USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 972 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 34 TYR OH : rot 84:sc= 1.17 USER MOD Set 1.2: A 53 HIS : no HE2:sc=-0.00782 K(o=1.2,f=-3.1) USER MOD Single : A 1 MET CE :methyl -163:sc= -0.117 (180deg=-0.506) USER MOD Single : A 1 MET N :NH3+ -171:sc= 0 (180deg=-0.11) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -2.6! K(o=-2.6!,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 169:sc= 0.0836 (180deg=0.0564) USER MOD Single : A 12 GLN : amide:sc= -4.3! K(o=-4.3!,f=-1.4) USER MOD Single : A 16 TYR OH : rot 150:sc= -0.9 USER MOD Single : A 17 ASN : amide:sc= -1.7 K(o=-1.7,f=-0.3) USER MOD Single : A 25 MET CE :methyl -157:sc= -1.05 (180deg=-2.5!) USER MOD Single : A 32 CYS SG : rot -136:sc= 0.00993! USER MOD Single : A 33 GLN : amide:sc= 0.255 X(o=0.26,f=0) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -2.05 K(o=-2.1,f=-7.7!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot -147:sc= 0.148 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.294 X(o=-0.29,f=0.024) USER MOD Single : A 79 HIS : no HE2:sc= -0.901 K(o=-0.9,f=-2.6!) USER MOD Single : A 81 THR OG1 : rot -78:sc= 0.317 USER MOD Single : A 83 THR OG1 : rot -170:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0.166 X(o=0.17,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 CYS SG : rot 83:sc= -0.0735 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -2.27! K(o=-2.3!,f=-0.62) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 134:sc= -0.125 (180deg=-0.564) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 GLN : amide:sc= -0.339 X(o=-0.34,f=0) USER MOD Single : A 122 LYS NZ :NH3+ 168:sc= -0.0117 (180deg=-0.146) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.157 0.465 0.536 1.00 0.00 N ATOM 2 CA MET A 1 2.415 0.220 -0.214 1.00 0.00 C ATOM 3 C MET A 1 2.299 -1.049 -1.077 1.00 0.00 C ATOM 4 O MET A 1 2.366 -0.980 -2.310 1.00 0.00 O ATOM 5 CB MET A 1 3.623 0.102 0.753 1.00 0.00 C ATOM 6 CG MET A 1 3.865 1.336 1.633 1.00 0.00 C ATOM 7 SD MET A 1 5.284 1.142 2.742 1.00 0.00 S ATOM 8 CE MET A 1 4.793 -0.267 3.743 1.00 0.00 C ATOM 0 H1 MET A 1 1.200 1.400 0.990 1.00 0.00 H new ATOM 0 H2 MET A 1 0.350 0.435 -0.120 1.00 0.00 H new ATOM 0 H3 MET A 1 1.039 -0.268 1.264 1.00 0.00 H new ATOM 0 HA MET A 1 2.582 1.073 -0.872 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.471 -0.763 1.398 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.522 -0.091 0.167 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.025 2.205 0.995 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.972 1.535 2.225 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.410 -0.308 4.641 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.746 -0.164 4.027 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.925 -1.184 3.170 1.00 0.00 H new ATOM 20 N ASN A 2 2.144 -2.221 -0.423 1.00 0.00 N ATOM 21 CA ASN A 2 2.072 -3.530 -1.117 1.00 0.00 C ATOM 22 C ASN A 2 0.777 -4.264 -0.737 1.00 0.00 C ATOM 23 O ASN A 2 0.758 -5.147 0.128 1.00 0.00 O ATOM 24 CB ASN A 2 3.325 -4.396 -0.825 1.00 0.00 C ATOM 25 CG ASN A 2 4.610 -3.774 -1.363 1.00 0.00 C ATOM 26 OD1 ASN A 2 5.053 -4.073 -2.471 1.00 0.00 O ATOM 27 ND2 ASN A 2 5.187 -2.873 -0.590 1.00 0.00 N ATOM 0 H ASN A 2 2.066 -2.289 0.592 1.00 0.00 H new ATOM 0 HA ASN A 2 2.056 -3.347 -2.191 1.00 0.00 H new ATOM 0 HB2 ASN A 2 3.419 -4.540 0.251 1.00 0.00 H new ATOM 0 HB3 ASN A 2 3.191 -5.383 -1.268 1.00 0.00 H new ATOM 0 HD21 ASN A 2 6.032 -2.396 -0.905 1.00 0.00 H new ATOM 0 HD22 ASN A 2 4.788 -2.653 0.323 1.00 0.00 H new ATOM 34 N SER A 3 -0.313 -3.825 -1.365 1.00 0.00 N ATOM 35 CA SER A 3 -1.649 -4.412 -1.198 1.00 0.00 C ATOM 36 C SER A 3 -1.756 -5.741 -1.962 1.00 0.00 C ATOM 37 O SER A 3 -2.160 -6.760 -1.399 1.00 0.00 O ATOM 38 CB SER A 3 -2.709 -3.412 -1.697 1.00 0.00 C ATOM 39 OG SER A 3 -2.635 -2.191 -0.991 1.00 0.00 O ATOM 0 H SER A 3 -0.296 -3.039 -2.015 1.00 0.00 H new ATOM 0 HA SER A 3 -1.820 -4.620 -0.142 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.566 -3.228 -2.762 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.703 -3.843 -1.579 1.00 0.00 H new ATOM 0 HG SER A 3 -3.318 -1.575 -1.330 1.00 0.00 H new ATOM 45 N GLU A 4 -1.337 -5.709 -3.240 1.00 0.00 N ATOM 46 CA GLU A 4 -1.437 -6.854 -4.179 1.00 0.00 C ATOM 47 C GLU A 4 -0.553 -8.048 -3.782 1.00 0.00 C ATOM 48 O GLU A 4 -0.679 -9.123 -4.368 1.00 0.00 O ATOM 49 CB GLU A 4 -1.079 -6.424 -5.628 1.00 0.00 C ATOM 50 CG GLU A 4 0.402 -6.042 -5.877 1.00 0.00 C ATOM 51 CD GLU A 4 0.827 -4.719 -5.216 1.00 0.00 C ATOM 52 OE1 GLU A 4 0.585 -3.646 -5.802 1.00 0.00 O ATOM 53 OE2 GLU A 4 1.372 -4.742 -4.098 1.00 0.00 O ATOM 0 H GLU A 4 -0.914 -4.881 -3.660 1.00 0.00 H new ATOM 0 HA GLU A 4 -2.477 -7.178 -4.129 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -1.342 -7.239 -6.303 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -1.704 -5.572 -5.898 1.00 0.00 H new ATOM 0 HG2 GLU A 4 1.041 -6.843 -5.505 1.00 0.00 H new ATOM 0 HG3 GLU A 4 0.572 -5.971 -6.951 1.00 0.00 H new ATOM 60 N ILE A 5 0.369 -7.834 -2.839 1.00 0.00 N ATOM 61 CA ILE A 5 1.231 -8.902 -2.307 1.00 0.00 C ATOM 62 C ILE A 5 0.516 -9.609 -1.137 1.00 0.00 C ATOM 63 O ILE A 5 0.647 -10.824 -0.953 1.00 0.00 O ATOM 64 CB ILE A 5 2.616 -8.328 -1.833 1.00 0.00 C ATOM 65 CG1 ILE A 5 3.286 -7.428 -2.932 1.00 0.00 C ATOM 66 CG2 ILE A 5 3.570 -9.461 -1.408 1.00 0.00 C ATOM 67 CD1 ILE A 5 3.603 -8.104 -4.254 1.00 0.00 C ATOM 0 H ILE A 5 0.541 -6.919 -2.422 1.00 0.00 H new ATOM 0 HA ILE A 5 1.423 -9.622 -3.102 1.00 0.00 H new ATOM 0 HB ILE A 5 2.419 -7.698 -0.966 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.628 -6.582 -3.130 1.00 0.00 H new ATOM 0 HG13 ILE A 5 4.212 -7.023 -2.524 1.00 0.00 H new ATOM 0 HG21 ILE A 5 4.520 -9.035 -1.085 1.00 0.00 H new ATOM 0 HG22 ILE A 5 3.126 -10.022 -0.586 1.00 0.00 H new ATOM 0 HG23 ILE A 5 3.740 -10.129 -2.252 1.00 0.00 H new ATOM 0 HD11 ILE A 5 4.062 -7.383 -4.931 1.00 0.00 H new ATOM 0 HD12 ILE A 5 4.292 -8.931 -4.084 1.00 0.00 H new ATOM 0 HD13 ILE A 5 2.683 -8.484 -4.698 1.00 0.00 H new ATOM 79 N GLU A 6 -0.265 -8.831 -0.367 1.00 0.00 N ATOM 80 CA GLU A 6 -1.034 -9.347 0.784 1.00 0.00 C ATOM 81 C GLU A 6 -2.388 -9.936 0.370 1.00 0.00 C ATOM 82 O GLU A 6 -2.943 -10.754 1.111 1.00 0.00 O ATOM 83 CB GLU A 6 -1.216 -8.244 1.853 1.00 0.00 C ATOM 84 CG GLU A 6 0.079 -7.900 2.603 1.00 0.00 C ATOM 85 CD GLU A 6 -0.114 -6.837 3.692 1.00 0.00 C ATOM 86 OE1 GLU A 6 -0.752 -7.148 4.722 1.00 0.00 O ATOM 87 OE2 GLU A 6 0.359 -5.695 3.520 1.00 0.00 O ATOM 0 H GLU A 6 -0.382 -7.830 -0.523 1.00 0.00 H new ATOM 0 HA GLU A 6 -0.456 -10.164 1.215 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -1.599 -7.343 1.373 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -1.969 -8.567 2.572 1.00 0.00 H new ATOM 0 HG2 GLU A 6 0.479 -8.806 3.057 1.00 0.00 H new ATOM 0 HG3 GLU A 6 0.822 -7.547 1.888 1.00 0.00 H new ATOM 94 N LEU A 7 -2.912 -9.526 -0.800 1.00 0.00 N ATOM 95 CA LEU A 7 -4.179 -10.072 -1.330 1.00 0.00 C ATOM 96 C LEU A 7 -4.104 -11.626 -1.522 1.00 0.00 C ATOM 97 O