2.191 8.142 1.00 53.31 H new ATOM 0 HA LYS A 131 -4.300 4.107 5.978 1.00 41.23 H new ATOM 0 HB2 LYS A 131 -6.624 4.593 6.802 1.00 44.12 H new ATOM 0 HB3 LYS A 131 -5.989 4.797 8.423 1.00 44.12 H new ATOM 0 HG2 LYS A 131 -4.454 6.646 7.388 1.00 73.41 H new ATOM 0 HG3 LYS A 131 -5.510 6.565 5.992 1.00 73.41 H new ATOM 0 HD2 LYS A 131 -6.280 8.377 7.423 1.00 63.12 H new ATOM 0 HD3 LYS A 131 -7.477 7.097 7.472 1.00 63.12 H new ATOM 0 HE2 LYS A 131 -6.593 6.302 9.649 1.00 21.12 H new ATOM 0 HE3 LYS A 131 -5.302 7.486 9.589 1.00 21.12 H new ATOM 0 HZ1 LYS A 131 -7.109 8.229 10.991 1.00 43.44 H new ATOM 0 HZ2 LYS A 131 -6.958 9.254 9.645 1.00 43.44 H new ATOM 0 HZ3 LYS A 131 -8.209 8.106 9.703 1.00 43.44 H new ATOM 1983 N VAL A 132 -2.401 5.039 7.425 1.00 70.44 N ATOM 1984 CA VAL A 132 -1.228 5.460 8.209 1.00 14.54 C ATOM 1985 C VAL A 132 -1.648 6.304 9.442 1.00 23.15 C ATOM 1986 O VAL A 132 -2.510 7.187 9.336 1.00 32.14 O ATOM 1987 CB VAL A 132 -0.190 6.261 7.329 1.00 22.33 C ATOM 1988 CG1 VAL A 132 -0.835 7.473 6.643 1.00 13.14 C ATOM 1989 CG2 VAL A 132 1.037 6.695 8.156 1.00 73.04 C ATOM 0 H VAL A 132 -2.405 5.389 6.467 1.00 70.44 H new ATOM 0 HA VAL A 132 -0.741 4.550 8.560 1.00 14.54 H new ATOM 0 HB VAL A 132 0.150 5.580 6.549 1.00 22.33 H new ATOM 0 HG11 VAL A 132 -0.086 7.996 6.048 1.00 13.14 H new ATOM 0 HG12 VAL A 132 -1.644 7.136 5.994 1.00 13.14 H new ATOM 0 HG13 VAL A 132 -1.234 8.149 7.399 1.00 13.14 H new ATOM 0 HG21 VAL A 132 1.730 7.244 7.518 1.00 73.04 H new ATOM 0 HG22 VAL A 132 0.714 7.336 8.977 1.00 73.04 H new ATOM 0 HG23 VAL A 132 1.535 5.813 8.558 1.00 73.04 H new ATOM 1999 N LYS A 133 -1.060 5.987 10.605 1.00 61.43 N ATOM 2000 CA LYS A 133 -1.237 6.766 11.845 1.00 12.31 C ATOM 2001 C LYS A 133 0.085 7.470 12.213 1.00 22.14 C ATOM 2002 O LYS A 133 0.076 8.617 12.670 1.00 2.12 O ATOM 2003 CB LYS A 133 -1.750 5.858 13.003 1.00 5.11 C ATOM 2004 CG LYS A 133 -0.847 4.650 13.355 1.00 24.43 C ATOM 2005 CD LYS A 133 -1.434 3.767 14.483 1.00 42.43 C ATOM 2006 CE LYS A 133 -1.663 4.533 15.800 1.00 75.42 C ATOM 2007 NZ LYS A 133 -2.393 3.714 16.800 1.00 72.12 N ATOM 0 H LYS A 133 -0.445 5.180 10.715 1.00 61.43 H new ATOM 0 HA LYS A 133 -1.995 7.532 11.680 1.00 12.31 H new ATOM 0 HB2 LYS A 133 -1.870 6.471 13.896 1.00 5.11 H new ATOM 0 HB3 LYS A 133 -2.739 5.485 12.737 1.00 5.11 H new ATOM 0 HG2 LYS A 133 -0.700 4.041 12.463 1.00 24.43 H new ATOM 0 HG3 LYS A 133 0.135 5.013 13.659 1.00 24.43 H new ATOM 0 HD2 LYS A 133 -2.381 3.343 14.148 1.00 42.43 H new ATOM 0 HD3 LYS A 133 -0.759 2.932 14.669 1.00 42.43 H new ATOM 0 HE2 LYS A 133 -0.702 4.838 16.214 1.00 75.42 H new ATOM 0 HE3 LYS A 133 -2.226 5.444 15.596 1.00 75.42 H new ATOM 0 HZ1 LYS A 133 -2.704 4.321 17.585 1.00 72.12 H new ATOM 0 HZ2 LYS A 133 -3.223 3.276 16.351 1.00 72.12 H new ATOM 0 HZ3 LYS A 133 -1.764 2.971 17.165 1.00 72.12 H new ATOM 2021 N GLU A 134 1.220 6.782 11.974 1.00 52.03 N ATOM 2022 CA GLU A 134 2.576 7.297 12.269 1.00 31.35 C ATOM 2023 C GLU A 134 3.398 7.364 10.974 1.00 53.11 C ATOM 2024 O GLU A 134 3.404 6.404 10.203 1.00 23.43 O ATOM 2025 CB GLU A 134 3.318 6.388 13.301 1.00 20.53 C ATOM 2026 CG GLU A 134 2.540 6.077 14.601 1.00 3.04 C ATOM 2027 CD GLU A 134 1.939 7.318 15.291 1.00 41.25 C ATOM 2028 OE1 GLU A 134 2.688 8.284 15.575 1.00 33.10 O ATOM 2029 OE2 GLU A 134 0.709 7.343 15.547 1.00 52.25 O ATOM 0 H GLU A 134 1.223 5.846 11.568 1.00 52.03 H new ATOM 0 HA GLU A 134 2.470 8.293 12.699 1.00 31.35 H new ATOM 0 HB2 GLU A 134 3.567 5.445 12.814 1.00 20.53 H new ATOM 0 HB3 GLU A 134 4.260 6.867 13.569 1.00 20.53 H new ATOM 0 HG2 GLU A 134 1.736 5.378 14.371 1.00 3.04 H new ATOM 0 HG3 GLU A 134 3.209 5.575 15.300 1.00 3.04 H new ATOM 2036 N GLY A 135 4.095 8.489 10.755 1.00 23.44 N ATOM 2037 CA GLY A 135 4.969 8.655 9.593 1.00 42.41 C ATOM 2038 C GLY A 135 4.224 9.049 8.328 1.00 61.34 C ATOM 2039 O GLY A 135 4.664 8.721 7.226 1.00 24.11 O ATOM 0 H GLY A 135 4.067 9.299 11.374 1.00 23.44 H new ATOM 0 HA2 GLY A 135 5.718 9.415 9.816 1.00 42.41 H new ATOM 0 HA3 GLY A 135 5.505 7.723 9.415 1.00 42.41 H new ATOM 2043 N MET