USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1288 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: B 57 LYS NZ :NH3+ -144:sc= 0.667 (180deg=0.136) USER MOD Set 1.2: B 64 TYR OH : rot 180:sc= -0.249 USER MOD Set 2.1: A 65 ASN : amide:sc= 0.992 K(o=1.5,f=-6.3!) USER MOD Set 2.2: A 68 HIS : no HD1:sc= 0.505 K(o=1.5,f=-3.7!) USER MOD Set 3.1: A 57 LYS NZ :NH3+ -131:sc= 1.16 (180deg=0.371) USER MOD Set 3.2: A 64 TYR OH : rot 180:sc= 1.04 USER MOD Set 4.1: A 3 LYS NZ :NH3+ 141:sc= -0.415 (180deg=-2.31!) USER MOD Set 4.2: B 50 ASN : amide:sc= 0.88 K(o=0.46,f=-8.7!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -161:sc= 0.013 (180deg=-0.265) USER MOD Single : A 4 LYS NZ :NH3+ 164:sc= -0.0378 (180deg=-0.313) USER MOD Single : A 9 ASN : amide:sc= -0.563 X(o=-0.56,f=-0.75) USER MOD Single : A 12 LYS NZ :NH3+ 172:sc= -0.0045 (180deg=-0.0667) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 18 ASN : amide:sc= -0.783 K(o=-0.78,f=0) USER MOD Single : A 24 SER OG : rot 83:sc= 0.313 USER MOD Single : A 31 LYS NZ :NH3+ 169:sc=-0.00975 (180deg=-0.144) USER MOD Single : A 33 ASN : amide:sc= -0.151 X(o=-0.15,f=-0.54) USER MOD Single : A 35 SER OG : rot 180:sc= -0.14 USER MOD Single : A 38 SER OG : rot 180:sc= 0.7 USER MOD Single : A 39 THR OG1 : rot 76:sc= 0.188 USER MOD Single : A 50 ASN : amide:sc= -1.66 K(o=-1.7,f=-0.24) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 ASN : amide:sc= -0.112 X(o=-0.11,f=-0.4) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 HIS : no HD1:sc= -0.0745 X(o=-0.074,f=-0.082) USER MOD Single : A 78 HIS : no HE2:sc= 0.00536 X(o=0.0054,f=-0.066) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 80 HIS : no HD1:sc= -0.121 X(o=-0.12,f=-0.5) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 1 MET CE :methyl -175:sc= -0.0173 (180deg=-0.0284) USER MOD Single : B 1 MET N :NH3+ -176:sc= -0.138 (180deg=-0.149) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 ASN : amide:sc= 0.614 K(o=0.61,f=-1.3) USER MOD Single : B 12 LYS NZ :NH3+ 171:sc= -0.0206 (180deg=-0.131) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=-0.022) USER MOD Single : B 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 24 SER OG : rot 180:sc= 0 USER MOD Single : B 31 LYS NZ :NH3+ -172:sc= 0.976 (180deg=0.805) USER MOD Single : B 33 ASN : amide:sc= -0.068 X(o=-0.068,f=-0.1) USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 38 SER OG : rot 180:sc= 0 USER MOD Single : B 39 THR OG1 : rot 74:sc= 0.303 USER MOD Single : B 51 LYS NZ :NH3+ 167:sc= 0.82 (180deg=0.545) USER MOD Single : B 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 65 ASN : amide:sc= -5.37! K(o=-5.4!,f=-1) USER MOD Single : B 68 HIS : no HD1:sc= 0.0543 X(o=0.054,f=-0.42) USER MOD Single : B 72 SER OG : rot 180:sc= -0.0674 USER MOD Single : B 77 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 78 HIS : no HE2:sc= -0.533 X(o=-0.53,f=-0.81) USER MOD Single : B 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 82 HIS : no HD1:sc= -0.269 X(o=-0.27,f=0.0019) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.014 15.816 -2.549 1.00 22.33 N ATOM 2 CA MET A 1 -0.922 16.543 -1.604 1.00 62.42 C ATOM 3 C MET A 1 -1.607 15.560 -0.624 1.00 21.33 C ATOM 4 O MET A 1 -2.170 15.955 0.404 1.00 23.12 O ATOM 5 CB MET A 1 -1.971 17.360 -2.426 1.00 1.14 C ATOM 6 CG MET A 1 -3.034 18.094 -1.589 1.00 61.41 C ATOM 7 SD MET A 1 -2.297 19.088 -0.272 1.00 53.04 S ATOM 8 CE MET A 1 -3.732 19.473 0.731 1.00 3.24 C ATOM 0 H1 MET A 1 0.662 16.487 -2.967 1.00 22.33 H new ATOM 0 H2 MET A 1 0.506 15.078 -2.032 1.00 22.33 H new ATOM 0 H3 MET A 1 -0.578 15.378 -3.305 1.00 22.33 H new ATOM 0 HA MET A 1 -0.335 17.234 -0.999 1.00 62.42 H new ATOM 0 HB2 MET A 1 -1.441 18.093 -3.034 1.00 1.14 H new ATOM 0 HB3 MET A 1 -2.477 16.682 -3.113 1.00 1.14 H new ATOM 0 HG2 MET A 1 -3.626 18.737 -2.240 1.00 61.41 H new ATOM 0 HG3 MET A 1 -3.718 17.366 -1.153 1.00 61.41 H new ATOM 0 HE1 MET A 1 -3.428 20.083 1.582 1.00 3.24 H new ATOM 0 HE2 MET A 1 -4.458 20.022 0.132 1.00 3.24 H new ATOM 0 HE3 MET A 1 -4.183 18.548 1.090 1.00 3.24 H new ATOM 20 N ASP A 2 -1.501 14.262 -0.916 1.00 14.01 N ATOM 21 CA ASP A 2 -2.332 13.227 -0.276 1.00 74.13 C ATOM 22 C ASP A 2 -1.663 12.569 0.942 1.00 24.10 C ATOM 23 O ASP A 2 -2.214 11.629 1.487 1.00 65.25 O ATOM 24 CB ASP A 2 -2.714 12.185 -1.346 1.00 63.52 C ATOM 25 CG ASP A 2 -3.289 12.866 -2.596 1.00 22.41 C ATOM 26 OD1 ASP A 2 -2.490 13.300 -3.458 1.00 2.23 O ATOM 27 OD2 ASP A 2 -4.524 13.027 -2.688 1.00 51.03 O ATOM 0 H ASP A 2 -0.840 13.894 -1.600 1.00 14.01 H new ATOM 0 HA ASP A 2 -3.226 13.705 0.124 1.00 74.13 H new ATOM 0 HB2 ASP A 2 -1.836 11.599 -1.618 1.00 63.52 H new ATOM 0 HB3 ASP A 2 -3.447 11.490 -0.937 1.00 63.52 H new ATOM 32 N LYS A 3 -0.529 13.119 1.411 1.00 73.21 N ATOM 33 CA LYS A 3 0.256 12.529 2.530 1.00 54.35 C ATOM 34 C LYS A 3 -0.532 12.543 3.883 1.00 23.21 C ATOM 35 O LYS A 3 -0.282 11.722 4.768 1.00 2.04 O ATOM 36 CB LYS A 3 1.614 13.271 2.670 1.00 51.41 C ATOM 37 CG LYS A 3 2.618 12.602 3.639 1.00 2.54 C ATOM 38 CD LYS A 3 3.022 11.174 3.190 1.00 5.53 C ATOM 39 CE LYS A 3 3.984 10.505 4.182 1.00 4.22 C ATOM 40 NZ LYS A 3 5.217 11.310 4.380 1.00 64.04 N ATOM 0 H LYS A 3 -0.127 13.977 1.035 1.00 73.21 H new ATOM 0 HA LYS A 3 0.442 11.482 2.290 1.00 54.35 H new ATOM 0 HB2 LYS A 3 2.075 13.346 1.685 1.00 51.41 H new ATOM 0 HB3 LYS A 3 1.423 14.289 3.011 1.00 51.41 H new ATOM 0 HG2 LYS A 3 3.512 13.221 3.714 1.00 2.54 H new ATOM 0 HG3 LYS A 3 2.178 12.554 4.635 1.00 2.54 H new ATOM 0 HD2 LYS A 3 2.127 10.561 3.085 1.00 5.53 H new ATOM 0 HD3 LYS A 3 3.492 11.223 2.208 1.00 5.53 H new ATOM 0 HE2 LYS A 3 3.482 10.367 5.139 1.00 4.22 H new ATOM 0 HE3 LYS A 3 4.252 9.513 3.817 1.00 4.22 H new ATOM 0 HZ1 LYS A 3 5.496 11.277 5.381 1.00 64.04 H new ATOM 0 HZ2 LYS A 3 5.983 10.921 3.794 1.00 64.04 H new ATOM 0 HZ3 LYS A 3 5.036 12.296 4.103 1.00 64.04 H new ATOM 54 N LYS A 4 -1.466 13.498 4.032 1.00 62.01 N ATOM 55 CA LYS A 4 -2.440 13.527 5.159 1.00 42.01 C ATOM 56 C LYS A 4 -3.707 12.705 4.823 1.00 3.33 C ATOM 57 O LYS A 4 -4.311 12.070 5.700 1.00 70.14 O ATOM 58 CB LYS A 4 -2.838 14.991 5.473 1.00 52.30 C ATOM 59 CG LYS A 4 -1.702 15.856 6.054 1.00 74.21 C ATOM 60 CD LYS A 4 -1.177 15.325 7.413 1.00 33.44 C ATOM 61 CE LYS A 4 -0.210 16.308 8.097 1.00 12.21 C ATOM 62 NZ LYS A 4 -0.869 17.609 8.398 1.00 42.34 N ATOM 0 H LYS A 4 -1.575 14.275 3.380 1.00 62.01 H new ATOM 0 HA LYS A 4 -1.962 13.081 6.031 1.00 42.01 H new ATOM 0 HB2 LYS A 4 -3.201 15.459 4.558 1.00 52.30 H new ATOM 0 HB3 LYS A 4 -3.669 14.984 6.179 1.00 52.30 H new ATOM 0 HG2 LYS A 4 -0.878 15.893 5.341 1.00 74.21 H new ATOM 0 HG3 LYS A 4 -2.059 16.878 6.182 1.00 74.21 H new ATOM 0 HD2 LYS A 4 -2.022 15.132 8.074 1.00 33.44 H new ATOM 0 HD3 LYS A 4 -0.671 14.373 7.256 1.00 33.44 H new ATOM 0 HE2 LYS A 4 0.164 15.867 9.021 1.00 12.21 H new ATOM 0 HE3 LYS A 4 0.653 16.477 7.453 1.00 12.21 H new ATOM 0 HZ1 LYS A 4 -0.295 18.138 9.085 1.00 42.34 H new ATOM 0 HZ2 LYS A 4 -0.960 18.163 7.523 1.00 42.34 H new ATOM 0 HZ3 LYS A 4 -1.814 17.436 8.797 1.00 42.34 H new ATOM 76 N ILE A 5 -4.090 12.740 3.537 1.00 12.54 N ATOM 77 CA ILE A 5 -5.293 12.061 3.011 1.00 2.41 C ATOM 78 C ILE A 5 -5.170 10.515 3.114 1.00 3.35 C ATOM 79 O ILE A 5 -6.180 9.825 3.236 1.00 51.13 O ATOM 80 CB ILE A 5 -5.562 12.517 1.523 1.00 54.22 C ATOM 81 CG1 ILE A 5 -5.661 14.082 1.448 1.00 31.54 C ATOM 82 CG2 ILE A 5 -6.827 11.849 0.924 1.00 74.30 C ATOM 83 CD1 ILE A 5 -5.786 14.658 0.044 1.00 12.10 C ATOM 0 H ILE A 5 -3.569 13.246 2.821 1.00 12.54 H new ATOM 0 HA ILE A 5 -6.146 12.352 3.625 1.00 2.41 H new ATOM 0 HB ILE A 5 -4.718 12.186 0.918 1.00 54.22 H new ATOM 0 HG12 ILE A 5 -6.522 14.404 2.033 1.00 31.54 H new ATOM 0 HG13 ILE A 5 -4.777 14.509 1.921 1.00 31.54 H new ATOM 0 HG21 ILE A 5 -6.970 12.194 -0.100 1.00 74.30 H new ATOM 0 HG22 ILE A 5 -6.703 10.766 0.928 1.00 74.30 H new ATOM 0 HG23 ILE A 5 -7.698 12.117 1.522 1.00 74.30 H new ATOM 0 HD11 ILE A 5 -5.848 15.745 0.101 1.00 12.10 H new ATOM 0 HD12 ILE A 5 -4.914 14.374 -0.545 1.00 12.10 H new ATOM 0 HD13 ILE A 5 -6.686 14.268 -0.431 1.00 12.10 H new ATOM 95 N VAL A 6 -3.920 9.985 3.115 1.00 55.45 N ATOM 96 CA VAL A 6 -3.654 8.536 3.325 1.00 31.25 C ATOM 97 C VAL A 6 -4.114 8.094 4.734 1.00 61.41 C ATOM 98 O VAL A 6 -4.569 6.969 4.913 1.00 70.13 O ATOM 99 CB VAL A 6 -2.128 8.159 3.115 1.00 52.21 C ATOM 100 CG1 VAL A 6 -1.640 8.619 1.730 1.00 0.14 C ATOM 101 CG2 VAL A 6 -1.217 8.727 4.235 1.00 43.41 C ATOM 0 H VAL A 6 -3.077 10.541 2.972 1.00 55.45 H new ATOM 0 HA VAL A 6 -4.230 8.002 2.569 1.00 31.25 H new ATOM 0 HB VAL A 6 -2.058 7.073 3.170 1.00 52.21 H new ATOM 0 HG11 VAL A 6 -0.591 8.351 1.606 1.00 0.14 H new ATOM 0 HG12 VAL A 6 -2.233 8.133 0.955 1.00 0.14 H new ATOM 0 HG13 VAL A 6 -1.750 9.700 1.646 1.00 0.14 H new ATOM 0 HG21 VAL A 6 -0.183 8.440 4.043 1.00 43.41 H new ATOM 0 HG22 VAL A 6 -1.295 9.814 4.251 1.00 43.41 H new ATOM 0 HG23 VAL A 6 -1.532 8.326 5.198 1.00 43.41 H new ATOM 111 N GLY A 7 -4.001 9.024 5.714 1.00 40.53 N ATOM 112 CA GLY A 7 -4.448 8.797 7.092 1.00 32.40 C ATOM 113 C GLY A 7 -5.968 8.814 7.234 1.00 34.24 C ATOM 114 O GLY A 7 -6.547 7.966 7.924 1.00 70.15 O ATOM 0 H GLY A 7 -3.597 9.948 5.562 1.00 40.53 H new ATOM 0 HA2 GLY A 7 -4.066 7.837 7.439 1.00 32.40 H new ATOM 0 HA3 GLY A 7 -4.019 9.563 7.739 1.00 32.40 H new ATOM 118 N ALA A 8 -6.613 9.788 6.556 1.00 44.25 N ATOM 119 CA ALA A 8 -8.091 9.901 6.506 1.00 31.01 C ATOM 120 C ALA A 8 -8.734 8.687 5.781 1.00 50.51 C ATOM 121 O ALA A 8 -9.834 8.249 6.129 1.00 72.14 O ATOM 122 CB ALA A 8 -8.492 11.217 5.819 1.00 25.30 C ATOM 0 H ALA A 8 -6.129 10.515 6.030 1.00 44.25 H new ATOM 0 HA ALA A 8 -8.465 9.903 7.530 1.00 31.01 H new ATOM 0 HB1 ALA A 8 -9.579 11.294 5.786 1.00 25.30 H new ATOM 0 HB2 ALA A 8 -8.086 12.059 6.380 1.00 25.30 H new ATOM 0 HB3 ALA A 8 -8.096 11.233 4.804 1.00 25.30 H new ATOM 128 N ASN A 9 -8.028 8.160 4.763 1.00 74.21 N ATOM 129 CA ASN A 9 -8.440 6.943 4.024 1.00 71.43 C ATOM 130 C ASN A 9 -8.173 5.666 4.853 1.00 43.43 C ATOM 131 O ASN A 9 -8.974 4.732 4.824 1.00 54.13 O ATOM 132 CB ASN A 9 -7.703 6.857 2.656 1.00 43.12 C ATOM 133 CG ASN A 9 -8.131 7.950 1.668 1.00 10.32 C ATOM 134 OD1 ASN A 9 -9.263 8.426 1.692 1.00 14.11 O ATOM 135 ND2 ASN A 9 -7.235 8.350 0.784 1.00 42.53 N ATOM 0 H ASN A 9 -7.154 8.564 4.426 1.00 74.21 H new ATOM 0 HA ASN A 9 -9.513 7.013 3.843 1.00 71.43 H new ATOM 0 HB2 ASN A 9 -6.629 6.929 2.825 1.00 43.12 H new ATOM 0 HB3 ASN A 9 -7.891 5.880 2.210 1.00 43.12 H new ATOM 0 HD21 ASN A 9 -7.477 9.069 0.102 1.00 42.53 H new ATOM 0 HD22 ASN A 9 -6.301 7.940 0.783 1.00 42.53 H new ATOM 142 N ALA A 10 -7.069 5.663 5.626 1.00 5.55 N ATOM 143 CA ALA A 10 -6.616 4.480 6.397 1.00 24.14 C ATOM 144 C ALA A 10 -7.562 4.180 7.581 1.00 53.55 C ATOM 145 O ALA A 10 -7.954 3.032 7.797 1.00 13.25 O ATOM 146 CB ALA A 10 -5.180 4.701 6.900 1.00 61.00 C ATOM 0 H ALA A 10 -6.465 6.477 5.736 1.00 5.55 H new ATOM 0 HA ALA A 10 -6.635 3.615 5.733 1.00 24.14 H new ATOM 0 HB1 ALA A 10 -4.854 3.828 7.465 1.00 61.00 H new ATOM 0 HB2 ALA A 10 -4.515 4.851 6.049 1.00 61.00 H new ATOM 0 HB3 ALA A 10 -5.151 5.581 7.543 1.00 61.00 H new ATOM 152 N GLY A 11 -7.937 5.241 8.323 1.00 42.41 N ATOM 153 CA GLY A 11 -8.886 5.128 9.445 1.00 22.21 C ATOM 154 C GLY A 11 -10.280 4.656 9.000 1.00 51.51 C ATOM 155 O GLY A 11 -10.960 3.918 9.717 1.00 50.31 O ATOM 0 H GLY A 11 -7.595 6.189 8.163 1.00 42.41 H new ATOM 0 HA2 GLY A 11 -8.489 4.430 10.182 1.00 22.21 H new ATOM 0 HA3 GLY A 11 -8.975 6.096 9.938 1.00 22.21 H new ATOM 159 N LYS A 12 -10.679 5.088 7.791 1.00 73.12 N ATOM 160 CA LYS A 12 -11.943 4.677 7.140 1.00 13.11 C ATOM 161 C LYS A 12 -11.929 3.162 6.782 1.00 71.14 C ATOM 162 O LYS A 12 -12.932 2.458 6.975 1.00 25.41 O ATOM 163 CB LYS A 12 -12.151 5.550 5.875 1.00 25.31 C ATOM 164 CG LYS A 12 -13.483 5.337 5.130 1.00 22.01 C ATOM 165 CD LYS A 12 -13.638 6.308 3.937 1.00 2.11 C ATOM 166 CE LYS A 12 -14.967 6.136 3.193 1.00 61.54 C ATOM 167 NZ LYS A 12 -16.142 6.395 4.055 1.00 52.14 N ATOM 0 H LYS A 12 -10.130 5.739 7.230 1.00 73.12 H new ATOM 0 HA LYS A 12 -12.773 4.828 7.830 1.00 13.11 H new ATOM 0 HB2 LYS A 12 -12.081 6.599 6.164 1.00 25.31 H new ATOM 0 HB3 LYS A 12 -11.333 5.355 5.182 1.00 25.31 H new ATOM 0 HG2 LYS A 12 -13.538 4.309 4.771 1.00 22.01 H new ATOM 0 HG3 LYS A 12 -14.313 5.477 5.823 1.00 22.01 H new ATOM 0 HD2 LYS A 12 -13.560 7.334 4.298 1.00 2.11 H new ATOM 0 HD3 LYS A 12 -12.815 6.152 3.240 1.00 2.11 H new ATOM 0 HE2 LYS A 12 -14.991 6.814 2.340 1.00 61.54 H new ATOM 0 HE3 LYS A 12 -15.028 5.122 2.797 1.00 61.54 H new ATOM 0 HZ1 LYS A 12 -17.005 6.398 3.474 1.00 52.14 H new ATOM 0 HZ2 LYS A 12 -16.214 5.650 4.777 1.00 52.14 H new ATOM 0 HZ3 LYS A 12 -16.034 7.319 4.520 1.00 52.14 H new ATOM 181 N VAL A 13 -10.768 2.681 6.274 1.00 74.52 N ATOM 182 CA VAL A 13 -10.532 1.243 5.980 1.00 50.45 C ATOM 183 C VAL A 13 -10.604 0.381 7.268 1.00 64.53 C ATOM 184 O VAL A 13 -11.295 -0.641 7.303 1.00 3.40 O ATOM 185 CB VAL A 13 -9.144 1.028 5.245 1.00 64.14 C ATOM 186 CG1 VAL A 13 -8.769 -0.476 5.124 1.00 25.00 C ATOM 187 CG2 VAL A 13 -9.149 1.702 3.844 1.00 52.51 C ATOM 0 H VAL A 13 -9.969 3.277 6.056 1.00 74.52 H new ATOM 0 HA VAL A 13 -11.327 0.915 5.311 1.00 50.45 H new ATOM 0 HB VAL A 13 -8.381 1.504 5.861 1.00 64.14 H new ATOM 0 HG11 VAL A 13 -7.811 -0.572 4.614 1.00 25.00 H new ATOM 0 HG12 VAL A 13 -8.696 -0.914 6.119 1.00 25.00 H new ATOM 0 HG13 VAL A 13 -9.538 -0.998 4.554 1.00 25.00 H new ATOM 0 HG21 VAL A 13 -8.186 1.541 3.359 1.00 52.51 H new ATOM 0 HG22 VAL A 13 -9.940 1.266 3.234 1.00 52.51 H new ATOM 0 HG23 VAL A 13 -9.324 2.772 3.956 1.00 52.51 H new ATOM 197 N TRP A 14 -9.909 0.834 8.330 1.00 0.13 N ATOM 198 CA TRP A 14 -9.816 0.091 9.611 1.00 3.43 C ATOM 199 C TRP A 14 -11.184 0.026 10.336 1.00 61.40 C ATOM 200 O TRP A 14 -11.491 -0.965 11.018 1.00 61.13 O ATOM 201 CB TRP A 14 -8.729 0.704 10.535 1.00 31.11 C ATOM 202 CG TRP A 14 -8.221 -0.269 11.581 1.00 20.22 C ATOM 203 CD1 TRP A 14 -7.225 -1.189 11.434 1.00 71.44 C ATOM 204 CD2 TRP A 14 -8.704 -0.427 12.915 1.00 31.34 C ATOM 205 NE1 TRP A 14 -7.061 -1.893 12.595 1.00 41.45 N ATOM 206 CE2 TRP A 14 -7.952 -1.441 13.522 1.00 62.42 C ATOM 207 CE3 TRP A 14 -9.694 0.205 13.644 1.00 60.50 C ATOM 208 CZ2 TRP A 14 -8.165 -1.841 14.839 1.00 51.13 C ATOM 209 CZ3 TRP A 14 -9.919 -0.182 14.952 1.00 2.33 C ATOM 210 CH2 TRP A 14 -9.150 -1.197 15.543 1.00 24.15 C ATOM 0 H TRP A 14 -9.399 1.717 8.329 1.00 0.13 H new ATOM 0 HA TRP A 14 -9.522 -0.931 9.372 1.00 3.43 H new ATOM 0 HB2 TRP A 14 -7.891 1.043 9.925 1.00 31.11 H new ATOM 0 HB3 TRP A 14 -9.137 1.583 11.033 1.00 31.11 H new ATOM 0 HD1 TRP A 14 -6.650 -1.340 10.532 1.00 71.44 H new ATOM 0 HE1 TRP A 14 -6.380 -2.638 12.743 1.00 41.45 H new ATOM 0 HE3 TRP A 14 -10.284 0.991 13.197 1.00 60.50 H new ATOM 0 HZ2 TRP A 14 -7.577 -2.628 15.288 1.00 51.13 H new ATOM 0 HZ3 TRP A 14 -10.695 0.302 15.526 1.00 2.33 H new ATOM 0 HH2 TRP A 14 -9.337 -1.475 16.570 1.00 24.15 H new ATOM 221 N HIS A 15 -11.994 1.096 10.176 1.00 51.31 N ATOM 222 CA HIS A 15 -13.383 1.157 10.693 1.00 4.22 C ATOM 223 C HIS A 15 -14.237 -0.003 10.114 1.00 43.23 C ATOM 224 O HIS A 15 -15.076 -0.581 10.818 1.00 62.52 O ATOM 225 CB HIS A 15 -14.012 2.536 10.346 1.00 4.12 C ATOM 226 CG HIS A 15 -15.410 2.749 10.882 1.00 54.53 C ATOM 227 ND1 HIS A 15 -15.660 3.206 12.159 1.00 74.53 N ATOM 228 CD2 HIS A 15 -16.632 2.566 10.312 1.00 71.30 C ATOM 229 CE1 HIS A 15 -16.959 3.294 12.350 1.00 73.42 C ATOM 230 NE2 HIS A 15 -17.573 2.913 11.250 1.00 24.42 N ATOM 0 H HIS A 15 -11.705 1.942 9.685 1.00 51.31 H new ATOM 0 HA HIS A 15 -13.362 1.044 11.777 1.00 4.22 H new ATOM 0 HB2 HIS A 15 -13.365 3.323 10.735 1.00 4.12 H new ATOM 0 HB3 HIS A 15 -14.033 2.647 9.262 1.00 4.12 H new ATOM 0 HD2 HIS A 15 -16.826 2.214 9.310 1.00 71.30 H new ATOM 0 HE1 HIS A 15 -17.441 3.624 13.258 1.00 73.42 H new ATOM 0 HE2 HIS A 15 -18.584 2.881 11.116 1.00 24.42 H new ATOM 239 N ALA A 16 -13.999 -0.330 8.827 1.00 61.13 N ATOM 240 CA ALA A 16 -14.640 -1.479 8.152 1.00 54.20 C ATOM 241 C ALA A 16 -14.096 -2.827 8.702 1.00 4.23 C ATOM 242 O ALA A 16 -14.871 -3.739 8.986 1.00 64.43 O ATOM 243 CB ALA A 16 -14.434 -1.390 6.628 1.00 52.45 C ATOM 0 H ALA A 16 -13.360 0.192 8.228 1.00 61.13 H new ATOM 0 HA ALA A 16 -15.709 -1.441 8.361 1.00 54.20 H new ATOM 0 HB1 ALA A 16 -14.912 -2.243 6.146 1.00 52.45 H new ATOM 0 HB2 ALA A 16 -14.877 -0.467 6.254 1.00 52.45 H new ATOM 0 HB3 ALA A 16 -13.367 -1.397 6.404 1.00 52.45 H new ATOM 249 N LEU A 17 -12.758 -2.900 8.914 1.00 63.54 N ATOM 250 CA LEU A 17 -12.044 -4.143 9.347 1.00 21.11 C ATOM 251 C LEU A 17 -12.453 -4.628 10.761 1.00 3.24 C ATOM 252 O LEU A 17 -12.198 -5.781 11.120 1.00 60.11 O ATOM 253 CB LEU A 17 -10.514 -3.904 9.324 1.00 0.31 C ATOM 254 CG LEU A 17 -9.888 -3.551 7.942 1.00 35.54 C ATOM 255 CD1 LEU A 17 -8.408 -3.156 8.112 1.00 34.13 C ATOM 256 CD2 LEU A 17 -10.062 -4.711 6.926 1.00 23.34 C ATOM 0 H LEU A 17 -12.136 -2.101 8.791 1.00 63.54 H new ATOM 0 HA LEU A 17 -12.331 -4.922 8.641 1.00 21.11 H new ATOM 0 HB2 LEU A 17 -10.284 -3.097 10.019 1.00 0.31 H new ATOM 0 HB3 LEU A 17 -10.023 -4.800 9.703 1.00 0.31 H new ATOM 0 HG LEU A 17 -10.421 -2.693 7.532 1.00 35.54 H new ATOM 0 HD11 LEU A 17 -7.982 -2.912 7.139 1.00 34.13 H new ATOM 0 HD12 LEU A 17 -8.336 -2.288 8.768 1.00 34.13 H new ATOM 0 HD13 LEU A 17 -7.857 -3.988 8.550 1.00 34.13 H new ATOM 0 HD21 LEU A 17 -9.614 -4.430 5.973 1.00 23.34 H new ATOM 0 HD22 LEU A 17 -9.571 -5.606 7.308 1.00 23.34 H new ATOM 0 HD23 LEU A 17 -11.124 -4.913 6.782 1.00 23.34 H new ATOM 268 N ASN A 18 -13.062 -3.722 11.554 1.00 33.33 N ATOM 269 CA ASN A 18 -13.496 -3.999 12.945 1.00 61.12 C ATOM 270 C ASN A 18 -14.496 -5.188 13.030 1.00 22.30 C ATOM 271 O ASN A 18 -14.481 -5.945 14.005 1.00 44.34 O ATOM 272 CB ASN A 18 -14.087 -2.708 13.569 1.00 54.42 C ATOM 273 CG ASN A 18 -14.511 -2.870 15.034 1.00 53.41 C ATOM 274 OD1 ASN A 18 -13.701 -2.738 15.942 1.00 2.44 O ATOM 275 ND2 ASN A 18 -15.780 -3.136 15.277 1.00 24.21 N ATOM 0 H ASN A 18 -13.269 -2.771 11.248 1.00 33.33 H new ATOM 0 HA ASN A 18 -12.622 -4.304 13.520 1.00 61.12 H new ATOM 0 HB2 ASN A 18 -13.348 -1.910 13.500 1.00 54.42 H new ATOM 0 HB3 ASN A 18 -14.950 -2.394 12.983 1.00 54.42 H new ATOM 0 HD21 ASN A 18 -16.105 -3.236 16.239 1.00 24.21 H new ATOM 0 HD22 ASN A 18 -16.436 -3.242 14.503 1.00 24.21 H new ATOM 282 