LEU A 7 -4.947 -12.327 -0.962 1.00 0.00 O ATOM 98 CB LEU A 7 -4.606 -9.369 -2.655 1.00 0.00 C ATOM 99 CG LEU A 7 -5.020 -7.866 -2.559 1.00 0.00 C ATOM 100 CD1 LEU A 7 -5.281 -7.264 -3.957 1.00 0.00 C ATOM 101 CD2 LEU A 7 -6.245 -7.680 -1.637 1.00 0.00 C ATOM 0 H LEU A 7 -2.480 -8.820 -1.396 1.00 0.00 H new ATOM 0 HA LEU A 7 -4.946 -9.864 -0.584 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -3.780 -9.448 -3.362 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.443 -9.924 -3.079 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.184 -7.324 -2.116 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -5.567 -6.217 -3.855 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -4.375 -7.336 -4.559 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.085 -7.814 -4.446 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.509 -6.623 -1.591 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.088 -8.247 -2.033 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.005 -8.038 -0.636 1.00 0.00 H new ATOM 113 N PRO A 8 -3.088 -12.202 -2.271 1.00 0.00 N ATOM 114 CA PRO A 8 -2.969 -13.672 -2.443 1.00 0.00 C ATOM 115 C PRO A 8 -2.737 -14.418 -1.115 1.00 0.00 C ATOM 116 O PRO A 8 -3.459 -15.364 -0.806 1.00 0.00 O ATOM 117 CB PRO A 8 -1.766 -13.843 -3.422 1.00 0.00 C ATOM 118 CG PRO A 8 -0.987 -12.582 -3.292 1.00 0.00 C ATOM 119 CD PRO A 8 -2.009 -11.507 -3.026 1.00 0.00 C ATOM 0 HA PRO A 8 -3.892 -14.107 -2.827 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.161 -14.710 -3.158 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.108 -13.993 -4.446 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -0.265 -12.648 -2.478 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -0.424 -12.372 -4.201 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -1.583 -10.688 -2.447 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -2.386 -11.078 -3.955 1.00 0.00 H new ATOM 127 N VAL A 9 -1.761 -13.946 -0.322 1.00 0.00 N ATOM 128 CA VAL A 9 -1.265 -14.680 0.866 1.00 0.00 C ATOM 129 C VAL A 9 -2.329 -14.783 1.983 1.00 0.00 C ATOM 130 O VAL A 9 -2.459 -15.830 2.633 1.00 0.00 O ATOM 131 CB VAL A 9 0.063 -14.048 1.408 1.00 0.00 C ATOM 132 CG1 VAL A 9 1.127 -13.955 0.282 1.00 0.00 C ATOM 133 CG2 VAL A 9 -0.173 -12.669 2.072 1.00 0.00 C ATOM 0 H VAL A 9 -1.294 -13.053 -0.480 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.050 -15.698 0.540 1.00 0.00 H new ATOM 0 HB VAL A 9 0.443 -14.710 2.186 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.041 -13.513 0.680 1.00 0.00 H new ATOM 0 HG12 VAL A 9 1.342 -14.953 -0.098 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.746 -13.333 -0.528 1.00 0.00 H new ATOM 0 HG21 VAL A 9 0.776 -12.271 2.432 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -0.601 -11.982 1.342 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -0.860 -12.782 2.910 1.00 0.00 H new ATOM 143 N GLN A 10 -3.108 -13.703 2.160 1.00 0.00 N ATOM 144 CA GLN A 10 -4.166 -13.625 3.180 1.00 0.00 C ATOM 145 C GLN A 10 -5.360 -14.506 2.768 1.00 0.00 C ATOM 146 O GLN A 10 -5.918 -15.241 3.590 1.00 0.00 O ATOM 147 CB GLN A 10 -4.580 -12.132 3.384 1.00 0.00 C ATOM 148 CG GLN A 10 -5.602 -11.854 4.528 1.00 0.00 C ATOM 149 CD GLN A 10 -7.080 -11.704 4.106 1.00 0.00 C ATOM 150 OE1 GLN A 10 -7.858 -11.049 4.798 1.00 0.00 O ATOM 151 NE2 GLN A 10 -7.477 -12.252 2.965 1.00 0.00 N ATOM 0 H GLN A 10 -3.021 -12.857 1.597 1.00 0.00 H new ATOM 0 HA GLN A 10 -3.797 -14.004 4.133 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -3.679 -11.550 3.579 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -5.002 -11.762 2.450 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -5.534 -12.666 5.252 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -5.299 -10.942 5.043 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -6.819 -12.792 2.403 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -8.440 -12.133 2.650 1.00 0.00 H new ATOM 160 N LYS A 11 -5.734 -14.425 1.475 1.00 0.00 N ATOM 161 CA LYS A 11 -6.893 -15.162 0.914 1.00 0.00 C ATOM 162 C LYS A 11 -6.646 -16.676 0.868 1.00 0.00 C ATOM 163 O LYS A 11 -7.600 -17.456 0.959 1.00 0.00 O ATOM 164 CB LYS A 11 -7.242 -14.632 -0.493 1.00 0.00 C ATOM 165 CG LYS A 11 -7.916 -13.246 -0.505 1.00 0.00 C ATOM 166 CD LYS A 11 -9.288 -13.272 0.189 1.00 0.00 C ATOM 167 CE LYS A 11 -10.003 -11.920 0.191 1.00 0.00 C ATOM 168 NZ LYS A 11 -11.295 -12.008 0.906 1.00 0.00 N ATOM 0 H LYS A 11 -5.245 -13.850 0.789 1.00 0.00 H new ATOM 0 HA LYS A 11 -7.739 -14.989 1.580 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.329 -14.583 -1.086 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.902 -15.347 -0.983 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.270 -12.523 -0.006 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -8.036 -12.909 -1.535 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.922 -14.007 -0.307 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -9.158 -13.606 1.219 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -9.370 -11.170 0.666 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -10.172 -11.592 -0.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -11.674 -11.051 1.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -11.969 -12.561 0.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -11.152 -12.474 1.825 1.00 0.00 H new ATOM 182 N GLN A 12 -5.368 -17.068 0.716 1.00 0.00 N ATOM 183 CA GLN A 12 -4.952 -18.478 0.809 1.00 0.00 C ATOM 184 C GLN A 12 -5.307 -19.047 2.185 1.00 0.00 C ATOM 185 O GLN A 12 -5.863 -20.133 2.284 1.00 0.00 O ATOM 186 CB GLN A 12 -3.430 -18.635 0.611 1.00 0.00 C ATOM 187 CG GLN A 12 -2.935 -18.496 -0.825 1.00 0.00 C ATOM 188 CD GLN A 12 -1.436 -18.696 -0.888 1.00 0.00 C ATOM 189 OE1 GLN A 12 -0.960 -19.801 -1.058 1.00 0.00 O ATOM 190 NE2 GLN A 12 -0.684 -17.628 -0.699 1.00 0.00 N ATOM 0 H GLN A 12 -4.601 -16.422 0.527 1.00 0.00 H new ATOM 0 HA GLN A 12 -5.478 -19.017 0.021 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -2.923 -17.891 1.225 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -3.132 -19.614 0.986 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -3.433 -19.228 -1.461 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -3.193 -17.510 -1.212 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -1.119 -16.716 -0.560 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.332 -17.715 -0.692 1.00 0.00 H new ATOM 199 N LEU A 13 -4.950 -18.287 3.234 1.00 0.00 N ATOM 200 CA LEU A 13 -5.218 -18.666 4.629 1.00 0.00 C ATOM 201 C LEU A 13 -6.719 -18.832 4.848 1.00 0.00 C ATOM 202 O LEU A 13 -7.159 -19.867 5.377 1.00 0.00 O ATOM 203 CB LEU A 13 -4.624 -17.610 5.604 1.00 0.00 C ATOM 204 CG LEU A 13 -4.864 -17.808 7.145 1.00 0.00 C ATOM 205 CD1 LEU A 13 -6.225 -17.263 7.646 1.00 0.00 C ATOM 206 CD2 LEU A 13 -4.630 -19.275 7.574 1.00 0.00 C ATOM 0 H LEU A 13 -4.468 -17.393 3.137 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.734 -19.621 4.835 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -3.548 -17.570 5.437 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -5.027 -16.636 5.326 