A 136 3.093 9.769 8.492 1.00 13.53 N ATOM 2044 CA MET A 136 2.293 10.296 7.369 1.00 50.52 C ATOM 2045 C MET A 136 3.139 11.241 6.494 1.00 64.25 C ATOM 2046 O MET A 136 3.106 11.156 5.264 1.00 2.35 O ATOM 2047 CB MET A 136 1.048 11.047 7.902 1.00 70.23 C ATOM 2048 CG MET A 136 0.185 11.705 6.811 1.00 61.33 C ATOM 2049 SD MET A 136 -0.424 10.512 5.604 1.00 53.44 S ATOM 2050 CE MET A 136 -1.200 11.588 4.410 1.00 13.11 C ATOM 0 H MET A 136 2.710 10.000 9.409 1.00 13.53 H new ATOM 0 HA MET A 136 1.967 9.454 6.759 1.00 50.52 H new ATOM 0 HB2 MET A 136 0.430 10.347 8.464 1.00 70.23 H new ATOM 0 HB3 MET A 136 1.375 11.816 8.602 1.00 70.23 H new ATOM 0 HG2 MET A 136 -0.661 12.211 7.277 1.00 61.33 H new ATOM 0 HG3 MET A 136 0.771 12.469 6.299 1.00 61.33 H new ATOM 0 HE1 MET A 136 -2.008 11.054 3.910 1.00 13.11 H new ATOM 0 HE2 MET A 136 -1.603 12.464 4.918 1.00 13.11 H new ATOM 0 HE3 MET A 136 -0.463 11.904 3.672 1.00 13.11 H new ATOM 2060 N ASN A 137 3.912 12.119 7.164 1.00 2.25 N ATOM 2061 CA ASN A 137 4.805 13.090 6.504 1.00 11.22 C ATOM 2062 C ASN A 137 5.918 12.381 5.706 1.00 1.02 C ATOM 2063 O ASN A 137 6.403 12.925 4.717 1.00 44.52 O ATOM 2064 CB ASN A 137 5.426 14.050 7.549 1.00 65.12 C ATOM 2065 CG ASN A 137 4.375 14.879 8.291 1.00 73.30 C ATOM 2066 OD1 ASN A 137 3.850 14.455 9.321 1.00 40.34 O ATOM 2067 ND2 ASN A 137 4.040 16.052 7.774 1.00 62.42 N ATOM 0 H ASN A 137 3.934 12.174 8.182 1.00 2.25 H new ATOM 0 HA ASN A 137 4.204 13.668 5.802 1.00 11.22 H new ATOM 0 HB2 ASN A 137 6.001 13.471 8.271 1.00 65.12 H new ATOM 0 HB3 ASN A 137 6.125 14.721 7.049 1.00 65.12 H new ATOM 0 HD21 ASN A 137 3.332 16.627 8.230 1.00 62.42 H new ATOM 0 HD22 ASN A 137 4.490 16.380 6.920 1.00 62.42 H new ATOM 2074 N ILE A 138 6.312 11.167 6.159 1.00 30.34 N ATOM 2075 CA ILE A 138 7.311 10.324 5.462 1.00 35.00 C ATOM 2076 C ILE A 138 6.711 9.750 4.160 1.00 2.11 C ATOM 2077 O ILE A 138 7.396 9.680 3.138 1.00 3.11 O ATOM 2078 CB ILE A 138 7.823 9.141 6.378 1.00 55.14 C ATOM 2079 CG1 ILE A 138 8.446 9.686 7.702 1.00 43.54 C ATOM 2080 CG2 ILE A 138 8.833 8.219 5.635 1.00 62.12 C ATOM 2081 CD1 ILE A 138 9.702 10.526 7.523 1.00 2.15 C ATOM 0 H ILE A 138 5.948 10.747 7.014 1.00 30.34 H new ATOM 0 HA ILE A 138 8.164 10.959 5.224 1.00 35.00 H new ATOM 0 HB ILE A 138 6.953 8.534 6.629 1.00 55.14 H new ATOM 0 HG12 ILE A 138 7.697 10.286 8.219 1.00 43.54 H new ATOM 0 HG13 ILE A 138 8.681 8.842 8.350 1.00 43.54 H new ATOM 0 HG21 ILE A 138 9.157 7.421 6.303 1.00 62.12 H new ATOM 0 HG22 ILE A 138 8.352 7.785 4.758 1.00 62.12 H new ATOM 0 HG23 ILE A 138 9.698 8.804 5.322 1.00 62.12 H new ATOM 0 HD11 ILE A 138 10.059 10.858 8.498 1.00 2.15 H new ATOM 0 HD12 ILE A 138 10.474 9.928 7.038 1.00 2.15 H new ATOM 0 HD13 ILE A 138 9.474 11.394 6.905 1.00 2.15 H new ATOM 2093 N VAL A 139 5.418 9.359 4.222 1.00 43.02 N ATOM 2094 CA VAL A 139 4.672 8.828 3.062 1.00 1.53 C ATOM 2095 C VAL A 139 4.536 9.920 1.967 1.00 74.43 C ATOM 2096 O VAL A 139 4.763 9.667 0.777 1.00 62.32 O ATOM 2097 CB VAL A 139 3.239 8.312 3.480 1.00 42.44 C ATOM 2098 CG1 VAL A 139 2.492 7.708 2.281 1.00 63.32 C ATOM 2099 CG2 VAL A 139 3.310 7.291 4.638 1.00 63.13 C ATOM 0 H VAL A 139 4.864 9.403 5.077 1.00 43.02 H new ATOM 0 HA VAL A 139 5.235 7.983 2.667 1.00 1.53 H new ATOM 0 HB VAL A 139 2.682 9.180 3.833 1.00 42.44 H new ATOM 0 HG11 VAL A 139 1.509 7.362 2.601 1.00 63.32 H new ATOM 0 HG12 VAL A 139 2.375 8.465 1.506 1.00 63.32 H new ATOM 0 HG13 VAL A 139 3.061 6.867 1.884 1.00 63.32 H new ATOM 0 HG21 VAL A 139 2.303 6.961 4.895 1.00 63.13 H new ATOM 0 HG22 VAL A 139 3.906 6.432 4.330 1.00 63.13 H new ATOM 0 HG23 VAL A 139 3.771 7.759 5.508 1.00 63.13 H new ATOM 2109 N GLU A 140 4.191 11.137 2.415 1.00 4.44 N ATOM 2110 CA GLU A 140 4.031 12.318 1.542 1.00 30.42 C ATOM 2111 C GLU A 140 5.387 12.759 0.960 1.00 21.31 C ATOM 2112 O GLU A 140 5.465 13.181 -0.200 1.00 14.11 O ATOM 2113 CB GLU A 140 3.365 13.473 2.338 1.00 74.45 C ATOM 2114 CG GLU A 140 1.994 13.100 2.938 1.00 34.43 C ATOM 2115 CD GLU A 140 1.365 14.211 3.789 1.00 33.14 C ATOM 2116 OE1 GLU A 140 1.797 14.398 4.947 1.00 