N GLU A 19 -15.356 -5.344 11.999 1.00 62.32 N ATOM 283 CA GLU A 19 -16.317 -6.479 11.897 1.00 20.43 C ATOM 284 C GLU A 19 -16.242 -7.173 10.520 1.00 54.03 C ATOM 285 O GLU A 19 -16.472 -8.383 10.415 1.00 41.10 O ATOM 286 CB GLU A 19 -17.768 -6.014 12.185 1.00 33.24 C ATOM 287 CG GLU A 19 -17.990 -5.505 13.623 1.00 44.54 C ATOM 288 CD GLU A 19 -19.472 -5.397 13.996 1.00 54.11 C ATOM 289 OE1 GLU A 19 -20.088 -6.455 14.256 1.00 75.23 O ATOM 290 OE2 GLU A 19 -20.027 -4.279 14.024 1.00 14.32 O ATOM 0 H GLU A 19 -15.408 -4.694 11.215 1.00 62.32 H new ATOM 0 HA GLU A 19 -16.029 -7.207 12.656 1.00 20.43 H new ATOM 0 HB2 GLU A 19 -18.030 -5.220 11.485 1.00 33.24 H new ATOM 0 HB3 GLU A 19 -18.449 -6.844 11.995 1.00 33.24 H new ATOM 0 HG2 GLU A 19 -17.493 -6.178 14.322 1.00 44.54 H new ATOM 0 HG3 GLU A 19 -17.521 -4.527 13.733 1.00 44.54 H new ATOM 297 N ALA A 20 -15.963 -6.391 9.466 1.00 70.44 N ATOM 298 CA ALA A 20 -15.764 -6.911 8.095 1.00 20.24 C ATOM 299 C ALA A 20 -14.256 -7.154 7.842 1.00 41.25 C ATOM 300 O ALA A 20 -13.529 -6.253 7.416 1.00 51.55 O ATOM 301 CB ALA A 20 -16.363 -5.928 7.070 1.00 34.10 C ATOM 0 H ALA A 20 -15.868 -5.378 9.535 1.00 70.44 H new ATOM 0 HA ALA A 20 -16.280 -7.864 7.983 1.00 20.24 H new ATOM 0 HB1 ALA A 20 -16.213 -6.317 6.063 1.00 34.10 H new ATOM 0 HB2 ALA A 20 -17.430 -5.811 7.259 1.00 34.10 H new ATOM 0 HB3 ALA A 20 -15.870 -4.960 7.163 1.00 34.10 H new ATOM 307 N ASP A 21 -13.803 -8.388 8.112 1.00 14.12 N ATOM 308 CA ASP A 21 -12.366 -8.750 8.132 1.00 63.31 C ATOM 309 C ASP A 21 -12.079 -9.969 7.228 1.00 35.22 C ATOM 310 O ASP A 21 -12.998 -10.721 6.867 1.00 65.12 O ATOM 311 CB ASP A 21 -11.921 -9.023 9.592 1.00 22.12 C ATOM 312 CG ASP A 21 -12.768 -10.104 10.292 1.00 62.32 C ATOM 313 OD1 ASP A 21 -13.823 -9.766 10.867 1.00 41.24 O ATOM 314 OD2 ASP A 21 -12.395 -11.296 10.256 1.00 4.25 O ATOM 0 H ASP A 21 -14.421 -9.171 8.324 1.00 14.12 H new ATOM 0 HA ASP A 21 -11.790 -7.914 7.735 1.00 63.31 H new ATOM 0 HB2 ASP A 21 -10.875 -9.331 9.595 1.00 22.12 H new ATOM 0 HB3 ASP A 21 -11.982 -8.097 10.163 1.00 22.12 H new ATOM 319 N GLY A 22 -10.785 -10.165 6.889 1.00 14.43 N ATOM 320 CA GLY A 22 -10.367 -11.233 5.970 1.00 35.02 C ATOM 321 C GLY A 22 -10.829 -10.974 4.546 1.00 70.51 C ATOM 322 O GLY A 22 -11.575 -11.766 3.963 1.00 23.13 O ATOM 0 H GLY A 22 -10.016 -9.594 7.241 1.00 14.43 H new ATOM 0 HA2 GLY A 22 -9.281 -11.322 5.988 1.00 35.02 H new ATOM 0 HA3 GLY A 22 -10.770 -12.185 6.314 1.00 35.02 H new ATOM 326 N ILE A 23 -10.375 -9.843 3.998 1.00 12.23 N ATOM 327 CA ILE A 23 -10.905 -9.280 2.752 1.00 1.22 C ATOM 328 C ILE A 23 -9.767 -8.658 1.903 1.00 24.10 C ATOM 329 O ILE A 23 -8.950 -7.884 2.412 1.00 21.25 O ATOM 330 CB ILE A 23 -12.028 -8.225 3.093 1.00 54.40 C ATOM 331 CG1 ILE A 23 -12.642 -7.616 1.801 1.00 41.23 C ATOM 332 CG2 ILE A 23 -11.515 -7.119 4.060 1.00 35.05 C ATOM 333 CD1 ILE A 23 -13.825 -6.699 2.037 1.00 35.24 C ATOM 0 H ILE A 23 -9.624 -9.288 4.409 1.00 12.23 H new ATOM 0 HA ILE A 23 -11.350 -10.074 2.152 1.00 1.22 H new ATOM 0 HB ILE A 23 -12.822 -8.758 3.616 1.00 54.40 H new ATOM 0 HG12 ILE A 23 -11.867 -7.060 1.273 1.00 41.23 H new ATOM 0 HG13 ILE A 23 -12.954 -8.428 1.145 1.00 41.23 H new ATOM 0 HG21 ILE A 23 -12.321 -6.415 4.267 1.00 35.05 H new ATOM 0 HG22 ILE A 23 -11.184 -7.576 4.992 1.00 35.05 H new ATOM 0 HG23 ILE A 23 -10.681 -6.590 3.598 1.00 35.05 H new ATOM 0 HD11 ILE A 23 -14.188 -6.321 1.082 1.00 35.24 H new ATOM 0 HD12 ILE A 23 -14.621 -7.253 2.534 1.00 35.24 H new ATOM 0 HD13 ILE A 23 -13.518 -5.863 2.665 1.00 35.24 H new ATOM 345 N SER A 24 -9.717 -9.014 0.607 1.00 61.14 N ATOM 346 CA SER A 24 -8.666 -8.537 -0.322 1.00 5.51 C ATOM 347 C SER A 24 -8.895 -7.051 -0.703 1.00 14.34 C ATOM 348 O SER A 24 -10.018 -6.545 -0.584 1.00 62.42 O ATOM 349 CB SER A 24 -8.643 -9.434 -1.583 1.00 14.22 C ATOM 350 OG SER A 24 -7.530 -9.151 -2.409 1.00 15.13 O ATOM 0 H SER A 24 -10.398 -9.637 0.172 1.00 61.14 H new ATOM 0 HA SER A 24 -7.699 -8.602 0.176 1.00 5.51 H new ATOM 0 HB2 SER A 24 -8.616 -10.482 -1.283 1.00 14.22 H new ATOM 0 HB3 SER A 24 -9.563 -9.288 -2.150 1.00 14.22 H new ATOM 0 HG SER A 24 -6.743 -9.628 -2.072 1.00 15.13 H new ATOM 356 N ILE A 25 -7.819 -6.383 -1.189 1.00 45.51 N ATOM 357 CA ILE A 25 -7.801 -4.920 -1.501 1.00 1.12 C ATOM 358 C ILE A 25 -9.012 -4.422 -2.376 1.00 4.14 C ATOM 359 O ILE A 25 -9.651 -3.445 -1.987 1.00 10.15 O ATOM 360 CB ILE A 25 -6.448 -4.490 -2.212 1.00 43.41 C ATOM 361 CG1 ILE A 25 -5.209 -4.816 -1.321 1.00 21.15 C ATOM 362 CG2 ILE A 25 -6.457 -2.988 -2.624 1.00 34.14 C ATOM 363 CD1 ILE A 25 -3.856 -4.683 -2.013 1.00 60.24 C ATOM 0 H ILE A 25 -6.929 -6.843 -1.379 1.00 45.51 H new ATOM 0 HA ILE A 25 -7.888 -4.441 -0.526 1.00 1.12 H new ATOM 0 HB ILE A 25 -6.370 -5.078 -3.127 1.00 43.41 H new ATOM 0 HG12 ILE A 25 -5.222 -4.156 -0.454 1.00 21.15 H new ATOM 0 HG13 ILE A 25 -5.309 -5.835 -0.947 1.00 21.15 H new ATOM 0 HG21 ILE A 25 -5.512 -2.737 -3.107 1.00 34.14 H new ATOM 0 HG22 ILE A 25 -7.278 -2.806 -3.317 1.00 34.14 H new ATOM 0 HG23 ILE A 25 -6.587 -2.368 -1.737 1.00 34.14 H new ATOM 0 HD11 ILE A 25 -3.061 -4.931 -1.309 1.00 60.24 H new ATOM 0 HD12 ILE A 25 -3.814 -5.364 -2.863 1.00 60.24 H new ATOM 0 HD13 ILE A 25 -3.725 -3.659 -2.362 1.00 60.24 H new ATOM 375 N PRO A 26 -9.356 -5.063 -3.566 1.00 25.31 N ATOM 376 CA PRO A 26 -10.416 -4.534 -4.469 1.00 75.13 C ATOM 377 C PRO A 26 -11.857 -4.705 -3.910 1.00 42.52 C ATOM 378 O PRO A 26 -12.752 -3.926 -4.237 1.00 25.51 O ATOM 379 CB PRO A 26 -10.222 -5.328 -5.803 1.00 2.41 C ATOM 380 CG PRO A 26 -8.976 -6.154 -5.615 1.00 72.11 C ATOM 381 CD PRO A 26 -8.781 -6.315 -4.126 1.00 41.45 C ATOM 0 HA PRO A 26 -10.315 -3.456 -4.594 1.00 75.13 H new ATOM 0 HB2 PRO A 26 -11.084 -5.963 -6.009 1.00 2.41 H new ATOM 0 HB3 PRO A 26 -10.117 -4.649 -6.650 1.00 2.41 H new ATOM 0 HG2 PRO A 26 -9.079 -7.125 -6.099 1.00 72.11 H new ATOM 0 HG3 PRO A 26 -8.114 -5.663 -6.067 1.00 72.11 H new ATOM 0 HD2 PRO A 26 -9.295 -7.198 -3.747 1.00 41.45 H new ATOM 0 HD3 PRO A 26 -7.728 -6.424 -3.868 1.00 41.45 H new ATOM 389 N GLU A 27 -12.057 -5.728 -3.060 1.00 50.13 N ATOM 390 CA GLU A 27 -13.358 -5.983 -2.386 1.00 10.13 C ATOM 391 C GLU A 27 -13.583 -4.914 -1.305 1.00 21.41 C ATOM 392 O GLU A 27 -14.671 -4.351 -1.139 1.00 2.53 O ATOM 393 CB GLU A 27 -13.335 -7.376 -1.718 1.00 0.25 C ATOM 394 CG GLU A 27 -13.064 -8.556 -2.663 1.00 22.11 C ATOM 395 CD GLU A 27 -13.013 -9.893 -1.913 1.00 24.50 C ATOM 396 OE1 GLU A 27 -11.958 -10.211 -1.325 1.00 54.12 O ATOM 397 OE2 GLU A 27 -14.044 -10.605 -1.861 1.00 2.50 O ATOM 0 H GLU A 27 -11.331 -6.402 -2.817 1.00 50.13 H new ATOM 0 HA GLU A 27 -14.160 -5.946 -3.123 1.00 10.13 H new ATOM 0 HB2 GLU A 27 -12.573 -7.374 -0.939 1.00 0.25 H new ATOM 0 HB3 GLU A 27 -14.293 -7.540 -1.225 1.00 0.25 H new ATOM 0 HG2 GLU A 27 -13.843 -8.597 -3.424 1.00 22.11 H new ATOM 0 HG3 GLU A 27 -12.119 -8.395 -3.182 1.00 22.11 H new ATOM 404 N LEU A 28 -12.484 -4.667 -0.596 1.00 70.24 N ATOM 405 CA LEU A 28 -12.371 -3.691 0.497 1.00 52.51 C ATOM 406 C LEU A 28 -12.541 -2.242 -0.027 1.00 11.22 C ATOM 407 O LEU A 28 -13.190 -1.409 0.618 1.00 32.51 O ATOM 408 CB LEU A 28 -10.982 -3.928 1.140 1.00 35.05 C ATOM 409 CG LEU A 28 -10.513 -2.962 2.255 1.00 22.14 C ATOM 410 CD1 LEU A 28 -11.471 -2.961 3.475 1.00 35.34 C ATOM 411 CD2 LEU A 28 -9.055 -3.305 2.653 1.00 62.10 C ATOM 0 H LEU A 28 -11.608 -5.160 -0.771 1.00 70.24 H new ATOM 0 HA LEU A 28 -13.160 -3.822 1.238 1.00 52.51 H new ATOM 0 HB2 LEU A 28 -10.974 -4.938 1.550 1.00 35.05 H new ATOM 0 HB3 LEU A 28 -10.238 -3.902 0.343 1.00 35.05 H new ATOM 0 HG LEU A 28 -10.537 -1.944 1.866 1.00 22.14 H new ATOM 0 HD11 LEU A 28 -11.099 -2.268 4.229 1.00 35.34 H new ATOM 0 HD12 LEU A 28 -12.466 -2.650 3.156 1.00 35.34 H new ATOM 0 HD13 LEU A 28 -11.523 -3.964 3.898 1.00 35.34 H new ATOM 0 HD21 LEU A 28 -8.723 -2.626 3.438 1.00 62.10 H new ATOM 0 HD22 LEU A 28 -9.009 -4.331 3.018 1.00 62.10 H new ATOM 0 HD23 LEU A 28 -8.406 -3.200 1.784 1.00 62.10 H new ATOM 423 N ALA A 29 -11.982 -1.997 -1.229 1.00 53.51 N ATOM 424 CA ALA A 29 -12.049 -0.701 -1.942 1.00 63.32 C ATOM 425 C ALA A 29 -13.507 -0.260 -2.221 1.00 51.21 C ATOM 426 O ALA A 29 -13.843 0.920 -2.083 1.00 13.13 O ATOM 427 CB ALA A 29 -11.249 -0.788 -3.255 1.00 63.11 C ATOM 0 H ALA A 29 -11.461 -2.707 -1.743 1.00 53.51 H new ATOM 0 HA ALA A 29 -11.607 0.058 -1.296 1.00 63.32 H new ATOM 0 HB1 ALA A 29 -11.301 0.168 -3.777 1.00 63.11 H new ATOM 0 HB2 ALA A 29 -10.208 -1.024 -3.032 1.00 63.11 H new ATOM 0 HB3 ALA A 29 -11.671 -1.570 -3.887 1.00 63.11 H new ATOM 433 N ARG A 30 -14.361 -1.237 -2.583 1.00 41.41 N ATOM 434 CA ARG A 30 -15.800 -1.002 -2.855 1.00 34.35 C ATOM 435 C ARG A 30 -16.536 -0.503 -1.591 1.00 24.00 C ATOM 436 O ARG A 30 -17.322 0.447 -1.656 1.00 45.31 O ATOM 437 CB ARG A 30 -16.466 -2.303 -3.368 1.00 45.53 C ATOM 438 CG ARG A 30 -15.836 -2.870 -4.654 1.00 14.50 C ATOM 439 CD ARG A 30 -16.503 -4.177 -5.112 1.00 35.03 C ATOM 440 NE ARG A 30 -15.899 -4.701 -6.348 1.00 54.53 N ATOM 441 CZ ARG A 30 -16.496 -5.493 -7.212 1.00 44.34 C ATOM 442 NH1 ARG A 30 -17.739 -5.843 -7.062 1.00 64.31 N ATOM 443 NH2 ARG A 30 -15.838 -5.928 -8.234 1.00 4.10 N ATOM 0 H ARG A 30 -14.078 -2.210 -2.696 1.00 41.41 H new ATOM 0 HA ARG A 30 -15.873 -0.230 -3.621 1.00 34.35 H new ATOM 0 HB2 ARG A 30 -16.410 -3.060 -2.585 1.00 45.53 H new ATOM 0 HB3 ARG A 30 -17.523 -2.110 -3.549 1.00 45.53 H new ATOM 0 HG2 ARG A 30 -15.913 -2.129 -5.449 1.00 14.50 H new ATOM 0 HG3 ARG A 30 -14.774 -3.048 -4.486 1.00 14.50 H new ATOM 0 HD2 ARG A 30 -16.418 -4.923 -4.322 1.00 35.03 H new ATOM 0 HD3 ARG A 30 -17.567 -4.004 -5.274 1.00 35.03 H new ATOM 0 HE ARG A 30 -14.938 -4.427 -6.551 1.00 54.53 H new ATOM 0 HH11 ARG A 30 -18.272 -5.502 -6.262 1.00 64.31 H new ATOM 0 HH12 ARG A 30 -18.182 -6.458 -7.745 1.00 64.31 H new ATOM 0 HH21 ARG A 30 -14.864 -5.657 -8.366 1.00 4.10 H new ATOM 0 HH22 ARG A 30 -16.293 -6.543 -8.909 1.00 4.10 H new ATOM 457 N LYS A 31 -16.243 -1.146 -0.443 1.00 22.34 N ATOM 458 CA LYS A 31 -16.894 -0.839 0.856 1.00 21.05 C ATOM 459 C LYS A 31 -16.531 0.577 1.353 1.00 51.34 C ATOM 460 O LYS A 31 -17.393 1.323 1.840 1.00 43.34 O ATOM 461 CB LYS A 31 -16.481 -1.889 1.923 1.00 64.12 C ATOM 462 CG LYS A 31 -16.719 -3.353 1.498 1.00 71.24 C ATOM 463 CD LYS A 31 -16.438 -4.358 2.638 1.00 74.30 C ATOM 464 CE LYS A 31 -17.445 -4.246 3.801 1.00 22.32 C ATOM 465 NZ LYS A 31 -18.831 -4.547 3.362 1.00 44.45 N ATOM 0 H LYS A 31 -15.550 -1.892 -0.385 1.00 22.34 H new ATOM 0 HA LYS A 31 -17.972 -0.878 0.702 1.00 21.05 H new ATOM 0 HB2 LYS A 31 -15.424 -1.758 2.155 1.00 64.12 H new ATOM 0 HB3 LYS A 31 -17.036 -1.695 2.841 1.00 64.12 H new ATOM 0 HG2 LYS A 31 -17.750 -3.467 1.165 1.00 71.24 H new ATOM 0 HG3 LYS A 31 -16.081 -3.588 0.646 1.00 71.24 H new ATOM 0 HD2 LYS A 31 -16.466 -5.371 2.237 1.00 74.30 H new ATOM 0 HD3 LYS A 31 -15.430 -4.194 3.020 1.00 74.30 H new ATOM 0 HE2 LYS A 31 -17.159 -4.933 4.597 1.00 22.32 H new ATOM 0 HE3 LYS A 31 -17.407 -3.240 4.219 1.00 22.32 H new ATOM 0 HZ1 LYS A 31 -19.446 -4.645 4.195 1.00 44.45 H new ATOM 0 HZ2 LYS A 31 -19.181 -3.773 2.762 1.00 44.45 H new ATOM 0 HZ3 LYS A 31 -18.839 -5.435 2.820 1.00 44.45 H new ATOM 479 N VAL A 32 -15.241 0.934 1.217 1.00 63.12 N ATOM 480 CA VAL A 32 -14.717 2.253 1.636 1.00 64.31 C ATOM 481 C VAL A 32 -14.848 3.321 0.517 1.00 33.44 C ATOM 482 O VAL A 32 -14.408 4.454 0.696 1.00 3.14 O ATOM 483 CB VAL A 32 -13.222 2.134 2.124 1.00 0.31 C ATOM 484 CG1 VAL A 32 -13.121 1.164 3.329 1.00 32.25 C ATOM 485 CG2 VAL A 32 -12.271 1.700 0.974 1.00 50.55 C ATOM 0 H VAL A 32 -14.532 0.321 0.815 1.00 63.12 H new ATOM 0 HA VAL A 32 -15.330 2.589 2.472 1.00 64.31 H new ATOM 0 HB VAL A 32 -12.899 3.123 2.448 1.00 0.31 H new ATOM 0 HG11 VAL A 32 -12.083 1.093 3.653 1.00 32.25 H new ATOM 0 HG12 VAL A 32 -13.733 1.538 4.150 1.00 32.25 H new ATOM 0 HG13 VAL A 32 -13.476 0.177 3.032 1.00 32.25 H new ATOM 0 HG21 VAL A 32 -11.251 1.630 1.352 1.00 50.55 H new ATOM 0 HG22 VAL A 32 -12.583 0.729 0.591 1.00 50.55 H new ATOM 0 HG23 VAL A 32 -12.311 2.437 0.172 1.00 50.55 H new ATOM 495 N ASN A 33 -15.447 2.932 -0.638 1.00 55.24 N ATOM 496 CA ASN A 33 -15.774 3.853 -1.768 1.00 74.21 C ATOM 497 C ASN A 33 -14.489 4.537 -2.361 1.00 52.03 C ATOM 498 O ASN A 33 -14.538 5.641 -2.921 1.00 24.44 O ATOM 499 CB ASN A 33 -16.850 4.891 -1.298 1.00 52.13 C ATOM 500 CG ASN A 33 -17.464 5.745 -2.418 1.00 24.40 C ATOM 501 OD1 ASN A 33 -17.576 5.317 -3.564 1.00 64.45 O ATOM 502 ND2 ASN A 33 -17.866 6.960 -2.095 1.00 21.32 N ATOM 0 H ASN A 33 -15.720 1.966 -0.817 1.00 55.24 H new ATOM 0 HA ASN A 33 -16.196 3.272 -2.588 1.00 74.21 H new ATOM 0 HB2 ASN A 33 -17.652 4.355 -0.790 1.00 52.13 H new ATOM 0 HB3 ASN A 33 -16.395 5.555 -0.563 1.00 52.13 H new ATOM 0 HD21 ASN A 33 -18.280 7.565 -2.804 1.00 21.32 H new ATOM 0 HD22 ASN A 33 -17.763 7.293 -1.137 1.00 21.32 H new ATOM 509 N LEU A 34 -13.341 3.850 -2.237 1.00 35.51 N ATOM 510 CA LEU A 34 -12.045 4.301 -2.803 1.00 73.54 C ATOM 511 C LEU A 34 -11.626 3.357 -3.953 1.00 60.11 C ATOM 512 O LEU A 34 -12.154 2.251 -4.075 1.00 2.22 O ATOM 513 CB LEU A 34 -10.948 4.309 -1.694 1.00 62.43 C ATOM 514 CG LEU A 34 -11.302 5.056 -0.361 1.00 12.04 C ATOM 515 CD1 LEU A 34 -10.176 4.901 0.683 1.00 74.15 C ATOM 516 CD2 LEU A 34 -11.648 6.545 -0.605 1.00 13.25 C ATOM 0 H LEU A 34 -13.279 2.961 -1.740 1.00 35.51 H new ATOM 0 HA LEU A 34 -12.158 5.313 -3.191 1.00 73.54 H new ATOM 0 HB2 LEU A 34 -10.702 3.275 -1.450 1.00 62.43 H new ATOM 0 HB3 LEU A 34 -10.047 4.761 -2.109 1.00 62.43 H new ATOM 0 HG LEU A 34 -12.197 4.585 0.044 1.00 12.04 H new ATOM 0 HD11 LEU A 34 -10.451 5.430 1.596 1.00 74.15 H new ATOM 0 HD12 LEU A 34 -10.029 3.844 0.906 1.00 74.15 H new ATOM 0 HD13 LEU A 34 -9.251 5.320 0.286 1.00 74.15 H new ATOM 0 HD21 LEU A 34 -11.887 7.023 0.345 1.00 13.25 H new ATOM 0 HD22 LEU A 34 -10.794 7.047 -1.060 1.00 13.25 H new ATOM 0 HD23 LEU A 34 -12.507 6.614 -1.272 1.00 13.25 H new ATOM 528 N SER A 35 -10.683 3.799 -4.800 1.00 23.45 N ATOM 529 CA SER A 35 -10.086 2.937 -5.855 1.00 71.35 C ATOM 530 C SER A 35 -9.048 1.960 -5.256 1.00 72.44 C ATOM 531 O SER A 35 -8.592 2.147 -4.123 1.00 41.34 O ATOM 532 CB SER A 35 -9.427 3.809 -6.946 1.00 51.24 C ATOM 533 OG SER A 35 -8.791 3.019 -7.940 1.00 31.34 O ATOM 0 H SER A 35 -10.311 4.749 -4.782 1.00 23.45 H new ATOM 0 HA SER A 35 -10.886 2.348 -6.303 1.00 71.35 H new ATOM 0 HB2 SER A 35 -10.183 4.440 -7.412 1.00 51.24 H new ATOM 0 HB3 SER A 35 -8.695 4.474 -6.487 1.00 51.24 H new ATOM 0 HG SER A 35 -8.387 3.604 -8.614 1.00 31.34 H new ATOM 539 N VAL A 36 -8.682 0.931 -6.046 1.00 5.14 N ATOM 540 CA VAL A 36 -7.720 -0.132 -5.646 1.00 41.14 C ATOM 541 C VAL A 36 -6.363 0.447 -5.152 1.00 12.31 C ATOM 542 O VAL A 36 -5.913 0.115 -4.051 1.00 51.23 O ATOM 543 CB VAL A 36 -7.471 -1.134 -6.842 1.00 1.34 C ATOM 544 CG1 VAL A 36 -6.386 -2.192 -6.504 1.00 12.24 C ATOM 545 CG2 VAL A 36 -8.793 -1.820 -7.274 1.00 32.34 C ATOM 0 H VAL A 36 -9.046 0.807 -6.991 1.00 5.14 H new ATOM 0 HA VAL A 36 -8.173 -0.666 -4.810 1.00 41.14 H new ATOM 0 HB VAL A 36 -7.097 -0.545 -7.679 1.00 1.34 H new ATOM 0 HG11 VAL A 36 -6.250 -2.858 -7.356 1.00 12.24 H new ATOM 0 HG12 VAL A 36 -5.445 -1.690 -6.282 1.00 12.24 H new ATOM 0 HG13 VAL A 36 -6.701 -2.772 -5.637 1.00 12.24 H new ATOM 0 HG21 VAL A 36 -8.595 -2.505 -8.099 1.00 32.34 H new ATOM 0 HG22 VAL A 36 -9.207 -2.376 -6.432 1.00 32.34 H new ATOM 0 HG23 VAL A 36 -9.508 -1.062 -7.595 1.00 32.34 H new ATOM 555 N GLU A 37 -5.736 1.312 -5.982 1.00 41.23 N ATOM 556 CA GLU A 37 -4.445 1.981 -5.647 1.00 40.12 C ATOM 557 C GLU A 37 -4.547 2.820 -4.343 1.00 11.33 C ATOM 558 O GLU A 37 -3.658 2.768 -3.485 1.00 71.42 O ATOM 559 CB GLU A 37 -3.982 2.879 -6.827 1.00 65.44 C ATOM 560 CG GLU A 37 -3.758 2.126 -8.154 1.00 12.44 C ATOM 561 CD GLU A 37 -3.255 3.043 -9.284 1.00 51.01 C ATOM 562 OE1 GLU A 37 -4.086 3.730 -9.926 1.00 44.13 O ATOM 563 OE2 GLU A 37 -2.028 3.098 -9.522 1.00 55.21 O ATOM 0 H GLU A 37 -6.103 1.569 -6.898 1.00 41.23 H new ATOM 0 HA GLU A 37 -3.705 1.198 -5.478 1.00 40.12 H new ATOM 0 HB2 GLU A 37 -4.727 3.659 -6.988 1.00 65.44 H new ATOM 0 HB3 GLU A 37 -3.054 3.377 -6.546 1.00 65.44 H new ATOM 0 HG2 GLU A 37 -3.036 1.325 -7.994 1.00 12.44 H new ATOM 0 HG3 GLU A 37 -4.692 1.657 -8.462 1.00 12.44 H new ATOM 570 N SER A 38 -5.663 3.558 -4.209 1.00 1.05 N ATOM 571 CA SER A 38 -5.949 4.425 -3.039 1.00 0.42 C ATOM 572 C SER A 38 -6.121 3.612 -1.730 1.00 73.11 C ATOM 573 O SER A 38 -5.694 4.051 -0.658 1.00 21.04 O ATOM 574 CB SER A 38 -7.228 5.255 -3.306 1.00 30.32 C ATOM 575 OG SER A 38 -7.066 6.118 -4.424 1.00 62.43 O ATOM 0 H SER A 38 -6.402 3.574 -4.912 1.00 1.05 H new ATOM 0 HA SER A 38 -5.091 5.084 -2.905 1.00 0.42 H new ATOM 0 HB2 SER A 38 -8.068 4.584 -3.482 1.00 30.32 H new ATOM 0 HB3 SER A 38 -7.471 5.845 -2.422 1.00 30.32 H new ATOM 0 HG SER A 38 -7.891 6.627 -4.567 1.00 62.43 H new ATOM 581 N THR A 39 -6.750 2.426 -1.845 1.00 22.11 N ATOM 582 CA THR A 39 -7.060 1.548 -0.688 1.00 43.24 C ATOM 583 C THR A 39 -5.806 0.768 -0.218 1.00 1.21 C ATOM 584 O THR A 39 -5.531 0.707 0.978 1.00 71.44 O ATOM 585 CB THR A 39 -8.219 0.552 -1.038 1.00 12.30 C ATOM 586 OG1 THR A 39 -9.386 1.301 -1.407 1.00 3.22 O ATOM 587 CG2 THR A 39 -8.579 -0.387 0.130 1.00 64.23 C ATOM 0 H THR A 39 -7.059 2.046 -2.739 1.00 22.11 H new ATOM 0 HA THR A 39 -7.386 2.189 0.131 1.00 43.24 H new ATOM 0 HB THR A 39 -7.869 -0.071 -1.861 1.00 12.30 H new ATOM 0 HG1 THR A 39 -9.272 1.660 -2.312 1.00 3.22 H new ATOM 0 HG21 THR A 39 -9.387 -1.052 -0.174 1.00 64.23 H new ATOM 0 HG22 THR A 39 -7.705 -0.979 0.404 1.00 64.23 H new ATOM 0 HG23 THR A 39 -8.899 0.205 0.987 1.00 64.23 H new ATOM 595 N ALA A 40 -5.051 0.199 -1.182 1.00 24.44 N ATOM 596 CA ALA A 40 -3.810 -0.590 -0.921 1.00 1.51 C ATOM 597 C ALA A 40 -2.751 0.231 -0.147 1.00 33.12 C ATOM 598 O ALA A 40 -2.198 -0.215 0.868 1.00 60.42 O ATOM 599 CB ALA A 40 -3.220 -1.067 -2.263 1.00 21.10 C ATOM 0 H ALA A 40 -5.280 0.270 -2.173 1.00 24.44 H new ATOM 0 HA ALA A 40 -4.079 -1.444 -0.300 1.00 1.51 H new ATOM 0 HB1 ALA A 40 -2.314 -1.644 -2.078 1.00 21.10 H new ATOM 0 HB2 ALA A 40 -3.949 -1.692 -2.779 1.00 21.10 H new ATOM 0 HB3 ALA A 40 -2.980 -0.203 -2.883 1.00 21.10 H new ATOM 605 N LEU A 41 -2.507 1.440 -0.666 1.00 15.11 N ATOM 606 CA LEU A 41 -1.560 2.423 -0.101 1.00 32.20 C ATOM 607 C LEU A 41 -2.043 2.927 1.305 1.00 0.13 C ATOM 608 O LEU