1.00 0.00 H new ATOM 0 HG LEU A 13 -4.113 -17.193 7.641 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -6.314 -17.438 8.718 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -6.284 -16.193 7.446 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -7.035 -17.774 7.126 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.805 -19.373 8.645 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -5.316 -19.926 7.033 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -3.603 -19.561 7.347 1.00 0.00 H new ATOM 218 N GLU A 14 -7.491 -17.801 4.451 1.00 0.00 N ATOM 219 CA GLU A 14 -8.946 -17.792 4.653 1.00 0.00 C ATOM 220 C GLU A 14 -9.611 -18.993 3.935 1.00 0.00 C ATOM 221 O GLU A 14 -10.674 -19.459 4.339 1.00 0.00 O ATOM 222 CB GLU A 14 -9.576 -16.457 4.180 1.00 0.00 C ATOM 223 CG GLU A 14 -9.055 -15.199 4.902 1.00 0.00 C ATOM 224 CD GLU A 14 -9.913 -13.948 4.622 1.00 0.00 C ATOM 225 OE1 GLU A 14 -10.026 -13.537 3.447 1.00 0.00 O ATOM 226 OE2 GLU A 14 -10.517 -13.398 5.567 1.00 0.00 O ATOM 0 H GLU A 14 -7.128 -16.967 3.990 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.129 -17.886 5.723 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -9.394 -16.346 3.111 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.656 -16.514 4.315 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -9.033 -15.385 5.976 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -8.028 -15.006 4.591 1.00 0.00 H new ATOM 233 N ALA A 15 -8.954 -19.461 2.863 1.00 0.00 N ATOM 234 CA ALA A 15 -9.353 -20.649 2.100 1.00 0.00 C ATOM 235 C ALA A 15 -8.845 -21.960 2.747 1.00 0.00 C ATOM 236 O ALA A 15 -9.516 -22.989 2.668 1.00 0.00 O ATOM 237 CB ALA A 15 -8.828 -20.524 0.664 1.00 0.00 C ATOM 0 H ALA A 15 -8.114 -19.014 2.496 1.00 0.00 H new ATOM 0 HA ALA A 15 -10.442 -20.700 2.098 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -9.121 -21.404 0.092 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -9.248 -19.632 0.199 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -7.741 -20.447 0.679 1.00 0.00 H new ATOM 243 N TYR A 16 -7.665 -21.913 3.408 1.00 0.00 N ATOM 244 CA TYR A 16 -6.954 -23.126 3.896 1.00 0.00 C ATOM 245 C TYR A 16 -7.693 -23.737 5.103 1.00 0.00 C ATOM 246 O TYR A 16 -7.827 -24.963 5.214 1.00 0.00 O ATOM 247 CB TYR A 16 -5.492 -22.751 4.264 1.00 0.00 C ATOM 248 CG TYR A 16 -4.547 -23.931 4.586 1.00 0.00 C ATOM 249 CD1 TYR A 16 -3.876 -24.623 3.570 1.00 0.00 C ATOM 250 CD2 TYR A 16 -4.303 -24.338 5.903 1.00 0.00 C ATOM 251 CE1 TYR A 16 -3.008 -25.661 3.852 1.00 0.00 C ATOM 252 CE2 TYR A 16 -3.427 -25.374 6.187 1.00 0.00 C ATOM 253 CZ TYR A 16 -2.787 -26.030 5.161 1.00 0.00 C ATOM 254 OH TYR A 16 -1.906 -27.049 5.446 1.00 0.00 O ATOM 0 H TYR A 16 -7.179 -21.041 3.619 1.00 0.00 H new ATOM 0 HA TYR A 16 -6.936 -23.878 3.107 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -5.064 -22.185 3.436 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -5.516 -22.085 5.127 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -4.041 -24.339 2.541 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -4.808 -23.835 6.714 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -2.505 -26.181 3.050 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -3.247 -25.666 7.211 1.00 0.00 H new ATOM 0 HH TYR A 16 -1.497 -26.892 6.322 1.00 0.00 H new ATOM 264 N ASN A 17 -8.195 -22.849 5.984 1.00 0.00 N ATOM 265 CA ASN A 17 -8.979 -23.228 7.184 1.00 0.00 C ATOM 266 C ASN A 17 -10.487 -23.355 6.869 1.00 0.00 C ATOM 267 O ASN A 17 -11.292 -23.626 7.764 1.00 0.00 O ATOM 268 CB ASN A 17 -8.722 -22.210 8.345 1.00 0.00 C ATOM 269 CG ASN A 17 -8.840 -20.712 7.984 1.00 0.00 C ATOM 270 OD1 ASN A 17 -8.138 -19.882 8.557 1.00 0.00 O ATOM 271 ND2 ASN A 17 -9.726 -20.335 7.066 1.00 0.00 N ATOM 0 H ASN A 17 -8.069 -21.842 5.885 1.00 0.00 H new ATOM 0 HA ASN A 17 -8.641 -24.212 7.508 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -9.426 -22.424 9.149 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -7.722 -22.388 8.741 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -9.828 -19.348 6.831 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -10.303 -21.033 6.597 1.00 0.00 H new ATOM 278 N ALA A 18 -10.855 -23.134 5.593 1.00 0.00 N ATOM 279 CA ALA A 18 -12.253 -23.222 5.106 1.00 0.00 C ATOM 280 C ALA A 18 -12.390 -24.284 3.991 1.00 0.00 C ATOM 281 O ALA A 18 -13.471 -24.446 3.416 1.00 0.00 O ATOM 282 CB ALA A 18 -12.718 -21.838 4.620 1.00 0.00 C ATOM 0 H ALA A 18 -10.188 -22.887 4.862 1.00 0.00 H new ATOM 0 HA ALA A 18 -12.894 -23.538 5.929 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.746 -21.904 4.262 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -12.666 -21.127 5.444 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -12.073 -21.501 3.809 1.00 0.00 H new ATOM 288 N ARG A 19 -11.270 -24.986 3.696 1.00 0.00 N ATOM 289 CA ARG A 19 -11.202 -26.131 2.748 1.00 0.00 C ATOM 290 C ARG A 19 -11.377 -25.721 1.261 1.00 0.00 C ATOM 291 O ARG A 19 -11.475 -26.593 0.382 1.00 0.00 O ATOM 292 CB ARG A 19 -12.208 -27.256 3.132 1.00 0.00 C ATOM 293 CG ARG A 19 -12.012 -27.845 4.543 1.00 0.00 C ATOM 294 CD ARG A 19 -10.614 -28.450 4.745 1.00 0.00 C ATOM 295 NE ARG A 19 -10.459 -29.026 6.097 1.00 0.00 N ATOM 296 CZ ARG A 19 -10.044 -30.273 6.360 1.00 0.00 C ATOM 297 NH1 ARG A 19 -9.791 -31.129 5.372 1.00 0.00 N ATOM 298 NH2 ARG A 19 -9.908 -30.672 7.615 1.00 0.00 N ATOM 0 H ARG A 19 -10.367 -24.770 4.118 1.00 0.00 H new ATOM 0 HA ARG A 19 -10.189 -26.523 2.841 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -13.221 -26.860 3.057 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -12.126 -28.062 2.403 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -12.175 -27.063 5.284 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -12.765 -28.613 4.719 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -10.441 -29.224 3.997 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -9.858 -27.681 4.588 1.00 0.00 H new ATOM 0 HE ARG A 19 -10.685 -28.428 6.892 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -9.912 -30.838 4.402 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -9.476 -32.075 5.585 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -10.119 -30.031 8.380 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -9.592 -31.621 7.817 1.00 0.00 H new ATOM 312 N ASP A 20 -11.368 -24.412 0.981 1.00 0.00 N ATOM 313 CA ASP A 20 -11.523 -23.888 -0.383 1.00 0.00 C ATOM 314 C ASP A 20 -10.186 -23.947 -1.151 1.00 0.00 C ATOM 315 O ASP A 20 -9.201 -23.324 -0.761 1.00 0.00 O ATOM 316 CB ASP A 20 -12.080 -22.442 -0.358 1.00 0.00 C ATOM 317 CG ASP A 20 -13.543 -22.375 0.120 1.00 0.00 C ATOM 318 OD1 ASP A 20 -14.464 -22.468 -0.725 1.00 0.00 O ATOM 319 OD2 ASP A 20 -13.781 -22.234 1.340 1.00 0.00 O ATOM 0 H ASP A 20 -11.254 -23.688 1.690 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.241 -24.519 -0.907 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.460 -21.830 0.297 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.009 -22.013 -1.357 1.00 0.00 H new ATOM 324 N ILE A 21 -10.168 -24.740 -2.230 1.00 0.00 N