45.34 O ATOM 2117 OE2 GLU A 140 0.428 14.891 3.310 1.00 23.54 O ATOM 0 H GLU A 140 4.013 11.334 3.400 1.00 4.44 H new ATOM 0 HA GLU A 140 3.385 12.052 0.705 1.00 30.42 H new ATOM 0 HB2 GLU A 140 4.033 13.780 3.143 1.00 74.45 H new ATOM 0 HB3 GLU A 140 3.242 14.333 1.680 1.00 74.45 H new ATOM 0 HG2 GLU A 140 1.311 12.846 2.128 1.00 34.43 H new ATOM 0 HG3 GLU A 140 2.108 12.206 3.551 1.00 34.43 H new ATOM 2124 N ALA A 141 6.448 12.617 1.779 1.00 51.44 N ATOM 2125 CA ALA A 141 7.829 12.970 1.392 1.00 71.41 C ATOM 2126 C ALA A 141 8.363 12.016 0.314 1.00 14.35 C ATOM 2127 O ALA A 141 8.978 12.461 -0.666 1.00 24.32 O ATOM 2128 CB ALA A 141 8.754 12.970 2.623 1.00 2.55 C ATOM 0 H ALA A 141 6.372 12.254 2.729 1.00 51.44 H new ATOM 0 HA ALA A 141 7.813 13.976 0.972 1.00 71.41 H new ATOM 0 HB1 ALA A 141 9.767 13.232 2.317 1.00 2.55 H new ATOM 0 HB2 ALA A 141 8.394 13.699 3.349 1.00 2.55 H new ATOM 0 HB3 ALA A 141 8.757 11.978 3.076 1.00 2.55 H new ATOM 2134 N MET A 142 8.094 10.702 0.497 1.00 62.44 N ATOM 2135 CA MET A 142 8.584 9.657 -0.422 1.00 23.01 C ATOM 2136 C MET A 142 7.800 9.682 -1.745 1.00 75.41 C ATOM 2137 O MET A 142 8.341 9.346 -2.803 1.00 34.34 O ATOM 2138 CB MET A 142 8.546 8.239 0.229 1.00 50.51 C ATOM 2139 CG MET A 142 7.162 7.597 0.382 1.00 52.11 C ATOM 2140 SD MET A 142 7.247 5.921 1.043 1.00 63.42 S ATOM 2141 CE MET A 142 5.512 5.506 1.194 1.00 31.25 C ATOM 0 H MET A 142 7.539 10.344 1.275 1.00 62.44 H new ATOM 0 HA MET A 142 9.629 9.879 -0.639 1.00 23.01 H new ATOM 0 HB2 MET A 142 9.168 7.572 -0.368 1.00 50.51 H new ATOM 0 HB3 MET A 142 9.004 8.304 1.216 1.00 50.51 H new ATOM 0 HG2 MET A 142 6.550 8.213 1.041 1.00 52.11 H new ATOM 0 HG3 MET A 142 6.665 7.577 -0.588 1.00 52.11 H new ATOM 0 HE1 MET A 142 5.360 4.894 2.083 1.00 31.25 H new ATOM 0 HE2 MET A 142 4.925 6.421 1.278 1.00 31.25 H new ATOM 0 HE3 MET A 142 5.193 4.950 0.312 1.00 31.25 H new ATOM 2151 N GLU A 143 6.531 10.125 -1.676 1.00 62.24 N ATOM 2152 CA GLU A 143 5.649 10.207 -2.847 1.00 62.23 C ATOM 2153 C GLU A 143 6.180 11.227 -3.891 1.00 41.32 C ATOM 2154 O GLU A 143 5.982 11.065 -5.105 1.00 42.41 O ATOM 2155 CB GLU A 143 4.211 10.563 -2.409 1.00 51.52 C ATOM 2156 CG GLU A 143 3.171 10.418 -3.531 1.00 52.13 C ATOM 2157 CD GLU A 143 1.748 10.739 -3.081 1.00 33.53 C ATOM 2158 OE1 GLU A 143 1.125 9.874 -2.439 1.00 54.50 O ATOM 2159 OE2 GLU A 143 1.252 11.857 -3.347 1.00 55.03 O ATOM 0 H GLU A 143 6.093 10.434 -0.808 1.00 62.24 H new ATOM 0 HA GLU A 143 5.635 9.229 -3.328 1.00 62.23 H new ATOM 0 HB2 GLU A 143 3.925 9.922 -1.575 1.00 51.52 H new ATOM 0 HB3 GLU A 143 4.196 11.589 -2.042 1.00 51.52 H new ATOM 0 HG2 GLU A 143 3.442 11.078 -4.355 1.00 52.13 H new ATOM 0 HG3 GLU A 143 3.202 9.399 -3.916 1.00 52.13 H new ATOM 2166 N ARG A 144 6.901 12.249 -3.403 1.00 12.12 N ATOM 2167 CA ARG A 144 7.480 13.308 -4.253 1.00 71.13 C ATOM 2168 C ARG A 144 8.655 12.787 -5.113 1.00 33.23 C ATOM 2169 O ARG A 144 9.058 13.453 -6.072 1.00 53.14 O ATOM 2170 CB ARG A 144 7.935 14.500 -3.382 1.00 4.31 C ATOM 2171 CG ARG A 144 6.812 15.137 -2.544 1.00 70.42 C ATOM 2172 CD ARG A 144 7.317 16.285 -1.653 1.00 52.15 C ATOM 2173 NE ARG A 144 8.407 15.855 -0.752 1.00 60.43 N ATOM 2174 CZ ARG A 144 8.724 16.435 0.417 1.00 74.21 C ATOM 2175 NH1 ARG A 144 8.045 17.487 0.871 1.00 21.55 N ATOM 2176 NH2 ARG A 144 9.727 15.946 1.132 1.00 34.02 N ATOM 0 H ARG A 144 7.100 12.367 -2.410 1.00 12.12 H new ATOM 0 HA ARG A 144 6.701 13.640 -4.939 1.00 71.13 H new ATOM 0 HB2 ARG A 144 8.726 14.164 -2.712 1.00 4.31 H new ATOM 0 HB3 ARG A 144 8.367 15.263 -4.029 1.00 4.31 H new ATOM 0 HG2 ARG A 144 6.036 15.514 -3.210 1.00 70.42 H new ATOM 0 HG3 ARG A 144 6.352 14.372 -1.919 1.00 70.42 H new ATOM 0 HD2 ARG A 144 7.669 17.103 -2.282 1.00 52.15 H new ATOM 0 HD3 ARG A 144 6.489 16.673 -1.059 1.00 52.15 H new ATOM 0 HE ARG A 144 8.964 15.051 -1.042 1.00 60.43 H new ATOM 0 HH11 ARG A 144 7.269 17.866 0.328 1.00 21.55 H new ATOM 0 HH12 ARG A 144 8.301 17.914 1.761 1.00 21.55 H new ATOM 0 HH21 ARG A 144 10.249 15.138 0.793 1.00 34.02 H new ATOM 0 HH22 ARG A 144 9.977 16.378 2.022 1.00 