A 41 -1.222 3.211 2.186 1.00 14.34 O ATOM 609 CB LEU A 41 -1.384 3.547 -1.187 1.00 41.53 C ATOM 610 CG LEU A 41 -0.466 4.795 -0.908 1.00 53.24 C ATOM 611 CD1 LEU A 41 -1.239 5.911 -0.202 1.00 73.20 C ATOM 612 CD2 LEU A 41 0.824 4.431 -0.132 1.00 42.13 C ATOM 0 H LEU A 41 -2.971 1.775 -1.510 1.00 15.11 H new ATOM 0 HA LEU A 41 -0.581 1.990 0.106 1.00 32.20 H new ATOM 0 HB2 LEU A 41 -1.006 3.066 -2.089 1.00 41.53 H new ATOM 0 HB3 LEU A 41 -2.379 3.926 -1.421 1.00 41.53 H new ATOM 0 HG LEU A 41 -0.149 5.166 -1.883 1.00 53.24 H new ATOM 0 HD11 LEU A 41 -0.575 6.757 -0.025 1.00 73.20 H new ATOM 0 HD12 LEU A 41 -2.073 6.229 -0.828 1.00 73.20 H new ATOM 0 HD13 LEU A 41 -1.620 5.543 0.751 1.00 73.20 H new ATOM 0 HD21 LEU A 41 1.417 5.331 0.031 1.00 42.13 H new ATOM 0 HD22 LEU A 41 0.558 3.992 0.830 1.00 42.13 H new ATOM 0 HD23 LEU A 41 1.406 3.713 -0.710 1.00 42.13 H new ATOM 624 N ALA A 42 -3.380 2.982 1.511 1.00 3.25 N ATOM 625 CA ALA A 42 -3.992 3.342 2.822 1.00 30.42 C ATOM 626 C ALA A 42 -3.803 2.219 3.882 1.00 23.43 C ATOM 627 O ALA A 42 -3.594 2.503 5.067 1.00 12.14 O ATOM 628 CB ALA A 42 -5.484 3.671 2.641 1.00 40.32 C ATOM 0 H ALA A 42 -4.064 2.781 0.782 1.00 3.25 H new ATOM 0 HA ALA A 42 -3.475 4.227 3.195 1.00 30.42 H new ATOM 0 HB1 ALA A 42 -5.919 3.932 3.606 1.00 40.32 H new ATOM 0 HB2 ALA A 42 -5.591 4.512 1.955 1.00 40.32 H new ATOM 0 HB3 ALA A 42 -6.001 2.803 2.233 1.00 40.32 H new ATOM 634 N VAL A 43 -3.874 0.939 3.441 1.00 30.32 N ATOM 635 CA VAL A 43 -3.621 -0.239 4.319 1.00 51.33 C ATOM 636 C VAL A 43 -2.147 -0.259 4.815 1.00 31.41 C ATOM 637 O VAL A 43 -1.872 -0.689 5.940 1.00 35.12 O ATOM 638 CB VAL A 43 -3.974 -1.601 3.593 1.00 52.01 C ATOM 639 CG1 VAL A 43 -3.632 -2.841 4.472 1.00 71.24 C ATOM 640 CG2 VAL A 43 -5.465 -1.633 3.161 1.00 2.54 C ATOM 0 H VAL A 43 -4.105 0.692 2.479 1.00 30.32 H new ATOM 0 HA VAL A 43 -4.279 -0.141 5.183 1.00 51.33 H new ATOM 0 HB VAL A 43 -3.352 -1.653 2.699 1.00 52.01 H new ATOM 0 HG11 VAL A 43 -3.891 -3.752 3.933 1.00 71.24 H new ATOM 0 HG12 VAL A 43 -2.566 -2.844 4.698 1.00 71.24 H new ATOM 0 HG13 VAL A 43 -4.199 -2.796 5.402 1.00 71.24 H new ATOM 0 HG21 VAL A 43 -5.680 -2.580 2.665 1.00 2.54 H new ATOM 0 HG22 VAL A 43 -6.101 -1.532 4.040 1.00 2.54 H new ATOM 0 HG23 VAL A 43 -5.662 -0.810 2.474 1.00 2.54 H new ATOM 650 N GLY A 44 -1.216 0.230 3.967 1.00 53.21 N ATOM 651 CA GLY A 44 0.201 0.394 4.351 1.00 2.30 C ATOM 652 C GLY A 44 0.412 1.399 5.503 1.00 25.34 C ATOM 653 O GLY A 44 1.335 1.248 6.315 1.00 11.23 O ATOM 0 H GLY A 44 -1.422 0.518 3.011 1.00 53.21 H new ATOM 0 HA2 GLY A 44 0.604 -0.575 4.646 1.00 2.30 H new ATOM 0 HA3 GLY A 44 0.769 0.725 3.482 1.00 2.30 H new ATOM 657 N TRP A 45 -0.466 2.418 5.572 1.00 53.05 N ATOM 658 CA TRP A 45 -0.471 3.426 6.660 1.00 34.55 C ATOM 659 C TRP A 45 -1.038 2.825 7.988 1.00 71.42 C ATOM 660 O TRP A 45 -0.703 3.289 9.086 1.00 15.31 O ATOM 661 CB TRP A 45 -1.286 4.661 6.206 1.00 35.50 C ATOM 662 CG TRP A 45 -1.162 5.871 7.109 1.00 60.53 C ATOM 663 CD1 TRP A 45 -2.066 6.314 8.035 1.00 3.33 C ATOM 664 CD2 TRP A 45 -0.054 6.787 7.171 1.00 62.34 C ATOM 665 NE1 TRP A 45 -1.609 7.460 8.629 1.00 23.14 N ATOM 666 CE2 TRP A 45 -0.377 7.767 8.124 1.00 32.52 C ATOM 667 CE3 TRP A 45 1.174 6.877 6.505 1.00 44.32 C ATOM 668 CZ2 TRP A 45 0.474 8.828 8.428 1.00 45.12 C ATOM 669 CZ3 TRP A 45 2.022 7.929 6.810 1.00 33.40 C ATOM 670 CH2 TRP A 45 1.669 8.892 7.764 1.00 35.34 C ATOM 0 H TRP A 45 -1.195 2.569 4.875 1.00 53.05 H new ATOM 0 HA TRP A 45 0.554 3.734 6.866 1.00 34.55 H new ATOM 0 HB2 TRP A 45 -0.967 4.940 5.202 1.00 35.50 H new ATOM 0 HB3 TRP A 45 -2.337 4.381 6.140 1.00 35.50 H new ATOM 0 HD1 TRP A 45 -3.004 5.830 8.264 1.00 3.33 H new ATOM 0 HE1 TRP A 45 -2.109 7.999 9.336 1.00 23.14 H new ATOM 0 HE3 TRP A 45 1.455 6.140 5.767 1.00 44.32 H new ATOM 0 HZ2 TRP A 45 0.200 9.573 9.161 1.00 45.12 H new ATOM 0 HZ3 TRP A 45 2.972 8.008 6.303 1.00 33.40 H new ATOM 0 HH2 TRP A 45 2.352 9.700 7.980 1.00 35.34 H new ATOM 681 N LEU A 46 -1.931 1.822 7.868 1.00 41.15 N ATOM 682 CA LEU A 46 -2.391 0.996 9.020 1.00 2.45 C ATOM 683 C LEU A 46 -1.301 0.000 9.482 1.00 71.22 C ATOM 684 O LEU A 46 -1.202 -0.321 10.675 1.00 23.22 O ATOM 685 CB LEU A 46 -3.689 0.236 8.652 1.00 72.33 C ATOM 686 CG LEU A 46 -4.942 1.121 8.399 1.00 42.41 C ATOM 687 CD1 LEU A 46 -6.155 0.265 7.967 1.00 25.23 C ATOM 688 CD2 LEU A 46 -5.262 1.988 9.647 1.00 52.40 C ATOM 0 H LEU A 46 -2.356 1.557 6.979 1.00 41.15 H new ATOM 0 HA LEU A 46 -2.595 1.672 9.850 1.00 2.45 H new ATOM 0 HB2 LEU A 46 -3.499 -0.357 7.757 1.00 72.33 H new ATOM 0 HB3 LEU A 46 -3.918 -0.464 9.455 1.00 72.33 H new ATOM 0 HG LEU A 46 -4.720 1.799 7.574 1.00 42.41 H new ATOM 0 HD11 LEU A 46 -7.015 0.912 7.798 1.00 25.23 H new ATOM 0 HD12 LEU A 46 -5.915 -0.268 7.047 1.00 25.23 H new ATOM 0 HD13 LEU A 46 -6.391 -0.454 8.752 1.00 25.23 H new ATOM 0 HD21 LEU A 46 -6.142 2.600 9.449 1.00 52.40 H new ATOM 0 HD22 LEU A 46 -5.456 1.339 10.501 1.00 52.40 H new ATOM 0 HD23 LEU A 46 -4.413 2.635 9.868 1.00 52.40 H new ATOM 700 N ALA A 47 -0.527 -0.531 8.507 1.00 52.03 N ATOM 701 CA ALA A 47 0.646 -1.403 8.767 1.00 24.13 C ATOM 702 C ALA A 47 1.729 -0.670 9.596 1.00 62.23 C ATOM 703 O ALA A 47 2.450 -1.301 10.370 1.00 71.44 O ATOM 704 CB ALA A 47 1.227 -1.931 7.441 1.00 63.12 C ATOM 0 H ALA A 47 -0.698 -0.367 7.515 1.00 52.03 H new ATOM 0 HA ALA A 47 0.307 -2.253 9.359 1.00 24.13 H new ATOM 0 HB1 ALA A 47 2.086 -2.569 7.649 1.00 63.12 H new ATOM 0 HB2 ALA A 47 0.466 -2.507 6.914 1.00 63.12 H new ATOM 0 HB3 ALA A 47 1.540 -1.091 6.821 1.00 63.12 H new ATOM 710 N ARG A 48 1.817 0.669 9.418 1.00 73.31 N ATOM 711 CA ARG A 48 2.605 1.570 10.300 1.00 43.11 C ATOM 712 C ARG A 48 2.231 1.363 11.787 1.00 42.13 C ATOM 713 O ARG A 48 3.094 1.170 12.646 1.00 30.45 O ATOM 714 CB ARG A 48 2.320 3.045 9.908 1.00 65.01 C ATOM 715 CG ARG A 48 2.946 4.117 10.837 1.00 3.40 C ATOM 716 CD ARG A 48 2.525 5.549 10.459 1.00 23.33 C ATOM 717 NE ARG A 48 1.071 5.773 10.637 1.00 23.43 N ATOM 718 CZ ARG A 48 0.527 6.728 11.372 1.00 54.44 C ATOM 719 NH1 ARG A 48 1.265 7.560 12.042 1.00 34.34 N ATOM 720 NH2 ARG A 48 -0.762 6.832 11.449 1.00 2.34 N ATOM 0 H ARG A 48 1.344 1.158 8.658 1.00 73.31 H new ATOM 0 HA ARG A 48 3.662 1.337 10.172 1.00 43.11 H new ATOM 0 HB2 ARG A 48 2.685 3.210 8.894 1.00 65.01 H new ATOM 0 HB3 ARG A 48 1.241 3.194 9.886 1.00 65.01 H new ATOM 0 HG2 ARG A 48 2.652 3.916 11.867 1.00 3.40 H new ATOM 0 HG3 ARG A 48 4.032 4.039 10.795 1.00 3.40 H new ATOM 0 HD2 ARG A 48 3.078 6.261 11.071 1.00 23.33 H new ATOM 0 HD3 ARG A 48 2.796 5.743 9.421 1.00 23.33 H new ATOM 0 HE ARG A 48 0.437 5.138 10.152 1.00 23.43 H new ATOM 0 HH11 ARG A 48 2.281 7.483 12.006 1.00 34.34 H new ATOM 0 HH12 ARG A 48 0.828 8.291 12.604 1.00 34.34 H new ATOM 0 HH21 ARG A 48 -1.358 6.177 10.943 1.00 2.34 H new ATOM 0 HH22 ARG A 48 -1.181 7.569 12.016 1.00 2.34 H new ATOM 734 N GLU A 49 0.917 1.383 12.046 1.00 74.23 N ATOM 735 CA GLU A 49 0.335 1.262 13.400 1.00 42.40 C ATOM 736 C GLU A 49 0.345 -0.198 13.924 1.00 12.45 C ATOM 737 O GLU A 49 0.082 -0.427 15.110 1.00 20.13 O ATOM 738 CB GLU A 49 -1.120 1.806 13.355 1.00 72.33 C ATOM 739 CG GLU A 49 -1.263 3.254 12.828 1.00 14.31 C ATOM 740 CD GLU A 49 -0.650 4.315 13.764 1.00 3.30 C ATOM 741 OE1 GLU A 49 0.584 4.535 13.715 1.00 12.00 O ATOM 742 OE2 GLU A 49 -1.395 4.931 14.558 1.00 30.50 O ATOM 0 H GLU A 49 0.214 1.485 11.314 1.00 74.23 H new ATOM 0 HA GLU A 49 0.946 1.842 14.091 1.00 42.40 H new ATOM 0 HB2 GLU A 49 -1.719 1.146 12.727 1.00 72.33 H new ATOM 0 HB3 GLU A 49 -1.541 1.758 14.359 1.00 72.33 H new ATOM 0 HG2 GLU A 49 -0.786 3.325 11.851 1.00 14.31 H new ATOM 0 HG3 GLU A 49 -2.320 3.476 12.683 1.00 14.31 H new ATOM 749 N ASN A 50 0.621 -1.167 13.012 1.00 14.44 N ATOM 750 CA ASN A 50 0.624 -2.633 13.294 1.00 53.13 C ATOM 751 C ASN A 50 -0.766 -3.153 13.748 1.00 62.35 C ATOM 752 O ASN A 50 -0.885 -4.225 14.352 1.00 70.04 O ATOM 753 CB ASN A 50 1.732 -3.001 14.325 1.00 31.51 C ATOM 754 CG ASN A 50 3.146 -2.634 13.862 1.00 40.43 C ATOM 755 OD1 ASN A 50 4.008 -2.319 14.669 1.00 43.22 O ATOM 756 ND2 ASN A 50 3.418 -2.704 12.567 1.00 21.20 N ATOM 0 H ASN A 50 0.852 -0.951 12.042 1.00 14.44 H new ATOM 0 HA ASN A 50 0.853 -3.137 12.355 1.00 53.13 H new ATOM 0 HB2 ASN A 50 1.524 -2.493 15.267 1.00 31.51 H new ATOM 0 HB3 ASN A 50 1.690 -4.072 14.524 1.00 31.51 H new ATOM 0 HD21 ASN A 50 4.358 -2.493 12.231 1.00 21.20 H new ATOM 0 HD22 ASN A 50 2.688 -2.968 11.906 1.00 21.20 H new ATOM 763 N LYS A 51 -1.818 -2.401 13.387 1.00 71.51 N ATOM 764 CA LYS A 51 -3.216 -2.724 13.736 1.00 40.31 C ATOM 765 C LYS A 51 -3.880 -3.632 12.668 1.00 44.43 C ATOM 766 O LYS A 51 -5.032 -4.042 12.826 1.00 60.41 O ATOM 767 CB LYS A 51 -4.001 -1.398 13.936 1.00 25.10 C ATOM 768 CG LYS A 51 -3.519 -0.566 15.152 1.00 12.44 C ATOM 769 CD LYS A 51 -4.144 0.847 15.225 1.00 15.31 C ATOM 770 CE LYS A 51 -5.677 0.829 15.324 1.00 41.14 C ATOM 771 NZ LYS A 51 -6.241 2.188 15.455 1.00 12.13 N ATOM 0 H LYS A 51 -1.724 -1.545 12.841 1.00 71.51 H new ATOM 0 HA LYS A 51 -3.232 -3.292 14.666 1.00 40.31 H new ATOM 0 HB2 LYS A 51 -3.910 -0.793 13.034 1.00 25.10 H new ATOM 0 HB3 LYS A 51 -5.059 -1.628 14.061 1.00 25.10 H new ATOM 0 HG2 LYS A 51 -3.757 -1.107 16.068 1.00 12.44 H new ATOM 0 HG3 LYS A 51 -2.434 -0.472 15.110 1.00 12.44 H new ATOM 0 HD2 LYS A 51 -3.737 1.372 16.089 1.00 15.31 H new ATOM 0 HD3 LYS A 51 -3.851 1.413 14.341 1.00 15.31 H new ATOM 0 HE2 LYS A 51 -6.092 0.349 14.438 1.00 41.14 H new ATOM 0 HE3 LYS A 51 -5.977 0.228 16.182 1.00 41.14 H new ATOM 0 HZ1 LYS A 51 -7.277 2.129 15.519 1.00 12.13 H new ATOM 0 HZ2 LYS A 51 -5.866 2.638 16.314 1.00 12.13 H new ATOM 0 HZ3 LYS A 51 -5.977 2.755 14.624 1.00 12.13 H new ATOM 785 N VAL A 52 -3.134 -3.945 11.588 1.00 64.12 N ATOM 786 CA VAL A 52 -3.571 -4.890 10.526 1.00 63.12 C ATOM 787 C VAL A 52 -2.513 -5.992 10.299 1.00 43.01 C ATOM 788 O VAL A 52 -1.321 -5.792 10.574 1.00 43.05 O ATOM 789 CB VAL A 52 -3.871 -4.164 9.154 1.00 32.12 C ATOM 790 CG1 VAL A 52 -5.040 -3.167 9.302 1.00 3.51 C ATOM 791 CG2 VAL A 52 -2.603 -3.469 8.576 1.00 3.03 C ATOM 0 H VAL A 52 -2.208 -3.551 11.423 1.00 64.12 H new ATOM 0 HA VAL A 52 -4.499 -5.338 10.880 1.00 63.12 H new ATOM 0 HB VAL A 52 -4.169 -4.929 8.438 1.00 32.12 H new ATOM 0 HG11 VAL A 52 -5.227 -2.681 8.345 1.00 3.51 H new ATOM 0 HG12 VAL A 52 -5.936 -3.701 9.619 1.00 3.51 H new ATOM 0 HG13 VAL A 52 -4.784 -2.414 10.048 1.00 3.51 H new ATOM 0 HG21 VAL A 52 -2.853 -2.982 7.633 1.00 3.03 H new ATOM 0 HG22 VAL A 52 -2.242 -2.724 9.285 1.00 3.03 H new ATOM 0 HG23 VAL A 52 -1.826 -4.214 8.405 1.00 3.03 H new ATOM 801 N VAL A 53 -2.978 -7.150 9.801 1.00 72.43 N ATOM 802 CA VAL A 53 -2.127 -8.308 9.441 1.00 41.32 C ATOM 803 C VAL A 53 -2.549 -8.871 8.057 1.00 71.42 C ATOM 804 O VAL A 53 -3.734 -9.059 7.784 1.00 52.53 O ATOM 805 CB VAL A 53 -2.190 -9.441 10.546 1.00 54.31 C ATOM 806 CG1 VAL A 53 -1.393 -9.028 11.817 1.00 5.14 C ATOM 807 CG2 VAL A 53 -3.662 -9.790 10.906 1.00 14.44 C ATOM 0 H VAL A 53 -3.970 -7.315 9.633 1.00 72.43 H new ATOM 0 HA VAL A 53 -1.095 -7.963 9.384 1.00 41.32 H new ATOM 0 HB VAL A 53 -1.724 -10.335 10.132 1.00 54.31 H new ATOM 0 HG11 VAL A 53 -1.453 -9.824 12.559 1.00 5.14 H new ATOM 0 HG12 VAL A 53 -0.350 -8.857 11.552 1.00 5.14 H new ATOM 0 HG13 VAL A 53 -1.817 -8.113 12.231 1.00 5.14 H new ATOM 0 HG21 VAL A 53 -3.675 -10.570 11.667 1.00 14.44 H new ATOM 0 HG22 VAL A 53 -4.163 -8.901 11.289 1.00 14.44 H new ATOM 0 HG23 VAL A 53 -4.181 -10.143 10.015 1.00 14.44 H new ATOM 817 N ILE A 54 -1.563 -9.108 7.180 1.00 22.51 N ATOM 818 CA ILE A 54 -1.791 -9.586 5.797 1.00 32.35 C ATOM 819 C ILE A 54 -1.369 -11.076 5.676 1.00 11.54 C ATOM 820 O ILE A 54 -0.236 -11.444 6.006 1.00 41.34 O ATOM 821 CB ILE A 54 -1.014 -8.709 4.721 1.00 43.15 C ATOM 822 CG1 ILE A 54 -1.531 -7.217 4.674 1.00 51.23 C ATOM 823 CG2 ILE A 54 -1.081 -9.357 3.306 1.00 45.25 C ATOM 824 CD1 ILE A 54 -1.107 -6.324 5.836 1.00 31.43 C ATOM 0 H ILE A 54 -0.577 -8.975 7.406 1.00 22.51 H new ATOM 0 HA ILE A 54 -2.856 -9.487 5.588 1.00 32.35 H new ATOM 0 HB ILE A 54 0.028 -8.681 5.039 1.00 43.15 H new ATOM 0 HG12 ILE A 54 -1.183 -6.762 3.747 1.00 51.23 H new ATOM 0 HG13 ILE A 54 -2.620 -7.232 4.632 1.00 51.23 H new ATOM 0 HG21 ILE A 54 -0.541 -8.733 2.594 1.00 45.25 H new ATOM 0 HG22 ILE A 54 -0.627 -10.348 3.338 1.00 45.25 H new ATOM 0 HG23 ILE A 54 -2.122 -9.444 2.995 1.00 45.25 H new ATOM 0 HD11 ILE A 54 -1.520 -5.325 5.696 1.00 31.43 H new ATOM 0 HD12 ILE A 54 -1.479 -6.743 6.771 1.00 31.43 H new ATOM 0 HD13 ILE A 54 -0.019 -6.265 5.872 1.00 31.43 H new ATOM 836 N GLU A 55 -2.296 -11.917 5.180 1.00 11.52 N ATOM 837 CA GLU A 55 -2.057 -13.361 4.942 1.00 63.03 C ATOM 838 C GLU A 55 -2.029 -13.676 3.434 1.00 23.33 C ATOM 839 O GLU A 55 -2.831 -13.142 2.660 1.00 74.54 O ATOM 840 CB GLU A 55 -3.151 -14.218 5.641 1.00 20.22 C ATOM 841 CG GLU A 55 -2.930 -14.476 7.149 1.00 14.45 C ATOM 842 CD GLU A 55 -1.802 -15.491 7.458 1.00 13.43 C ATOM 843 OE1 GLU A 55 -1.541 -16.396 6.625 1.00 5.11 O ATOM 844 OE2 GLU A 55 -1.199 -15.418 8.551 1.00 71.10 O ATOM 0 H GLU A 55 -3.238 -11.616 4.930 1.00 11.52 H new ATOM 0 HA GLU A 55 -1.085 -13.612 5.366 1.00 63.03 H new ATOM 0 HB2 GLU A 55 -4.113 -13.723 5.512 1.00 20.22 H new ATOM 0 HB3 GLU A 55 -3.216 -15.179 5.131 1.00 20.22 H new ATOM 0 HG2 GLU A 55 -2.697 -13.530 7.638 1.00 14.45 H new ATOM 0 HG3 GLU A 55 -3.861 -14.840 7.585 1.00 14.45 H new ATOM 851 N ARG A 56 -1.096 -14.557 3.040 1.00 1.40 N ATOM 852 CA ARG A 56 -0.990 -15.093 1.668 1.00 52.34 C ATOM 853 C ARG A 56 -1.240 -16.613 1.686 1.00 74.31 C ATOM 854 O ARG A 56 -0.554 -17.359 2.391 1.00 3.03 O ATOM 855 CB ARG A 56 0.402 -14.787 1.067 1.00 53.50 C ATOM 856 CG ARG A 56 0.726 -13.282 0.960 1.00 42.32 C ATOM 857 CD ARG A 56 2.126 -13.017 0.378 1.00 23.22 C ATOM 858 NE ARG A 56 3.186 -13.709 1.136 1.00 2.32 N ATOM 859 CZ ARG A 56 4.468 -13.689 0.847 1.00 72.22 C ATOM 860 NH1 ARG A 56 4.919 -13.009 -0.158 1.00 73.02 N ATOM 861 NH2 ARG A 56 5.290 -14.371 1.573 1.00 3.12 N ATOM 0 H ARG A 56 -0.384 -14.924 3.671 1.00 1.40 H new ATOM 0 HA ARG A 56 -1.743 -14.612 1.044 1.00 52.34 H new ATOM 0 HB2 ARG A 56 1.164 -15.269 1.679 1.00 53.50 H new ATOM 0 HB3 ARG A 56 0.463 -15.232 0.074 1.00 53.50 H new ATOM 0 HG2 ARG A 56 -0.022 -12.797 0.333 1.00 42.32 H new ATOM 0 HG3 ARG A 56 0.656 -12.828 1.948 1.00 42.32 H new ATOM 0 HD2 ARG A 56 2.153 -13.344 -0.662 1.00 23.22 H new ATOM 0 HD3 ARG A 56 2.321 -11.945 0.380 1.00 23.22 H new ATOM 0 HE ARG A 56 2.900 -14.248 1.953 1.00 2.32 H new ATOM 0 HH11 ARG A 56 4.276 -12.475 -0.743 1.00 73.02 H new ATOM 0 HH12 ARG A 56 5.918 -13.007 -0.365 1.00 73.02 H new ATOM 0 HH21 ARG A 56 4.942 -14.917 2.361 1.00 3.12 H new ATOM 0 HH22 ARG A 56 6.287 -14.363 1.358 1.00 3.12 H new ATOM 875 N LYS A 57 -2.218 -17.055 0.890 1.00 51.25 N ATOM 876 CA LYS A 57 -2.644 -18.467 0.813 1.00 0.14 C ATOM 877 C LYS A 57 -2.909 -18.845 -0.654 1.00 21.54 C ATOM 878 O LYS A 57 -3.773 -18.244 -1.296 1.00 21.41 O ATOM 879 CB LYS A 57 -3.906 -18.741 1.709 1.00 55.30 C ATOM 880 CG LYS A 57 -5.221 -17.957 1.382 1.00 43.31 C ATOM 881 CD LYS A 57 -5.147 -16.427 1.625 1.00 23.23 C ATOM 882 CE LYS A 57 -4.970 -16.058 3.100 1.00 62.54 C ATOM 883 NZ LYS A 57 -6.109 -16.520 3.931 1.00 61.43 N ATOM 0 H LYS A 57 -2.746 -16.440 0.271 1.00 51.25 H new ATOM 0 HA LYS A 57 -1.841 -19.094 1.201 1.00 0.14 H new ATOM 0 HB2 LYS A 57 -4.130 -19.806 1.655 1.00 55.30 H new ATOM 0 HB3 LYS A 57 -3.636 -18.524 2.742 1.00 55.30 H new ATOM 0 HG2 LYS A 57 -5.481 -18.132 0.338 1.00 43.31 H new ATOM 0 HG3 LYS A 57 -6.031 -18.367 1.985 1.00 43.31 H new ATOM 0 HD2 LYS A 57 -4.317 -16.014 1.052 1.00 23.23 H new ATOM 0 HD3 LYS A 57 -6.057 -15.961 1.247 1.00 23.23 H new ATOM 0 HE2 LYS A 57 -4.046 -16.498 3.475 1.00 62.54 H new ATOM 0 HE3 LYS A 57 -4.869 -14.977 3.193 1.00 62.54 H new ATOM 0 HZ1 LYS A 57 -6.442 -15.737 4.529 1.00 61.43 H new ATOM 0 HZ2 LYS A 57 -6.883 -16.838 3.313 1.00 61.43 H new ATOM 0 HZ3 LYS A 57 -5.801 -17.309 4.534 1.00 61.43 H new ATOM 897 N ASN A 58 -2.141 -19.822 -1.185 1.00 13.42 N ATOM 898 CA ASN A 58 -2.254 -20.281 -2.596 1.00 65.44 C ATOM 899 C ASN A 58 -2.017 -19.094 -3.607 1.00 43.12 C ATOM 900 O ASN A 58 -2.573 -19.053 -4.713 1.00 34.33 O ATOM 901 CB ASN A 58 -3.648 -20.978 -2.767 1.00 33.11 C ATOM 902 CG ASN A 58 -3.867 -21.682 -4.101 1.00 4.11 C ATOM 903 OD1 ASN A 58 -2.943 -22.212 -4.710 1.00 43.33 O ATOM 904 ND2 ASN A 58 -5.098 -21.681 -4.569 1.00 72.02 N ATOM 0 H ASN A 58 -1.425 -20.317 -0.652 1.00 13.42 H new ATOM 0 HA ASN A 58 -1.474 -21.006 -2.829 1.00 65.44 H new ATOM 0 HB2 ASN A 58 -3.772 -21.707 -1.966 1.00 33.11 H new ATOM 0 HB3 ASN A 58 -4.429 -20.228 -2.639 1.00 33.11 H new ATOM 0 HD21 ASN A 58 -5.305 -22.129 -5.462 1.00 72.02 H new ATOM 0 HD22 ASN A 58 -5.845 -21.232 -4.039 1.00 72.02 H new ATOM 911 N GLY A 59 -1.151 -18.135 -3.194 1.00 44.31 N ATOM 912 CA GLY A 59 -0.846 -16.926 -3.993 1.00 62.24 C ATOM 913 C GLY A 59 -1.831 -15.759 -3.778 1.00 2.50 C ATOM 914 O GLY A 59 -1.591 -14.639 -4.254 1.00 72.40 O ATOM 0 H GLY A 59 -0.650 -18.178 -2.307 1.00 44.31 H new ATOM 0 HA2 GLY A 59 0.160 -16.587 -3.748 1.00 62.24 H new ATOM 0 HA3 GLY A 59 -0.843 -17.194 -5.050 1.00 62.24 H new ATOM 918 N LEU A 60 -2.942 -16.024 -3.066 1.00 21.20 N ATOM 919 CA LEU A 60 -4.011 -15.035 -2.795 1.00 55.54 C ATOM 920 C LEU A 60 -3.648 -14.151 -1.578 1.00 21.34 C ATOM 921 O LEU A 60 -3.406 -14.663 -0.488 1.00 32.11 O ATOM 922 CB LEU A 60 -5.352 -15.779 -2.532 1.00 42.13 C ATOM 923 CG LEU A 60 -5.881 -16.677 -3.698 1.00 61.45 C ATOM 924 CD1 LEU A 60 -7.135 -17.476 -3.265 1.00 74.44 C ATOM 925 CD2 LEU A 60 -6.154 -15.842 -4.974 1.00 1.43 C ATOM 0 H LEU A 60 -3.128 -16.940 -2.657 1.00 21.20 H new ATOM 0 HA LEU A 60 -4.117 -14.388 -3.665 1.00 55.54 H new ATOM 0 HB2 LEU A 60 -5.230 -16.403 -1.647 1.00 42.13 H new ATOM 0 HB3 LEU A 60 -6.115 -15.037 -2.297 1.00 42.13 H new ATOM 0 HG LEU A 60 -5.100 -17.397 -3.941 1.00 61.45 H new ATOM 0 HD11 LEU A 60 -7.480 -18.091 -4.096 1.00 74.44 H new ATOM 0 HD12 LEU A 60 -6.884 -18.117 -2.419 1.00 74.44 H new ATOM 0 HD13 LEU A 60 -7.925 -16.784 -2.974 1.00 74.44 H new ATOM 0 HD21 LEU A 60 -6.520 -16.496 -5.765 1.00 1.43 H new ATOM 0 HD22 LEU A 60 -6.903 -15.080 -4.757 1.00 1.43 H new ATOM 0 HD23 LEU A 60 -5.231 -15.362 -5.299 1.00 1.43 H new ATOM 937 N ILE A 61 -3.599 -12.831 -1.784 1.00 42.53 N ATOM 938 CA ILE A 61 -3.321 -11.851 -0.710 1.00 5.12 C ATOM 939 C ILE A 61 -4.655 -11.305 -0.140 1.00 3.11 C ATOM 940 O ILE A 61 -5.515 -10.852 -0.906 1.00 45.13 O ATOM 941 CB ILE A 61 -2.436 -10.669 -1.265 1.00 51.23 C ATOM 942 CG1 ILE A 61 -1.114 -11.230 -1.894 1.00 63.22 C ATOM 943 CG2 ILE A 61 -2.136 -9.613 -0.167 1.00 34.44 C ATOM 944 CD1 ILE A 61 -0.212 -10.189 -2.539 1.00 51.22 C ATOM 0 H ILE A 61 -3.750 -12.404 -2.698 1.00 42.53 H new ATOM 0 HA ILE A 61 -2.771 -12.347 0.090 1.00 5.12 H new ATOM 0 HB ILE A 61 -3.001 -10.161 -2.047 1.00 51.23 H new ATOM 0 HG12 ILE A 61 -0.550 -11.744 -1.116 1.00 63.22 H new ATOM 0 HG13 ILE A 61 -1.375 -11.976 -2.644 1.00 63.22 H new ATOM 0 HG21 ILE A 61 -1.524 -8.815 -0.587 1.00 34.44 H new ATOM 0 HG22 ILE A 61 -3.073 -9.196 0.202 1.00 34.44 H new ATOM 0 HG23 ILE A 61 -1.600 -10.086 0.656 1.00 34.44 H new ATOM 0 HD11 ILE A 61 0.675 -10.677 -2.944 1.00 51.22 H new ATOM 0 HD12 ILE A 61 -0.751 -9.689 -3.344 1.00 51.22 H new ATOM 0 HD13 ILE A 61 0.087 -9.454 -1.792 1.00 51.22 H new ATOM 956 N GLU A 62 -4.834 -11.381 1.199 1.00 70.35 N ATOM 957 CA GLU A 62 -6.045 -10.871 1.899 1.00 41.41 C ATOM 958 C GLU A 62 -5.641 -10.037 3.141 1.00 34.12 C ATOM 959 O GLU A 62 -4.687 -10.379 3.853 1.00 63.44 O ATOM 960 CB GLU A 62 -6.981 -12.036 2.330 1.00 54.44 C ATOM 961 CG GLU A 62 -7.489 -12.929 1.178 1.00 22.12 C ATOM 962 CD GLU A 62 -8.475 -14.024 1.639 1.00 70.13 C ATOM 963 OE1 GLU A 62 -8.150 -14.769 2.590 1.00 44.13 O ATOM 964 OE2 GLU A 62 -9.573 -14.154 1.049 1.00 1.14 O ATOM 0 H GLU A 62 -4.146 -11.796 1.828 1.00 70.35 H new ATOM 0 HA GLU A 62 -6.588 -10.235 1.200 1.00 41.41 H new ATOM 0 HB2 GLU A 62 -6.450 -12.662 3.047 1.00 54.44 H new ATOM 0 HB3 GLU A 62 -7.842 -11.616 2.850 1.00 54.44 H new ATOM 0 HG2 GLU A 62 -7.977 -12.303 0.431 1.00 22.12 H new ATOM 0 HG3 GLU A 62 -6.636 -13.401 0.691 1.00 22.12 H new ATOM 971 N ILE A 63 -6.391 -8.945 3.384 1.00 1.43 N ATOM 972 CA ILE A 63 -6.153 -8.011 4.506 1.00 5.13 C ATOM 973 C ILE A 63 -7.078 -8.371 5.690 1.00 51.14 C ATOM 974 O ILE A 63 -8.309 -8.346 5.578 1.00 42.30 O ATOM 975 CB ILE A 63 -6.372 -6.490 4.097 1.00 41.54 C ATOM 976 CG1 ILE A 63 -5.307 -6.007 3.046 1.00 40.15 C ATOM 977 CG2 ILE A 63 -6.361 -5.552 5.347 1.00 32.35 C ATOM 978 CD1 ILE A 63 -5.385 -6.654 1.674 1.00 20.52 C ATOM 0 H ILE A 63 -7.187 -8.682 2.803 1.00 1.43 H new ATOM 0 HA ILE A 63 -5.108 -8.118 4.796 1.00 5.13 H new ATOM 0 HB ILE A 63 -7.356 -6.431 3.632 1.00 41.54 H new ATOM 0 HG12 ILE A 63 -5.409 -4.929 2.924 1.00 40.15 H new ATOM 0 HG13 ILE A 63 -4.313 -6.188 3.455 1.00 40.15 H new ATOM 0 HG21 ILE A 63 -6.513 -4.521 5.029 1.00 32.35 H new ATOM 0 HG22 ILE A 63 -7.161 -5.844 6.028 1.00 32.35 H new ATOM 0 HG23 ILE A 63 -5.401 -5.637 5.857 1.00 32.35 H new ATOM 0 HD11 ILE A 63 -4.604 -6.244 1.034 1.00 20.52 H new ATOM 0 HD12 ILE A 63 -5.247 -7.731 1.771 1.00 20.52 H new ATOM 0 HD13 ILE A 63 -6.360 -6.452 1.231 1.00 20.52 H new ATOM 990 N TYR A 64 -6.453 -8.730 6.808 1.00 71.03 N ATOM 991 CA TYR A 64 -7.122 -8.981 8.097 1.00 3.43 C ATOM 992 C TYR A 64 -6.795 -7.826 9.070 1.00 41.44 C ATOM 993 O TYR A 64 -5.861 -7.048 8.841 1.00 21.14 O ATOM 994 CB TYR A 64 -6.632 -10.333 8.698 1.00 52.23 C ATOM 995 CG TYR A 64 -6.920 -11.577 7.836 1.00 32.41 C ATOM 996 CD1 TYR A 64 -6.208 -11.816 6.656 1.00 33.20 C ATOM 997 CD2 TYR A 64 -7.895 -12.512 8.202 1.00 73.45 C ATOM 998 CE1 TYR A 64 -6.463 -12.925 5.877 1.00 3.43 C ATOM 999 CE2 TYR A 64 -8.148 -13.627 7.420 1.00 71.12 C ATOM 1000 CZ TYR A 64 -7.427 -13.825 6.261 1.00 33.11 C ATOM 1001 OH TYR A 64 -7.676 -14.926 5.477 1.00 62.35 O ATOM 0 H TYR A 64 -5.442 -8.860 6.852 1.00 71.03 H new ATOM 0 HA TYR A 64 -8.200 -9.036 7.942 1.00 3.43 H new ATOM 0 HB2 TYR A 64 -5.557 -10.269 8.867 1.00 52.23 H new ATOM 0 HB3 TYR A 64 -7.100 -10.470 9.673 1.00 52.23 H new ATOM 0 HD1 TYR A 64 -5.443 -11.118 6.349 1.00 33.20 H new ATOM 0 HD2 TYR A 64 -8.460 -12.362 9.110 1.00 73.45 H new ATOM 0 HE1 TYR A 64 -5.905 -13.086 4.966 1.00 3.43 H new ATOM 0 HE2 TYR A 64 -8.906 -14.337 7.716 1.00 71.12 H new ATOM 0 HH TYR A 64 -8.385 -15.465 5.886 1.00 62.35 H new ATOM 1011 N ASN A 65 -7.567 -7.725 10.152 1.00 35.35 N ATOM 1012 CA ASN A 65 -7.255 -6.828 11.290 1.00 61.00 C ATOM 1013 C ASN A 65 -6.484 -7.617 12.368 1.00 51.21 C ATOM 1014 O ASN A 65 -6.500 -8.856 12.370 1.00 71.23 O ATOM 1015 CB ASN A 65 -8.555 -6.230 11.897 1.00 45.01 C ATOM 1016 CG ASN A 65 -9.558 -7.289 12.388 1.00 33.52 C ATOM 1017 OD1 ASN A 65 -9.710 -8.343 11.793 1.00 64.42 O ATOM 1018 ND2 ASN A 65 -10.220 -7.036 13.496 1.00 74.35 N ATOM 0 H ASN A 65 -8.428 -8.258 10.275 1.00 35.35 H new ATOM 0 HA ASN A 65 -6.640 -6.004 10.928 1.00 61.00 H new ATOM 0 HB2 ASN A 65 -8.290 -5.581 12.731 1.00 45.01 H new ATOM 0 HB3 ASN A 65 -9.040 -5.604 11.148 1.00 45.01 H new ATOM 0 HD21 ASN A 65 -10.872 -7.726 13.870 1.00 74.35 H new ATOM 0 HD22 ASN A 65 -10.082 -6.150 13.982 1.00 74.35 H new ATOM 1025 N GLU A 66 -5.805 -6.911 13.275 1.00 13.12 N ATOM 1026 CA GLU A 66 -5.211 -7.548 14.464 1.00 43.42 C ATOM 1027 C GLU A 66 -6.325 -7.819 15.505 1.00 72.53 C ATOM 1028 O GLU A 66 -7.159 -6.947 15.781 1.00 52.14 O ATOM 1029 CB GLU A 66 -4.069 -6.686 15.060 1.00 11.51 C ATOM 1030 CG GLU A 66 -3.354 -7.324 16.279 1.00 61.51 C ATOM 1031 CD GLU A 66 -2.829 -8.755 16.013 1.00 51.02 C ATOM 1032 OE1 GLU A 66 -1.800 -8.897 15.319 1.00 34.32 O ATOM 1033 OE2 GLU A 66 -3.451 -9.742 16.491 1.00 74.12 O ATOM 0 H GLU A 66 -5.651 -5.905 13.214 1.00 13.12 H new ATOM 0 HA GLU A 66 -4.761 -8.497 14.172 1.00 43.42 H new ATOM 0 HB2 GLU A 66 -3.331 -6.494 14.281 1.00 11.51 H new ATOM 0 HB3 GLU A 66 -4.477 -5.720 15.358 1.00 11.51 H new ATOM 0 HG2 GLU A 66 -2.518 -6.689 16.572 1.00 61.51 H new ATOM 0 HG3 GLU A 66 -4.045 -7.351 17.121 1.00 61.51 H new ATOM 1040 N GLY A 67 -6.323 -9.035 16.063 1.00 71.04 N ATOM 1041 CA GLY A 67 -7.415 -9.534 16.912 1.00 44.42 C ATOM 1042 C GLY A 67 -7.686 -11.028 16.698 1.00 74.43 C ATOM 1043 O GLY A 67 -8.500 -11.628 17.398 1.00 12.14 O ATOM 0 H GLY A 67 -5.563 -9.704 15.939 1.00 71.04 H new ATOM 0 HA2 GLY A 67 -7.167 -9.359 17.959 1.00 44.42 H new ATOM 0 HA3 GLY A 67 -8.323 -8.969 16.701 1.00 44.42 H new ATOM 1047 N HIS A 68 -6.994 -11.620 15.707 1.00 52.44 N ATOM 1048 CA HIS A 68 -7.147 -13.047 15.340 1.00 53.20 C ATOM 1049 C HIS A 68 -6.127 -13.948 16.078 1.00 51.52 C ATOM 1050 O HIS A 68 -6.300 -15.165 16.127 1.00 50.43 O ATOM 1051 CB HIS A 68 -6.974 -13.211 13.810 1.00 54.34 C ATOM 1052 CG HIS A 68 -8.030 -12.524 12.979 1.00 15.41 C ATOM 1053 ND1 HIS A 68 -8.875 -13.202 12.134 1.00 13.30 N ATOM 1054 CD2 HIS A 68 -8.355 -11.220 12.842 1.00 21.32 C ATOM 1055 CE1 HIS A 68 -9.660 -12.356 11.518 1.00 50.14 C ATOM 1056 NE2 HIS A 68 -9.375 -11.145 11.927 1.00 63.24 N ATOM 0 H HIS A 68 -6.311 -11.124 15.135 1.00 52.44 H new ATOM 0 HA HIS A 68 -8.146 -13.362 15.641 1.00 53.20 H new ATOM 0 HB2 HIS A 68 -5.997 -12.822 13.525 1.00 54.34 H new ATOM 0 HB3 HIS A 68 -6.977 -14.274 13.570 1.00 54.34 H new ATOM 0 HD2 HIS A 68 -7.896 -10.389 13.358 1.00 21.32 H new ATOM 0 HE1 HIS A 68 -10.417 -12.614 10.793 1.00 50.14 H new ATOM 0 HE2 HIS A 68 -9.835 -10.289 11.617 1.00 63.24 H new ATOM 1065 N PHE A 69 -5.060 -13.343 16.630 1.00 43.10 N ATOM 1066 CA PHE A 69 -3.936 -14.087 17.255 1.00 4.01 C ATOM 1067 C PHE A 69 -4.034 -14.080 18.789 1.00 54.50 C ATOM 1068 O PHE A 69 -3.674 -15.063 19.448 1.00 60.05 O ATOM 1069 CB PHE A 69 -2.589 -13.476 16.804 1.00 41.21 C ATOM 1070 CG PHE A 69 -2.405 -13.510 15.290 1.00 22.44 C ATOM 1071 CD1 PHE A 69 -2.089 -14.700 14.638 1.00 70.31 C ATOM 1072 CD2 PHE A 69 -2.576 -12.364 14.515 1.00 62.13 C ATOM 1073 CE1 PHE A 69 -1.945 -14.739 13.264 1.00 32.14 C ATOM 1074 CE2 PHE A 69 -2.436 -12.409 13.145 1.00 51.34 C ATOM 1075 CZ PHE A 69 -2.119 -13.595 12.519 1.00 15.30 C ATOM 0 H PHE A 69 -4.947 -12.330 16.659 1.00 43.10 H new ATOM 0 HA PHE A 69 -3.995 -15.124 16.926 1.00 4.01 H new ATOM 0 HB2 PHE A 69 -2.529 -12.444 17.150 1.00 41.21 H new ATOM 0 HB3 PHE A 69 -1.771 -14.019 17.278 1.00 41.21 H new ATOM 0 HD1 PHE A 69 -1.955 -15.604 15.214 1.00 70.31 H new ATOM 0 HD2 PHE A 69 -2.822 -11.428 14.995 1.00 62.13 H new ATOM 0 HE1 PHE A 69 -1.696 -15.669 12.774 1.00 32.14 H new ATOM 0 HE2 PHE A 69 -2.575 -11.512 12.560 1.00 51.34 H new ATOM 0 HZ PHE A 69 -2.007 -13.627 11.445 1.00 15.30 H new ATOM 1085 N ASP A 70 -4.490 -12.956 19.351 1.00 14.24 N ATOM 1086 CA ASP A 70 -4.682 -12.806 20.806 1.00 43.12 C ATOM 1087 C ASP A 70 -6.064 -13.344 21.250 1.00 21.54 C ATOM 1088 O ASP A 70 -7.034 -13.354 20.477 1.00 3.14 O ATOM 1089 CB ASP A 70 -4.517 -11.322 21.218 1.00 62.41 C ATOM 1090 CG ASP A 70 -5.519 -10.396 20.515 1.00 41.44 C ATOM 1091 OD1 ASP A 70 -5.334 -10.130 19.311 1.00 30.41 O ATOM 1092 OD2 ASP A 70 -6.489 -9.934 21.156 1.00 42.30 O ATOM 0 H ASP A 70 -4.737 -12.124 18.816 1.00 14.24 H new ATOM 0 HA ASP A 70 -3.919 -13.398 21.310 1.00 43.12 H new ATOM 0 HB2 ASP A 70 -4.642 -11.233 22.297 1.00 62.41 H new ATOM 0 HB3 ASP A 70 -3.503 -10.996 20.987 1.00 62.41 H new ATOM 1097 N PHE A 71 -6.123 -13.782 22.509 1.00 32.22 N ATOM 1098 CA PHE A 71 -7.362 -14.253 23.165 1.00 0.45 C ATOM 1099 C PHE A 71 -8.240 -13.062 23.658 1.00 0.32 C ATOM 1100 O PHE A 71 -9.441 -13.232 23.905 1.00 44.42 O ATOM 1101 CB PHE A 71 -6.975 -15.190 24.347 1.00 73.35 C ATOM 1102 CG PHE A 71 -8.151 -15.869 25.056 1.00 1.11 C ATOM 1103 CD1 PHE A 71 -8.999 -16.729 24.356 1.00 73.10 C ATOM 1104 CD2 PHE A 71 -8.418 -15.641 26.411 1.00 13.22 C ATOM 1105 CE1 PHE A 71 -10.067 -17.339 24.987 1.00 53.02 C ATOM 1106 CE2 PHE A 71 -9.489 -16.252 27.036 1.00 51.01 C ATOM 1107 CZ PHE A 71 -10.314 -17.099 26.324 1.00 61.41 C ATOM 0 H PHE A 71 -5.305 -13.823 23.117 1.00 32.22 H new ATOM 0 HA PHE A 71 -7.962 -14.804 22.441 1.00 0.45 H new ATOM 0 HB2 PHE A 71 -6.303 -15.962 23.972 1.00 73.35 H new ATOM 0 HB3 PHE A 71 -6.416 -14.610 25.081 1.00 73.35 H new ATOM 0 HD1 PHE A 71 -8.818 -16.920 23.308 1.00 73.10 H new ATOM 0 HD2 PHE A 71 -7.779 -14.979 26.976 1.00 13.22 H new ATOM 0 HE1 PHE A 71 -10.710 -18.006 24.432 1.00 53.02 H new ATOM 0 HE2 PHE A 71 -9.680 -16.066 28.083 1.00 51.01 H new ATOM 0 HZ PHE A 71 -11.152 -17.574 26.812 1.00 61.41 H new ATOM 1117 N SER A 72 -7.628 -11.863 23.775 1.00 50.02 N ATOM 1118 CA SER A 72 -8.286 -10.652 24.336 1.00 50.32 C ATOM 1119 C SER A 72 -9.465 -10.150 23.471 1.00 43.13 C ATOM 1120 O SER A 72 -10.480 -9.693 24.008 1.00 54.44 O ATOM 1121 CB SER A 72 -7.251 -9.512 24.517 1.00 14.30 C ATOM 1122 OG SER A 72 -6.178 -9.917 25.355 1.00 33.45 O ATOM 0 H SER A 72 -6.664 -11.703 23.484 1.00 50.02 H new ATOM 0 HA SER A 72 -8.696 -10.943 25.303 1.00 50.32 H new ATOM 0 HB2 SER A 72 -6.862 -9.213 23.544 1.00 14.30 H new ATOM 0 HB3 SER A 72 -7.741 -8.638 24.947 1.00 14.30 H new ATOM 0 HG SER A 72 -5.540 -9.179 25.450 1.00 33.45 H new ATOM 1128 N PHE A 73 -9.326 -10.234 22.134 1.00 34.43 N ATOM 1129 CA PHE A 73 -10.368 -9.762 21.190 1.00 30.22 C ATOM 1130 C PHE A 73 -11.576 -10.732 21.141 1.00 62.22 C ATOM 1131 O PHE A 73 -11.409 -11.955 21.180 1.00 14.12 O ATOM 1132 CB PHE A 73 -9.767 -9.572 19.776 1.00 32.24 C ATOM 1133 CG PHE A 73 -10.733 -8.966 18.743 1.00 23.42 C ATOM 1134 CD1 PHE A 73 -11.033 -7.600 18.756 1.00 35.22 C ATOM 1135 CD2 PHE A 73 -11.349 -9.759 17.765 1.00 43.13 C ATOM 1136 CE1 PHE A 73 -11.906 -7.051 17.831 1.00 4.34 C ATOM 1137 CE2 PHE A 73 -12.222 -9.205 16.844 1.00 55.42 C ATOM 1138 CZ PHE A 73 -12.499 -7.852 16.876 1.00 4.12 C ATOM 0 H PHE A 73 -8.501 -10.625 21.678 1.00 34.43 H new ATOM 0 HA PHE A 73 -10.733 -8.800 21.551 1.00 30.22 H new ATOM 0 HB2 PHE A 73 -8.889 -8.930 19.852 1.00 32.24 H new ATOM 0 HB3 PHE A 73 -9.424 -10.539 19.409 1.00 32.24 H new ATOM 0 HD1 PHE A 73 -10.577 -6.963 19.499 1.00 35.22 H new ATOM 0 HD2 PHE A 73 -11.140 -10.818 17.729 1.00 43.13 H new ATOM 0 HE1 PHE A 73 -12.123 -5.993 17.857 1.00 4.34 H new ATOM 0 HE2 PHE A 73 -12.688 -9.832 16.098 1.00 55.42 H new ATOM 0 HZ PHE A 73 -13.178 -7.422 16.155 1.00 4.12 H new ATOM 1148 N GLY A 74 -12.783 -10.157 21.041 1.00 21.35 N ATOM 1149 CA GLY A 74 -14.033 -10.919 20.971 1.00 53.32 C ATOM 1150 C GLY A 74 -15.198 -10.103 21.524 1.00 2.14 C ATOM 1151 O GLY A 74 -15.711 -9.224 20.825 1.00 14.44 O ATOM 0 H GLY A 74 -12.918 -9.147 21.006 1.00 21.35 H new ATOM 0 HA2 GLY A 74 -14.237 -11.197 19.937 1.00 53.32 H new ATOM 0 HA3 GLY A 74 -13.931 -11.845 21.536 1.00 53.32 H new ATOM 1155 N LEU A 75 -15.568 -10.381 22.798 1.00 22.04 N ATOM 1156 CA LEU A 75 -16.568 -9.615 23.592 1.00 55.12 C ATOM 1157 C LEU A 75 -18.007 -9.684 22.992 1.00 34.11 C ATOM 1158 O LEU A 75 -18.882 -10.355 23.554 1.00 14.41 O ATOM 1159 CB LEU A 75 -16.113 -8.138 23.857 1.00 43.11 C ATOM 1160 CG LEU A 75 -14.896 -7.939 24.843 1.00 10.41 C ATOM 1161 CD1 LEU A 75 -13.562 -8.464 24.260 1.00 63.31 C ATOM 1162 CD2 LEU A 75 -14.759 -6.461 25.281 1.00 33.11 C ATOM 0 H LEU A 75 -15.171 -11.164 23.318 1.00 22.04 H new ATOM 0 HA LEU A 75 -16.619 -10.111 24.561 1.00 55.12 H new ATOM 0 HB2 LEU A 75 -15.854 -7.685 22.900 1.00 43.11 H new ATOM 0 HB3 LEU A 75 -16.965 -7.585 24.252 1.00 43.11 H new ATOM 0 HG LEU A 75 -15.117 -8.540 25.725 1.00 10.41 H new ATOM 0 HD11 LEU A 75 -12.761 -8.301 24.981 1.00 63.31 H new ATOM 0 HD12 LEU A 75 -13.651 -9.530 24.051 1.00 63.31 H new ATOM 0 HD13 LEU A 75 -13.334 -7.931 23.337 1.00 63.31 H new ATOM 0 HD21 LEU A 75 -13.912 -6.360 25.959 1.00 33.11 H new ATOM 0 HD22 LEU A 75 -14.598 -5.835 24.403 1.00 33.11 H new ATOM 0 HD23 LEU A 75 -15.670 -6.146 25.789 1.00 33.11 H new ATOM 1174 N GLU A 76 -18.244 -8.995 21.857 1.00 31.44 N ATOM 1175 CA GLU A 76 -19.569 -8.962 21.190 1.00 32.35 C ATOM 1176 C GLU A 76 -19.450 -8.653 19.676 1.00 52.11 C ATOM 1177 O GLU A 76 -18.873 -7.629 19.286 1.00 20.34 O ATOM 1178 CB GLU A 76 -20.472 -7.892 21.857 1.00 11.02 C ATOM 1179 CG GLU A 76 -21.910 -7.833 21.306 1.00 2.21 C ATOM 1180 CD GLU A 76 -22.770 -6.774 22.001 1.00 60.10 C ATOM 1181 OE1 GLU A 76 -23.090 -6.960 23.197 1.00 1.34 O ATOM 1182 OE2 GLU A 76 -23.110 -5.750 21.374 1.00 52.23 O ATOM 0 H GLU A 76 -17.530 -8.448 21.377 1.00 31.44 H new ATOM 0 HA GLU A 76 -20.011 -9.952 21.301 1.00 32.35 H new ATOM 0 HB2 GLU A 76 -20.515 -8.088 22.928 1.00 11.02 H new ATOM 0 HB3 GLU A 76 -20.008 -6.914 21.731 1.00 11.02 H new ATOM 0 HG2 GLU A 76 -21.876 -7.622 20.237 1.00 2.21 H new ATOM 0 HG3 GLU A 76 -22.379 -8.810 21.424 1.00 2.21 H new ATOM 1189 N HIS A 77 -20.021 -9.541 18.838 1.00 1.43 N ATOM 1190 CA HIS A 77 -20.247 -9.259 17.402 1.00 24.51 C ATOM 1191 C HIS A 77 -21.612 -8.547 17.238 1.00 15.51 C ATOM 1192 O HIS A 77 -22.644 -9.046 17.707 1.00 22.24 O ATOM 1193 CB HIS A 77 -20.173 -10.559 16.545 1.00 20.34 C ATOM 1194 CG HIS A 77 -21.116 -11.668 16.953 1.00 60.20 C ATOM 1195 ND1 HIS A 77 -22.387 -11.805 16.438 1.00 22.53 N ATOM 1196 CD2 HIS A 77 -20.969 -12.695 17.830 1.00 61.24 C ATOM 1197 CE1 HIS A 77 -22.974 -12.855 16.974 1.00 33.24 C ATOM 1198 NE2 HIS A 77 -22.139 -13.412 17.818 1.00 15.24 N ATOM 0 H HIS A 77 -20.337 -10.466 19.131 1.00 1.43 H new ATOM 0 HA HIS A 77 -19.456 -8.604 17.037 1.00 24.51 H new ATOM 0 HB2 HIS A 77 -20.375 -10.299 15.506 1.00 20.34 H new ATOM 0 HB3 HIS A 77 -19.153 -10.941 16.585 1.00 20.34 H new ATOM 0 HD2 HIS A 77 -20.094 -12.908 18.426 1.00 61.24 H new ATOM 0 HE1 HIS A 77 -23.974 -13.199 16.755 1.00 33.24 H new ATOM 0 HE2 HIS A 77 -22.329 -14.245 18.376 1.00 15.24 H new ATOM 1207 N HIS A 78 -21.603 -7.367 16.607 1.00 1.02 N ATOM 1208 CA HIS A 78 -22.807 -6.521 16.466 1.00 71.01 C ATOM 1209 C HIS A 78 -23.603 -6.949 15.206 1.00 31.44 C ATOM 1210 O HIS A 78 -24.710 -7.467 15.338 1.00 42.10 O ATOM 1211 CB HIS A 78 -22.406 -5.021 16.427 1.00 65.13 C ATOM 1212 CG HIS A 78 -21.445 -4.639 17.525 1.00 51.31 C ATOM 1213 ND1 HIS A 78 -21.790 -4.631 18.860 1.00 2.13 N ATOM 1214 CD2 HIS A 78 -20.129 -4.309 17.484 1.00 11.42 C ATOM 1215 CE1 HIS A 78 -20.739 -4.314 19.585 1.00 62.23 C ATOM 1216 NE2 HIS A 78 -19.720 -4.115 18.778 1.00 30.14 N ATOM 0 H HIS A 78 -20.768 -6.968 16.179 1.00 1.02 H new ATOM 0 HA HIS A 78 -23.458 -6.658 17.330 1.00 71.01 H new ATOM 0 HB2 HIS A 78 -21.953 -4.797 15.461 1.00 65.13 H new ATOM 0 HB3 HIS A 78 -23.304 -4.408 16.508 1.00 65.13 H new ATOM 0 HD1 HIS A 78 -22.718 -4.839 19.229 1.00 2.13 H new ATOM 0 HD2 HIS A 78 -19.518 -4.217 16.598 1.00 11.42 H new ATOM 0 HE1 HIS A 78 -20.717 -4.231 20.662 1.00 62.23 H new ATOM 1225 N HIS A 79 -23.006 -6.737 14.002 1.00 50.43 N ATOM 1226 CA HIS A 79 -23.502 -7.269 12.698 1.00 64.34 C ATOM 1227 C HIS A 79 -24.955 -6.814 12.370 1.00 43.25 C ATOM 1228 O HIS A 79 -25.914 -7.349 12.934 1.00 63.13 O ATOM 1229 CB HIS A 79 -23.360 -8.823 12.675 1.00 72.31 C ATOM 1230 CG HIS A 79 -23.815 -9.509 11.405 1.00 74.13 C ATOM 1231 ND1 HIS A 79 -23.025 -9.626 10.281 1.00 4.24 N ATOM 1232 CD2 HIS A 79 -24.979 -10.145 11.101 1.00 60.35 C ATOM 1233 CE1 HIS A 79 -23.677 -10.295 9.352 1.00 43.24 C ATOM 1234 NE2 HIS A 79 -24.858 -10.621 9.822 1.00 20.43 N ATOM 0 H HIS A 79 -22.154 -6.184 13.906 1.00 50.43 H new ATOM 0 HA HIS A 79 -22.881 -6.846 11.908 1.00 64.34 H new ATOM 0 HB2 HIS A 79 -22.314 -9.076 12.847 1.00 72.31 H new ATOM 0 HB3 HIS A 79 -23.928 -9.233 13.510 1.00 72.31 H new ATOM 0 HD2 HIS A 79 -25.838 -10.254 11.747 1.00 60.35 H new ATOM 0 HE1 HIS A 79 -23.302 -10.535 8.368 1.00 43.24 H new ATOM 0 HE2 HIS A 79 -25.572 -11.145 9.316 1.00 20.43 H new ATOM 1243 N HIS A 80 -25.084 -5.809 11.468 1.00 33.11 N ATOM 1244 CA HIS A 80 -26.386 -5.201 11.047 1.00 32.33 C ATOM 1245 C HIS A 80 -27.034 -4.326 12.179 1.00 12.22 C ATOM 1246 O HIS A 80 -28.109 -3.740 11.992 1.00 74.35 O ATOM 1247 CB HIS A 80 -27.364 -6.299 10.505 1.00 20.23 C ATOM 1248 CG HIS A 80 -28.632 -5.781 9.871 1.00 35.33 C ATOM 1249 ND1 HIS A 80 -29.810 -5.612 10.570 1.00 11.43 N ATOM 1250 CD2 HIS A 80 -28.902 -5.396 8.604 1.00 64.00 C ATOM 1251 CE1 HIS A 80 -30.739 -5.154 9.767 1.00 73.22 C ATOM 1252 NE2 HIS A 80 -30.216 -5.011 8.571 1.00 32.00 N ATOM 0 H HIS A 80 -24.280 -5.388 11.002 1.00 33.11 H new ATOM 0 HA HIS A 80 -26.177 -4.514 10.227 1.00 32.33 H new ATOM 0 HB2 HIS A 80 -26.832 -6.905 9.771 1.00 20.23 H new ATOM 0 HB3 HIS A 80 -27.634 -6.960 11.329 1.00 20.23 H new ATOM 0 HD2 HIS A 80 -28.211 -5.393 7.774 1.00 64.00 H new ATOM 0 HE1 HIS A 80 -31.760 -4.932 10.042 1.00 73.22 H new ATOM 0 HE2 HIS A 80 -30.710 -4.667 7.748 1.00 32.00 H new ATOM 1261 N HIS A 81 -26.351 -4.220 13.341 1.00 72.42 N ATOM 1262 CA HIS A 81 -26.768 -3.345 14.454 1.00 2.54 C ATOM 1263 C HIS A 81 -26.549 -1.861 14.053 1.00 