ATOM 325 CA ILE A 21 -9.058 -24.792 -3.199 1.00 0.00 C ATOM 326 C ILE A 21 -9.193 -23.644 -4.221 1.00 0.00 C ATOM 327 O ILE A 21 -8.194 -23.177 -4.773 1.00 0.00 O ATOM 328 CB ILE A 21 -9.021 -26.204 -3.917 1.00 0.00 C ATOM 329 CG1 ILE A 21 -8.562 -27.307 -2.914 1.00 0.00 C ATOM 330 CG2 ILE A 21 -8.134 -26.212 -5.195 1.00 0.00 C ATOM 331 CD1 ILE A 21 -7.112 -27.171 -2.474 1.00 0.00 C ATOM 0 H ILE A 21 -10.933 -25.374 -2.461 1.00 0.00 H new ATOM 0 HA ILE A 21 -8.114 -24.663 -2.670 1.00 0.00 H new ATOM 0 HB ILE A 21 -10.037 -26.420 -4.249 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -9.204 -27.274 -2.034 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -8.702 -28.285 -3.375 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.149 -27.206 -5.642 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.521 -25.487 -5.911 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -7.110 -25.949 -4.929 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -6.866 -27.973 -1.778 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -6.460 -27.234 -3.345 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -6.969 -26.208 -1.983 1.00 0.00 H new ATOM 343 N ASP A 22 -10.441 -23.176 -4.423 1.00 0.00 N ATOM 344 CA ASP A 22 -10.785 -22.140 -5.420 1.00 0.00 C ATOM 345 C ASP A 22 -9.946 -20.858 -5.238 1.00 0.00 C ATOM 346 O ASP A 22 -9.343 -20.383 -6.194 1.00 0.00 O ATOM 347 CB ASP A 22 -12.298 -21.815 -5.330 1.00 0.00 C ATOM 348 CG ASP A 22 -12.778 -20.758 -6.353 1.00 0.00 C ATOM 349 OD1 ASP A 22 -12.981 -21.113 -7.533 1.00 0.00 O ATOM 350 OD2 ASP A 22 -12.944 -19.575 -5.983 1.00 0.00 O ATOM 0 H ASP A 22 -11.247 -23.509 -3.894 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.553 -22.535 -6.409 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -12.866 -22.734 -5.479 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -12.524 -21.461 -4.324 1.00 0.00 H new ATOM 355 N ALA A 23 -9.868 -20.353 -3.999 1.00 0.00 N ATOM 356 CA ALA A 23 -9.033 -19.172 -3.659 1.00 0.00 C ATOM 357 C ALA A 23 -7.562 -19.576 -3.509 1.00 0.00 C ATOM 358 O ALA A 23 -6.654 -18.831 -3.904 1.00 0.00 O ATOM 359 CB ALA A 23 -9.533 -18.507 -2.369 1.00 0.00 C ATOM 0 H ALA A 23 -10.374 -20.742 -3.203 1.00 0.00 H new ATOM 0 HA ALA A 23 -9.116 -18.453 -4.474 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -8.908 -17.645 -2.138 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -10.565 -18.182 -2.504 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -9.482 -19.222 -1.548 1.00 0.00 H new ATOM 365 N PHE A 24 -7.347 -20.794 -2.977 1.00 0.00 N ATOM 366 CA PHE A 24 -6.004 -21.334 -2.694 1.00 0.00 C ATOM 367 C PHE A 24 -5.241 -21.658 -4.008 1.00 0.00 C ATOM 368 O PHE A 24 -4.069 -22.037 -3.974 1.00 0.00 O ATOM 369 CB PHE A 24 -6.118 -22.585 -1.774 1.00 0.00 C ATOM 370 CG PHE A 24 -4.842 -22.888 -0.987 1.00 0.00 C ATOM 371 CD1 PHE A 24 -4.530 -22.146 0.148 1.00 0.00 C ATOM 372 CD2 PHE A 24 -3.941 -23.869 -1.391 1.00 0.00 C ATOM 373 CE1 PHE A 24 -3.369 -22.375 0.858 1.00 0.00 C ATOM 374 CE2 PHE A 24 -2.776 -24.090 -0.679 1.00 0.00 C ATOM 375 CZ PHE A 24 -2.490 -23.344 0.442 1.00 0.00 C ATOM 0 H PHE A 24 -8.103 -21.433 -2.731 1.00 0.00 H new ATOM 0 HA PHE A 24 -5.425 -20.575 -2.169 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -6.940 -22.436 -1.073 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -6.372 -23.452 -2.384 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.210 -21.375 0.480 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.153 -24.463 -2.268 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -3.152 -21.792 1.741 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.085 -24.854 -1.005 1.00 0.00 H new ATOM 0 HZ PHE A 24 -1.578 -23.520 0.992 1.00 0.00 H new ATOM 385 N MET A 25 -5.940 -21.575 -5.159 1.00 0.00 N ATOM 386 CA MET A 25 -5.326 -21.709 -6.496 1.00 0.00 C ATOM 387 C MET A 25 -5.521 -20.443 -7.364 1.00 0.00 C ATOM 388 O MET A 25 -4.661 -20.138 -8.206 1.00 0.00 O ATOM 389 CB MET A 25 -5.861 -22.987 -7.201 1.00 0.00 C ATOM 390 CG MET A 25 -5.330 -23.219 -8.630 1.00 0.00 C ATOM 391 SD MET A 25 -3.571 -22.829 -8.833 1.00 0.00 S ATOM 392 CE MET A 25 -2.762 -23.815 -7.575 1.00 0.00 C ATOM 0 H MET A 25 -6.947 -21.413 -5.187 1.00 0.00 H new ATOM 0 HA MET A 25 -4.249 -21.814 -6.363 1.00 0.00 H new ATOM 0 HB2 MET A 25 -5.606 -23.853 -6.591 1.00 0.00 H new ATOM 0 HB3 MET A 25 -6.949 -22.933 -7.239 1.00 0.00 H new ATOM 0 HG2 MET A 25 -5.495 -24.261 -8.903 1.00 0.00 H new ATOM 0 HG3 MET A 25 -5.909 -22.612 -9.325 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.795 -23.374 -7.332 1.00 0.00 H new ATOM 0 HE2 MET A 25 -3.383 -23.843 -6.680 1.00 0.00 H new ATOM 0 HE3 MET A 25 -2.615 -24.829 -7.946 1.00 0.00 H new ATOM 402 N ALA A 26 -6.619 -19.690 -7.132 1.00 0.00 N ATOM 403 CA ALA A 26 -6.964 -18.485 -7.940 1.00 0.00 C ATOM 404 C ALA A 26 -5.820 -17.460 -7.966 1.00 0.00 C ATOM 405 O ALA A 26 -5.400 -16.999 -9.031 1.00 0.00 O ATOM 406 CB ALA A 26 -8.237 -17.807 -7.407 1.00 0.00 C ATOM 0 H ALA A 26 -7.288 -19.892 -6.389 1.00 0.00 H new ATOM 0 HA ALA A 26 -7.137 -18.835 -8.958 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -8.465 -16.931 -8.015 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -9.070 -18.508 -7.455 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -8.080 -17.500 -6.373 1.00 0.00 H new ATOM 412 N TRP A 27 -5.280 -17.181 -6.781 1.00 0.00 N ATOM 413 CA TRP A 27 -4.317 -16.093 -6.556 1.00 0.00 C ATOM 414 C TRP A 27 -2.873 -16.439 -6.984 1.00 0.00 C ATOM 415 O TRP A 27 -1.964 -15.616 -6.815 1.00 0.00 O ATOM 416 CB TRP A 27 -4.357 -15.716 -5.065 1.00 0.00 C ATOM 417 CG TRP A 27 -5.637 -15.035 -4.631 1.00 0.00 C ATOM 418 CD1 TRP A 27 -6.704 -15.599 -3.990 1.00 0.00 C ATOM 419 CD2 TRP A 27 -5.966 -13.647 -4.812 1.00 0.00 C ATOM 420 NE1 TRP A 27 -7.660 -14.653 -3.750 1.00 0.00 N ATOM 421 CE2 TRP A 27 -7.235 -13.445 -4.245 1.00 0.00 C ATOM 422 CE3 TRP A 27 -5.301 -12.558 -5.391 1.00 0.00 C ATOM 423 CZ2 TRP A 27 -7.859 -12.198 -4.246 1.00 0.00 C ATOM 424 CZ3 TRP A 27 -5.919 -11.323 -5.392 1.00 0.00 C ATOM 425 CH2 TRP A 27 -7.190 -11.151 -4.820 1.00 0.00 C ATOM 0 H TRP A 27 -5.499 -17.709 -5.936 1.00 0.00 H new ATOM 0 HA TRP A 27 -4.613 -15.254 -7.185 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -4.219 -16.619 -4.470 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -3.516 -15.058 -4.846 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -6.780 -16.640 -3.714 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -8.549 -14.818 -3.278 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -4.322 -12.682 -5.829 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -8.837 -12.063 -3.809 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -5.418 -10.477 -5.839 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -7.649 -10.173 -4.833 1.00 0.00 H new ATOM 436 N TRP A 28 -2.668 -17.642 -7.528 1.00 0.00 N ATOM 437 CA TRP A 28 -1.347 -18.113 -7.979 1.00 0.00 C ATOM 438 C TRP A 28 -1.177 -17.844 -9.481 1.00 0.00 C ATOM 439 O TRP A 28 -2.144 -17.501 -10.176 1.00 0.00 O ATOM 440 CB TRP A 28 -1.201 -19.631 -7.690 1.00 0.00 C ATOM 441 CG TRP A 28 -1.274 -20.016 -6.227 1.00 0.00 C ATOM 442 CD1 TRP A 28 -2.291 -19.765 -5.342 1.00 0.00 C ATOM 443 CD2 TRP A 28 -0.297 -20.763 -5.494 1.00 0.00 C ATOM 444 NE1 TRP A 28 -1.992 -20.302 -4.119 1.00 0.00 N ATOM 445 CE2 TRP A 28 -0.780 -20.927 -4.193 1.00 0.00 C ATOM 446 CE3 TRP A 28 0.937 -21.305 -5.825 1.00 0.00 C ATOM 447 CZ2 TRP A 28 -0.066 -21.612 -3.214 1.00 0.00 C ATOM 448 CZ3 TRP A 28 1.642 -21.987 -4.856 1.00 0.00 C ATOM 449 CH2 TRP A 28 1.134 -22.141 -3.565 1.00 0.00 C ATOM 0 H TRP A 28 -3.414 -18.323 -7.670 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.573 -17.572 -7.435 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.983 -20.165 -8.230 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -0.247 -19.972 -8.092 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -3.195 -19.223 -5.576 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -2.579 -20.245 -3.287 1.00 0.00 H new ATOM 0 HE3 TRP A 28 1.337 -21.195 -6.822 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -0.453 -21.719 -2.211 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.605 -22.410 -5.100 1.00 0.00 H new ATOM 0 HH2 TRP A 28 1.706 -22.691 -2.832 1.00 0.00 H new ATOM 460 N ALA A 29 0.062 -18.000 -9.967 1.00 0.00 N ATOM 461 CA ALA A 29 0.383 -17.964 -11.404 1.00 0.00 C ATOM 462 C ALA A 29 0.211 -19.366 -11.998 1.00 0.00 C ATOM 463 O ALA A 29 0.444 -20.358 -11.304 1.00 0.00 O ATOM 464 CB ALA A 29 1.818 -17.454 -11.621 1.00 0.00 C ATOM 0 H ALA A 29 0.876 -18.156 -9.372 1.00 0.00 H new ATOM 0 HA ALA A 29 -0.297 -17.278 -11.909 1.00 0.00 H new ATOM 0 HB1 ALA A 29 2.039 -17.433 -12.688 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.913 -16.448 -11.211 1.00 0.00 H new ATOM 0 HB3 ALA A 29 2.520 -18.118 -11.117 1.00 0.00 H new ATOM 470 N ASP A 30 -0.183 -19.437 -13.282 1.00 0.00 N ATOM 471 CA ASP A 30 -0.400 -20.726 -14.003 1.00 0.00 C ATOM 472 C ASP A 30 0.907 -21.557 -14.099 1.00 0.00 C ATOM 473 O ASP A 30 0.879 -22.791 -14.191 1.00 0.00 O ATOM 474 CB ASP A 30 -0.970 -20.434 -15.416 1.00 0.00 C ATOM 475 CG ASP A 30 -1.309 -21.704 -16.234 1.00 0.00 C ATOM 476 OD1 ASP A 30 -2.407 -22.269 -16.042 1.00 0.00 O ATOM 477 OD2 ASP A 30 -0.492 -22.128 -17.081 1.00 0.00 O ATOM 0 H ASP A 30 -0.362 -18.613 -13.856 1.00 0.00 H new ATOM 0 HA ASP A 30 -1.116 -21.322 -13.437 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -1.871 -19.828 -15.315 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -0.246 -19.839 -15.972 1.00 0.00 H new ATOM 482 N ASP A 31 2.041 -20.848 -14.051 1.00 0.00 N ATOM 483 CA ASP A 31 3.396 -21.414 -14.164 1.00 0.00 C ATOM 484 C ASP A 31 4.145 -21.360 -12.810 1.00 0.00 C ATOM 485 O ASP A 31 5.373 -21.485 -12.785 1.00 0.00 O ATOM 486 CB ASP A 31 4.174 -20.623 -15.254 1.00 0.00 C ATOM 487 CG ASP A 31 4.322 -19.119 -14.929 1.00 0.00 C ATOM 488 OD1 ASP A 31 3.301 -18.394 -14.959 1.00 0.00 O ATOM 489 OD2 ASP A 31 5.452 -18.650 -14.649 1.00 0.00 O ATOM 0 H ASP A 31 2.044 -19.835 -13.929 1.00 0.00 H new ATOM 0 HA ASP A 31 3.324 -22.464 -14.447 1.00 0.00 H new ATOM 0 HB2 ASP A 31 5.165 -21.061 -15.373 1.00 0.00 H new ATOM 0 HB3 ASP A 31 3.660 -20.732 -16.209 1.00 0.00 H new ATOM 494 N CYS A 32 3.399 -21.207 -11.692 1.00 0.00 N ATOM 495 CA CYS A 32 3.990 -20.999 -10.346 1.00 0.00 C ATOM 496 C CYS A 32 4.884 -22.177 -9.899 1.00 0.00 C ATOM 497 O CYS A 32 4.506 -23.344 -10.034 1.00 0.00 O ATOM 498 CB CYS A 32 2.903 -20.757 -9.286 1.00 0.00 C ATOM 499 SG CYS A 32 3.559 -20.474 -7.621 1.00 0.00 S ATOM 0 H CYS A 32 2.379 -21.224 -11.694 1.00 0.00 H new ATOM 0 HA CYS A 32 4.617 -20.111 -10.432 1.00 0.00 H new ATOM 0 HB2 CYS A 32 2.305 -19.896 -9.582 1.00 0.00 H new ATOM 0 HB3 CYS A 32 2.234 -21.617 -9.262 1.00 0.00 H new ATOM 0 HG CYS A 32 2.854 -21.143 -6.757 1.00 0.00 H new ATOM 505 N GLN A 33 6.072 -21.845 -9.370 1.00 0.00 N ATOM 506 CA GLN A 33 7.070 -22.832 -8.927 1.00 0.00 C ATOM 507 C GLN A 33 6.925 -23.084 -7.416 1.00 0.00 C ATOM 508 O GLN A 33 7.311 -22.239 -6.601 1.00 0.00 O ATOM 509 CB GLN A 33 8.490 -22.314 -9.244 1.00 0.00 C ATOM 510 CG GLN A 33 8.752 -21.972 -10.718 1.00 0.00 C ATOM 511 CD GLN A 33 8.705 -23.172 -11.660 1.00 0.00 C ATOM 512 OE1 GLN A 33 9.686 -23.890 -11.824 1.00 0.00 O ATOM 513 NE2 GLN A 33 7.580 -23.365 -12.322 1.00 0.00 N ATOM 0 H GLN A 33 6.369 -20.878 -9.237 1.00 0.00 H new ATOM 0 HA GLN A 33 6.906 -23.770 -9.457 1.00 0.00 H new ATOM 0 HB2 GLN A 33 8.676 -21.424 -8.643 1.00 0.00 H new ATOM 0 HB3 GLN A 33 9.212 -23.068 -8.929 1.00 0.00 H new ATOM 0 HG2 GLN A 33 8.015 -21.239 -11.045 1.00 0.00 H new ATOM 0 HG3 GLN A 33 9.730 -21.498 -10.800 1.00 0.00 H new ATOM 0 HE21 GLN A 33 6.782 -22.750 -12.162 1.00 0.00 H new ATOM 0 HE22 GLN A 33 7.508 -24.130 -12.993 1.00 0.00 H new ATOM 522 N TYR A 34 6.361 -24.245 -7.060 1.00 0.00 N ATOM 523 CA TYR A 34 6.119 -24.638 -5.666 1.00 0.00 C ATOM 524 C TYR A 34 7.284 -25.495 -5.145 1.00 0.00 C ATOM 525 O TYR A 34 7.484 -26.627 -5.599 1.00 0.00 O ATOM 526 CB TYR A 34 4.782 -25.411 -5.577 1.00 0.00 C ATOM 527 CG TYR A 34 4.275 -25.692 -4.155 1.00 0.00 C ATOM 528 CD1 TYR A 34 3.868 -24.641 -3.329 1.00 0.00 C ATOM 529 CD2 TYR A 34 4.175 -26.995 -3.655 1.00 0.00 C ATOM 530 CE1 TYR A 34 3.387 -24.878 -2.059 1.00 0.00 C ATOM 531 CE2 TYR A 34 3.684 -27.232 -2.388 1.00 0.00 C ATOM 532 CZ TYR A 34 3.293 -26.173 -1.595 1.00 0.00 C ATOM 533 OH TYR A 34 2.775 -26.411 -0.340 1.00 0.00 O ATOM 0 H TYR A 34 6.057 -24.944 -7.738 1.00 0.00 H new ATOM 0 HA TYR A 34 6.053 -23.747 -5.042 1.00 0.00 H new ATOM 0 HB2 TYR A 34 4.019 -24.845 -6.111 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.897 -26.362 -6.098 1.00 0.00 H new ATOM 0 HD1 TYR A 34 3.931 -23.626 -3.692 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.487 -27.827 -4.270 1.00 0.00 H new ATOM 0 HE1 TYR A 34 3.085 -24.053 -1.430 1.00 0.00 H new ATOM 0 HE2 TYR A 34 3.606 -28.244 -2.018 1.00 0.00 H new ATOM 0 HH TYR A 34 1.797 -26.442 -0.390 1.00 0.00 H new ATOM 543 N TYR A 35 8.050 -24.928 -4.204 1.00 0.00 N ATOM 544 CA TYR A 35 9.141 -25.616 -3.499 1.00 0.00 C ATOM 545 C TYR A 35 8.704 -25.966 -2.065 1.00 0.00 C ATOM 546 O TYR A 35 8.024 -25.181 -1.398 1.00 0.00 O ATOM 547 CB TYR A 35 10.426 -24.742 -3.474 1.00 0.00 C ATOM 548 CG TYR A 35 11.061 -24.523 -4.859 1.00 0.00 C ATOM 549 CD1 TYR A 35 10.546 -23.585 -5.753 1.00 0.00 C ATOM 550 CD2 TYR A 35 12.171 -25.263 -5.271 1.00 0.00 C ATOM 551 CE1 TYR A 35 11.108 -23.397 -6.998 1.00 0.00 C ATOM 552 CE2 TYR A 35 12.733 -25.080 -6.517 1.00 0.00 C ATOM 553 CZ TYR A 35 12.199 -24.145 -7.378 1.00 0.00 C ATOM 554 OH TYR A 35 12.746 -23.967 -8.631 1.00 0.00 O ATOM 0 H TYR A 35 7.927 -23.960 -3.905 1.00 0.00 H new ATOM 0 HA TYR A 35 9.370 -26.537 -4.036 1.00 0.00 H new ATOM 0 HB2 TYR A 35 10.185 -23.772 -3.039 1.00 0.00 H new ATOM 0 HB3 TYR A 35 11.160 -25.212 -2.819 1.00 0.00 H new ATOM 0 HD1 TYR A 35 9.690 -22.994 -5.464 1.00 0.00 H new ATOM 0 HD2 TYR A 35 12.598 -25.994 -4.600 1.00 0.00 H new ATOM 0 HE1 TYR A 35 10.693 -22.664 -7.674 1.00 0.00 H new ATOM 0 HE2 TYR A 35 13.588 -25.667 -6.817 1.00 0.00 H new