34.02 H new ATOM 2190 N PHE A 145 9.200 11.601 -4.769 1.00 53.50 N ATOM 2191 CA PHE A 145 10.277 10.958 -5.559 1.00 1.41 C ATOM 2192 C PHE A 145 9.712 10.165 -6.768 1.00 51.22 C ATOM 2193 O PHE A 145 10.490 9.614 -7.557 1.00 33.12 O ATOM 2194 CB PHE A 145 11.134 10.025 -4.661 1.00 54.45 C ATOM 2195 CG PHE A 145 11.888 10.731 -3.529 1.00 15.53 C ATOM 2196 CD1 PHE A 145 12.958 11.578 -3.804 1.00 74.55 C ATOM 2197 CD2 PHE A 145 11.543 10.531 -2.194 1.00 43.50 C ATOM 2198 CE1 PHE A 145 13.653 12.201 -2.783 1.00 52.24 C ATOM 2199 CE2 PHE A 145 12.234 11.158 -1.172 1.00 13.43 C ATOM 2200 CZ PHE A 145 13.289 11.988 -1.467 1.00 71.45 C ATOM 0 H PHE A 145 8.913 11.067 -3.949 1.00 53.50 H new ATOM 0 HA PHE A 145 10.910 11.755 -5.950 1.00 1.41 H new ATOM 0 HB2 PHE A 145 10.484 9.266 -4.226 1.00 54.45 H new ATOM 0 HB3 PHE A 145 11.857 9.504 -5.289 1.00 54.45 H new ATOM 0 HD1 PHE A 145 13.250 11.751 -4.829 1.00 74.55 H new ATOM 0 HD2 PHE A 145 10.721 9.874 -1.952 1.00 43.50 H new ATOM 0 HE1 PHE A 145 14.481 12.855 -3.015 1.00 52.24 H new ATOM 0 HE2 PHE A 145 11.945 10.995 -0.144 1.00 13.43 H new ATOM 0 HZ PHE A 145 13.833 12.474 -0.671 1.00 71.45 H new ATOM 2210 N GLY A 146 8.367 10.114 -6.906 1.00 3.03 N ATOM 2211 CA GLY A 146 7.714 9.461 -8.059 1.00 5.14 C ATOM 2212 C GLY A 146 7.364 10.453 -9.166 1.00 21.15 C ATOM 2213 O GLY A 146 7.613 11.658 -9.022 1.00 45.13 O ATOM 0 H GLY A 146 7.715 10.517 -6.233 1.00 3.03 H new ATOM 0 HA2 GLY A 146 8.374 8.691 -8.459 1.00 5.14 H new ATOM 0 HA3 GLY A 146 6.806 8.960 -7.723 1.00 5.14 H new ATOM 2217 N SER A 147 6.759 9.958 -10.261 1.00 1.42 N ATOM 2218 CA SER A 147 6.421 10.775 -11.456 1.00 1.22 C ATOM 2219 C SER A 147 4.972 10.514 -11.906 1.00 12.43 C ATOM 2220 O SER A 147 4.341 9.567 -11.440 1.00 74.52 O ATOM 2221 CB SER A 147 7.410 10.461 -12.598 1.00 23.15 C ATOM 2222 OG SER A 147 8.746 10.589 -12.157 1.00 52.11 O ATOM 0 H SER A 147 6.487 8.979 -10.349 1.00 1.42 H new ATOM 0 HA SER A 147 6.504 11.830 -11.195 1.00 1.22 H new ATOM 0 HB2 SER A 147 7.239 9.449 -12.964 1.00 23.15 H new ATOM 0 HB3 SER A 147 7.233 11.137 -13.434 1.00 23.15 H new ATOM 0 HG SER A 147 9.045 9.740 -11.769 1.00 52.11 H new ATOM 2228 N ARG A 148 4.474 11.352 -12.840 1.00 74.52 N ATOM 2229 CA ARG A 148 3.063 11.332 -13.304 1.00 31.44 C ATOM 2230 C ARG A 148 2.701 10.027 -14.056 1.00 11.01 C ATOM 2231 O ARG A 148 1.534 9.617 -14.058 1.00 11.43 O ATOM 2232 CB ARG A 148 2.775 12.570 -14.204 1.00 64.21 C ATOM 2233 CG ARG A 148 2.947 13.937 -13.500 1.00 53.21 C ATOM 2234 CD ARG A 148 1.946 14.169 -12.349 1.00 42.32 C ATOM 2235 NE ARG A 148 2.269 15.401 -11.596 1.00 24.45 N ATOM 2236 CZ ARG A 148 1.429 16.414 -11.335 1.00 34.23 C ATOM 2237 NH1 ARG A 148 0.172 16.392 -11.754 1.00 55.11 N ATOM 2238 NH2 ARG A 148 1.869 17.458 -10.650 1.00 51.24 N ATOM 0 H ARG A 148 5.039 12.067 -13.298 1.00 74.52 H new ATOM 0 HA ARG A 148 2.434 11.372 -12.415 1.00 31.44 H new ATOM 0 HB2 ARG A 148 3.439 12.536 -15.068 1.00 64.21 H new ATOM 0 HB3 ARG A 148 1.755 12.498 -14.582 1.00 64.21 H new ATOM 0 HG2 ARG A 148 3.962 14.009 -13.108 1.00 53.21 H new ATOM 0 HG3 ARG A 148 2.832 14.733 -14.236 1.00 53.21 H new ATOM 0 HD2 ARG A 148 0.936 14.241 -12.752 1.00 42.32 H new ATOM 0 HD3 ARG A 148 1.960 13.313 -11.674 1.00 42.32 H new ATOM 0 HE ARG A 148 3.221 15.489 -11.241 1.00 24.45 H new ATOM 0 HH11 ARG A 148 -0.174 15.594 -12.286 1.00 55.11 H new ATOM 0 HH12 ARG A 148 -0.449 17.173 -11.544 1.00 55.11 H new ATOM 0 HH21 ARG A 148 2.836 17.485 -10.328 1.00 51.24 H new ATOM 0 HH22 ARG A 148 1.241 18.235 -10.445 1.00 51.24 H new ATOM 2252 N ASN A 149 3.706 9.398 -14.699 1.00 53.10 N ATOM 2253 CA ASN A 149 3.534 8.118 -15.433 1.00 13.41 C ATOM 2254 C ASN A 149 3.579 6.908 -14.479 1.00 31.24 C ATOM 2255 O ASN A 149 3.163 5.803 -14.849 1.00 73.42 O ATOM 2256 CB ASN A 149 4.618 7.956 -16.543 1.00 24.22 C ATOM 2257 CG ASN A 149 6.064 7.807 -16.027 1.00 11.15 C ATOM 2258 OD1 ASN A 149 6.436 8.348 -14.984 1.00 21.13 O ATOM 2259 ND2 ASN A 149 6.893 7.077 -16.761 1.00 61.12 N ATOM 0 H ASN A 149 4.660 9.759 -14.727 1.00 53.10 H new ATOM 0 HA ASN A 