63.20 C ATOM 1264 O HIS A 81 -25.415 -1.366 14.070 1.00 52.20 O ATOM 1265 CB HIS A 81 -25.977 -3.716 15.740 1.00 0.02 C ATOM 1266 CG HIS A 81 -26.354 -2.928 16.974 1.00 4.52 C ATOM 1267 ND1 HIS A 81 -27.301 -3.355 17.880 1.00 0.22 N ATOM 1268 CD2 HIS A 81 -25.877 -1.760 17.469 1.00 73.51 C ATOM 1269 CE1 HIS A 81 -27.385 -2.494 18.870 1.00 44.01 C ATOM 1270 NE2 HIS A 81 -26.533 -1.518 18.646 1.00 12.10 N ATOM 0 H HIS A 81 -25.495 -4.740 13.531 1.00 72.42 H new ATOM 0 HA HIS A 81 -27.828 -3.486 14.665 1.00 2.54 H new ATOM 0 HB2 HIS A 81 -26.125 -4.776 15.946 1.00 0.02 H new ATOM 0 HB3 HIS A 81 -24.914 -3.574 15.548 1.00 0.02 H new ATOM 0 HD2 HIS A 81 -25.120 -1.136 17.018 1.00 73.51 H new ATOM 0 HE1 HIS A 81 -28.043 -2.575 19.723 1.00 44.01 H new ATOM 0 HE2 HIS A 81 -26.385 -0.711 19.252 1.00 12.10 H new ATOM 1279 N HIS A 82 -27.648 -1.189 13.667 1.00 72.53 N ATOM 1280 CA HIS A 82 -27.633 0.204 13.164 1.00 25.23 C ATOM 1281 C HIS A 82 -27.138 1.198 14.240 1.00 51.12 C ATOM 1282 O HIS A 82 -27.764 1.383 15.284 1.00 51.04 O ATOM 1283 CB HIS A 82 -29.054 0.578 12.657 1.00 30.31 C ATOM 1284 CG HIS A 82 -29.151 1.909 11.946 1.00 3.34 C ATOM 1285 ND1 HIS A 82 -29.009 2.041 10.580 1.00 70.04 N ATOM 1286 CD2 HIS A 82 -29.385 3.164 12.410 1.00 14.21 C ATOM 1287 CE1 HIS A 82 -29.148 3.305 10.240 1.00 70.41 C ATOM 1288 NE2 HIS A 82 -29.376 4.006 11.327 1.00 75.50 N ATOM 0 H HIS A 82 -28.582 -1.598 13.694 1.00 72.53 H new ATOM 0 HA HIS A 82 -26.928 0.271 12.336 1.00 25.23 H new ATOM 0 HB2 HIS A 82 -29.399 -0.204 11.980 1.00 30.31 H new ATOM 0 HB3 HIS A 82 -29.736 0.587 13.507 1.00 30.31 H new ATOM 0 HD2 HIS A 82 -29.548 3.446 13.440 1.00 14.21 H new ATOM 0 HE1 HIS A 82 -29.085 3.699 9.236 1.00 70.41 H new ATOM 0 HE2 HIS A 82 -29.523 5.015 11.361 1.00 75.50 H new TER 1297 HIS A 82 ATOM 1298 N MET B 1 3.640 -12.084 9.865 1.00 13.33 N ATOM 1299 CA MET B 1 4.774 -12.331 8.959 1.00 21.05 C ATOM 1300 C MET B 1 5.014 -11.134 8.007 1.00 72.21 C ATOM 1301 O MET B 1 6.169 -10.779 7.725 1.00 45.55 O ATOM 1302 CB MET B 1 4.541 -13.633 8.144 1.00 60.03 C ATOM 1303 CG MET B 1 3.229 -13.670 7.343 1.00 62.10 C ATOM 1304 SD MET B 1 3.077 -15.159 6.336 1.00 65.43 S ATOM 1305 CE MET B 1 1.479 -14.903 5.564 1.00 64.13 C ATOM 0 H1 MET B 1 3.550 -12.876 10.533 1.00 13.33 H new ATOM 0 H2 MET B 1 3.803 -11.203 10.393 1.00 13.33 H new ATOM 0 H3 MET B 1 2.765 -11.998 9.310 1.00 13.33 H new ATOM 0 HA MET B 1 5.668 -12.451 9.571 1.00 21.05 H new ATOM 0 HB2 MET B 1 5.374 -13.767 7.454 1.00 60.03 H new ATOM 0 HB3 MET B 1 4.555 -14.481 8.829 1.00 60.03 H new ATOM 0 HG2 MET B 1 2.385 -13.613 8.031 1.00 62.10 H new ATOM 0 HG3 MET B 1 3.175 -12.792 6.699 1.00 62.10 H new ATOM 0 HE1 MET B 1 1.211 -15.785 4.982 1.00 64.13 H new ATOM 0 HE2 MET B 1 0.726 -14.734 6.334 1.00 64.13 H new ATOM 0 HE3 MET B 1 1.527 -14.035 4.907 1.00 64.13 H new ATOM 1315 N ASP B 2 3.898 -10.521 7.542 1.00 2.32 N ATOM 1316 CA ASP B 2 3.887 -9.419 6.545 1.00 64.33 C ATOM 1317 C ASP B 2 4.809 -8.241 6.941 1.00 1.04 C ATOM 1318 O ASP B 2 5.530 -7.719 6.104 1.00 31.11 O ATOM 1319 CB ASP B 2 2.430 -8.922 6.334 1.00 11.22 C ATOM 1320 CG ASP B 2 1.741 -8.514 7.653 1.00 30.21 C ATOM 1321 OD1 ASP B 2 1.257 -9.413 8.378 1.00 65.53 O ATOM 1322 OD2 ASP B 2 1.703 -7.309 7.983 1.00 13.43 O ATOM 0 H ASP B 2 2.963 -10.782 7.854 1.00 2.32 H new ATOM 0 HA ASP B 2 4.282 -9.820 5.611 1.00 64.33 H new ATOM 0 HB2 ASP B 2 2.436 -8.070 5.654 1.00 11.22 H new ATOM 0 HB3 ASP B 2 1.848 -9.709 5.854 1.00 11.22 H new ATOM 1327 N LYS B 3 4.781 -7.883 8.235 1.00 61.43 N ATOM 1328 CA LYS B 3 5.574 -6.780 8.837 1.00 12.21 C ATOM 1329 C LYS B 3 7.085 -6.872 8.490 1.00 12.15 C ATOM 1330 O LYS B 3 7.717 -5.872 8.123 1.00 43.11 O ATOM 1331 CB LYS B 3 5.369 -6.838 10.370 1.00 13.40 C ATOM 1332 CG LYS B 3 5.997 -5.685 11.191 1.00 4.20 C ATOM 1333 CD LYS B 3 5.732 -5.839 12.712 1.00 42.22 C ATOM 1334 CE LYS B 3 4.229 -5.995 13.035 1.00 1.30 C ATOM 1335 NZ LYS B 3 3.973 -6.184 14.479 1.00 3.51 N ATOM 0 H LYS B 3 4.192 -8.361 8.917 1.00 61.43 H new ATOM 0 HA LYS B 3 5.227 -5.831 8.428 1.00 12.21 H new ATOM 0 HB2 LYS B 3 4.298 -6.857 10.571 1.00 13.40 H new ATOM 0 HB3 LYS B 3 5.779 -7.780 10.734 1.00 13.40 H new ATOM 0 HG2 LYS B 3 7.072 -5.657 11.012 1.00 4.20 H new ATOM 0 HG3 LYS B 3 5.591 -4.733 10.847 1.00 4.20 H new ATOM 0 HD2 LYS B 3 6.273 -6.708 13.086 1.00 42.22 H new ATOM 0 HD3 LYS B 3 6.125 -4.968 13.237 1.00 42.22 H new ATOM 0 HE2 LYS B 3 3.693 -5.112 12.688 1.00 1.30 H new ATOM 0 HE3 LYS B 3 3.830 -6.847 12.485 1.00 1.30 H new ATOM 0 HZ1 LYS B 3 2.950 -6.283 14.640 1.00 3.51 H new ATOM 0 HZ2 LYS B 3 4.460 -7.042 14.809 1.00 3.51 H new ATOM 0 HZ3 LYS B 3 4.328 -5.360 15.005 1.00 3.51 H new ATOM 1349 N LYS B 4 7.635 -8.093 8.600 1.00 74.44 N ATOM 1350 CA LYS B 4 9.063 -8.379 8.322 1.00 1.50 C ATOM 1351 C LYS B 4 9.343 -8.450 6.801 1.00 53.44 C ATOM 1352 O LYS B 4 10.377 -7.958 6.329 1.00 21.25 O ATOM 1353 CB LYS B 4 9.460 -9.713 9.004 1.00 3.55 C ATOM 1354 CG LYS B 4 9.231 -9.728 10.535 1.00 52.21 C ATOM 1355 CD LYS B 4 9.525 -11.103 11.177 1.00 65.44 C ATOM 1356 CE LYS B 4 8.592 -12.212 10.658 1.00 20.22 C ATOM 1357 NZ LYS B 4 8.891 -13.522 11.282 1.00 11.40 N ATOM 0 H LYS B 4 7.104 -8.916 8.885 1.00 74.44 H new ATOM 0 HA LYS B 4 9.663 -7.564 8.727 1.00 1.50 H new ATOM 0 HB2 LYS B 4 8.888 -10.524 8.553 1.00 3.55 H new ATOM 0 HB3 LYS B 4 10.512 -9.914 8.802 1.00 3.55 H new ATOM 0 HG2 LYS B 4 9.866 -8.973 10.999 1.00 52.21 H new ATOM 0 HG3 LYS B 4 8.199 -9.449 10.745 1.00 52.21 H new ATOM 0 HD2 LYS B 4 10.560 -11.380 10.975 1.00 65.44 H new ATOM 0 HD3 LYS B 4 9.422 -11.024 12.259 1.00 65.44 H new ATOM 0 HE2 LYS B 4 7.556 -11.940 10.862 1.00 20.22 H new ATOM 0 HE3 LYS B 4 8.692 -12.294 9.576 1.00 20.22 H new ATOM 0 HZ1 LYS B 4 8.241 -14.242 10.906 1.00 11.40 H new ATOM 0 HZ2 LYS B 4 9.871 -13.794 11.066 1.00 11.40 H new ATOM 0 HZ3 LYS B 4 8.771 -13.451 12.313 1.00 11.40 H new ATOM 1371 N ILE B 5 8.408 -9.076 6.054 1.00 3.02 N ATOM 1372 CA ILE B 5 8.512 -9.244 4.583 1.00 53.12 C ATOM 1373 C ILE B 5 8.571 -7.871 3.864 1.00 20.42 C ATOM 1374 O ILE B 5 9.552 -7.564 3.182 1.00 35.25 O ATOM 1375 CB ILE B 5 7.307 -10.097 4.021 1.00 63.54 C ATOM 1376 CG1 ILE B 5 7.257 -11.505 4.711 1.00 25.42 C ATOM 1377 CG2 ILE B 5 7.383 -10.237 2.474 1.00 2.51 C ATOM 1378 CD1 ILE B 5 6.044 -12.356 4.350 1.00 0.15 C ATOM 0 H ILE B 5 7.559 -9.480 6.451 1.00 3.02 H new ATOM 0 HA ILE B 5 9.440 -9.779 4.382 1.00 53.12 H new ATOM 0 HB ILE B 5 6.384 -9.567 4.257 1.00 63.54 H new ATOM 0 HG12 ILE B 5 8.160 -12.055 4.446 1.00 25.42 H new ATOM 0 HG13 ILE B 5 7.275 -11.364 5.792 1.00 25.42 H new ATOM 0 HG21 ILE B 5 6.539 -10.829 2.120 1.00 2.51 H new ATOM 0 HG22 ILE B 5 7.349 -9.248 2.017 1.00 2.51 H new ATOM 0 HG23 ILE B 5 8.314 -10.732 2.199 1.00 2.51 H new ATOM 0 HD11 ILE B 5 6.099 -13.309 4.876 1.00 0.15 H new ATOM 0 HD12 ILE B 5 5.133 -11.833 4.641 1.00 0.15 H new ATOM 0 HD13 ILE B 5 6.032 -12.535 3.275 1.00 0.15 H new ATOM 1390 N VAL B 6 7.526 -7.039 4.067 1.00 4.22 N ATOM 1391 CA VAL B 6 7.422 -5.696 3.450 1.00 5.12 C ATOM 1392 C VAL B 6 8.577 -4.765 3.890 1.00 30.54 C ATOM 1393 O VAL B 6 8.944 -3.867 3.148 1.00 74.11 O ATOM 1394 CB VAL B 6 6.036 -5.010 3.755 1.00 3.12 C ATOM 1395 CG1 VAL B 6 4.869 -5.870 3.215 1.00 71.53 C ATOM 1396 CG2 VAL B 6 5.860 -4.712 5.268 1.00 44.54 C ATOM 0 H VAL B 6 6.732 -7.278 4.661 1.00 4.22 H new ATOM 0 HA VAL B 6 7.497 -5.853 2.374 1.00 5.12 H new ATOM 0 HB VAL B 6 6.022 -4.051 3.236 1.00 3.12 H new ATOM 0 HG11 VAL B 6 3.922 -5.378 3.436 1.00 71.53 H new ATOM 0 HG12 VAL B 6 4.973 -5.989 2.136 1.00 71.53 H new ATOM 0 HG13 VAL B 6 4.889 -6.850 3.691 1.00 71.53 H new ATOM 0 HG21 VAL B 6 4.892 -4.239 5.436 1.00 44.54 H new ATOM 0 HG22 VAL B 6 5.911 -5.644 5.831 1.00 44.54 H new ATOM 0 HG23 VAL B 6 6.653 -4.043 5.602 1.00 44.54 H new ATOM 1406 N GLY B 7 9.133 -5.007 5.104 1.00 64.43 N ATOM 1407 CA GLY B 7 10.336 -4.306 5.578 1.00 73.24 C ATOM 1408 C GLY B 7 11.562 -4.567 4.697 1.00 32.51 C ATOM 1409 O GLY B 7 12.235 -3.625 4.253 1.00 1.51 O ATOM 0 H GLY B 7 8.760 -5.686 5.768 1.00 64.43 H new ATOM 0 HA2 GLY B 7 10.138 -3.235 5.609 1.00 73.24 H new ATOM 0 HA3 GLY B 7 10.555 -4.619 6.599 1.00 73.24 H new ATOM 1413 N ALA B 8 11.819 -5.863 4.422 1.00 53.13 N ATOM 1414 CA ALA B 8 12.920 -6.316 3.536 1.00 0.23 C ATOM 1415 C ALA B 8 12.745 -5.803 2.079 1.00 70.42 C ATOM 1416 O ALA B 8 13.721 -5.438 1.414 1.00 12.14 O ATOM 1417 CB ALA B 8 13.004 -7.853 3.554 1.00 3.53 C ATOM 0 H ALA B 8 11.268 -6.630 4.808 1.00 53.13 H new ATOM 0 HA ALA B 8 13.850 -5.894 3.918 1.00 0.23 H new ATOM 0 HB1 ALA B 8 13.814 -8.181 2.902 1.00 3.53 H new ATOM 0 HB2 ALA B 8 13.196 -8.195 4.571 1.00 3.53 H new ATOM 0 HB3 ALA B 8 12.062 -8.273 3.202 1.00 3.53 H new ATOM 1423 N ASN B 9 11.488 -5.780 1.601 1.00 55.32 N ATOM 1424 CA ASN B 9 11.152 -5.337 0.225 1.00 3.34 C ATOM 1425 C ASN B 9 10.976 -3.802 0.102 1.00 15.12 C ATOM 1426 O ASN B 9 10.954 -3.284 -1.014 1.00 1.32 O ATOM 1427 CB ASN B 9 9.887 -6.069 -0.283 1.00 50.14 C ATOM 1428 CG ASN B 9 10.132 -7.565 -0.495 1.00 34.32 C ATOM 1429 OD1 ASN B 9 10.650 -7.975 -1.528 1.00 5.21 O ATOM 1430 ND2 ASN B 9 9.753 -8.393 0.454 1.00 54.23 N ATOM 0 H ASN B 9 10.677 -6.065 2.150 1.00 55.32 H new ATOM 0 HA ASN B 9 12.003 -5.601 -0.402 1.00 3.34 H new ATOM 0 HB2 ASN B 9 9.078 -5.933 0.434 1.00 50.14 H new ATOM 0 HB3 ASN B 9 9.561 -5.619 -1.221 1.00 50.14 H new ATOM 0 HD21 ASN B 9 9.888 -9.397 0.338 1.00 54.23 H new ATOM 0 HD22 ASN B 9 9.324 -8.031 1.306 1.00 54.23 H new ATOM 1437 N ALA B 10 10.872 -3.081 1.238 1.00 12.13 N ATOM 1438 CA ALA B 10 10.684 -1.604 1.243 1.00 33.55 C ATOM 1439 C ALA B 10 11.968 -0.874 0.812 1.00 0.21 C ATOM 1440 O ALA B 10 11.913 0.114 0.081 1.00 20.05 O ATOM 1441 CB ALA B 10 10.237 -1.115 2.625 1.00 71.21 C ATOM 0 H ALA B 10 10.915 -3.494 2.170 1.00 12.13 H new ATOM 0 HA ALA B 10 9.902 -1.372 0.520 1.00 33.55 H new ATOM 0 HB1 ALA B 10 10.106 -0.033 2.603 1.00 71.21 H new ATOM 0 HB2 ALA B 10 9.292 -1.589 2.891 1.00 71.21 H new ATOM 0 HB3 ALA B 10 10.994 -1.374 3.365 1.00 71.21 H new ATOM 1447 N GLY B 11 13.123 -1.385 1.271 1.00 51.12 N ATOM 1448 CA GLY B 11 14.428 -0.856 0.850 1.00 32.32 C ATOM 1449 C GLY B 11 14.737 -1.166 -0.619 1.00 11.13 C ATOM 1450 O GLY B 11 15.422 -0.396 -1.297 1.00 42.02 O ATOM 0 H GLY B 11 13.178 -2.161 1.931 1.00 51.12 H new ATOM 0 HA2 GLY B 11 14.446 0.223 1.002 1.00 32.32 H new ATOM 0 HA3 GLY B 11 15.210 -1.280 1.480 1.00 32.32 H new ATOM 1454 N LYS B 12 14.216 -2.313 -1.100 1.00 42.42 N ATOM 1455 CA LYS B 12 14.370 -2.765 -2.497 1.00 54.53 C ATOM 1456 C LYS B 12 13.556 -1.875 -3.474 1.00 74.45 C ATOM 1457 O LYS B 12 14.070 -1.458 -4.522 1.00 34.52 O ATOM 1458 CB LYS B 12 13.937 -4.252 -2.602 1.00 20.14 C ATOM 1459 CG LYS B 12 14.200 -4.915 -3.972 1.00 4.32 C ATOM 1460 CD LYS B 12 13.889 -6.431 -3.963 1.00 11.23 C ATOM 1461 CE LYS B 12 14.204 -7.109 -5.307 1.00 63.44 C ATOM 1462 NZ LYS B 12 15.624 -6.952 -5.712 1.00 22.23 N ATOM 0 H LYS B 12 13.672 -2.956 -0.525 1.00 42.42 H new ATOM 0 HA LYS B 12 15.417 -2.675 -2.785 1.00 54.53 H new ATOM 0 HB2 LYS B 12 14.460 -4.822 -1.834 1.00 20.14 H new ATOM 0 HB3 LYS B 12 12.872 -4.321 -2.381 1.00 20.14 H new ATOM 0 HG2 LYS B 12 13.590 -4.426 -4.732 1.00 4.32 H new ATOM 0 HG3 LYS B 12 15.242 -4.762 -4.252 1.00 4.32 H new ATOM 0 HD2 LYS B 12 14.467 -6.912 -3.174 1.00 11.23 H new ATOM 0 HD3 LYS B 12 12.836 -6.580 -3.723 1.00 11.23 H new ATOM 0 HE2 LYS B 12 13.966 -8.170 -5.238 1.00 63.44 H new ATOM 0 HE3 LYS B 12 13.562 -6.688 -6.080 1.00 63.44 H new ATOM 0 HZ1 LYS B 12 15.817 -7.551 -6.540 1.00 22.23 H new ATOM 0 HZ2 LYS B 12 15.808 -5.957 -5.954 1.00 22.23 H new ATOM 0 HZ3 LYS B 12 16.243 -7.237 -4.926 1.00 22.23 H new ATOM 1476 N VAL B 13 12.282 -1.579 -3.116 1.00 74.41 N ATOM 1477 CA VAL B 13 11.410 -0.690 -3.927 1.00 2.41 C ATOM 1478 C VAL B 13 11.862 0.789 -3.834 1.00 75.12 C ATOM 1479 O VAL B 13 11.729 1.536 -4.807 1.00 34.43 O ATOM 1480 CB VAL B 13 9.872 -0.833 -3.567 1.00 65.15 C ATOM 1481 CG1 VAL B 13 9.381 -2.290 -3.779 1.00 21.20 C ATOM 1482 CG2 VAL B 13 9.559 -0.349 -2.132 1.00 21.15 C ATOM 0 H VAL B 13 11.836 -1.941 -2.274 1.00 74.41 H new ATOM 0 HA VAL B 13 11.523 -1.020 -4.960 1.00 2.41 H new ATOM 0 HB VAL B 13 9.325 -0.184 -4.251 1.00 65.15 H new ATOM 0 HG11 VAL B 13 8.323 -2.358 -3.524 1.00 21.20 H new ATOM 0 HG12 VAL B 13 9.522 -2.573 -4.822 1.00 21.20 H new ATOM 0 HG13 VAL B 13 9.952 -2.963 -3.140 1.00 21.20 H new ATOM 0 HG21 VAL B 13 8.494 -0.467 -1.932 1.00 21.15 H new ATOM 0 HG22 VAL B 13 10.130 -0.940 -1.416 1.00 21.15 H new ATOM 0 HG23 VAL B 13 9.832 0.702 -2.035 1.00 21.15 H new ATOM 1492 N TRP B 14 12.415 1.192 -2.660 1.00 70.24 N ATOM 1493 CA TRP B 14 12.976 2.554 -2.468 1.00 2.21 C ATOM 1494 C TRP B 14 14.280 2.730 -3.286 1.00 32.12 C ATOM 1495 O TRP B 14 14.572 3.830 -3.754 1.00 63.05 O ATOM 1496 CB TRP B 14 13.218 2.896 -0.967 1.00 71.31 C ATOM 1497 CG TRP B 14 13.316 4.396 -0.696 1.00 62.33 C ATOM 1498 CD1 TRP B 14 12.297 5.249 -0.359 1.00 12.20 C ATOM 1499 CD2 TRP B 14 14.494 5.214 -0.776 1.00 51.23 C ATOM 1500 NE1 TRP B 14 12.774 6.525 -0.214 1.00 50.24 N ATOM 1501 CE2 TRP B 14 14.118 6.531 -0.467 1.00 44.35 C ATOM 1502 CE3 TRP B 14 15.826 4.947 -1.077 1.00 63.35 C ATOM 1503 CZ2 TRP B 14 15.033 7.579 -0.451 1.00 20.11 C ATOM 1504 CZ3 TRP B 14 16.737 5.984 -1.066 1.00 53.31 C ATOM 1505 CH2 TRP B 14 16.337 7.288 -0.752 1.00 72.25 C ATOM 0 H TRP B 14 12.484 0.595 -1.836 1.00 70.24 H new ATOM 0 HA TRP B 14 12.230 3.258 -2.837 1.00 2.21 H new ATOM 0 HB2 TRP B 14 12.406 2.479 -0.371 1.00 71.31 H new ATOM 0 HB3 TRP B 14 14.137 2.413 -0.635 1.00 71.31 H new ATOM 0 HD1 TRP B 14 11.266 4.957 -0.227 1.00 12.20 H new ATOM 0 HE1 TRP B 14 12.216 7.340 0.042 1.00 50.24 H new ATOM 0 HE3 TRP B 14 16.143 3.942 -1.316 1.00 63.35 H new ATOM 0 HZ2 TRP B 14 14.726 8.586 -0.210 1.00 20.11 H new ATOM 0 HZ3 TRP B 14 17.772 5.787 -1.303 1.00 53.31 H new ATOM 0 HH2 TRP B 14 17.071 8.080 -0.747 1.00 72.25 H new ATOM 1516 N HIS B 15 15.067 1.643 -3.437 1.00 35.13 N ATOM 1517 CA HIS B 15 16.241 1.616 -4.347 1.00 63.01 C ATOM 1518 C HIS B 15 15.812 1.938 -5.796 1.00 4.52 C ATOM 1519 O HIS B 15 16.456 2.731 -6.485 1.00 30.41 O ATOM 1520 CB HIS B 15 16.954 0.236 -4.293 1.00 21.25 C ATOM 1521 CG HIS B 15 18.034 0.051 -5.340 1.00 13.43 C ATOM 1522 ND1 HIS B 15 19.298 0.583 -5.222 1.00 2.05 N ATOM 1523 CD2 HIS B 15 18.012 -0.574 -6.550 1.00 50.13 C ATOM 1524 CE1 HIS B 15 19.999 0.299 -6.302 1.00 72.12 C ATOM 1525 NE2 HIS B 15 19.245 -0.397 -7.122 1.00 51.13 N ATOM 0 H HIS B 15 14.912 0.766 -2.939 1.00 35.13 H new ATOM 0 HA HIS B 15 16.944 2.379 -4.012 1.00 63.01 H new ATOM 0 HB2 HIS B 15 17.396 0.107 -3.305 1.00 21.25 H new ATOM 0 HB3 HIS B 15 16.209 -0.550 -4.414 1.00 21.25 H new ATOM 0 HD2 HIS B 15 17.178 -1.110 -6.979 1.00 50.13 H new ATOM 0 HE1 HIS B 15 21.023 0.590 -6.482 1.00 72.12 H new ATOM 0 HE2 HIS B 15 19.531 -0.749 -8.036 1.00 51.13 H new ATOM 1534 N ALA B 16 14.722 1.299 -6.233 1.00 45.31 N ATOM 1535 CA ALA B 16 14.146 1.511 -7.571 1.00 14.40 C ATOM 1536 C ALA B 16 13.539 2.940 -7.718 1.00 64.52 C ATOM 1537 O ALA B 16 13.518 3.506 -8.818 1.00 3.04 O ATOM 1538 CB ALA B 16 13.119 0.411 -7.850 1.00 23.34 C ATOM 0 H ALA B 16 14.211 0.619 -5.670 1.00 45.31 H new ATOM 0 HA ALA B 16 14.937 1.448 -8.319 1.00 14.40 H new ATOM 0 HB1 ALA B 16 12.686 0.560 -8.839 1.00 23.34 H new ATOM 0 HB2 ALA B 16 13.608 -0.562 -7.810 1.00 23.34 H new ATOM 0 HB3 ALA B 16 12.330 0.451 -7.099 1.00 23.34 H new ATOM 1544 N LEU B 17 13.059 3.505 -6.588 1.00 51.32 N ATOM 1545 CA LEU B 17 12.639 4.928 -6.479 1.00 34.32 C ATOM 1546 C LEU B 17 13.857 5.889 -6.556 1.00 3.34 C ATOM 1547 O LEU B 17 13.740 7.010 -7.058 1.00 63.43 O ATOM 1548 CB LEU B 17 11.884 5.149 -5.135 1.00 2.35 C ATOM 1549 CG LEU B 17 10.430 4.593 -5.050 1.00 45.32 C ATOM 1550 CD1 LEU B 17 9.920 4.587 -3.590 1.00 44.31 C ATOM 1551 CD2 LEU B 17 9.487 5.404 -5.971 1.00 31.13 C ATOM 0 H LEU B 17 12.950 2.986 -5.717 1.00 51.32 H new ATOM 0 HA LEU B 17 11.980 5.150 -7.318 1.00 34.32 H new ATOM 0 HB2 LEU B 17 12.470 4.694 -4.337 1.00 2.35 H new ATOM 0 HB3 LEU B 17 11.851 6.220 -4.935 1.00 2.35 H new ATOM 0 HG LEU B 17 10.438 3.560 -5.397 1.00 45.32 H new ATOM 0 HD11 LEU B 17 8.904 4.194 -3.561 1.00 44.31 H new ATOM 0 HD12 LEU B 17 10.569 3.959 -2.980 1.00 44.31 H new ATOM 0 HD13 LEU B 17 9.927 5.604 -3.198 1.00 44.31 H new ATOM 0 HD21 LEU B 17 8.476 5.003 -5.900 1.00 31.13 H new ATOM 0 HD22 LEU B 17 9.486 6.449 -5.661 1.00 31.13 H new ATOM 0 HD23 LEU B 17 9.834 5.332 -7.002 1.00 31.13 H new ATOM 1563 N ASN B 18 15.010 5.435 -6.032 1.00 62.15 N ATOM 1564 CA ASN B 18 16.274 6.211 -6.016 1.00 24.52 C ATOM 1565 C ASN B 18 16.886 6.305 -7.441 1.00 33.13 C ATOM 1566 O ASN B 18 17.555 7.289 -7.779 1.00 33.33 O ATOM 1567 CB ASN B 18 17.257 5.554 -5.001 1.00 42.04 C ATOM 1568 CG ASN B 18 18.635 6.220 -4.928 1.00 2.25 C ATOM 1569 OD1 ASN B 18 19.578 5.806 -5.594 1.00 52.32 O ATOM 1570 ND2 ASN B 18 18.767 7.252 -4.123 1.00 14.04 N ATOM 0 H ASN B 18 15.097 4.513 -5.604 1.00 62.15 H new ATOM 0 HA ASN B 18 16.074 7.234 -5.696 1.00 24.52 H new ATOM 0 HB2 ASN B 18 16.804 5.576 -4.010 1.00 42.04 H new ATOM 0 HB3 ASN B 18 17.388 4.505 -5.268 1.00 42.04 H new ATOM 0 HD21 ASN B 18 19.667 7.725 -4.043 1.00 14.04 H new ATOM 0 HD22 ASN B 18 17.969 7.579 -3.578 1.00 14.04 H new ATOM 1577 N GLU B 19 16.631 5.274 -8.272 1.00 24.43 N ATOM 1578 CA GLU B 19 17.060 5.237 -9.692 1.00 10.04 C ATOM 1579 C GLU B 19 16.144 6.134 -10.566 1.00 2.13 C ATOM 1580 O GLU B 19 16.620 6.957 -11.357 1.00 43.22 O ATOM 1581 CB GLU B 19 16.998 3.777 -10.214 1.00 53.11 C ATOM 1582 CG GLU B 19 17.837 2.761 -9.406 1.00 4.12 C ATOM 1583 CD GLU B 19 17.605 1.297 -9.826 1.00 21.44 C ATOM 1584 OE1 GLU B 19 16.426 0.894 -9.999 1.00 14.33 O ATOM 1585 OE2 GLU B 19 18.587 0.530 -9.962 1.00 33.21 O ATOM 0 H GLU B 19 16.121 4.440 -7.980 1.00 24.43 H new ATOM 0 HA GLU B 19 18.081 5.612 -9.756 1.00 10.04 H new ATOM 0 HB2 GLU B 19 15.958 3.450 -10.213 1.00 53.11 H new ATOM 0 HB3 GLU B 19 17.336 3.762 -11.250 1.00 53.11 H new ATOM 0 HG2 GLU B 19 18.894 3.001 -9.523 1.00 4.12 H new ATOM 0 HG3 GLU B 19 17.601 2.868 -8.347 1.00 4.12 H new ATOM 1592 N ALA B 20 14.820 5.949 -10.395 1.00 25.34 N ATOM 1593 CA ALA B 20 13.773 6.670 -11.160 1.00 13.24 C ATOM 1594 C ALA B 20 12.634 7.085 -10.208 1.00 42.14 C ATOM 1595 O ALA B 20 12.111 6.251 -9.463 1.00 63.33 O ATOM 1596 CB ALA B 20 13.245 5.785 -12.301 1.00 5.13 