ATOM 0 HH TYR A 35 13.510 -24.570 -8.743 1.00 0.00 H new ATOM 564 N ALA A 36 9.094 -27.166 -1.618 1.00 0.00 N ATOM 565 CA ALA A 36 8.863 -27.655 -0.249 1.00 0.00 C ATOM 566 C ALA A 36 10.169 -27.669 0.536 1.00 0.00 C ATOM 567 O ALA A 36 11.236 -27.663 -0.066 1.00 0.00 O ATOM 568 CB ALA A 36 8.254 -29.064 -0.282 1.00 0.00 C ATOM 0 H ALA A 36 9.588 -27.838 -2.206 1.00 0.00 H new ATOM 0 HA ALA A 36 8.163 -26.981 0.246 1.00 0.00 H new ATOM 0 HB1 ALA A 36 8.089 -29.413 0.737 1.00 0.00 H new ATOM 0 HB2 ALA A 36 7.304 -29.037 -0.815 1.00 0.00 H new ATOM 0 HB3 ALA A 36 8.937 -29.744 -0.792 1.00 0.00 H new ATOM 574 N PHE A 37 10.055 -27.717 1.875 1.00 0.00 N ATOM 575 CA PHE A 37 11.209 -27.744 2.801 1.00 0.00 C ATOM 576 C PHE A 37 12.254 -28.842 2.406 1.00 0.00 C ATOM 577 O PHE A 37 11.868 -29.999 2.201 1.00 0.00 O ATOM 578 CB PHE A 37 10.705 -27.975 4.256 1.00 0.00 C ATOM 579 CG PHE A 37 11.821 -28.033 5.305 1.00 0.00 C ATOM 580 CD1 PHE A 37 12.569 -26.898 5.608 1.00 0.00 C ATOM 581 CD2 PHE A 37 12.137 -29.218 5.970 1.00 0.00 C ATOM 582 CE1 PHE A 37 13.591 -26.941 6.535 1.00 0.00 C ATOM 583 CE2 PHE A 37 13.161 -29.263 6.895 1.00 0.00 C ATOM 584 CZ PHE A 37 13.886 -28.123 7.177 1.00 0.00 C ATOM 0 H PHE A 37 9.154 -27.738 2.352 1.00 0.00 H new ATOM 0 HA PHE A 37 11.715 -26.781 2.735 1.00 0.00 H new ATOM 0 HB2 PHE A 37 10.014 -27.175 4.521 1.00 0.00 H new ATOM 0 HB3 PHE A 37 10.141 -28.907 4.290 1.00 0.00 H new ATOM 0 HD1 PHE A 37 12.345 -25.967 5.108 1.00 0.00 H new ATOM 0 HD2 PHE A 37 11.572 -30.114 5.758 1.00 0.00 H new ATOM 0 HE1 PHE A 37 14.158 -26.049 6.756 1.00 0.00 H new ATOM 0 HE2 PHE A 37 13.395 -30.190 7.398 1.00 0.00 H new ATOM 0 HZ PHE A 37 14.686 -28.158 7.902 1.00 0.00 H new ATOM 594 N PRO A 38 13.588 -28.499 2.253 1.00 0.00 N ATOM 595 CA PRO A 38 14.126 -27.106 2.313 1.00 0.00 C ATOM 596 C PRO A 38 13.802 -26.259 1.045 1.00 0.00 C ATOM 597 O PRO A 38 13.279 -25.144 1.163 1.00 0.00 O ATOM 598 CB PRO A 38 15.652 -27.324 2.500 1.00 0.00 C ATOM 599 CG PRO A 38 15.929 -28.649 1.857 1.00 0.00 C ATOM 600 CD PRO A 38 14.687 -29.491 2.083 1.00 0.00 C ATOM 0 HA PRO A 38 13.671 -26.526 3.116 1.00 0.00 H new ATOM 0 HB2 PRO A 38 16.227 -26.527 2.028 1.00 0.00 H new ATOM 0 HB3 PRO A 38 15.925 -27.331 3.555 1.00 0.00 H new ATOM 0 HG2 PRO A 38 16.132 -28.531 0.793 1.00 0.00 H new ATOM 0 HG3 PRO A 38 16.806 -29.121 2.299 1.00 0.00 H new ATOM 0 HD2 PRO A 38 14.497 -30.153 1.238 1.00 0.00 H new ATOM 0 HD3 PRO A 38 14.791 -30.123 2.965 1.00 0.00 H new ATOM 608 N ALA A 39 14.090 -26.811 -0.154 1.00 0.00 N ATOM 609 CA ALA A 39 13.755 -26.176 -1.446 1.00 0.00 C ATOM 610 C ALA A 39 13.715 -27.261 -2.539 1.00 0.00 C ATOM 611 O ALA A 39 14.677 -27.451 -3.290 1.00 0.00 O ATOM 612 CB ALA A 39 14.742 -25.038 -1.794 1.00 0.00 C ATOM 0 H ALA A 39 14.562 -27.710 -0.252 1.00 0.00 H new ATOM 0 HA ALA A 39 12.772 -25.710 -1.375 1.00 0.00 H new ATOM 0 HB1 ALA A 39 14.464 -24.595 -2.750 1.00 0.00 H new ATOM 0 HB2 ALA A 39 14.706 -24.275 -1.017 1.00 0.00 H new ATOM 0 HB3 ALA A 39 15.753 -25.441 -1.861 1.00 0.00 H new ATOM 618 N THR A 40 12.598 -28.006 -2.576 1.00 0.00 N ATOM 619 CA THR A 40 12.381 -29.119 -3.514 1.00 0.00 C ATOM 620 C THR A 40 11.188 -28.792 -4.418 1.00 0.00 C ATOM 621 O THR A 40 10.058 -28.702 -3.922 1.00 0.00 O ATOM 622 CB THR A 40 12.086 -30.452 -2.742 1.00 0.00 C ATOM 623 OG1 THR A 40 13.101 -30.676 -1.750 1.00 0.00 O ATOM 624 CG2 THR A 40 12.018 -31.669 -3.688 1.00 0.00 C ATOM 0 H THR A 40 11.810 -27.850 -1.947 1.00 0.00 H new ATOM 0 HA THR A 40 13.285 -29.251 -4.109 1.00 0.00 H new ATOM 0 HB THR A 40 11.111 -30.343 -2.266 1.00 0.00 H new ATOM 0 HG1 THR A 40 12.911 -31.509 -1.270 1.00 0.00 H new ATOM 0 HG21 THR A 40 11.812 -32.569 -3.109 1.00 0.00 H new ATOM 0 HG22 THR A 40 11.224 -31.518 -4.419 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.971 -31.781 -4.206 1.00 0.00 H new ATOM 632 N LEU A 41 11.431 -28.612 -5.730 1.00 0.00 N ATOM 633 CA LEU A 41 10.361 -28.279 -6.685 1.00 0.00 C ATOM 634 C LEU A 41 9.390 -29.469 -6.813 1.00 0.00 C ATOM 635 O LEU A 41 9.699 -30.472 -7.464 1.00 0.00 O ATOM 636 CB LEU A 41 10.955 -27.891 -8.072 1.00 0.00 C ATOM 637 CG LEU A 41 9.934 -27.355 -9.126 1.00 0.00 C ATOM 638 CD1 LEU A 41 9.221 -26.079 -8.633 1.00 0.00 C ATOM 639 CD2 LEU A 41 10.613 -27.120 -10.495 1.00 0.00 C ATOM 0 H LEU A 41 12.357 -28.692 -6.151 1.00 0.00 H new ATOM 0 HA LEU A 41 9.810 -27.416 -6.311 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.721 -27.131 -7.918 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.453 -28.766 -8.490 1.00 0.00 H new ATOM 0 HG LEU A 41 9.172 -28.123 -9.257 1.00 0.00 H new ATOM 0 HD11 LEU A 41 8.519 -25.737 -9.394 1.00 0.00 H new ATOM 0 HD12 LEU A 41 8.680 -26.297 -7.712 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.959 -25.300 -8.444 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.877 -26.747 -11.207 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.413 -26.388 -10.383 1.00 0.00 H new ATOM 0 HD23 LEU A 41 11.029 -28.059 -10.861 1.00 0.00 H new ATOM 651 N LEU A 42 8.235 -29.358 -6.134 1.00 0.00 N ATOM 652 CA LEU A 42 7.157 -30.351 -6.211 1.00 0.00 C ATOM 653 C LEU A 42 6.343 -30.140 -7.492 1.00 0.00 C ATOM 654 O LEU A 42 5.910 -31.102 -8.137 1.00 0.00 O ATOM 655 CB LEU A 42 6.218 -30.241 -4.980 1.00 0.00 C ATOM 656 CG LEU A 42 6.860 -30.494 -3.581 1.00 0.00 C ATOM 657 CD1 LEU A 42 5.784 -30.486 -2.472 1.00 0.00 C ATOM 658 CD2 LEU A 42 7.684 -31.803 -3.557 1.00 0.00 C ATOM 0 H LEU A 42 8.025 -28.574 -5.516 1.00 0.00 H new ATOM 0 HA LEU A 42 7.607 -31.344 -6.222 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.778 -29.244 -4.976 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.400 -30.950 -5.112 1.00 0.00 H new ATOM 0 HG LEU A 42 7.553 -29.676 -3.384 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.256 -30.665 -1.506 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.283 -29.518 -2.458 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.053 -31.270 -2.669 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.115 -31.944 -2.566 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.035 -32.646 -3.793 1.00 0.00 H new ATOM 0 HD23 LEU A 42 8.484 -31.743 -4.295 1.00 0.00 H new ATOM 670 N ALA A 43 6.176 -28.865 -7.859 1.00 0.00 N ATOM 671 CA ALA A 43 5.266 -28.460 -8.923 1.00 0.00 C ATOM 672 C ALA A 43 5.864 -27.308 -9.734 1.00 0.00 C ATOM 673 O ALA A 43 6.060 -26.217 -9.200 1.00 0.00 O ATOM 674 CB ALA A 43 3.943 -28.049 -8.276 1.00 0.00 C ATOM 0 H ALA A 43 6.671 -28.087 -7.423 1.00 0.00 H new ATOM 0 HA ALA A 43 5.100 -29.286 -9.615 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.240 -27.740 -9.050 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.529 -28.894 -7.726 1.00 0.00 H new ATOM 0 HB3 ALA A 43 4.116 -27.219 -7.590 1.00 0.00 H new ATOM 680 N GLY A 44 6.129 -27.556 -11.028 1.00 0.00 N ATOM 681 CA GLY A 44 6.689 -26.538 -11.929 1.00 0.00 C ATOM 682 C GLY A 44 5.609 -25.732 -12.657 1.00 0.00 C ATOM 683 O GLY A 44 5.837 -25.252 -13.770 1.00 0.00 O ATOM 0 H GLY A 44 5.963 -28.458 -11.474 1.00 0.00 H new ATOM 0 HA2 GLY