149 2.551 8.150 -15.903 1.00 13.41 H new ATOM 0 HB2 ASN A 149 4.372 7.082 -17.145 1.00 24.22 H new ATOM 0 HB3 ASN A 149 4.572 8.822 -17.204 1.00 24.22 H new ATOM 0 HD21 ASN A 149 7.862 6.954 -16.466 1.00 61.12 H new ATOM 0 HD22 ASN A 149 6.562 6.639 -17.621 1.00 61.12 H new ATOM 2266 N GLY A 150 4.103 7.128 -13.257 1.00 71.41 N ATOM 2267 CA GLY A 150 4.238 6.075 -12.248 1.00 53.42 C ATOM 2268 C GLY A 150 5.689 5.721 -11.952 1.00 21.54 C ATOM 2269 O GLY A 150 5.975 5.108 -10.927 1.00 2.05 O ATOM 0 H GLY A 150 4.442 8.039 -12.949 1.00 71.41 H new ATOM 0 HA2 GLY A 150 3.753 6.397 -11.327 1.00 53.42 H new ATOM 0 HA3 GLY A 150 3.714 5.182 -12.589 1.00 53.42 H new ATOM 2273 N LYS A 151 6.613 6.114 -12.843 1.00 31.42 N ATOM 2274 CA LYS A 151 8.043 5.796 -12.690 1.00 2.53 C ATOM 2275 C LYS A 151 8.636 6.536 -11.476 1.00 43.02 C ATOM 2276 O LYS A 151 8.397 7.734 -11.290 1.00 40.01 O ATOM 2277 CB LYS A 151 8.829 6.169 -13.971 1.00 44.33 C ATOM 2278 CG LYS A 151 10.351 5.907 -13.887 1.00 70.31 C ATOM 2279 CD LYS A 151 11.093 6.241 -15.193 1.00 23.33 C ATOM 2280 CE LYS A 151 12.602 5.965 -15.098 1.00 61.31 C ATOM 2281 NZ LYS A 151 12.891 4.540 -14.777 1.00 22.13 N ATOM 0 H LYS A 151 6.395 6.654 -13.680 1.00 31.42 H new ATOM 0 HA LYS A 151 8.133 4.722 -12.526 1.00 2.53 H new ATOM 0 HB2 LYS A 151 8.421 5.605 -14.810 1.00 44.33 H new ATOM 0 HB3 LYS A 151 8.666 7.225 -14.188 1.00 44.33 H new ATOM 0 HG2 LYS A 151 10.772 6.500 -13.075 1.00 70.31 H new ATOM 0 HG3 LYS A 151 10.520 4.860 -13.637 1.00 70.31 H new ATOM 0 HD2 LYS A 151 10.670 5.654 -16.008 1.00 23.33 H new ATOM 0 HD3 LYS A 151 10.933 7.291 -15.440 1.00 23.33 H new ATOM 0 HE2 LYS A 151 13.078 6.227 -16.043 1.00 61.31 H new ATOM 0 HE3 LYS A 151 13.040 6.605 -14.332 1.00 61.31 H new ATOM 0 HZ1 LYS A 151 13.909 4.359 -14.888 1.00 22.13 H new ATOM 0 HZ2 LYS A 151 12.609 4.341 -13.796 1.00 22.13 H new ATOM 0 HZ3 LYS A 151 12.357 3.924 -15.422 1.00 22.13 H new ATOM 2295 N THR A 152 9.403 5.807 -10.660 1.00 73.22 N ATOM 2296 CA THR A 152 10.093 6.363 -9.498 1.00 72.10 C ATOM 2297 C THR A 152 11.514 6.801 -9.895 1.00 21.44 C ATOM 2298 O THR A 152 12.287 6.003 -10.443 1.00 4.35 O ATOM 2299 CB THR A 152 10.135 5.310 -8.343 1.00 44.33 C ATOM 2300 OG1 THR A 152 10.698 4.069 -8.815 1.00 51.04 O ATOM 2301 CG2 THR A 152 8.735 5.038 -7.779 1.00 63.25 C ATOM 0 H THR A 152 9.562 4.808 -10.790 1.00 73.22 H new ATOM 0 HA THR A 152 9.550 7.238 -9.141 1.00 72.10 H new ATOM 0 HB THR A 152 10.759 5.724 -7.550 1.00 44.33 H new ATOM 0 HG1 THR A 152 11.316 4.250 -9.554 1.00 51.04 H new ATOM 0 HG21 THR A 152 8.802 4.301 -6.978 1.00 63.25 H new ATOM 0 HG22 THR A 152 8.315 5.964 -7.386 1.00 63.25 H new ATOM 0 HG23 THR A 152 8.092 4.655 -8.571 1.00 63.25 H new ATOM 2309 N SER A 153 11.827 8.092 -9.656 1.00 42.02 N ATOM 2310 CA SER A 153 13.176 8.655 -9.855 1.00 5.45 C ATOM 2311 C SER A 153 14.174 7.991 -8.895 1.00 74.11 C ATOM 2312 O SER A 153 15.332 7.755 -9.247 1.00 62.22 O ATOM 2313 CB SER A 153 13.157 10.189 -9.630 1.00 1.23 C ATOM 2314 OG SER A 153 14.445 10.775 -9.771 1.00 14.40 O ATOM 0 H SER A 153 11.148 8.774 -9.319 1.00 42.02 H new ATOM 0 HA SER A 153 13.489 8.456 -10.880 1.00 5.45 H new ATOM 0 HB2 SER A 153 12.472 10.649 -10.342 1.00 1.23 H new ATOM 0 HB3 SER A 153 12.771 10.402 -8.633 1.00 1.23 H new ATOM 0 HG SER A 153 14.383 11.742 -9.622 1.00 14.40 H new ATOM 2320 N LYS A 154 13.690 7.692 -7.677 1.00 15.32 N ATOM 2321 CA LYS A 154 14.480 7.073 -6.603 1.00 61.44 C ATOM 2322 C LYS A 154 13.824 5.743 -6.205 1.00 51.54 C ATOM 2323 O LYS A 154 12.593 5.678 -6.078 1.00 21.10 O ATOM 2324 CB LYS A 154 14.570 8.032 -5.385 1.00 51.32 C ATOM 2325 CG LYS A 154 15.135 9.440 -5.703 1.00 51.23 C ATOM 2326 CD LYS A 154 16.537 9.400 -6.357 1.00 31.20 C ATOM 2327 CE LYS A 154 17.096 10.801 -6.648 1.00 75.23 C ATOM 2328 NZ LYS A 154 16.180 11.601 -7.506 1.00 74.12 N ATOM 0 H LYS A 154 12.723 7.877 -7.409 1.00 15.32 H new ATOM 0 HA LYS A 154 15.494 6.880 -6.953 1.00 61.44 H new ATOM 0 HB2 LYS A 154 13.575 8.145 -4.955 1.00 51.32 H new ATOM 0 HB3 LYS A 154 15.196 7.569 -4.622 1.00 51.32 H new ATOM 