C ATOM 0 H ALA B 20 14.440 5.289 -9.716 1.00 25.34 H new ATOM 0 HA ALA B 20 14.200 7.569 -11.604 1.00 13.24 H new ATOM 0 HB1 ALA B 20 12.477 6.325 -12.855 1.00 5.13 H new ATOM 0 HB2 ALA B 20 14.065 5.529 -12.972 1.00 5.13 H new ATOM 0 HB3 ALA B 20 12.818 4.872 -11.886 1.00 5.13 H new ATOM 1602 N ASP B 21 12.215 8.359 -10.284 1.00 22.34 N ATOM 1603 CA ASP B 21 11.400 9.003 -9.227 1.00 41.25 C ATOM 1604 C ASP B 21 9.973 9.371 -9.731 1.00 40.25 C ATOM 1605 O ASP B 21 9.786 9.714 -10.907 1.00 12.32 O ATOM 1606 CB ASP B 21 12.162 10.255 -8.707 1.00 52.03 C ATOM 1607 CG ASP B 21 11.602 10.836 -7.406 1.00 34.35 C ATOM 1608 OD1 ASP B 21 11.049 10.071 -6.611 1.00 63.33 O ATOM 1609 OD2 ASP B 21 11.731 12.053 -7.169 1.00 32.41 O ATOM 0 H ASP B 21 12.427 8.972 -11.071 1.00 22.34 H new ATOM 0 HA ASP B 21 11.256 8.297 -8.409 1.00 41.25 H new ATOM 0 HB2 ASP B 21 13.208 9.991 -8.553 1.00 52.03 H new ATOM 0 HB3 ASP B 21 12.138 11.027 -9.476 1.00 52.03 H new ATOM 1614 N GLY B 22 8.981 9.304 -8.808 1.00 41.10 N ATOM 1615 CA GLY B 22 7.555 9.471 -9.154 1.00 64.34 C ATOM 1616 C GLY B 22 7.019 8.361 -10.076 1.00 4.42 C ATOM 1617 O GLY B 22 6.029 8.553 -10.787 1.00 51.51 O ATOM 0 H GLY B 22 9.148 9.135 -7.816 1.00 41.10 H new ATOM 0 HA2 GLY B 22 6.965 9.489 -8.237 1.00 64.34 H new ATOM 0 HA3 GLY B 22 7.417 10.436 -9.641 1.00 64.34 H new ATOM 1621 N ILE B 23 7.675 7.190 -10.032 1.00 14.13 N ATOM 1622 CA ILE B 23 7.447 6.073 -10.977 1.00 33.44 C ATOM 1623 C ILE B 23 6.144 5.290 -10.644 1.00 10.12 C ATOM 1624 O ILE B 23 5.792 5.126 -9.475 1.00 20.02 O ATOM 1625 CB ILE B 23 8.699 5.102 -10.977 1.00 11.42 C ATOM 1626 CG1 ILE B 23 8.533 3.925 -11.997 1.00 64.24 C ATOM 1627 CG2 ILE B 23 9.000 4.570 -9.551 1.00 73.34 C ATOM 1628 CD1 ILE B 23 9.711 2.966 -12.060 1.00 33.21 C ATOM 0 H ILE B 23 8.388 6.985 -9.332 1.00 14.13 H new ATOM 0 HA ILE B 23 7.322 6.496 -11.974 1.00 33.44 H new ATOM 0 HB ILE B 23 9.556 5.690 -11.304 1.00 11.42 H new ATOM 0 HG12 ILE B 23 7.637 3.361 -11.737 1.00 64.24 H new ATOM 0 HG13 ILE B 23 8.370 4.344 -12.990 1.00 64.24 H new ATOM 0 HG21 ILE B 23 9.864 3.907 -9.585 1.00 73.34 H new ATOM 0 HG22 ILE B 23 9.212 5.408 -8.887 1.00 73.34 H new ATOM 0 HG23 ILE B 23 8.136 4.021 -9.178 1.00 73.34 H new ATOM 0 HD11 ILE B 23 9.506 2.185 -12.792 1.00 33.21 H new ATOM 0 HD12 ILE B 23 10.609 3.511 -12.353 1.00 33.21 H new ATOM 0 HD13 ILE B 23 9.864 2.513 -11.080 1.00 33.21 H new ATOM 1640 N SER B 24 5.432 4.837 -11.703 1.00 42.32 N ATOM 1641 CA SER B 24 4.199 4.016 -11.579 1.00 62.24 C ATOM 1642 C SER B 24 4.484 2.678 -10.862 1.00 3.35 C ATOM 1643 O SER B 24 5.516 2.056 -11.111 1.00 32.41 O ATOM 1644 CB SER B 24 3.602 3.730 -12.978 1.00 31.21 C ATOM 1645 OG SER B 24 3.299 4.927 -13.674 1.00 31.24 O ATOM 0 H SER B 24 5.695 5.030 -12.670 1.00 42.32 H new ATOM 0 HA SER B 24 3.484 4.584 -10.984 1.00 62.24 H new ATOM 0 HB2 SER B 24 4.308 3.139 -13.561 1.00 31.21 H new ATOM 0 HB3 SER B 24 2.697 3.132 -12.872 1.00 31.21 H new ATOM 0 HG SER B 24 2.926 4.709 -14.553 1.00 31.24 H new ATOM 1651 N ILE B 25 3.536 2.239 -10.013 1.00 11.34 N ATOM 1652 CA ILE B 25 3.673 1.026 -9.165 1.00 1.24 C ATOM 1653 C ILE B 25 3.953 -0.292 -9.982 1.00 70.52 C ATOM 1654 O ILE B 25 4.838 -1.054 -9.583 1.00 43.42 O ATOM 1655 CB ILE B 25 2.405 0.834 -8.237 1.00 21.22 C ATOM 1656 CG1 ILE B 25 2.167 2.109 -7.354 1.00 44.53 C ATOM 1657 CG2 ILE B 25 2.527 -0.447 -7.364 1.00 51.43 C ATOM 1658 CD1 ILE B 25 0.886 2.092 -6.524 1.00 75.20 C ATOM 0 H ILE B 25 2.643 2.716 -9.891 1.00 11.34 H new ATOM 0 HA ILE B 25 4.553 1.200 -8.546 1.00 1.24 H new ATOM 0 HB ILE B 25 1.535 0.702 -8.880 1.00 21.22 H new ATOM 0 HG12 ILE B 25 3.016 2.229 -6.681 1.00 44.53 H new ATOM 0 HG13 ILE B 25 2.149 2.984 -8.004 1.00 44.53 H new ATOM 0 HG21 ILE B 25 1.639 -0.548 -6.739 1.00 51.43 H new ATOM 0 HG22 ILE B 25 2.617 -1.320 -8.010 1.00 51.43 H new ATOM 0 HG23 ILE B 25 3.410 -0.372 -6.730 1.00 51.43 H new ATOM 0 HD11 ILE B 25 0.813 3.015 -5.949 1.00 75.20 H new ATOM 0 HD12 ILE B 25 0.024 2.007 -7.186 1.00 75.20 H new ATOM 0 HD13 ILE B 25 0.905 1.241 -5.843 1.00 75.20 H new ATOM 1670 N PRO B 26 3.222 -0.612 -11.127 1.00 40.41 N ATOM 1671 CA PRO B 26 3.523 -1.833 -11.939 1.00 63.42 C ATOM 1672 C PRO B 26 4.900 -1.783 -12.666 1.00 20.44 C ATOM 1673 O PRO B 26 5.498 -2.825 -12.930 1.00 23.52 O ATOM 1674 CB PRO B 26 2.350 -1.894 -12.957 1.00 21.32 C ATOM 1675 CG PRO B 26 1.900 -0.471 -13.084 1.00 41.43 C ATOM 1676 CD PRO B 26 2.042 0.115 -11.692 1.00 31.05 C ATOM 0 HA PRO B 26 3.602 -2.717 -11.306 1.00 63.42 H new ATOM 0 HB2 PRO B 26 2.676 -2.296 -13.916 1.00 21.32 H new ATOM 0 HB3 PRO B 26 1.545 -2.536 -12.599 1.00 21.32 H new ATOM 0 HG2 PRO B 26 2.511 0.073 -13.805 1.00 41.43 H new ATOM 0 HG3 PRO B 26 0.869 -0.413 -13.433 1.00 41.43 H new ATOM 0 HD2 PRO B 26 2.211 1.191 -11.725 1.00 31.05 H new ATOM 0 HD3 PRO B 26 1.145 -0.049 -11.094 1.00 31.05 H new ATOM 1684 N GLU B 27 5.391 -0.565 -12.961 1.00 62.22 N ATOM 1685 CA GLU B 27 6.697 -0.352 -13.643 1.00 63.22 C ATOM 1686 C GLU B 27 7.851 -0.566 -12.640 1.00 43.41 C ATOM 1687 O GLU B 27 8.880 -1.193 -12.926 1.00 70.45 O ATOM 1688 CB GLU B 27 6.740 1.087 -14.222 1.00 34.41 C ATOM 1689 CG GLU B 27 7.992 1.415 -15.066 1.00 22.25 C ATOM 1690 CD GLU B 27 8.212 0.430 -16.227 1.00 52.24 C ATOM 1691 OE1 GLU B 27 7.508 0.533 -17.251 1.00 44.14 O ATOM 1692 OE2 GLU B 27 9.066 -0.474 -16.111 1.00 23.10 O ATOM 0 H GLU B 27 4.901 0.301 -12.737 1.00 62.22 H new ATOM 0 HA GLU B 27 6.810 -1.068 -14.457 1.00 63.22 H new ATOM 0 HB2 GLU B 27 5.854 1.241 -14.839 1.00 34.41 H new ATOM 0 HB3 GLU B 27 6.681 1.796 -13.397 1.00 34.41 H new ATOM 0 HG2 GLU B 27 7.899 2.424 -15.467 1.00 22.25 H new ATOM 0 HG3 GLU B 27 8.870 1.408 -14.420 1.00 22.25 H new ATOM 1699 N LEU B 28 7.621 0.000 -11.462 1.00 60.22 N ATOM 1700 CA LEU B 28 8.434 -0.161 -10.253 1.00 54.04 C ATOM 1701 C LEU B 28 8.527 -1.656 -9.839 1.00 3.32 C ATOM 1702 O LEU B 28 9.600 -2.145 -9.466 1.00 71.32 O ATOM 1703 CB LEU B 28 7.734 0.705 -9.174 1.00 15.43 C ATOM 1704 CG LEU B 28 8.349 0.768 -7.755 1.00 73.01 C ATOM 1705 CD1 LEU B 28 9.779 1.333 -7.776 1.00 50.01 C ATOM 1706 CD2 LEU B 28 7.425 1.588 -6.824 1.00 11.33 C ATOM 0 H LEU B 28 6.822 0.616 -11.312 1.00 60.22 H new ATOM 0 HA LEU B 28 9.465 0.159 -10.403 1.00 54.04 H new ATOM 0 HB2 LEU B 28 7.677 1.725 -9.555 1.00 15.43 H new ATOM 0 HB3 LEU B 28 6.710 0.345 -9.074 1.00 15.43 H new ATOM 0 HG LEU B 28 8.426 -0.247 -7.366 1.00 73.01 H new ATOM 0 HD11 LEU B 28 10.174 1.360 -6.761 1.00 50.01 H new ATOM 0 HD12 LEU B 28 10.412 0.697 -8.395 1.00 50.01 H new ATOM 0 HD13 LEU B 28 9.765 2.342 -8.187 1.00 50.01 H new ATOM 0 HD21 LEU B 28 7.860 1.631 -5.826 1.00 11.33 H new ATOM 0 HD22 LEU B 28 7.317 2.599 -7.217 1.00 11.33 H new ATOM 0 HD23 LEU B 28 6.445 1.113 -6.773 1.00 11.33 H new ATOM 1718 N ALA B 29 7.381 -2.364 -9.969 1.00 63.40 N ATOM 1719 CA ALA B 29 7.254 -3.818 -9.695 1.00 22.11 C ATOM 1720 C ALA B 29 8.150 -4.678 -10.622 1.00 72.14 C ATOM 1721 O ALA B 29 8.655 -5.722 -10.208 1.00 70.12 O ATOM 1722 CB ALA B 29 5.783 -4.258 -9.817 1.00 24.22 C ATOM 0 H ALA B 29 6.505 -1.937 -10.271 1.00 63.40 H new ATOM 0 HA ALA B 29 7.599 -3.982 -8.674 1.00 22.11 H new ATOM 0 HB1 ALA B 29 5.705 -5.326 -9.614 1.00 24.22 H new ATOM 0 HB2 ALA B 29 5.177 -3.706 -9.098 1.00 24.22 H new ATOM 0 HB3 ALA B 29 5.425 -4.054 -10.826 1.00 24.22 H new ATOM 1728 N ARG B 30 8.323 -4.220 -11.880 1.00 24.40 N ATOM 1729 CA ARG B 30 9.191 -4.889 -12.884 1.00 41.01 C ATOM 1730 C ARG B 30 10.682 -4.851 -12.477 1.00 71.12 C ATOM 1731 O ARG B 30 11.393 -5.852 -12.620 1.00 44.44 O ATOM 1732 CB ARG B 30 9.001 -4.224 -14.274 1.00 12.03 C ATOM 1733 CG ARG B 30 7.581 -4.382 -14.854 1.00 75.41 C ATOM 1734 CD ARG B 30 7.346 -3.536 -16.117 1.00 54.22 C ATOM 1735 NE ARG B 30 5.975 -3.715 -16.635 1.00 44.42 N ATOM 1736 CZ ARG B 30 5.132 -2.750 -16.938 1.00 4.35 C ATOM 1737 NH1 ARG B 30 5.475 -1.504 -16.849 1.00 60.42 N ATOM 1738 NH2 ARG B 30 3.946 -3.052 -17.350 1.00 13.12 N ATOM 0 H ARG B 30 7.868 -3.378 -12.232 1.00 24.40 H new ATOM 0 HA ARG B 30 8.892 -5.936 -12.934 1.00 41.01 H new ATOM 0 HB2 ARG B 30 9.233 -3.162 -14.193 1.00 12.03 H new ATOM 0 HB3 ARG B 30 9.718 -4.655 -14.973 1.00 12.03 H new ATOM 0 HG2 ARG B 30 7.406 -5.432 -15.090 1.00 75.41 H new ATOM 0 HG3 ARG B 30 6.852 -4.100 -14.095 1.00 75.41 H new ATOM 0 HD2 ARG B 30 7.517 -2.484 -15.889 1.00 54.22 H new ATOM 0 HD3 ARG B 30 8.067 -3.817 -16.885 1.00 54.22 H new ATOM 0 HE ARG B 30 5.652 -4.673 -16.770 1.00 44.42 H new ATOM 0 HH11 ARG B 30 6.414 -1.254 -16.539 1.00 60.42 H new ATOM 0 HH12 ARG B 30 4.806 -0.772 -17.089 1.00 60.42 H new ATOM 0 HH21 ARG B 30 3.670 -4.030 -17.438 1.00 13.12 H new ATOM 0 HH22 ARG B 30 3.285 -2.312 -17.587 1.00 13.12 H new ATOM 1752 N LYS B 31 11.142 -3.691 -11.960 1.00 2.35 N ATOM 1753 CA LYS B 31 12.558 -3.506 -11.553 1.00 64.24 C ATOM 1754 C LYS B 31 12.894 -4.274 -10.255 1.00 1.11 C ATOM 1755 O LYS B 31 14.036 -4.707 -10.059 1.00 75.42 O ATOM 1756 CB LYS B 31 12.901 -2.000 -11.394 1.00 75.04 C ATOM 1757 CG LYS B 31 12.663 -1.152 -12.674 1.00 74.32 C ATOM 1758 CD LYS B 31 13.410 0.205 -12.649 1.00 24.21 C ATOM 1759 CE LYS B 31 12.999 1.110 -11.476 1.00 12.12 C ATOM 1760 NZ LYS B 31 13.823 2.343 -11.413 1.00 43.51 N ATOM 0 H LYS B 31 10.557 -2.868 -11.814 1.00 2.35 H new ATOM 0 HA LYS B 31 13.173 -3.922 -12.351 1.00 64.24 H new ATOM 0 HB2 LYS B 31 12.303 -1.587 -10.582 1.00 75.04 H new ATOM 0 HB3 LYS B 31 13.946 -1.906 -11.099 1.00 75.04 H new ATOM 0 HG2 LYS B 31 12.985 -1.722 -13.546 1.00 74.32 H new ATOM 0 HG3 LYS B 31 11.594 -0.970 -12.789 1.00 74.32 H new ATOM 0 HD2 LYS B 31 14.483 0.019 -12.596 1.00 24.21 H new ATOM 0 HD3 LYS B 31 13.224 0.731 -13.586 1.00 24.21 H new ATOM 0 HE2 LYS B 31 11.948 1.381 -11.577 1.00 12.12 H new ATOM 0 HE3 LYS B 31 13.098 0.559 -10.541 1.00 12.12 H new ATOM 0 HZ1 LYS B 31 13.609 2.859 -10.536 1.00 43.51 H new ATOM 0 HZ2 LYS B 31 14.831 2.088 -11.427 1.00 43.51 H new ATOM 0 HZ3 LYS B 31 13.607 2.947 -12.232 1.00 43.51 H new ATOM 1774 N VAL B 32 11.891 -4.431 -9.366 1.00 2.55 N ATOM 1775 CA VAL B 32 12.051 -5.169 -8.086 1.00 31.32 C ATOM 1776 C VAL B 32 11.577 -6.646 -8.177 1.00 52.45 C ATOM 1777 O VAL B 32 11.700 -7.394 -7.204 1.00 41.53 O ATOM 1778 CB VAL B 32 11.307 -4.426 -6.916 1.00 11.44 C ATOM 1779 CG1 VAL B 32 11.844 -2.985 -6.763 1.00 2.01 C ATOM 1780 CG2 VAL B 32 9.770 -4.429 -7.114 1.00 34.55 C ATOM 0 H VAL B 32 10.954 -4.055 -9.509 1.00 2.55 H new ATOM 0 HA VAL B 32 13.120 -5.191 -7.874 1.00 31.32 H new ATOM 0 HB VAL B 32 11.511 -4.972 -5.995 1.00 11.44 H new ATOM 0 HG11 VAL B 32 11.318 -2.485 -5.949 1.00 2.01 H new ATOM 0 HG12 VAL B 32 12.911 -3.016 -6.541 1.00 2.01 H new ATOM 0 HG13 VAL B 32 11.682 -2.436 -7.691 1.00 2.01 H new ATOM 0 HG21 VAL B 32 9.295 -3.906 -6.284 1.00 34.55 H new ATOM 0 HG22 VAL B 32 9.523 -3.926 -8.049 1.00 34.55 H new ATOM 0 HG23 VAL B 32 9.410 -5.457 -7.149 1.00 34.55 H new ATOM 1790 N ASN B 33 11.001 -7.036 -9.340 1.00 44.32 N ATOM 1791 CA ASN B 33 10.579 -8.439 -9.647 1.00 54.31 C ATOM 1792 C ASN B 33 9.404 -8.931 -8.727 1.00 23.12 C ATOM 1793 O ASN B 33 9.094 -10.127 -8.667 1.00 13.40 O ATOM 1794 CB ASN B 33 11.823 -9.391 -9.608 1.00 54.32 C ATOM 1795 CG ASN B 33 11.591 -10.757 -10.249 1.00 22.12 C ATOM 1796 OD1 ASN B 33 11.317 -11.744 -9.577 1.00 70.21 O ATOM 1797 ND2 ASN B 33 11.686 -10.824 -11.559 1.00 43.33 N ATOM 0 H ASN B 33 10.811 -6.386 -10.103 1.00 44.32 H new ATOM 0 HA ASN B 33 10.172 -8.460 -10.658 1.00 54.31 H new ATOM 0 HB2 ASN B 33 12.656 -8.902 -10.114 1.00 54.32 H new ATOM 0 HB3 ASN B 33 12.122 -9.536 -8.570 1.00 54.32 H new ATOM 0 HD21 ASN B 33 11.530 -11.712 -12.037 1.00 43.33 H new ATOM 0 HD22 ASN B 33 11.915 -9.988 -12.097 1.00 43.33 H new ATOM 1804 N LEU B 34 8.721 -7.987 -8.048 1.00 45.01 N ATOM 1805 CA LEU B 34 7.586 -8.297 -7.143 1.00 35.43 C ATOM 1806 C LEU B 34 6.239 -8.114 -7.866 1.00 62.33 C ATOM 1807 O LEU B 34 6.170 -7.488 -8.932 1.00 62.02 O ATOM 1808 CB LEU B 34 7.628 -7.383 -5.885 1.00 44.10 C ATOM 1809 CG LEU B 34 8.944 -7.422 -5.047 1.00 63.24 C ATOM 1810 CD1 LEU B 34 8.882 -6.410 -3.884 1.00 45.12 C ATOM 1811 CD2 LEU B 34 9.258 -8.856 -4.550 1.00 1.33 C ATOM 0 H LEU B 34 8.936 -6.992 -8.108 1.00 45.01 H new ATOM 0 HA LEU B 34 7.681 -9.338 -6.835 1.00 35.43 H new ATOM 0 HB2 LEU B 34 7.455 -6.355 -6.203 1.00 44.10 H new ATOM 0 HB3 LEU B 34 6.799 -7.659 -5.233 1.00 44.10 H new ATOM 0 HG LEU B 34 9.767 -7.126 -5.697 1.00 63.24 H new ATOM 0 HD11 LEU B 34 9.810 -6.454 -3.313 1.00 45.12 H new ATOM 0 HD12 LEU B 34 8.749 -5.405 -4.283 1.00 45.12 H new ATOM 0 HD13 LEU B 34 8.043 -6.655 -3.233 1.00 45.12 H new ATOM 0 HD21 LEU B 34 10.181 -8.846 -3.970 1.00 1.33 H new ATOM 0 HD22 LEU B 34 8.440 -9.211 -3.924 1.00 1.33 H new ATOM 0 HD23 LEU B 34 9.375 -9.520 -5.406 1.00 1.33 H new ATOM 1823 N SER B 35 5.173 -8.678 -7.274 1.00 51.00 N ATOM 1824 CA SER B 35 3.781 -8.445 -7.723 1.00 64.11 C ATOM 1825 C SER B 35 3.382 -6.970 -7.479 1.00 10.10 C ATOM 1826 O SER B 35 3.907 -6.340 -6.555 1.00 75.01 O ATOM 1827 CB SER B 35 2.810 -9.394 -6.975 1.00 0.45 C ATOM 1828 OG SER B 35 3.179 -10.750 -7.156 1.00 52.32 O ATOM 0 H SER B 35 5.246 -9.306 -6.474 1.00 51.00 H new ATOM 0 HA SER B 35 3.718 -8.653 -8.791 1.00 64.11 H new ATOM 0 HB2 SER B 35 2.809 -9.153 -5.912 1.00 0.45 H new ATOM 0 HB3 SER B 35 1.794 -9.239 -7.338 1.00 0.45 H new ATOM 0 HG SER B 35 2.552 -11.327 -6.673 1.00 52.32 H new ATOM 1834 N VAL B 36 2.460 -6.434 -8.304 1.00 53.50 N ATOM 1835 CA VAL B 36 2.022 -5.009 -8.227 1.00 52.42 C ATOM 1836 C VAL B 36 1.502 -4.638 -6.806 1.00 64.44 C ATOM 1837 O VAL B 36 1.874 -3.600 -6.250 1.00 45.42 O ATOM 1838 CB VAL B 36 0.915 -4.696 -9.308 1.00 54.25 C ATOM 1839 CG1 VAL B 36 0.451 -3.211 -9.252 1.00 43.34 C ATOM 1840 CG2 VAL B 36 1.403 -5.074 -10.735 1.00 33.33 C ATOM 0 H VAL B 36 1.996 -6.965 -9.041 1.00 53.50 H new ATOM 0 HA VAL B 36 2.899 -4.396 -8.435 1.00 52.42 H new ATOM 0 HB VAL B 36 0.050 -5.315 -9.070 1.00 54.25 H new ATOM 0 HG11 VAL B 36 -0.311 -3.039 -10.012 1.00 43.34 H new ATOM 0 HG12 VAL B 36 0.036 -2.996 -8.267 1.00 43.34 H new ATOM 0 HG13 VAL B 36 1.303 -2.556 -9.437 1.00 43.34 H new ATOM 0 HG21 VAL B 36 0.620 -4.848 -11.459 1.00 33.33 H new ATOM 0 HG22 VAL B 36 2.298 -4.501 -10.977 1.00 33.33 H new ATOM 0 HG23 VAL B 36 1.633 -6.139 -10.771 1.00 33.33 H new ATOM 1850 N GLU B 37 0.656 -5.521 -6.240 1.00 61.33 N ATOM 1851 CA GLU B 37 0.122 -5.389 -4.856 1.00 33.11 C ATOM 1852 C GLU B 37 1.245 -5.410 -3.785 1.00 13.34 C ATOM 1853 O GLU B 37 1.240 -4.593 -2.862 1.00 61.41 O ATOM 1854 CB GLU B 37 -0.898 -6.520 -4.575 1.00 30.11 C ATOM 1855 CG GLU B 37 -2.096 -6.533 -5.533 1.00 70.34 C ATOM 1856 CD GLU B 37 -3.055 -7.701 -5.261 1.00 52.20 C ATOM 1857 OE1 GLU B 37 -3.934 -7.566 -4.385 1.00 1.25 O ATOM 1858 OE2 GLU B 37 -2.923 -8.766 -5.908 1.00 64.41 O ATOM 0 H GLU B 37 0.318 -6.352 -6.726 1.00 61.33 H new ATOM 0 HA GLU B 37 -0.371 -4.419 -4.789 1.00 33.11 H new ATOM 0 HB2 GLU B 37 -0.386 -7.480 -4.637 1.00 30.11 H new ATOM 0 HB3 GLU B 37 -1.264 -6.419 -3.553 1.00 30.11 H new ATOM 0 HG2 GLU B 37 -2.639 -5.593 -5.442 1.00 70.34 H new ATOM 0 HG3 GLU B 37 -1.735 -6.595 -6.560 1.00 70.34 H new ATOM 1865 N SER B 38 2.209 -6.345 -3.945 1.00 4.44 N ATOM 1866 CA SER B 38 3.358 -6.517 -3.004 1.00 71.44 C ATOM 1867 C SER B 38 4.265 -5.261 -2.983 1.00 5.14 C ATOM 1868 O SER B 38 4.763 -4.848 -1.929 1.00 72.45 O ATOM 1869 CB SER B 38 4.197 -7.762 -3.403 1.00 32.25 C ATOM 1870 OG SER B 38 5.313 -7.947 -2.541 1.00 13.42 O ATOM 0 H SER B 38 2.220 -7.003 -4.724 1.00 4.44 H new ATOM 0 HA SER B 38 2.949 -6.659 -2.004 1.00 71.44 H new ATOM 0 HB2 SER B 38 3.565 -8.650 -3.375 1.00 32.25 H new ATOM 0 HB3 SER B 38 4.546 -7.651 -4.430 1.00 32.25 H new ATOM 0 HG SER B 38 5.816 -8.740 -2.822 1.00 13.42 H new ATOM 1876 N THR B 39 4.447 -4.671 -4.174 1.00 33.12 N ATOM 1877 CA THR B 39 5.243 -3.445 -4.377 1.00 14.22 C ATOM 1878 C THR B 39 4.546 -2.223 -3.727 1.00 43.30 C ATOM 1879 O THR B 39 5.171 -1.487 -2.964 1.00 74.31 O ATOM 1880 CB THR B 39 5.474 -3.198 -5.907 1.00 65.21 C ATOM 1881 OG1 THR B 39 6.125 -4.343 -6.481 1.00 44.14 O ATOM 1882 CG2 THR B 39 6.325 -1.948 -6.188 1.00 73.14 C ATOM 0 H THR B 39 4.041 -5.035 -5.036 1.00 33.12 H new ATOM 0 HA THR B 39 6.211 -3.578 -3.894 1.00 14.22 H new ATOM 0 HB THR B 39 4.494 -3.036 -6.357 1.00 65.21 H new ATOM 0 HG1 THR B 39 5.484 -5.081 -6.556 1.00 44.14 H new ATOM 0 HG21 THR B 39 6.451 -1.828 -7.264 1.00 73.14 H new ATOM 0 HG22 THR B 39 5.825 -1.069 -5.781 1.00 73.14 H new ATOM 0 HG23 THR B 39 7.302 -2.060 -5.718 1.00 73.14 H new ATOM 1890 N ALA B 40 3.231 -2.056 -4.011 1.00 10.22 N ATOM 1891 CA ALA B 40 2.389 -0.958 -3.451 1.00 51.44 C ATOM 1892 C ALA B 40 2.343 -0.978 -1.901 1.00 62.35 C ATOM 1893 O ALA B 40 2.320 0.074 -1.252 1.00 35.02 O ATOM 1894 CB ALA B 40 0.957 -1.055 -4.018 1.00 45.04 C ATOM 0 H ALA B 40 2.719 -2.678 -4.636 1.00 10.22 H new ATOM 0 HA ALA B 40 2.846 -0.015 -3.750 1.00 51.44 H new ATOM 0 HB1 ALA B 40 0.347 -0.251 -3.606 1.00 45.04 H new ATOM 0 HB2 ALA B 40 0.989 -0.966 -5.104 1.00 45.04 H new ATOM 0 HB3 ALA B 40 0.522 -2.017 -3.745 1.00 45.04 H new ATOM 1900 N LEU B 41 2.324 -2.197 -1.340 1.00 34.35 N ATOM 1901 CA LEU B 41 2.323 -2.437 0.123 1.00 21.45 C ATOM 1902 C LEU B 41 3.669 -1.966 0.742 1.00 41.31 C ATOM 1903 O LEU B 41 3.691 -1.248 1.748 1.00 41.34 O ATOM 1904 CB LEU B 41 2.095 -3.960 0.398 1.00 20.45 C ATOM 1905 CG LEU B 41 1.289 -4.372 1.685 1.00 75.45 C ATOM 1906 CD1 LEU B 41 1.346 -5.900 1.862 1.00 24.14 C ATOM 1907 CD2 LEU B 41 1.752 -3.637 2.972 1.00 33.24 C ATOM 0 H LEU B 41 2.309 -3.056 -1.889 1.00 34.35 H new ATOM 0 HA LEU B 41 1.516 -1.868 0.585 1.00 21.45 H new ATOM 0 HB2 LEU B 41 1.580 -4.381 -0.466 1.00 20.45 H new ATOM 0 HB3 LEU B 41 3.073 -4.439 0.450 1.00 20.45 H new ATOM 0 HG LEU B 41 0.256 -4.058 1.532 1.00 75.45 H new ATOM 0 HD11 LEU B 41 0.787 -6.184 2.754 1.00 24.14 H new ATOM 0 HD12 LEU B 41 0.907 -6.384 0.989 1.00 24.14 H new ATOM 0 HD13 LEU B 41 2.384 -6.216 1.968 1.00 24.14 H new ATOM 0 HD21 LEU B 41 1.152 -3.972 3.818 1.00 33.24 H new ATOM 0 HD22 LEU B 41 2.802 -3.861 3.161 1.00 33.24 H new ATOM 0 HD23 LEU B 41 1.628 -2.562 2.842 1.00 33.24 H new ATOM 1919 N ALA B 42 4.782 -2.386 0.103 1.00 62.30 N ATOM 1920 CA ALA B 42 6.156 -2.019 0.524 1.00 3.40 C ATOM 1921 C ALA B 42 6.392 -0.489 0.433 1.00 31.32 C ATOM 1922 O ALA B 42 7.210 0.069 1.168 1.00 52.54 O ATOM 1923 CB ALA B 42 7.183 -2.782 -0.326 1.00 13.23 C ATOM 0 H ALA B 42 4.756 -2.989 -0.719 1.00 62.30 H new ATOM 0 HA ALA B 42 6.279 -2.302 1.569 1.00 3.40 H new ATOM 0 HB1 ALA B 42 8.190 -2.508 -0.012 1.00 13.23 H new ATOM 0 HB2 ALA B 42 7.040 -3.854 -0.193 1.00 13.23 H new ATOM 0 HB3 ALA B 42 7.048 -2.525 -1.377 1.00 13.23 H new ATOM 1929 N VAL B 43 5.647 0.173 -0.475 1.00 0.52 N ATOM 1930 CA VAL B 43 5.677 1.653 -0.633 1.00 33.04 C ATOM 1931 C VAL B 43 4.850 2.352 0.486 1.00 31.34 C ATOM 1932 O VAL B 43 5.248 3.409 0.997 1.00 31.24 O ATOM 1933 CB VAL B 43 5.168 2.089 -2.060 1.00 13.34 C ATOM 1934 CG1 VAL B 43 5.029 3.628 -2.182 1.00 4.13 C ATOM 1935 CG2 VAL B 43 6.102 1.536 -3.174 1.00 61.21 C ATOM 0 H VAL B 43 5.009 -0.294 -1.119 1.00 0.52 H new ATOM 0 HA VAL B 43 6.715 1.972 -0.538 1.00 33.04 H new ATOM 0 HB VAL B 43 4.175 1.659 -2.191 1.00 13.34 H new ATOM 0 HG11 VAL B 43 4.676 3.883 -3.181 1.00 4.13 H new ATOM 0 HG12 VAL B 43 4.315 3.989 -1.442 1.00 4.13 H new ATOM 0 HG13 VAL B 43 5.998 4.096 -2.009 1.00 4.13 H new ATOM 0 HG21 VAL B 43 5.730 1.850 -4.149 1.00 61.21 H new ATOM 0 HG22 VAL B 43 7.111 1.923 -3.028 1.00 61.21 H new ATOM 0 HG23 VAL B 43 6.120 0.447 -3.126 1.00 61.21 H new ATOM 1945 N GLY B 44 3.708 1.741 0.870 1.00 34.12 N ATOM 1946 CA GLY B 44 2.924 2.201 2.036 1.00 15.32 C ATOM 1947 C GLY B 44 3.697 2.048 3.357 1.00 50.10 C ATOM 1948 O GLY B 44 3.489 2.800 4.317 1.00 22.23 O ATOM 0 H GLY B 44 3.311 0.932 0.392 1.00 34.12 H new ATOM 0 HA2 GLY B 44 2.650 3.247 1.897 1.00 15.32 H new ATOM 0 HA3 GLY B 44 1.995 1.633 2.093 1.00 15.32 H new ATOM 1952 N TRP B 45 4.611 1.062 3.370 1.00 61.45 N ATOM 1953 CA TRP B 45 5.547 0.811 4.482 1.00 73.14 C ATOM 1954 C TRP B 45 6.670 1.893 4.521 1.00 61.14 C ATOM 1955 O TRP B 45 7.201 2.207 5.584 1.00 42.34 O ATOM 1956 CB TRP B 45 6.137 -0.613 4.320 1.00 1.53 C ATOM 1957 CG TRP B 45 6.923 -1.114 5.507 1.00 4.41 C ATOM 1958 CD1 TRP B 45 8.273 -1.266 5.601 1.00 4.35 C ATOM 1959 CD2 TRP B 45 6.391 -1.538 6.771 1.00 4.24 C ATOM 1960 NE1 TRP B 45 8.609 -1.764 6.829 1.00 61.32 N ATOM 1961 CE2 TRP B 45 7.475 -1.941 7.566 1.00 52.34 C ATOM 1962 CE3 TRP B 45 5.102 -1.615 7.303 1.00 14.14 C ATOM 1963 CZ2 TRP B 45 7.316 -2.418 8.861 1.00 44.51 C ATOM 1964 CZ3 TRP B 45 4.944 -2.090 8.589 1.00 53.42 C ATOM 1965 CH2 TRP B 45 6.045 -2.485 9.356 1.00 42.05 C ATOM 0 H TRP B 45 4.723 0.406 2.597 1.00 61.45 H new ATOM 0 HA TRP B 45 5.016 0.874 5.432 1.00 73.14 H new ATOM 0 HB2 TRP B 45 5.321 -1.308 4.123 1.00 1.53 H new ATOM 0 HB3 TRP B 45 6.784 -0.625 3.443 1.00 1.53 H new ATOM 0 HD1 TRP B 45 8.977 -1.027 4.818 1.00 4.35 H new ATOM 0 HE1 TRP B 45 9.557 -1.970 7.144 1.00 61.32 H new ATOM 0 HE3 TRP B 45 4.246 -1.309 6.720 1.00 14.14 H new ATOM 0 HZ2 TRP B 45 8.165 -2.724 9.454 1.00 44.51 H new ATOM 0 HZ3 TRP B 45 3.952 -2.158 9.011 1.00 53.42 H new ATOM 0 HH2 TRP B 45 5.887 -2.850 10.360 1.00 42.05 H new ATOM 1976 N LEU B 46 7.030 2.444 3.346 1.00 2.13 N ATOM 1977 CA LEU B 46 7.952 3.609 3.240 1.00 72.14 C ATOM 1978 C LEU B 46 7.276 4.917 3.714 1.00 41.50 C ATOM 1979 O LEU B 46 7.941 5.802 4.270 1.00 51.02 O ATOM 1980 CB LEU B 46 8.442 3.771 1.781 1.00 21.34 C ATOM 1981 CG LEU B 46 9.356 2.630 1.252 1.00 52.03 C ATOM 1982 CD1 LEU B 46 9.616 2.780 -0.261 1.00 33.30 C ATOM 1983 CD2 LEU B 46 10.678 2.568 2.058 1.00 52.02 C ATOM 0 H LEU B 46 6.697 2.102 2.445 1.00 2.13 H new ATOM 0 HA LEU B 46 8.804 3.415 3.891 1.00 72.14 H new ATOM 0 HB2 LEU B 46 7.571 3.847 1.130 1.00 21.34 H new ATOM 0 HB3 LEU B 46 8.983 4.714 1.700 1.00 21.34 H new ATOM 0 HG LEU B 46 8.837 1.683 1.396 1.00 52.03 H new ATOM 0 HD11 LEU B 46 10.258 1.968 -0.602 1.00 33.30 H new ATOM 0 HD12 LEU B 46 8.668 2.744 -0.798 1.00 33.30 H new ATOM 0 HD13 LEU B 46 10.106 3.735 -0.453 1.00 33.30 H new ATOM 0 HD21 LEU B 46 11.303 1.763 1.671 1.00 52.02 H new ATOM 0 HD22 LEU B 46 11.207 3.516 1.962 1.00 52.02 H new ATOM 0 HD23 LEU B 46 10.455 2.382 3.109 1.00 52.02 H new ATOM 1995 N ALA B 47 5.951 5.032 3.462 1.00 14.54 N ATOM 1996 CA ALA B 47 5.123 6.184 3.909 1.00 31.14 C ATOM 1997 C ALA B 47 5.169 6.367 5.443 1.00 23.14 C ATOM 1998 O ALA B 47 5.102 7.500 5.937 1.00 61.03 O ATOM 1999 CB ALA B 47 3.667 6.021 3.432 1.00 11.42 C ATOM 0 H ALA B 47 5.423 4.330 2.943 1.00 14.54 H new ATOM 0 HA ALA B 47 5.546 7.082 3.458 1.00 31.14 H new ATOM 0 HB1 ALA B 47 3.076 6.873 3.768 1.00 11.42 H new ATOM 0 HB2 ALA B 47 3.644 5.971 2.343 1.00 11.42 H new ATOM 0 HB3 ALA B 47 3.249 5.104 3.846 1.00 11.42 H new ATOM 2005 N ARG B 48 5.310 5.235 6.176 1.00 25.33 N ATOM 2006 CA ARG B 48 5.424 5.222 7.656 1.00 22.41 C ATOM 2007 C ARG B 48 6.678 6.017 8.141 1.00 64.43 C ATOM 2008 O ARG B 48 6.635 6.698 9.168 1.00 22.53 O ATOM 2009 CB ARG B 48 5.441 3.738 8.184 1.00 3.40 C ATOM 2010 CG ARG B 48 6.825 3.148 8.539 1.00 63.33 C ATOM 2011 CD ARG B 48 6.793 1.644 8.871 1.00 35.34 C ATOM 2012 NE ARG B 48 8.089 1.176 9.396 1.00 21.51 N ATOM 2013 CZ ARG B 48 9.182 0.975 8.689 1.00 42.11 C ATOM 2014 NH1 ARG B 48 9.197 1.132 7.402 1.00 71.23 N ATOM 2015 NH2 ARG B 48 10.264 0.611 9.285 1.00 41.15 N ATOM 0 H ARG B 48 5.348 4.305 5.758 1.00 25.33 H new ATOM 0 HA ARG B 48 4.551 5.725 8.072 1.00 22.41 H new ATOM 0 HB2 ARG B 48 4.810 3.684 9.071 1.00 3.40 H new ATOM 0 HB3 ARG B 48 4.983 3.101 7.427 1.00 3.40 H new ATOM 0 HG2 ARG B 48 7.505 3.312 7.703 1.00 63.33 H new ATOM 0 HG3 ARG B 48 7.233 3.690 9.392 1.00 63.33 H new ATOM 0 HD2 ARG B 48 6.011 1.449 9.605 1.00 35.34 H new ATOM 0 HD3 ARG B 48 6.537 1.078 7.975 1.00 35.34 H new ATOM 0 HE ARG B 48 8.144 0.991 10.398 1.00 21.51 H new ATOM 0 HH11 ARG B 48 8.349 1.418 6.913 1.00 71.23 H new ATOM 0 HH12 ARG B 48 10.057 0.970 6.878 1.00 71.23 H new ATOM 0 HH21 ARG B 48 10.270 0.481 10.297 1.00 41.15 H new ATOM 0 HH22 ARG B 48 11.115 0.453 8.745 1.00 41.15 H new ATOM 2029 N GLU B 49 7.790 5.911 7.371 1.00 21.13 N ATOM 2030 CA GLU B 49 9.065 6.619 7.656 1.00 4.43 C ATOM 2031 C GLU B 49 9.157 7.969 6.894 1.00 42.33 C ATOM 2032 O GLU B 49 10.201 8.635 6.929 1.00 22.51 O ATOM 2033 CB GLU B 49 10.263 5.725 7.254 1.00 25.12 C ATOM 2034 CG GLU B 49 10.335 4.360 7.941 1.00 50.25 C ATOM 2035 CD GLU B 49 11.516 3.515 7.432 1.00 50.41 C ATOM 2036 OE1 GLU B 49 11.353 2.802 6.415 1.00 51.33 O ATOM 2037 OE2 GLU B 49 12.609 3.575 8.032 1.00 43.23 O ATOM 0 H GLU B 49 7.828 5.331 6.533 1.00 21.13 H new ATOM 0 HA GLU B 49 9.093 6.829 8.725 1.00 4.43 H new ATOM 0 HB2 GLU B 49 10.228 5.567 6.176 1.00 25.12 H new ATOM 0 HB3 GLU B 49 11.184 6.267 7.467 1.00 25.12 H new ATOM 0 HG2 GLU B 49 10.429 4.502 9.018 1.00 50.25 H new ATOM 0 HG3 GLU B 49 9.404 3.820 7.771 1.00 50.25 H new ATOM 2044 N ASN B 50 8.056 8.341 6.199 1.00 43.14 N ATOM 2045 CA ASN B 50 7.944 9.587 5.394 1.00 12.33 C ATOM 2046 C ASN B 50 8.920 9.616 4.183 1.00 61.45 C ATOM 2047 O ASN B 50 9.215 10.688 3.642 1.00 64.33 O ATOM 2048 CB ASN B 50 8.108 10.851 6.294 1.00 30.03 C ATOM 2049 CG ASN B 50 7.029 10.946 7.378 1.00 13.23 C ATOM 2050 OD1 ASN B 50 5.954 11.495 7.149 1.00 73.52 O ATOM 2051 ND2 ASN B 50 7.301 10.409 8.555 1.00 41.44 N ATOM 0 H ASN B 50 7.206 7.777 6.180 1.00 43.14 H new ATOM 0 HA ASN B 50 6.939 9.598 4.972 1.00 12.33 H new ATOM 0 HB2 ASN B 50 9.091 10.832 6.765 1.00 30.03 H new ATOM 0 HB3 ASN B 50 8.071 11.744 5.670 1.00 30.03 H new ATOM 0 HD21 ASN B 50 6.609 10.444 9.304 1.00 41.44 H new ATOM 0 HD22 ASN B 50 8.203 9.960 8.715 1.00 41.44 H new ATOM 2058 N LYS B 51 9.351 8.421 3.725 1.00 71.00 N ATOM 2059 CA LYS B 51 10.340 8.278 2.629 1.00 3.41 C ATOM 2060 C LYS B 51 9.712 8.470 1.227 1.00 71.43 C ATOM 2061 O LYS B 51 10.445 8.599 0.239 1.00 34.41 O ATOM 2062 CB LYS B 51 11.029 6.892 2.706 1.00 21.21 C ATOM 2063 CG LYS B 51 11.661 6.577 4.074 1.00 34.54 C ATOM 2064 CD LYS B 51 12.434 5.237 4.097 1.00 51.13 C ATOM 2065 CE LYS B 51 13.744 5.293 3.296 1.00 10.11 C ATOM 2066 NZ LYS B 51 14.703 6.267 3.885 1.00 23.31 N ATOM 0 H LYS B 51 9.026 7.530 4.101 1.00 71.00 H new ATOM 0 HA LYS B 51 11.077 9.069 2.766 1.00 3.41 H new ATOM 0 HB2 LYS B 51 10.296 6.121 2.471 1.00 21.21 H new ATOM 0 HB3 LYS B 51 11.803 6.840 1.940 1.00 21.21 H new ATOM 0 HG2 LYS B 51 12.340 7.385 4.347 1.00 34.54 H new ATOM 0 HG3 LYS B 51 10.877 6.549 4.831 1.00 34.54 H new ATOM 0 HD2 LYS B 51 12.656 4.968 5.130 1.00 51.13 H new ATOM 0 HD3 LYS B 51 11.799 4.449 3.692 1.00 51.13 H new ATOM 0 HE2 LYS B 51 14.199 4.303 3.271 1.00 10.11 H new ATOM 0 HE3 LYS B 51 13.529 5.571 2.264 1.00 10.11 H new ATOM 0 HZ1 LYS B 51 15.644 6.125 3.465 1.00 23.31 H new ATOM 0 HZ2 LYS B 51 14.378 7.235 3.689 1.00 23.31 H new ATOM 0 HZ3 LYS B 51 14.758 6.122 4.913 1.00 23.31 H new ATOM 2080 N VAL B 52 8.357 8.464 1.143 1.00 64.41 N ATOM 2081 CA VAL B 52 7.626 8.680 -0.134 1.00 24.12 C ATOM 2082 C VAL B 52 6.638 9.874 -0.049 1.00 12.42 C ATOM 2083 O VAL B 52 6.023 10.130 1.000 1.00 12.42 O ATOM 2084 CB VAL B 52 6.879 7.381 -0.642 1.00 30.21 C ATOM 2085 CG1 VAL B 52 7.888 6.267 -1.019 1.00 64.14 C ATOM 2086 CG2 VAL B 52 5.850 6.870 0.396 1.00 14.42 C ATOM 0 H VAL B 52 7.747 8.312 1.946 1.00 64.41 H new ATOM 0 HA VAL B 52 8.392 8.925 -0.870 1.00 24.12 H new ATOM 0 HB VAL B 52 6.328 7.655 -1.541 1.00 30.21 H new ATOM 0 HG11 VAL B 52 7.346 5.387 -1.364 1.00 64.14 H new ATOM 0 HG12 VAL B 52 8.544 6.624 -1.813 1.00 64.14 H new ATOM 0 HG13 VAL B 52 8.485 6.006 -0.145 1.00 64.14 H new ATOM 0 HG21 VAL B 52 5.358 5.977 0.011 1.00 14.42 H new ATOM 0 HG22 VAL B 52 6.362 6.629 1.328 1.00 14.42 H new ATOM 0 HG23 VAL B 52 5.105 7.644 0.581 1.00 14.42 H new ATOM 2096 N VAL B 53 6.525 10.613 -1.176 1.00 65.12 N ATOM 2097 CA VAL B 53 5.662 11.812 -1.315 1.00 4.44 C ATOM 2098 C VAL B 53 4.506 11.522 -2.320 1.00 24.34 C ATOM 2099 O VAL B 53 4.732 11.467 -3.534 1.00 73.30 O ATOM 2100 CB VAL B 53 6.513 13.053 -1.805 1.00 43.21 C ATOM 2101 CG1 VAL B 53 5.669 14.358 -1.819 1.00 72.12 C ATOM 2102 CG2 VAL B 53 7.815 13.217 -0.961 1.00 42.43 C ATOM 0 H VAL B 53 7.038 10.391 -2.029 1.00 65.12 H new ATOM 0 HA VAL B 53 5.234 12.050 -0.341 1.00 4.44 H new ATOM 0 HB VAL B 53 6.814 12.857 -2.834 1.00 43.21 H new ATOM 0 HG11 VAL B 53 6.288 15.188 -2.161 1.00 72.12 H new ATOM 0 HG12 VAL B 53 4.821 14.236 -2.493 1.00 72.12 H new ATOM 0 HG13 VAL B 53 5.305 14.567 -0.813 1.00 72.12 H new ATOM 0 HG21 VAL B 53 8.377 14.078 -1.323 1.00 42.43 H new ATOM 0 HG22 VAL B 53 7.553 13.368 0.086 1.00 42.43 H new ATOM 0 HG23 VAL B 53 8.426 12.319 -1.056 1.00 42.43 H new ATOM 2112 N ILE B 54 3.275 11.321 -1.796 1.00 50.40 N ATOM 2113 CA ILE B 54 2.090 10.935 -2.615 1.00 4.31 C ATOM 2114 C ILE B 54 1.394 12.194 -3.215 1.00 62.25 C ATOM 2115 O ILE B 54 0.929 13.075 -2.471 1.00 35.52 O ATOM 2116 CB ILE B 54 1.030 10.077 -1.792 1.00 32.10 C ATOM 2117 CG1 ILE B 54 1.652 8.741 -1.222 1.00 15.35 C ATOM 2118 CG2 ILE B 54 -0.223 9.756 -2.665 1.00 62.51 C ATOM 2119 CD1 ILE B 54 2.595 8.892 -0.034 1.00 21.13 C ATOM 0 H ILE B 54 3.070 11.419 -0.802 1.00 50.40 H new ATOM 0 HA ILE B 54 2.467 10.308 -3.423 1.00 4.31 H new ATOM 0 HB ILE B 54 0.725 10.687 -0.941 1.00 32.10 H new ATOM 0 HG12 ILE B 54 0.836 8.080 -0.930 1.00 15.35 H new ATOM 0 HG13 ILE B 54 2.192 8.243 -2.027 1.00 15.35 H new ATOM 0 HG21 ILE B 54 -0.932 9.169 -2.081 1.00 62.51 H new ATOM 0 HG22 ILE B 54 -0.695 10.687 -2.981 1.00 62.51 H new ATOM 0 HG23 ILE B 54 0.082 9.187 -3.544 1.00 62.51 H new ATOM 0 HD11 ILE B 54 2.958 7.910 0.269 1.00 21.13 H new ATOM 0 HD12 ILE B 54 3.440 9.520 -0.317 1.00 21.13 H new ATOM 0 HD13 ILE B 54 2.062 9.354 0.797 1.00 21.13 H new ATOM 2131 N GLU B 55 1.344 12.268 -4.568 1.00 71.50 N ATOM 2132 CA GLU B 55 0.696 13.378 -5.314 1.00 13.22 C ATOM 2133 C GLU B 55 -0.275 12.833 -6.400 1.00 3.14 C ATOM 2134 O GLU B 55 0.149 12.137 -7.328 1.00 32.02 O ATOM 2135 CB GLU B 55 1.766 14.286 -5.986 1.00 51.40 C ATOM 2136 CG GLU B 55 2.789 14.924 -5.018 1.00 44.23 C ATOM 2137 CD GLU B 55 3.649 16.008 -5.691 1.00 72.15 C ATOM 2138 OE1 GLU B 55 4.413 15.681 -6.620 1.00 62.20 O ATOM 2139 OE2 GLU B 55 3.554 17.197 -5.314 1.00 73.44 O ATOM 0 H GLU B 55 1.753 11.558 -5.175 1.00 71.50 H new ATOM 0 HA GLU B 55 0.125 13.966 -4.595 1.00 13.22 H new ATOM 0 HB2 GLU B 55 2.308 13.696 -6.725 1.00 51.40 H new ATOM 0 HB3 GLU B 55 1.255 15.083 -6.527 1.00 51.40 H new ATOM 0 HG2 GLU B 55 2.259 15.361 -4.172 1.00 44.23 H new ATOM 0 HG3 GLU B 55 3.440 14.146 -4.619 1.00 44.23 H new ATOM 2146 N ARG B 56 -1.580 13.151 -6.260 1.00 61.35 N ATOM 2147 CA ARG B 56 -2.604 12.879 -7.295 1.00 11.04 C ATOM 2148 C ARG B 56 -2.642 14.026 -8.327 1.00 54.00 C ATOM 2149 O ARG B 56 -2.952 15.175 -7.992 1.00 4.31 O ATOM 2150 CB ARG B 56 -4.013 12.692 -6.667 1.00 72.14 C ATOM 2151 CG ARG B 56 -4.210 11.361 -5.913 1.00 23.13 C ATOM 2152 CD ARG B 56 -5.626 11.231 -5.323 1.00 42.43 C ATOM 2153 NE ARG B 56 -5.849 9.922 -4.671 1.00 4.04 N ATOM 2154 CZ ARG B 56 -6.239 9.748 -3.427 1.00 55.14 C ATOM 2155 NH1 ARG B 56 -6.271 10.733 -2.583 1.00 53.51 N ATOM 2156 NH2 ARG B 56 -6.552 8.568 -3.024 1.00 21.53 N ATOM 0 H ARG B 56 -1.955 13.604 -5.426 1.00 61.35 H new ATOM 0 HA ARG B 56 -2.328 11.951 -7.795 1.00 11.04 H new ATOM 0 HB2 ARG B 56 -4.201 13.516 -5.978 1.00 72.14 H new ATOM 0 HB3 ARG B 56 -4.760 12.760 -7.457 1.00 72.14 H new ATOM 0 HG2 ARG B 56 -4.024 10.529 -6.593 1.00 23.13 H new ATOM 0 HG3 ARG B 56 -3.476 11.288 -5.111 1.00 23.13 H new ATOM 0 HD2 ARG B 56 -5.788 12.028 -4.597 1.00 42.43 H new ATOM 0 HD3 ARG B 56 -6.361 11.368 -6.116 1.00 42.43 H new ATOM 0 HE ARG B 56 -5.687 9.086 -5.232 1.00 4.04 H new ATOM 0 HH11 ARG B 56 -5.990 11.668 -2.879 1.00 53.51 H new ATOM 0 HH12 ARG B 56 -6.577 10.573 -1.623 1.00 53.51 H new ATOM 0 HH21 ARG B 56 -6.497 7.778 -3.667 1.00 21.53 H new ATOM 0 HH22 ARG B 56 -6.856 8.422 -2.061 1.00 21.53 H new ATOM 2170 N LYS B 57 -2.307 13.692 -9.576 1.00 43.25 N ATOM 2171 CA LYS B 57 -2.327 14.617 -10.723 1.00 4.53 C ATOM 2172 C LYS B 57 -3.208 13.996 -11.824 1.00 53.21 C ATOM 2173 O LYS B 57 -2.877 12.929 -12.343 1.00 1.24 O ATOM 2174 CB LYS B 57 -0.874 14.841 -11.211 1.00 5.31 C ATOM 2175 CG LYS B 57 0.033 15.551 -10.167 1.00 1.54 C ATOM 2176 CD LYS B 57 1.528 15.259 -10.383 1.00 51.33 C ATOM 2177 CE LYS B 57 2.437 15.964 -9.367 1.00 62.03 C ATOM 2178 NZ LYS B 57 3.845 15.519 -9.498 1.00 44.33 N ATOM 0 H LYS B 57 -2.007 12.750 -9.828 1.00 43.25 H new ATOM 0 HA LYS B 57 -2.743 15.586 -10.448 1.00 4.53 H new ATOM 0 HB2 LYS B 57 -0.433 13.877 -11.467 1.00 5.31 H new ATOM 0 HB3 LYS B 57 -0.894 15.435 -12.125 1.00 5.31 H new ATOM 0 HG2 LYS B 57 -0.134 16.627 -10.219 1.00 1.54 H new ATOM 0 HG3 LYS B 57 -0.254 15.232 -9.165 1.00 1.54 H new ATOM 0 HD2 LYS B 57 1.693 14.183 -10.323 1.00 51.33 H new ATOM 0 HD3 LYS B 57 1.810 15.569 -11.389 1.00 51.33 H new ATOM 0 HE2 LYS B 57 2.380 17.043 -9.513 1.00 62.03 H new ATOM 0 HE3 LYS B 57 2.082 15.760 -8.357 1.00 62.03 H new ATOM 0 HZ1 LYS B 57 4.285 15.478 -8.557 1.00 44.33 H new ATOM 0 HZ2 LYS B 57 3.872 14.575 -9.934 1.00 44.33 H new ATOM 0 HZ3 LYS B 57 4.367 16.191 -10.095 1.00 44.33 H new ATOM 2192 N ASN B 58 -4.342 14.665 -12.141 1.00 41.32 N ATOM 2193 CA ASN B 58 -5.435 14.118 -13.000 1.00 65.43 C ATOM 2194 C ASN B 58 -6.011 12.799 -12.405 1.00 61.01 C ATOM 2195 O ASN B 58 -6.488 11.917 -13.130 1.00 33.41 O ATOM 2196 CB ASN B 58 -4.956 13.922 -14.468 1.00 24.03 C ATOM 2197 CG ASN B 58 -4.501 15.228 -15.121 1.00 61.13 C ATOM 2198 OD1 ASN B 58 -5.294 15.955 -15.706 1.00 44.23 O ATOM 2199 ND2 ASN B 58 -3.226 15.544 -15.013 1.00 21.13 N ATOM 0 H ASN B 58 -4.532 15.610 -11.807 1.00 41.32 H new ATOM 0 HA ASN B 58 -6.243 14.850 -13.017 1.00 65.43 H new ATOM 0 HB2 ASN B 58 -4.134 13.207 -14.485 1.00 24.03 H new ATOM 0 HB3 ASN B 58 -5.766 13.490 -15.055 1.00 24.03 H new ATOM 0 HD21 ASN B 58 -2.879 16.412 -15.422 1.00 21.13 H new ATOM 0 HD22 ASN B 58 -2.586 14.921 -14.520 1.00 21.13 H new ATOM 2206 N GLY B 59 -5.984 12.710 -11.059 1.00 60.33 N ATOM 2207 CA GLY B 59 -6.416 11.512 -10.323 1.00 1.44 C ATOM 2208 C GLY B 59 -5.304 10.468 -10.126 1.00 31.22 C ATOM 2209 O GLY B 59 -5.397 9.619 -9.236 1.00 63.51 O ATOM 0 H GLY B 59 -5.662 13.467 -10.456 1.00 60.33 H new ATOM 0 HA2 GLY B 59 -6.795 11.814 -9.347 1.00 1.44 H new ATOM 0 HA3 GLY B 59 -7.246 11.049 -10.857 1.00 1.44 H new ATOM 2213 N LEU B 60 -4.242 10.553 -10.949 1.00 51.00 N ATOM 2214 CA LEU B 60 -3.163 9.543 -11.020 1.00 32.13 C ATOM 2215 C LEU B 60 -2.138 9.735 -9.871 1.00 14.03 C ATOM 2216 O LEU B 60 -1.550 10.811 -9.732 1.00 11.33 O ATOM 2217 CB LEU B 60 -2.460 9.652 -12.407 1.00 21.50 C ATOM 2218 CG LEU B 60 -3.408 9.692 -13.660 1.00 14.42 C ATOM 2219 CD1 LEU B 60 -2.605 9.832 -14.972 1.00 15.22 C ATOM 2220 CD2 LEU B 60 -4.360 8.471 -13.702 1.00 31.21 C ATOM 0 H LEU B 60 -4.105 11.333 -11.592 1.00 51.00 H new ATOM 0 HA LEU B 60 -3.596 8.550 -10.905 1.00 32.13 H new ATOM 0 HB2 LEU B 60 -1.847 10.553 -12.411 1.00 21.50 H new ATOM 0 HB3 LEU B 60 -1.782 8.805 -12.516 1.00 21.50 H new ATOM 0 HG LEU B 60 -4.032 10.580 -13.563 1.00 14.42 H new ATOM 0 HD11 LEU B 60 -3.292 9.856 -15.818 1.00 15.22 H new ATOM 0 HD12 LEU B 60 -2.026 10.755 -14.948 1.00 15.22 H new ATOM 0 HD13 LEU B 60 -1.929 8.983 -15.077 1.00 15.22 H new ATOM 0 HD21 LEU B 60 -4.998 8.537 -14.583 1.00 31.21 H new ATOM 0 HD22 LEU B 60 -3.773 7.554 -13.747 1.00 31.21 H new ATOM 0 HD23 LEU B 60 -4.980 8.462 -12.805 1.00 31.21 H new ATOM 2232 N ILE B 61 -1.935 8.679 -9.064 1.00 34.32 N ATOM 2233 CA ILE B 61 -1.030 8.704 -7.889 1.00 42.24 C ATOM 2234 C ILE B 61 0.450 8.514 -8.325 1.00 51.01 C ATOM 2235 O ILE B 61 0.780 7.560 -9.042 1.00 23.11 O ATOM 2236 CB ILE B 61 -1.405 7.584 -6.813 1.00 21.23 C ATOM 2237 CG1 ILE B 61 -2.832 7.818 -6.181 1.00 33.53 C ATOM 2238 CG2 ILE B 61 -0.325 7.479 -5.690 1.00 30.10 C ATOM 2239 CD1 ILE B 61 -4.019 7.506 -7.079 1.00 42.34 C ATOM 0 H ILE B 61 -2.393 7.778 -9.204 1.00 34.32 H new ATOM 0 HA ILE B 61 -1.155 9.682 -7.424 1.00 42.24 H new ATOM 0 HB ILE B 61 -1.432 6.638 -7.353 1.00 21.23 H new ATOM 0 HG12 ILE B 61 -2.913 7.209 -5.281 1.00 33.53 H new ATOM 0 HG13 ILE B 61 -2.902 8.860 -5.868 1.00 33.53 H new ATOM 0 HG21 ILE B 61 -0.615 6.707 -4.977 1.00 30.10 H new ATOM 0 HG22 ILE B 61 0.637 7.221 -6.133 1.00 30.10 H new ATOM 0 HG23 ILE B 61 -0.242 8.436 -5.175 1.00 30.10 H new ATOM 0 HD11 ILE B 61 -4.945 7.704 -6.540 1.00 42.34 H new ATOM 0 HD12 ILE B 61 -3.976 8.133 -7.969 1.00 42.34 H new ATOM 0 HD13 ILE B 61 -3.987 6.457 -7.373 1.00 42.34 H new ATOM 2251 N GLU B 62 1.324 9.433 -7.877 1.00 34.23 N ATOM 2252 CA GLU B 62 2.795 9.292 -7.971 1.00 65.51 C ATOM 2253 C GLU B 62 3.394 9.238 -6.550 1.00 12.23 C ATOM 2254 O GLU B 62 2.894 9.900 -5.638 1.00 