0 HG2 LYS A 154 14.445 9.960 -6.368 1.00 51.23 H new ATOM 0 HG3 LYS A 154 15.187 10.020 -4.782 1.00 51.23 H new ATOM 0 HD2 LYS A 154 17.225 8.868 -5.700 1.00 31.20 H new ATOM 0 HD3 LYS A 154 16.483 8.834 -7.287 1.00 31.20 H new ATOM 0 HE2 LYS A 154 17.263 11.327 -5.708 1.00 75.23 H new ATOM 0 HE3 LYS A 154 18.065 10.710 -7.139 1.00 75.23 H new ATOM 0 HZ1 LYS A 154 16.718 12.355 -7.980 1.00 74.12 H new ATOM 0 HZ2 LYS A 154 15.746 10.983 -8.221 1.00 74.12 H new ATOM 0 HZ3 LYS A 154 15.435 12.025 -6.917 1.00 74.12 H new ATOM 2342 N LYS A 155 14.647 4.691 -6.009 1.00 21.33 N ATOM 2343 CA LYS A 155 14.152 3.326 -5.738 1.00 61.03 C ATOM 2344 C LYS A 155 13.828 3.167 -4.255 1.00 21.41 C ATOM 2345 O LYS A 155 14.685 2.806 -3.442 1.00 34.44 O ATOM 2346 CB LYS A 155 15.187 2.261 -6.200 1.00 53.13 C ATOM 2347 CG LYS A 155 15.525 2.358 -7.697 1.00 22.14 C ATOM 2348 CD LYS A 155 14.276 2.243 -8.604 1.00 74.31 C ATOM 2349 CE LYS A 155 14.618 2.451 -10.083 1.00 3.30 C ATOM 2350 NZ LYS A 155 15.628 1.477 -10.564 1.00 74.25 N ATOM 0 H LYS A 155 15.664 4.763 -6.034 1.00 21.33 H new ATOM 0 HA LYS A 155 13.236 3.169 -6.308 1.00 61.03 H new ATOM 0 HB2 LYS A 155 16.102 2.376 -5.619 1.00 53.13 H new ATOM 0 HB3 LYS A 155 14.796 1.266 -5.986 1.00 53.13 H new ATOM 0 HG2 LYS A 155 16.023 3.308 -7.891 1.00 22.14 H new ATOM 0 HG3 LYS A 155 16.231 1.569 -7.957 1.00 22.14 H new ATOM 0 HD2 LYS A 155 13.821 1.261 -8.472 1.00 74.31 H new ATOM 0 HD3 LYS A 155 13.535 2.981 -8.296 1.00 74.31 H new ATOM 0 HE2 LYS A 155 13.711 2.358 -10.681 1.00 3.30 H new ATOM 0 HE3 LYS A 155 14.993 3.464 -10.229 1.00 3.30 H new ATOM 0 HZ1 LYS A 155 15.743 1.575 -11.593 1.00 74.25 H new ATOM 0 HZ2 LYS A 155 16.538 1.660 -10.095 1.00 74.25 H new ATOM 0 HZ3 LYS A 155 15.312 0.511 -10.342 1.00 74.25 H new ATOM 2364 N ILE A 156 12.574 3.449 -3.925 1.00 42.11 N ATOM 2365 CA ILE A 156 12.075 3.393 -2.558 1.00 24.42 C ATOM 2366 C ILE A 156 11.650 1.954 -2.255 1.00 52.21 C ATOM 2367 O ILE A 156 10.977 1.330 -3.061 1.00 4.12 O ATOM 2368 CB ILE A 156 10.899 4.409 -2.370 1.00 21.14 C ATOM 2369 CG1 ILE A 156 11.389 5.836 -2.781 1.00 40.30 C ATOM 2370 CG2 ILE A 156 10.343 4.393 -0.919 1.00 63.25 C ATOM 2371 CD1 ILE A 156 10.315 6.892 -2.818 1.00 33.30 C ATOM 0 H ILE A 156 11.868 3.726 -4.607 1.00 42.11 H new ATOM 0 HA ILE A 156 12.855 3.680 -1.853 1.00 24.42 H new ATOM 0 HB ILE A 156 10.072 4.113 -3.015 1.00 21.14 H new ATOM 0 HG12 ILE A 156 12.165 6.152 -2.083 1.00 40.30 H new ATOM 0 HG13 ILE A 156 11.852 5.775 -3.766 1.00 40.30 H new ATOM 0 HG21 ILE A 156 9.529 5.113 -0.833 1.00 63.25 H new ATOM 0 HG22 ILE A 156 9.972 3.396 -0.682 1.00 63.25 H new ATOM 0 HG23 ILE A 156 11.138 4.659 -0.222 1.00 63.25 H new ATOM 0 HD11 ILE A 156 10.752 7.846 -3.113 1.00 33.30 H new ATOM 0 HD12 ILE A 156 9.548 6.606 -3.538 1.00 33.30 H new ATOM 0 HD13 ILE A 156 9.866 6.989 -1.830 1.00 33.30 H new ATOM 2383 N THR A 157 12.114 1.421 -1.126 1.00 33.31 N ATOM 2384 CA THR A 157 11.894 0.030 -0.713 1.00 72.35 C ATOM 2385 C THR A 157 11.588 -0.010 0.792 1.00 25.34 C ATOM 2386 O THR A 157 11.961 0.916 1.527 1.00 73.23 O ATOM 2387 CB THR A 157 13.171 -0.834 -1.007 1.00 23.33 C ATOM 2388 OG1 THR A 157 14.322 -0.198 -0.419 1.00 14.11 O ATOM 2389 CG2 THR A 157 13.423 -1.043 -2.514 1.00 10.42 C ATOM 0 H THR A 157 12.667 1.954 -0.455 1.00 33.31 H new ATOM 0 HA THR A 157 11.054 -0.378 -1.275 1.00 72.35 H new ATOM 0 HB THR A 157 13.000 -1.817 -0.569 1.00 23.33 H new ATOM 0 HG1 THR A 157 15.121 -0.736 -0.599 1.00 14.11 H new ATOM 0 HG21 THR A 157 14.319 -1.648 -2.653 1.00 10.42 H new ATOM 0 HG22 THR A 157 12.569 -1.554 -2.958 1.00 10.42 H new ATOM 0 HG23 THR A 157 13.559 -0.076 -2.998 1.00 10.42 H new ATOM 2397 N ILE A 158 10.901 -1.072 1.245 1.00 30.42 N ATOM 2398 CA ILE A 158 10.692 -1.322 2.684 1.00 52.54 C ATOM 2399 C ILE A 158 12.013 -1.834 3.303 1.00 32.41 C ATOM 2400 O ILE A 158 12.338 -3.024 3.196 1.00 73.51 O ATOM 2401 CB ILE A 158 9.511 -2.342 2.939 1.00 5.22 C ATOM 2402 CG1 ILE A 158 8.155 -1.754 2.422 1.00 52.55 C ATOM 2403 CG2 ILE A 158 9.412 -2.737 4.435 1.00 31.23 C ATOM 2404 CD1 ILE A 158 