3.30 O ATOM 2255 CB GLU B 62 3.442 10.471 -8.741 1.00 60.40 C ATOM 2256 CG GLU B 62 3.111 10.541 -10.238 1.00 53.23 C ATOM 2257 CD GLU B 62 3.950 11.610 -10.958 1.00 74.30 C ATOM 2258 OE1 GLU B 62 5.067 11.294 -11.433 1.00 41.55 O ATOM 2259 OE2 GLU B 62 3.517 12.776 -11.029 1.00 11.23 O ATOM 0 H GLU B 62 1.030 10.304 -7.435 1.00 34.23 H new ATOM 0 HA GLU B 62 3.005 8.372 -8.517 1.00 65.51 H new ATOM 0 HB2 GLU B 62 3.128 11.404 -8.273 1.00 60.40 H new ATOM 0 HB3 GLU B 62 4.524 10.406 -8.628 1.00 60.40 H new ATOM 0 HG2 GLU B 62 3.291 9.568 -10.696 1.00 53.23 H new ATOM 0 HG3 GLU B 62 2.052 10.763 -10.366 1.00 53.23 H new ATOM 2266 N ILE B 63 4.467 8.444 -6.376 1.00 22.51 N ATOM 2267 CA ILE B 63 5.228 8.361 -5.109 1.00 1.52 C ATOM 2268 C ILE B 63 6.702 8.784 -5.350 1.00 64.01 C ATOM 2269 O ILE B 63 7.495 8.079 -5.987 1.00 61.42 O ATOM 2270 CB ILE B 63 5.126 6.933 -4.401 1.00 0.13 C ATOM 2271 CG1 ILE B 63 5.628 5.739 -5.296 1.00 15.01 C ATOM 2272 CG2 ILE B 63 3.674 6.678 -3.908 1.00 54.52 C ATOM 2273 CD1 ILE B 63 4.741 5.367 -6.475 1.00 73.40 C ATOM 0 H ILE B 63 4.834 7.839 -7.111 1.00 22.51 H new ATOM 0 HA ILE B 63 4.769 9.059 -4.408 1.00 1.52 H new ATOM 0 HB ILE B 63 5.803 6.968 -3.548 1.00 0.13 H new ATOM 0 HG12 ILE B 63 6.618 5.989 -5.677 1.00 15.01 H new ATOM 0 HG13 ILE B 63 5.743 4.860 -4.662 1.00 15.01 H new ATOM 0 HG21 ILE B 63 3.619 5.701 -3.428 1.00 54.52 H new ATOM 0 HG22 ILE B 63 3.392 7.451 -3.193 1.00 54.52 H new ATOM 0 HG23 ILE B 63 2.992 6.703 -4.758 1.00 54.52 H new ATOM 0 HD11 ILE B 63 5.187 4.533 -7.017 1.00 73.40 H new ATOM 0 HD12 ILE B 63 3.755 5.077 -6.111 1.00 73.40 H new ATOM 0 HD13 ILE B 63 4.644 6.224 -7.142 1.00 73.40 H new ATOM 2285 N TYR B 64 7.021 10.001 -4.902 1.00 1.51 N ATOM 2286 CA TYR B 64 8.385 10.569 -4.974 1.00 14.14 C ATOM 2287 C TYR B 64 9.241 10.157 -3.760 1.00 31.12 C ATOM 2288 O TYR B 64 8.758 9.496 -2.856 1.00 51.52 O ATOM 2289 CB TYR B 64 8.311 12.110 -5.092 1.00 65.41 C ATOM 2290 CG TYR B 64 7.710 12.601 -6.418 1.00 35.02 C ATOM 2291 CD1 TYR B 64 6.326 12.640 -6.624 1.00 21.13 C ATOM 2292 CD2 TYR B 64 8.531 13.026 -7.467 1.00 25.33 C ATOM 2293 CE1 TYR B 64 5.797 13.084 -7.817 1.00 51.21 C ATOM 2294 CE2 TYR B 64 8.000 13.471 -8.659 1.00 52.55 C ATOM 2295 CZ TYR B 64 6.636 13.498 -8.826 1.00 31.05 C ATOM 2296 OH TYR B 64 6.103 13.957 -10.005 1.00 21.53 O ATOM 0 H TYR B 64 6.341 10.630 -4.475 1.00 1.51 H new ATOM 0 HA TYR B 64 8.870 10.166 -5.863 1.00 14.14 H new ATOM 0 HB2 TYR B 64 7.715 12.500 -4.267 1.00 65.41 H new ATOM 0 HB3 TYR B 64 9.314 12.522 -4.984 1.00 65.41 H new ATOM 0 HD1 TYR B 64 5.662 12.317 -5.836 1.00 21.13 H new ATOM 0 HD2 TYR B 64 9.603 13.005 -7.341 1.00 25.33 H new ATOM 0 HE1 TYR B 64 4.727 13.107 -7.959 1.00 51.21 H new ATOM 0 HE2 TYR B 64 8.652 13.796 -9.456 1.00 52.55 H new ATOM 0 HH TYR B 64 6.827 14.212 -10.614 1.00 21.53 H new ATOM 2306 N ASN B 65 10.534 10.523 -3.776 1.00 63.04 N ATOM 2307 CA ASN B 65 11.448 10.292 -2.629 1.00 32.53 C ATOM 2308 C ASN B 65 11.372 11.450 -1.607 1.00 42.41 C ATOM 2309 O ASN B 65 10.919 12.565 -1.924 1.00 51.40 O ATOM 2310 CB ASN B 65 12.920 10.112 -3.110 1.00 5.42 C ATOM 2311 CG ASN B 65 13.196 8.818 -3.883 1.00 41.14 C ATOM 2312 OD1 ASN B 65 14.262 8.221 -3.757 1.00 43.23 O ATOM 2313 ND2 ASN B 65 12.279 8.395 -4.719 1.00 32.51 N ATOM 0 H ASN B 65 10.977 10.982 -4.571 1.00 63.04 H new ATOM 0 HA ASN B 65 11.123 9.374 -2.140 1.00 32.53 H new ATOM 0 HB2 ASN B 65 13.186 10.959 -3.743 1.00 5.42 H new ATOM 0 HB3 ASN B 65 13.577 10.145 -2.241 1.00 5.42 H new ATOM 0 HD21 ASN B 65 12.445 7.558 -5.277 1.00 32.51 H new ATOM 0 HD22 ASN B 65 11.399 8.903 -4.811 1.00 32.51 H new ATOM 2320 N GLU B 66 11.801 11.139 -0.371 1.00 4.32 N ATOM 2321 CA GLU B 66 12.007 12.117 0.727 1.00 22.42 C ATOM 2322 C GLU B 66 12.881 13.328 0.277 1.00 65.22 C ATOM 2323 O GLU B 66 14.116 13.266 0.248 1.00 3.44 O ATOM 2324 CB GLU B 66 12.643 11.394 1.957 1.00 23.44 C ATOM 2325 CG GLU B 66 13.819 10.461 1.595 1.00 64.30 C ATOM 2326 CD GLU B 66 14.530 9.843 2.808 1.00 72.23 C ATOM 2327 OE1 GLU B 66 13.898 9.065 3.537 1.00 71.44 O ATOM 2328 OE2 GLU B 66 15.734 10.121 3.021 1.00 63.42 O ATOM 0 H GLU B 66 12.021 10.182 -0.095 1.00 4.32 H new ATOM 0 HA GLU B 66 11.035 12.522 1.009 1.00 22.42 H new ATOM 0 HB2 GLU B 66 12.992 12.144 2.666 1.00 23.44 H new ATOM 0 HB3 GLU B 66 11.872 10.812 2.462 1.00 23.44 H new ATOM 0 HG2 GLU B 66 13.448 9.658 0.958 1.00 64.30 H new ATOM 0 HG3 GLU B 66 14.547 11.023 1.009 1.00 64.30 H new ATOM 2335 N GLY B 67 12.204 14.415 -0.110 1.00 62.44 N ATOM 2336 CA GLY B 67 12.873 15.616 -0.619 1.00 12.35 C ATOM 2337 C GLY B 67 11.899 16.590 -1.270 1.00 65.11 C ATOM 2338 O GLY B 67 11.993 17.809 -1.087 1.00 3.11 O ATOM 0 H GLY B 67 11.187 14.487 -0.080 1.00 62.44 H new ATOM 0 HA2 GLY B 67 13.390 16.116 0.200 1.00 12.35 H new ATOM 0 HA3 GLY B 67 13.632 15.326 -1.345 1.00 12.35 H new ATOM 2342 N HIS B 68 10.936 16.026 -2.022 1.00 42.24 N ATOM 2343 CA HIS B 68 9.938 16.802 -2.794 1.00 41.35 C ATOM 2344 C HIS B 68 8.746 17.289 -1.912 1.00 4.11 C ATOM 2345 O HIS B 68 7.946 18.115 -2.358 1.00 0.43 O ATOM 2346 CB HIS B 68 9.449 15.926 -3.982 1.00 1.23 C ATOM 2347 CG HIS B 68 8.522 16.608 -4.960 1.00 24.50 C ATOM 2348 ND1 HIS B 68 8.733 17.884 -5.446 1.00 32.24 N ATOM 2349 CD2 HIS B 68 7.381 16.181 -5.544 1.00 52.52 C ATOM 2350 CE1 HIS B 68 7.769 18.200 -6.286 1.00 64.30 C ATOM 2351 NE2 HIS B 68 6.939 17.187 -6.360 1.00 43.20 N ATOM 0 H HIS B 68 10.825 15.016 -2.114 1.00 42.24 H new ATOM 0 HA HIS B 68 10.411 17.709 -3.171 1.00 41.35 H new ATOM 0 HB2 HIS B 68 10.321 15.566 -4.527 1.00 1.23 H new ATOM 0 HB3 HIS B 68 8.941 15.050 -3.579 1.00 1.23 H new ATOM 0 HD2 HIS B 68 6.906 15.223 -5.395 1.00 52.52 H new ATOM 0 HE1 HIS B 68 7.678 19.133 -6.822 1.00 64.30 H new ATOM 0 HE2 HIS B 68 6.097 17.154 -6.935 1.00 43.20 H new ATOM 2360 N PHE B 69 8.647 16.788 -0.658 1.00 11.21 N ATOM 2361 CA PHE B 69 7.540 17.155 0.270 1.00 15.35 C ATOM 2362 C PHE B 69 7.703 18.599 0.823 1.00 32.31 C ATOM 2363 O PHE B 69 8.787 18.985 1.257 1.00 32.21 O ATOM 2364 CB PHE B 69 7.423 16.120 1.438 1.00 45.33 C ATOM 2365 CG PHE B 69 8.641 16.014 2.383 1.00 1.11 C ATOM 2366 CD1 PHE B 69 9.750 15.231 2.051 1.00 23.45 C ATOM 2367 CD2 PHE B 69 8.666 16.689 3.613 1.00 11.00 C ATOM 2368 CE1 PHE B 69 10.838 15.131 2.907 1.00 31.20 C ATOM 2369 CE2 PHE B 69 9.757 16.587 4.463 1.00 60.52 C ATOM 2370 CZ PHE B 69 10.840 15.808 4.110 1.00 61.20 C ATOM 0 H PHE B 69 9.317 16.129 -0.262 1.00 11.21 H new ATOM 0 HA PHE B 69 6.614 17.130 -0.304 1.00 15.35 H new ATOM 0 HB2 PHE B 69 6.548 16.376 2.035 1.00 45.33 H new ATOM 0 HB3 PHE B 69 7.238 15.136 1.006 1.00 45.33 H new ATOM 0 HD1 PHE B 69 9.761 14.695 1.113 1.00 23.45 H new ATOM 0 HD2 PHE B 69 7.822 17.298 3.902 1.00 11.00 H new ATOM 0 HE1 PHE B 69 11.686 14.522 2.631 1.00 31.20 H new ATOM 0 HE2 PHE B 69 9.759 17.118 5.403 1.00 60.52 H new ATOM 0 HZ PHE B 69 11.688 15.728 4.774 1.00 61.20 H new ATOM 2380 N ASP B 70 6.620 19.390 0.786 1.00 74.52 N ATOM 2381 CA ASP B 70 6.589 20.750 1.375 1.00 51.23 C ATOM 2382 C ASP B 70 5.347 20.909 2.286 1.00 20.22 C ATOM 2383 O ASP B 70 4.293 20.321 2.020 1.00 45.40 O ATOM 2384 CB ASP B 70 6.595 21.821 0.249 1.00 51.32 C ATOM 2385 CG ASP B 70 6.617 23.261 0.797 1.00 12.41 C ATOM 2386 OD1 ASP B 70 7.696 23.738 1.209 1.00 13.14 O ATOM 2387 OD2 ASP B 70 5.547 23.908 0.865 1.00 34.21 O ATOM 0 H ASP B 70 5.741 19.112 0.350 1.00 74.52 H new ATOM 0 HA ASP B 70 7.480 20.894 1.986 1.00 51.23 H new ATOM 0 HB2 ASP B 70 7.465 21.666 -0.389 1.00 51.32 H new ATOM 0 HB3 ASP B 70 5.713 21.689 -0.377 1.00 51.32 H new ATOM 2392 N PHE B 71 5.490 21.718 3.350 1.00 51.13 N ATOM 2393 CA PHE B 71 4.414 21.983 4.327 1.00 74.33 C ATOM 2394 C PHE B 71 4.684 23.320 5.059 1.00 70.32 C ATOM 2395 O PHE B 71 4.070 24.349 4.746 1.00 10.04 O ATOM 2396 CB PHE B 71 4.293 20.783 5.327 1.00 74.13 C ATOM 2397 CG PHE B 71 3.319 20.989 6.498 1.00 31.44 C ATOM 2398 CD1 PHE B 71 1.955 21.180 6.274 1.00 44.23 C ATOM 2399 CD2 PHE B 71 3.775 20.999 7.825 1.00 22.44 C ATOM 2400 CE1 PHE B 71 1.083 21.377 7.330 1.00 73.05 C ATOM 2401 CE2 PHE B 71 2.898 21.197 8.877 1.00 62.35 C ATOM 2402 CZ PHE B 71 1.553 21.384 8.629 1.00 61.11 C ATOM 0 H PHE B 71 6.359 22.210 3.559 1.00 51.13 H new ATOM 0 HA PHE B 71 3.460 22.077 3.807 1.00 74.33 H new ATOM 0 HB2 PHE B 71 3.981 19.899 4.770 1.00 74.13 H new ATOM 0 HB3 PHE B 71 5.282 20.571 5.734 1.00 74.13 H new ATOM 0 HD1 PHE B 71 1.575 21.174 5.263 1.00 44.23 H new ATOM 0 HD2 PHE B 71 4.825 20.850 8.028 1.00 22.44 H new ATOM 0 HE1 PHE B 71 0.031 21.526 7.138 1.00 73.05 H new ATOM 0 HE2 PHE B 71 3.266 21.205 9.892 1.00 62.35 H new ATOM 0 HZ PHE B 71 0.868 21.536 9.450 1.00 61.11 H new ATOM 2412 N SER B 72 5.658 23.290 5.979 1.00 4.30 N ATOM 2413 CA SER B 72 5.972 24.400 6.917 1.00 34.12 C ATOM 2414 C SER B 72 7.162 23.972 7.815 1.00 14.22 C ATOM 2415 O SER B 72 7.809 22.953 7.544 1.00 25.02 O ATOM 2416 CB SER B 72 4.721 24.747 7.790 1.00 22.41 C ATOM 2417 OG SER B 72 4.955 25.840 8.675 1.00 15.54 O ATOM 0 H SER B 72 6.267 22.481 6.102 1.00 4.30 H new ATOM 0 HA SER B 72 6.243 25.292 6.353 1.00 34.12 H new ATOM 0 HB2 SER B 72 3.882 24.987 7.137 1.00 22.41 H new ATOM 0 HB3 SER B 72 4.433 23.870 8.370 1.00 22.41 H new ATOM 0 HG SER B 72 4.144 26.018 9.196 1.00 15.54 H new ATOM 2423 N PHE B 73 7.470 24.763 8.860 1.00 22.14 N ATOM 2424 CA PHE B 73 8.429 24.356 9.909 1.00 20.52 C ATOM 2425 C PHE B 73 7.872 23.135 10.694 1.00 10.43 C ATOM 2426 O PHE B 73 6.666 23.054 10.956 1.00 73.33 O ATOM 2427 CB PHE B 73 8.726 25.543 10.867 1.00 34.45 C ATOM 2428 CG PHE B 73 9.819 25.243 11.896 1.00 55.31 C ATOM 2429 CD1 PHE B 73 11.161 25.237 11.518 1.00 14.43 C ATOM 2430 CD2 PHE B 73 9.511 24.945 13.228 1.00 53.11 C ATOM 2431 CE1 PHE B 73 12.156 24.947 12.430 1.00 23.23 C ATOM 2432 CE2 PHE B 73 10.510 24.657 14.138 1.00 23.25 C ATOM 2433 CZ PHE B 73 11.831 24.657 13.738 1.00 45.22 C ATOM 0 H PHE B 73 7.069 25.690 9.002 1.00 22.14 H new ATOM 0 HA PHE B 73 9.367 24.064 9.436 1.00 20.52 H new ATOM 0 HB2 PHE B 73 9.023 26.410 10.276 1.00 34.45 H new ATOM 0 HB3 PHE B 73 7.810 25.813 11.391 1.00 34.45 H new ATOM 0 HD1 PHE B 73 11.426 25.463 10.496 1.00 14.43 H new ATOM 0 HD2 PHE B 73 8.480 24.940 13.549 1.00 53.11 H new ATOM 0 HE1 PHE B 73 13.190 24.947 12.118 1.00 23.23 H new ATOM 0 HE2 PHE B 73 10.257 24.432 15.163 1.00 23.25 H new ATOM 0 HZ PHE B 73 12.611 24.430 14.450 1.00 45.22 H new ATOM 2443 N GLY B 74 8.765 22.210 11.079 1.00 32.33 N ATOM 2444 CA GLY B 74 8.372 20.916 11.677 1.00 11.50 C ATOM 2445 C GLY B 74 8.727 19.729 10.771 1.00 70.02 C ATOM 2446 O GLY B 74 8.098 18.670 10.837 1.00 12.12 O ATOM 0 H GLY B 74 9.773 22.332 10.987 1.00 32.33 H new ATOM 0 HA2 GLY B 74 8.868 20.797 12.640 1.00 11.50 H new ATOM 0 HA3 GLY B 74 7.299 20.917 11.869 1.00 11.50 H new ATOM 2450 N LEU B 75 9.761 19.924 9.934 1.00 52.04 N ATOM 2451 CA LEU B 75 10.257 18.921 8.976 1.00 2.14 C ATOM 2452 C LEU B 75 11.092 17.837 9.693 1.00 54.40 C ATOM 2453 O LEU B 75 11.964 18.155 10.514 1.00 25.23 O ATOM 2454 CB LEU B 75 11.123 19.639 7.901 1.00 60.45 C ATOM 2455 CG LEU B 75 10.391 20.760 7.087 1.00 61.44 C ATOM 2456 CD1 LEU B 75 11.393 21.619 6.283 1.00 3.00 C ATOM 2457 CD2 LEU B 75 9.289 20.163 6.171 1.00 42.23 C ATOM 0 H LEU B 75 10.285 20.799 9.904 1.00 52.04 H new ATOM 0 HA LEU B 75 9.407 18.429 8.503 1.00 2.14 H new ATOM 0 HB2 LEU B 75 11.991 20.078 8.392 1.00 60.45 H new ATOM 0 HB3 LEU B 75 11.497 18.891 7.202 1.00 60.45 H new ATOM 0 HG LEU B 75 9.900 21.419 7.803 1.00 61.44 H new ATOM 0 HD11 LEU B 75 10.852 22.387 5.730 1.00 3.00 H new ATOM 0 HD12 LEU B 75 12.097 22.093 6.967 1.00 3.00 H new ATOM 0 HD13 LEU B 75 11.938 20.984 5.584 1.00 3.00 H new ATOM 0 HD21 LEU B 75 8.800 20.966 5.620 1.00 42.23 H new ATOM 0 HD22 LEU B 75 9.740 19.463 5.468 1.00 42.23 H new ATOM 0 HD23 LEU B 75 8.552 19.641 6.781 1.00 42.23 H new ATOM 2469 N GLU B 76 10.806 16.565 9.384 1.00 14.31 N ATOM 2470 CA GLU B 76 11.603 15.421 9.867 1.00 72.33 C ATOM 2471 C GLU B 76 12.965 15.378 9.114 1.00 34.22 C ATOM 2472 O GLU B 76 13.009 15.096 7.907 1.00 13.11 O ATOM 2473 CB GLU B 76 10.806 14.098 9.679 1.00 63.13 C ATOM 2474 CG GLU B 76 11.471 12.840 10.288 1.00 51.44 C ATOM 2475 CD GLU B 76 11.619 12.907 11.823 1.00 23.24 C ATOM 2476 OE1 GLU B 76 10.614 12.692 12.543 1.00 65.44 O ATOM 2477 OE2 GLU B 76 12.733 13.183 12.318 1.00 32.54 O ATOM 0 H GLU B 76 10.018 16.297 8.794 1.00 14.31 H new ATOM 0 HA GLU B 76 11.806 15.538 10.932 1.00 72.33 H new ATOM 0 HB2 GLU B 76 9.819 14.220 10.125 1.00 63.13 H new ATOM 0 HB3 GLU B 76 10.656 13.931 8.612 1.00 63.13 H new ATOM 0 HG2 GLU B 76 10.880 11.963 10.025 1.00 51.44 H new ATOM 0 HG3 GLU B 76 12.456 12.706 9.841 1.00 51.44 H new ATOM 2484 N HIS B 77 14.058 15.702 9.834 1.00 72.40 N ATOM 2485 CA HIS B 77 15.418 15.811 9.257 1.00 10.14 C ATOM 2486 C HIS B 77 16.011 14.399 8.977 1.00 34.24 C ATOM 2487 O HIS B 77 16.698 13.815 9.822 1.00 61.00 O ATOM 2488 CB HIS B 77 16.316 16.647 10.219 1.00 20.12 C ATOM 2489 CG HIS B 77 17.680 17.012 9.685 1.00 71.00 C ATOM 2490 ND1 HIS B 77 17.922 18.163 8.962 1.00 5.41 N ATOM 2491 CD2 HIS B 77 18.884 16.390 9.797 1.00 65.15 C ATOM 2492 CE1 HIS B 77 19.199 18.232 8.657 1.00 45.51 C ATOM 2493 NE2 HIS B 77 19.804 17.173 9.149 1.00 43.14 N ATOM 0 H HIS B 77 14.025 15.896 10.835 1.00 72.40 H new ATOM 0 HA HIS B 77 15.373 16.327 8.298 1.00 10.14 H new ATOM 0 HB2 HIS B 77 15.788 17.566 10.474 1.00 20.12 H new ATOM 0 HB3 HIS B 77 16.446 16.087 11.145 1.00 20.12 H new ATOM 0 HD2 HIS B 77 19.079 15.455 10.301 1.00 65.15 H new ATOM 0 HE1 HIS B 77 19.672 19.025 8.097 1.00 45.51 H new ATOM 0 HE2 HIS B 77 20.799 16.967 9.062 1.00 43.14 H new ATOM 2502 N HIS B 78 15.684 13.850 7.792 1.00 75.22 N ATOM 2503 CA HIS B 78 16.160 12.516 7.342 1.00 10.10 C ATOM 2504 C HIS B 78 17.686 12.544 7.022 1.00 55.03 C ATOM 2505 O HIS B 78 18.131 13.214 6.086 1.00 34.34 O ATOM 2506 CB HIS B 78 15.310 12.016 6.127 1.00 64.23 C ATOM 2507 CG HIS B 78 15.231 12.969 4.955 1.00 72.23 C ATOM 2508 ND1 HIS B 78 16.012 12.836 3.829 1.00 64.12 N ATOM 2509 CD2 HIS B 78 14.451 14.055 4.732 1.00 65.11 C ATOM 2510 CE1 HIS B 78 15.723 13.792 2.974 1.00 14.14 C ATOM 2511 NE2 HIS B 78 14.782 14.543 3.492 1.00 32.32 N ATOM 0 H HIS B 78 15.081 14.315 7.114 1.00 75.22 H new ATOM 0 HA HIS B 78 16.022 11.803 8.155 1.00 10.10 H new ATOM 0 HB2 HIS B 78 15.727 11.071 5.778 1.00 64.23 H new ATOM 0 HB3 HIS B 78 14.298 11.809 6.474 1.00 64.23 H new ATOM 0 HD1 HIS B 78 16.709 12.106 3.681 1.00 64.12 H new ATOM 0 HD2 HIS B 78 13.709 14.460 5.404 1.00 65.11 H new ATOM 0 HE1 HIS B 78 16.183 13.934 2.008 1.00 14.14 H new ATOM 2520 N HIS B 79 18.470 11.809 7.834 1.00 0.11 N ATOM 2521 CA HIS B 79 19.955 11.836 7.815 1.00 44.02 C ATOM 2522 C HIS B 79 20.540 10.720 6.903 1.00 53.50 C ATOM 2523 O HIS B 79 20.192 9.549 7.049 1.00 11.02 O ATOM 2524 CB HIS B 79 20.471 11.684 9.275 1.00 70.04 C ATOM 2525 CG HIS B 79 21.977 11.624 9.438 1.00 3.43 C ATOM 2526 ND1 HIS B 79 22.772 12.746 9.549 1.00 3.22 N ATOM 2527 CD2 HIS B 79 22.825 10.565 9.538 1.00 72.41 C ATOM 2528 CE1 HIS B 79 24.027 12.384 9.707 1.00 31.00 C ATOM 2529 NE2 HIS B 79 24.088 11.070 9.705 1.00 22.54 N ATOM 0 H HIS B 79 18.090 11.170 8.532 1.00 0.11 H new ATOM 0 HA HIS B 79 20.288 12.787 7.399 1.00 44.02 H new ATOM 0 HB2 HIS B 79 20.094 12.521 9.863 1.00 70.04 H new ATOM 0 HB3 HIS B 79 20.042 10.777 9.700 1.00 70.04 H new ATOM 0 HD2 HIS B 79 22.553 9.521 9.494 1.00 72.41 H new ATOM 0 HE1 HIS B 79 24.867 13.054 9.820 1.00 31.00 H new ATOM 0 HE2 HIS B 79 24.938 10.516 9.811 1.00 22.54 H new ATOM 2538 N HIS B 80 21.439 11.114 5.981 1.00 4.41 N ATOM 2539 CA HIS B 80 22.208 10.183 5.111 1.00 72.24 C ATOM 2540 C HIS B 80 23.478 10.881 4.561 1.00 11.54 C ATOM 2541 O HIS B 80 23.568 12.111 4.576 1.00 22.54 O ATOM 2542 CB HIS B 80 21.324 9.647 3.946 1.00 23.45 C ATOM 2543 CG HIS B 80 20.718 10.718 3.071 1.00 72.41 C ATOM 2544 ND1 HIS B 80 19.464 11.246 3.298 1.00 62.10 N ATOM 2545 CD2 HIS B 80 21.193 11.358 1.971 1.00 65.41 C ATOM 2546 CE1 HIS B 80 19.199 12.156 2.385 1.00 72.23 C ATOM 2547 NE2 HIS B 80 20.227 12.244 1.572 1.00 53.41 N ATOM 0 H HIS B 80 21.659 12.096 5.812 1.00 4.41 H new ATOM 0 HA HIS B 80 22.517 9.330 5.715 1.00 72.24 H new ATOM 0 HB2 HIS B 80 21.928 8.987 3.324 1.00 23.45 H new ATOM 0 HB3 HIS B 80 20.520 9.042 4.366 1.00 23.45 H new ATOM 0 HD2 HIS B 80 22.152 11.199 1.500 1.00 65.41 H new ATOM 0 HE1 HIS B 80 18.289 12.734 2.316 1.00 72.23 H new ATOM 0 HE2 HIS B 80 20.295 12.872 0.771 1.00 53.41 H new ATOM 2556 N HIS B 81 24.441 10.080 4.061 1.00 41.30 N ATOM 2557 CA HIS B 81 25.713 10.593 3.494 1.00 11.23 C ATOM 2558 C HIS B 81 25.503 11.156 2.068 1.00 41.23 C ATOM 2559 O HIS B 81 24.997 10.456 1.185 1.00 4.34 O ATOM 2560 CB HIS B 81 26.791 9.474 3.477 1.00 33.20 C ATOM 2561 CG HIS B 81 27.218 9.009 4.844 1.00 60.22 C ATOM 2562 ND1 HIS B 81 26.591 7.987 5.521 1.00 11.13 N ATOM 2563 CD2 HIS B 81 28.221 9.431 5.654 1.00 14.43 C ATOM 2564 CE1 HIS B 81 27.180 7.802 6.681 1.00 20.35 C ATOM 2565 NE2 HIS B 81 28.170 8.661 6.785 1.00 4.31 N ATOM 0 H HIS B 81 24.363 9.063 4.037 1.00 41.30 H new ATOM 0 HA HIS B 81 26.059 11.406 4.132 1.00 11.23 H new ATOM 0 HB2 HIS B 81 26.405 8.621 2.919 1.00 33.20 H new ATOM 0 HB3 HIS B 81 27.667 9.836 2.939 1.00 33.20 H new ATOM 0 HD2 HIS B 81 28.925 10.223 5.446 1.00 14.43 H new ATOM 0 HE1 HIS B 81 26.899 7.069 7.423 1.00 20.35 H new ATOM 0 HE2 HIS B 81 28.801 8.741 7.583 1.00 4.31 H new ATOM 2574 N HIS B 82 25.882 12.438 1.876 1.00 45.11 N ATOM 2575 CA HIS B 82 25.838 13.128 0.561 1.00 12.01 C ATOM 2576 C HIS B 82 26.858 12.530 -0.437 1.00 45.13 C ATOM 2577 O HIS B 82 27.922 12.034 -0.049 1.00 22.22 O ATOM 2578 CB HIS B 82 26.080 14.658 0.738 1.00 24.44 C ATOM 2579 CG HIS B 82 27.431 15.031 1.315 1.00 14.41 C ATOM 2580 ND1 HIS B 82 28.418 15.651 0.580 1.00 62.14 N ATOM 2581 CD2 HIS B 82 27.947 14.882 2.561 1.00 24.22 C ATOM 2582 CE1 HIS B 82 29.468 15.867 1.341 1.00 21.11 C ATOM 2583 NE2 HIS B 82 29.210 15.412 2.544 1.00 43.33 N ATOM 0 H HIS B 82 26.230 13.030 2.631 1.00 45.11 H new ATOM 0 HA HIS B 82 24.843 12.974 0.144 1.00 12.01 H new ATOM 0 HB2 HIS B 82 25.970 15.142 -0.232 1.00 24.44 H new ATOM 0 HB3 HIS B 82 25.301 15.061 1.386 1.00 24.44 H new ATOM 0 HD2 HIS B 82 27.454 14.430 3.409 1.00 24.22 H new ATOM 0 HE1 HIS B 82 30.388 16.339 1.029 1.00 21.11 H new ATOM 0 HE2 HIS B 82 29.848 15.447 3.339 1.00 43.33 H new TER 2592 HIS B 82