6.926 -2.609 2.710 1.00 15.32 C ATOM 0 H ILE A 158 10.480 -1.773 0.636 1.00 30.42 H new ATOM 0 HA ILE A 158 10.403 -0.387 3.164 1.00 52.54 H new ATOM 0 HB ILE A 158 9.728 -3.251 2.377 1.00 5.22 H new ATOM 0 HG12 ILE A 158 8.008 -0.772 2.871 1.00 52.55 H new ATOM 0 HG13 ILE A 158 8.229 -1.604 1.345 1.00 52.55 H new ATOM 0 HG21 ILE A 158 8.589 -3.439 4.572 1.00 31.23 H new ATOM 0 HG22 ILE A 158 10.345 -3.205 4.750 1.00 31.23 H new ATOM 0 HG23 ILE A 158 9.232 -1.845 5.036 1.00 31.23 H new ATOM 0 HD11 ILE A 158 6.039 -2.116 2.313 1.00 15.32 H new ATOM 0 HD12 ILE A 158 7.042 -3.584 2.237 1.00 15.32 H new ATOM 0 HD13 ILE A 158 6.817 -2.739 3.787 1.00 15.32 H new ATOM 2416 N ALA A 159 12.794 -0.898 3.884 1.00 30.32 N ATOM 2417 CA ALA A 159 14.095 -1.176 4.540 1.00 43.13 C ATOM 2418 C ALA A 159 13.995 -2.303 5.574 1.00 12.43 C ATOM 2419 O ALA A 159 14.809 -3.236 5.577 1.00 22.14 O ATOM 2420 CB ALA A 159 14.637 0.098 5.211 1.00 3.05 C ATOM 0 H ALA A 159 12.536 0.088 3.912 1.00 30.32 H new ATOM 0 HA ALA A 159 14.783 -1.503 3.760 1.00 43.13 H new ATOM 0 HB1 ALA A 159 15.592 -0.120 5.689 1.00 3.05 H new ATOM 0 HB2 ALA A 159 14.777 0.874 4.459 1.00 3.05 H new ATOM 0 HB3 ALA A 159 13.927 0.444 5.962 1.00 3.05 H new ATOM 2426 N ASP A 160 12.981 -2.208 6.445 1.00 24.14 N ATOM 2427 CA ASP A 160 12.800 -3.152 7.553 1.00 10.02 C ATOM 2428 C ASP A 160 11.317 -3.217 7.962 1.00 21.11 C ATOM 2429 O ASP A 160 10.528 -2.352 7.585 1.00 73.50 O ATOM 2430 CB ASP A 160 13.726 -2.737 8.739 1.00 3.31 C ATOM 2431 CG ASP A 160 13.846 -3.778 9.870 1.00 32.40 C ATOM 2432 OD1 ASP A 160 13.726 -4.993 9.596 1.00 53.24 O ATOM 2433 OD2 ASP A 160 14.080 -3.387 11.035 1.00 55.32 O ATOM 0 H ASP A 160 12.268 -1.479 6.401 1.00 24.14 H new ATOM 0 HA ASP A 160 13.085 -4.156 7.240 1.00 10.02 H new ATOM 0 HB2 ASP A 160 14.722 -2.532 8.347 1.00 3.31 H new ATOM 0 HB3 ASP A 160 13.352 -1.805 9.162 1.00 3.31 H new ATOM 2438 N CYS A 161 10.946 -4.281 8.686 1.00 4.13 N ATOM 2439 CA CYS A 161 9.594 -4.475 9.246 1.00 73.22 C ATOM 2440 C CYS A 161 9.732 -4.990 10.694 1.00 64.23 C ATOM 2441 O CYS A 161 10.860 -5.102 11.209 1.00 63.02 O ATOM 2442 CB CYS A 161 8.789 -5.450 8.358 1.00 14.52 C ATOM 2443 SG CYS A 161 9.514 -7.096 8.200 1.00 30.33 S ATOM 0 H CYS A 161 11.584 -5.046 8.905 1.00 4.13 H new ATOM 0 HA CYS A 161 9.046 -3.533 9.264 1.00 73.22 H new ATOM 0 HB2 CYS A 161 7.784 -5.548 8.768 1.00 14.52 H new ATOM 0 HB3 CYS A 161 8.687 -5.015 7.364 1.00 14.52 H new ATOM 0 HG CYS A 161 8.567 -7.975 8.057 1.00 30.33 H new ATOM 2449 N GLY A 162 8.607 -5.352 11.339 1.00 11.03 N ATOM 2450 CA GLY A 162 8.592 -5.584 12.792 1.00 30.54 C ATOM 2451 C GLY A 162 7.441 -4.845 13.449 1.00 52.45 C ATOM 2452 O GLY A 162 7.651 -4.022 14.346 1.00 43.02 O ATOM 0 H GLY A 162 7.706 -5.489 10.881 1.00 11.03 H new ATOM 0 HA2 GLY A 162 8.505 -6.652 12.992 1.00 30.54 H new ATOM 0 HA3 GLY A 162 9.536 -5.254 13.226 1.00 30.54 H new ATOM 2456 N GLN A 163 6.224 -5.122 12.939 1.00 34.13 N ATOM 2457 CA GLN A 163 4.979 -4.399 13.273 1.00 21.31 C ATOM 2458 C GLN A 163 4.760 -4.181 14.796 1.00 15.21 C ATOM 2459 O GLN A 163 5.090 -5.042 15.620 1.00 64.02 O ATOM 2460 CB GLN A 163 3.772 -5.137 12.636 1.00 15.34 C ATOM 2461 CG GLN A 163 3.487 -6.556 13.151 1.00 33.43 C ATOM 2462 CD GLN A 163 2.304 -7.235 12.443 1.00 13.24 C ATOM 2463 OE1 GLN A 163 2.032 -6.989 11.268 1.00 24.22 O ATOM 2464 NE2 GLN A 163 1.613 -8.115 13.144 1.00 2.14 N ATOM 0 H GLN A 163 6.075 -5.874 12.266 1.00 34.13 H new ATOM 0 HA GLN A 163 5.072 -3.396 12.855 1.00 21.31 H new ATOM 0 HB2 GLN A 163 2.880 -4.531 12.794 1.00 15.34 H new ATOM 0 HB3 GLN A 163 3.934 -5.191 11.560 1.00 15.34 H new ATOM 0 HG2 GLN A 163 4.379 -7.168 13.020 1.00 33.43 H new ATOM 0 HG3 GLN A 163 3.284 -6.512 14.221 1.00 33.43 H new ATOM 0 HE21 GLN A 163 1.860 -8.300 14.116 1.00 2.14 H new ATOM 0 HE22 GLN A 163 0.832 -8.610 12.713 1.00 2.14 H new ATOM 2473 N LEU A 164 4.203 -3.002 15.142 1.00 13.12 N ATOM 2474 CA LEU A 164 4.066 -2.538 16.537 1.00 12.54 C ATOM 2475 C LEU A 164 2.650 -2.804 17.070 1.00 74.43 C ATOM 2476 O LEU A 164 1.702 -2.120 16.680 1.00 45.42 O ATOM 2477 CB LEU A 164 4.372 -1.018 16.619 1.00 1.11 C ATOM 2478 CG LEU A 164 5.831 -0.590 16.273 1.00 31.23 C ATOM 2479 CD1 LEU A 164 5.977 0.947 16.272 1.00 54.50 C ATOM 2480 CD2 LEU A 164 6.854 -1.256 17.225 1.00 60.13 C ATOM 0 H LEU A 164 3.834 -2.342 14.457 1.00 13.12 H new ATOM 0 HA LEU A 164 4.777 -3.091 17.150 1.00 12.54 H new ATOM 0 HB2 LEU A 164 3.693 -0.495 15.946 1.00 1.11 H new ATOM 0 HB3 LEU A 164 4.145 -0.677 17.629 1.00 1.11 H new ATOM 0 HG LEU A 164 6.048 -0.941 15.264 1.00 31.23 H new ATOM 0 HD11 LEU A 164 7.005 1.215 16.027 1.00 54.50 H new ATOM 0 HD12 LEU A 164 5.304 1.376 15.530 1.00 54.50 H new ATOM 0 HD13 LEU A 164 5.725 1.337 17.258 1.00 54.50 H new ATOM 0 HD21 LEU A 164 7.861 -0.937 16.957 1.00 60.13 H new ATOM 0 HD22 LEU A 164 6.641 -0.961 18.252 1.00 60.13 H new ATOM 0 HD23 LEU A 164 6.781 -2.340 17.137 1.00 60.13 H new ATOM 2540 N PRO B 218 -1.395 -2.944 -13.144 1.00 54.25 N ATOM 2541 CA PRO B 218 -1.967 -3.455 -11.879 1.00 24.31 C ATOM 2542 C PRO B 218 -1.902 -2.374 -10.774 1.00 34.22 C ATOM 2543 O PRO B 218 -1.014 -2.385 -9.915 1.00 24.13 O ATOM 2544 CB PRO B 218 -1.101 -4.720 -11.563 1.00 2.23 C ATOM 2545 CG PRO B 218 -0.105 -4.837 -12.702 1.00 33.23 C ATOM 2546 CD PRO B 218 -0.016 -3.458 -13.327 1.00 62.34 C ATOM 0 HA PRO B 218 -3.025 -3.709 -11.945 1.00 24.31 H new ATOM 0 HB2 PRO B 218 -0.590 -4.614 -10.606 1.00 2.23 H new ATOM 0 HB3 PRO B 218 -1.723 -5.612 -11.495 1.00 2.23 H new ATOM 0 HG2 PRO B 218 0.869 -5.163 -12.336 1.00 33.23 H new ATOM 0 HG3 PRO B 218 -0.434 -5.576 -13.433 1.00 33.23 H new ATOM 0 HD2 PRO B 218 0.722 -2.831 -12.827 1.00 62.34 H new ATOM 0 HD3 PRO B 218 0.265 -3.505 -14.379 1.00 62.34 H new ATOM 2554 N GLY B 219 -2.839 -1.420 -10.866 1.00 22.22 N ATOM 2555 CA GLY B 219 -2.940 -0.294 -9.943 1.00 60.14 C ATOM 2556 C GLY B 219 -4.126 0.609 -10.290 1.00 70.41 C ATOM 2557 O GLY B 219 -4.676 0.499 -11.393 1.00 43.13 O ATOM 0 H GLY B 219 -3.554 -1.414 -11.594 1.00 22.22 H new ATOM 0 HA2 GLY B 219 -3.050 -0.666 -8.924 1.00 60.14 H new ATOM 0 HA3 GLY B 219 -2.018 0.287 -9.973 1.00 60.14 H new ATOM 2561 N PRO B 220 -4.556 1.521 -9.361 1.00 62.32 N ATOM 2562 CA PRO B 220 -5.729 2.419 -9.582 1.00 5.24 C ATOM 2563 C PRO B 220 -5.397 3.667 -10.445 1.00 32.12 C ATOM 2564 O PRO B 220 -4.229 4.055 -10.565 1.00 63.01 O ATOM 2565 CB PRO B 220 -6.097 2.810 -8.133 1.00 15.44 C ATOM 2566 CG PRO B 220 -4.772 2.873 -7.424 1.00 71.01 C ATOM 2567 CD PRO B 220 -3.942 1.744 -8.017 1.00 21.30 C ATOM 0 HA PRO B 220 -6.532 1.939 -10.141 1.00 5.24 H new ATOM 0 HB2 PRO B 220 -6.614 3.769 -8.098 1.00 15.44 H new ATOM 0 HB3 PRO B 220 -6.759 2.074 -7.677 1.00 15.44 H new ATOM 0 HG2 PRO B 220 -4.289 3.838 -7.578 1.00 71.01 H new ATOM 0 HG3 PRO B 220 -4.896 2.747 -6.348 1.00 71.01 H new ATOM 0 HD2 PRO B 220 -2.891 2.020 -8.098 1.00 21.30 H new ATOM 0 HD3 PRO B 220 -3.989 0.846 -7.401 1.00 21.30 H new ATOM 2575 N TYR B 221 -6.451 4.294 -11.015 1.00 41.43 N ATOM 2576 CA TYR B 221 -6.334 5.498 -11.878 1.00 23.23 C ATOM 2577 C TYR B 221 -5.872 6.721 -11.064 1.00 41.21 C ATOM 2578 O TYR B 221 -6.401 6.988 -9.982 1.00 52.34 O ATOM 2579 CB TYR B 221 -7.686 5.805 -12.567 1.00 23.51 C ATOM 2580 CG TYR B 221 -8.091 4.812 -13.674 1.00 73.43 C ATOM 2581 CD1 TYR B 221 -8.618 3.552 -13.369 1.00 42.32 C ATOM 2582 CD2 TYR B 221 -7.954 5.146 -15.028 1.00 15.11 C ATOM 2583 CE1 TYR B 221 -8.997 2.671 -14.364 1.00 23.41 C ATOM 2584 CE2 TYR B 221 -8.330 4.263 -16.024 1.00 1.34 C ATOM 2585 CZ TYR B 221 -8.851 3.030 -15.687 1.00 70.41 C ATOM 2586 OH TYR B 221 -9.232 2.153 -16.682 1.00 0.45 O ATOM 0 H TYR B 221 -7.413 3.979 -10.890 1.00 41.43 H new ATOM 0 HA TYR B 221 -5.585 5.289 -12.641 1.00 23.23 H new ATOM 0 HB2 TYR B 221 -8.469 5.820 -11.808 1.00 23.51 H new ATOM 0 HB3 TYR B 221 -7.639 6.806 -12.996 1.00 23.51 H new ATOM 0 HD1 TYR B 221 -8.731 3.262 -12.335 1.00 42.32 H new ATOM 0 HD2 TYR B 221 -7.548 6.109 -15.298 1.00 15.11 H new ATOM 0 HE1 TYR B 221 -9.406 1.705 -14.106 1.00 23.41 H new ATOM 0 HE2 TYR B 221 -8.216 4.537 -17.062 1.00 1.34 H new ATOM 0 HH TYR B 221 -9.064 2.559 -17.558 1.00 0.45 H new