A 44 7.319 -25.858 -11.355 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.331 -27.023 -12.664 1.00 0.00 H new ATOM 687 N ASN A 45 4.474 -25.522 -11.965 1.00 0.00 N ATOM 688 CA ASN A 45 3.200 -25.015 -12.541 1.00 0.00 C ATOM 689 C ASN A 45 2.054 -25.212 -11.529 1.00 0.00 C ATOM 690 O ASN A 45 2.123 -26.101 -10.675 1.00 0.00 O ATOM 691 CB ASN A 45 2.807 -25.707 -13.882 1.00 0.00 C ATOM 692 CG ASN A 45 2.596 -27.211 -13.743 1.00 0.00 C ATOM 693 OD1 ASN A 45 1.498 -27.665 -13.446 1.00 0.00 O ATOM 694 ND2 ASN A 45 3.641 -27.991 -13.961 1.00 0.00 N ATOM 0 H ASN A 45 4.409 -25.703 -10.963 1.00 0.00 H new ATOM 0 HA ASN A 45 3.361 -23.958 -12.754 1.00 0.00 H new ATOM 0 HB2 ASN A 45 1.893 -25.252 -14.264 1.00 0.00 H new ATOM 0 HB3 ASN A 45 3.587 -25.523 -14.621 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.547 -29.004 -13.884 1.00 0.00 H new ATOM 0 HD22 ASN A 45 4.542 -27.580 -14.207 1.00 0.00 H new ATOM 701 N ALA A 46 0.978 -24.424 -11.699 1.00 0.00 N ATOM 702 CA ALA A 46 -0.186 -24.395 -10.785 1.00 0.00 C ATOM 703 C ALA A 46 -1.050 -25.672 -10.862 1.00 0.00 C ATOM 704 O ALA A 46 -1.748 -25.999 -9.894 1.00 0.00 O ATOM 705 CB ALA A 46 -1.032 -23.157 -11.073 1.00 0.00 C ATOM 0 H ALA A 46 0.888 -23.779 -12.484 1.00 0.00 H new ATOM 0 HA ALA A 46 0.203 -24.352 -9.768 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.889 -23.137 -10.399 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.430 -22.261 -10.921 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -1.382 -23.188 -12.105 1.00 0.00 H new ATOM 711 N ALA A 47 -1.009 -26.374 -12.012 1.00 0.00 N ATOM 712 CA ALA A 47 -1.802 -27.610 -12.230 1.00 0.00 C ATOM 713 C ALA A 47 -1.421 -28.699 -11.223 1.00 0.00 C ATOM 714 O ALA A 47 -2.285 -29.388 -10.682 1.00 0.00 O ATOM 715 CB ALA A 47 -1.614 -28.141 -13.649 1.00 0.00 C ATOM 0 H ALA A 47 -0.433 -26.108 -12.811 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.850 -27.348 -12.085 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.206 -29.047 -13.780 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.940 -27.387 -14.366 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.561 -28.369 -13.816 1.00 0.00 H new ATOM 721 N GLU A 48 -0.108 -28.834 -10.988 1.00 0.00 N ATOM 722 CA GLU A 48 0.433 -29.803 -10.029 1.00 0.00 C ATOM 723 C GLU A 48 0.212 -29.315 -8.579 1.00 0.00 C ATOM 724 O GLU A 48 0.011 -30.127 -7.678 1.00 0.00 O ATOM 725 CB GLU A 48 1.940 -30.047 -10.285 1.00 0.00 C ATOM 726 CG GLU A 48 2.327 -30.412 -11.726 1.00 0.00 C ATOM 727 CD GLU A 48 3.789 -30.893 -11.823 1.00 0.00 C ATOM 728 OE1 GLU A 48 4.052 -32.083 -11.539 1.00 0.00 O ATOM 729 OE2 GLU A 48 4.686 -30.083 -12.159 1.00 0.00 O ATOM 0 H GLU A 48 0.605 -28.276 -11.457 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.098 -30.745 -10.166 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.487 -29.149 -9.999 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.275 -30.848 -9.626 1.00 0.00 H new ATOM 0 HG2 GLU A 48 1.662 -31.194 -12.094 1.00 0.00 H new ATOM 0 HG3 GLU A 48 2.186 -29.544 -12.371 1.00 0.00 H new ATOM 736 N ILE A 49 0.239 -27.979 -8.378 1.00 0.00 N ATOM 737 CA ILE A 49 0.061 -27.354 -7.043 1.00 0.00 C ATOM 738 C ILE A 49 -1.358 -27.608 -6.501 1.00 0.00 C ATOM 739 O ILE A 49 -1.520 -27.988 -5.332 1.00 0.00 O ATOM 740 CB ILE A 49 0.325 -25.797 -7.090 1.00 0.00 C ATOM 741 CG1 ILE A 49 1.754 -25.496 -7.610 1.00 0.00 C ATOM 742 CG2 ILE A 49 0.100 -25.130 -5.710 1.00 0.00 C ATOM 743 CD1 ILE A 49 2.096 -24.031 -7.806 1.00 0.00 C ATOM 0 H ILE A 49 0.384 -27.305 -9.130 1.00 0.00 H new ATOM 0 HA ILE A 49 0.792 -27.814 -6.378 1.00 0.00 H new ATOM 0 HB ILE A 49 -0.398 -25.369 -7.784 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.471 -25.926 -6.911 1.00 0.00 H new ATOM 0 HG13 ILE A 49 1.889 -26.010 -8.561 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.292 -24.060 -5.787 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -0.930 -25.291 -5.391 1.00 0.00 H new ATOM 0 HG23 ILE A 49 0.779 -25.569 -4.979 1.00 0.00 H new ATOM 0 HD11 ILE A 49 3.119 -23.942 -8.172 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.412 -23.592 -8.532 1.00 0.00 H new ATOM 0 HD13 ILE A 49 2.003 -23.505 -6.856 1.00 0.00 H new ATOM 755 N ARG A 50 -2.371 -27.399 -7.367 1.00 0.00 N ATOM 756 CA ARG A 50 -3.787 -27.486 -6.970 1.00 0.00 C ATOM 757 C ARG A 50 -4.143 -28.916 -6.548 1.00 0.00 C ATOM 758 O ARG A 50 -4.615 -29.119 -5.434 1.00 0.00 O ATOM 759 CB ARG A 50 -4.729 -26.962 -8.102 1.00 0.00 C ATOM 760 CG ARG A 50 -4.705 -27.756 -9.429 1.00 0.00 C ATOM 761 CD ARG A 50 -5.571 -27.124 -10.526 1.00 0.00 C ATOM 762 NE ARG A 50 -6.976 -26.962 -10.102 1.00 0.00 N ATOM 763 CZ ARG A 50 -7.762 -25.912 -10.389 1.00 0.00 C ATOM 764 NH1 ARG A 50 -7.304 -24.893 -11.114 1.00 0.00 N ATOM 765 NH2 ARG A 50 -9.004 -25.892 -9.938 1.00 0.00 N ATOM 0 H ARG A 50 -2.231 -27.168 -8.350 1.00 0.00 H new ATOM 0 HA ARG A 50 -3.939 -26.839 -6.106 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -5.751 -26.958 -7.723 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.464 -25.927 -8.317 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -3.677 -27.828 -9.783 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -5.050 -28.773 -9.243 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -5.160 -26.151 -10.796 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.532 -27.746 -11.421 1.00 0.00 H new ATOM 0 HE ARG A 50 -7.384 -27.712 -9.544 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -6.344 -24.903 -11.459 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -7.913 -24.102 -11.324 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -9.356 -26.669 -9.378 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -9.611 -25.100 -10.149 1.00 0.00 H new ATOM 779 N VAL A 51 -3.815 -29.903 -7.408 1.00 0.00 N ATOM 780 CA VAL A 51 -4.180 -31.320 -7.185 1.00 0.00 C ATOM 781 C VAL A 51 -3.469 -31.907 -5.952 1.00 0.00 C ATOM 782 O VAL A 51 -4.052 -32.704 -5.214 1.00 0.00 O ATOM 783 CB VAL A 51 -3.895 -32.201 -8.456 1.00 0.00 C ATOM 784 CG1 VAL A 51 -4.843 -31.812 -9.624 1.00 0.00 C ATOM 785 CG2 VAL A 51 -2.409 -32.114 -8.894 1.00 0.00 C ATOM 0 H VAL A 51 -3.294 -29.743 -8.270 1.00 0.00 H new ATOM 0 HA VAL A 51 -5.253 -31.339 -6.994 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.094 -33.238 -8.186 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.626 -32.435 -10.492 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -5.878 -31.963 -9.318 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -4.690 -30.764 -9.883 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -2.252 -32.736 -9.775 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.160 -31.080 -9.131 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -1.770 -32.465 -8.084 1.00 0.00 H new ATOM 795 N ARG A 52 -2.225 -31.461 -5.735 1.00 0.00 N ATOM 796 CA ARG A 52 -1.378 -31.908 -4.621 1.00 0.00 C ATOM 797 C ARG A 52 -1.902 -31.343 -3.284 1.00 0.00 C ATOM 798 O ARG A 52 -1.846 -32.013 -2.250 1.00 0.00 O ATOM 799 CB ARG A 52 0.078 -31.473 -4.909 1.00 0.00 C ATOM 800 CG ARG A 52 1.157 -32.008 -3.953 1.00 0.00 C ATOM 801 CD ARG A 52 2.580 -31.735 -4.484 1.00 0.00 C ATOM 802 NE ARG A 52 2.812 -32.319 -5.832 1.00 0.00 N ATOM 803 CZ ARG A 52 3.907 -33.015 -6.211 1.00 0.00 C ATOM 804 NH1 ARG A 52 4.855 -33.331 -5.337 1.00 0.00 N ATOM 805 NH2 ARG A 52 4.033 -33.421 -7.464 1.00 0.00 N ATOM 0 H ARG A 52 -1.773 -30.771 -6.335 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.407 -32.994 -4.532 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.334 -31.786 -5.921 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.118 -30.384 -4.893 1.00 0.00 H new ATOM 0 HG2 ARG A 52 1.039 -31.543 -2.975 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.020 -33.080 -3.814 1.00 0.00 H new ATOM 0 HD2 ARG A 52 2.748 -30.659 -4.525 1.00 0.00 H new ATOM 0 HD3 ARG A 52 3.309 -32.145 -3.785 1.00 0.00 H new ATOM 0 HE ARG A 52 2.082 -32.183 -6.531 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.764 -33.048 -4.361 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.674 -33.857 -5.641 1.00 0.00 H new ATOM 0 HH21 ARG A 52 3.304 -33.209 -8.145 1.00 0.00 H new ATOM 0 HH22 ARG A 52 4.860 -33.946 -7.749 1.00 0.00 H new ATOM 819 N HIS A 53 -2.442 -30.107 -3.323 1.00 0.00 N ATOM 820 CA HIS A 53 -3.068 -29.473 -2.142 1.00 0.00 C ATOM 821 C HIS A 53 -4.447 -30.071 -1.844 1.00 0.00 C ATOM 822 O HIS A 53 -4.817 -30.157 -0.686 1.00 0.00 O ATOM 823 CB HIS A 53 -3.156 -27.931 -2.291 1.00 0.00 C ATOM 824 CG HIS A 53 -1.858 -27.230 -1.996 1.00 0.00 C ATOM 825 ND1 HIS A 53 -1.251 -26.355 -2.869 1.00 0.00 N ATOM 826 CD2 HIS A 53 -1.084 -27.241 -0.881 1.00 0.00 C ATOM 827 CE1 HIS A 53 -0.153 -25.873 -2.316 1.00 0.00 C ATOM 828 NE2 HIS A 53 -0.034 -26.394 -1.112 1.00 0.00 N ATOM 0 H HIS A 53 -2.457 -29.526 -4.161 1.00 0.00 H new ATOM 0 HA HIS A 53 -2.420 -29.686 -1.292 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -3.469 -27.688 -3.306 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -3.927 -27.551 -1.620 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -1.596 -26.116 -3.799 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -1.263 -27.811 0.019 1.00 0.00 H new ATOM 0 HE1 HIS A 53 0.530 -25.172 -2.772 1.00 0.00 H new ATOM 837 N ILE A 54 -5.190 -30.496 -2.882 1.00 0.00 N ATOM 838 CA ILE A 54 -6.490 -31.187 -2.706 1.00 0.00 C ATOM 839 C ILE A 54 -6.300 -32.465 -1.852 1.00 0.00 C ATOM 840 O ILE A 54 -7.129 -32.777 -0.992 1.00 0.00 O ATOM 841 CB ILE A 54 -7.137 -31.535 -4.102 1.00 0.00 C ATOM 842 CG1 ILE A 54 -7.486 -30.237 -4.899 1.00 0.00 C ATOM 843 CG2 ILE A 54 -8.389 -32.429 -3.953 1.00 0.00 C ATOM 844 CD1 ILE A 54 -7.929 -30.457 -6.336 1.00 0.00 C ATOM 0 H ILE A 54 -4.915 -30.375 -3.857 1.00 0.00 H new ATOM 0 HA ILE A 54 -7.172 -30.516 -2.183 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.393 -32.099 -4.664 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -8.277 -29.707 -4.369 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -6.612 -29.586 -4.901 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -8.802 -32.644 -4.939 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -8.113 -33.363 -3.464 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -9.136 -31.911 -3.351 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.147 -29.495 -6.801 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -7.133 -30.955 -6.890 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.825 -31.078 -6.350 1.00 0.00 H new ATOM 856 N GLU A 55 -5.163 -33.153 -2.077 1.00 0.00 N ATOM 857 CA GLU A 55 -4.758 -34.344 -1.299 1.00 0.00 C ATOM 858 C GLU A 55 -4.450 -33.985 0.171 1.00 0.00 C ATOM 859 O GLU A 55 -4.716 -34.778 1.082 1.00 0.00 O ATOM 860 CB GLU A 55 -3.532 -35.009 -1.959 1.00 0.00 C ATOM 861 CG GLU A 55 -3.762 -35.436 -3.417 1.00 0.00 C ATOM 862 CD GLU A 55 -2.527 -36.094 -4.039 1.00 0.00 C ATOM 863 OE1 GLU A 55 -1.665 -35.377 -4.582 1.00 0.00 O ATOM 864 OE2 GLU A 55 -2.403 -37.333 -3.965 1.00 0.00 O ATOM 0 H GLU A 55 -4.496 -32.898 -2.806 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.592 -35.046 -1.297 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.692 -34.316 -1.922 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.248 -35.885 -1.375 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -4.600 -36.131 -3.460 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -4.041 -34.563 -4.008 1.00 0.00 H new ATOM 871 N ARG A 56 -3.893 -32.785 0.388 1.00 0.00 N ATOM 872 CA ARG A 56 -3.612 -32.263 1.745 1.00 0.00 C ATOM 873 C ARG A 56 -4.927 -31.800 2.422 1.00 0.00 C ATOM 874 O ARG A 56 -5.037 -31.814 3.648 1.00 0.00 O ATOM 875 CB ARG A 56 -2.560 -31.113 1.670 1.00 0.00 C ATOM 876 CG ARG A 56 -2.132 -30.497 3.030 1.00 0.00 C ATOM 877 CD ARG A 56 -1.589 -31.542 4.034 1.00 0.00 C ATOM 878 NE ARG A 56 -0.435 -32.306 3.509 1.00 0.00 N ATOM 879 CZ ARG A 56 -0.017 -33.499 3.979 1.00 0.00 C ATOM 880 NH1 ARG A 56 -0.665 -34.107 4.968 1.00 0.00 N ATOM 881 NH2 ARG A 56 1.040 -34.087 3.438 1.00 0.00 N ATOM 0 H ARG A 56 -3.624 -32.148 -0.362 1.00 0.00 H new ATOM 0 HA ARG A 56 -3.188 -33.058 2.359 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -1.670 -31.493 1.169 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -2.964 -30.318 1.044 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -1.366 -29.742 2.853 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -2.987 -29.987 3.474 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -1.294 -31.035 4.953 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -2.388 -32.236 4.295 1.00 0.00 H new ATOM 0 HE ARG A 56 0.084 -31.899 2.731 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -1.490 -33.671 5.381 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -0.338 -35.009 5.314 1.00 0.00 H new ATOM 0 HH21 ARG A 56 1.535 -33.637 2.668 1.00 0.00 H new ATOM 0 HH22 ARG A 56 1.358 -34.989 3.792 1.00 0.00 H new ATOM 895 N PHE A 57 -5.928 -31.424 1.603 1.00 0.00 N ATOM 896 CA PHE A 57 -7.260 -30.996 2.082 1.00 0.00 C ATOM 897 C PHE A 57 -8.185 -32.217 2.348 1.00 0.00 C ATOM 898 O PHE A 57 -9.310 -32.045 2.828 1.00 0.00 O ATOM 899 CB PHE A 57 -7.904 -29.984 1.075 1.00 0.00 C ATOM 900 CG PHE A 57 -7.357 -28.538 1.119 1.00 0.00 C ATOM 901 CD1 PHE A 57 -5.993 -28.269 1.257 1.00 0.00 C ATOM 902 CD2 PHE A 57 -8.218 -27.449 0.989 1.00 0.00 C ATOM 903 CE1 PHE A 57 -5.518 -26.969 1.263 1.00 0.00 C ATOM 904 CE2 PHE A 57 -7.741 -26.147 0.999 1.00 0.00 C ATOM 905 CZ PHE A 57 -6.394 -25.909 1.135 1.00 0.00 C ATOM 0 H PHE A 57 -5.837 -31.408 0.587 1.00 0.00 H new ATOM 0 HA PHE A 57 -7.134 -30.483 3.035 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.768 -30.371 0.065 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -8.977 -29.950 1.262 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -5.298 -29.089 1.361 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -9.278 -27.623 0.878 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.459 -26.783 1.368 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -8.428 -25.320 0.900 1.00 0.00 H new ATOM 0 HZ PHE A 57 -6.022 -24.895 1.142 1.00 0.00 H new ATOM 915 N LYS A 58 -7.705 -33.444 2.030 1.00 0.00 N ATOM 916 CA LYS A 58 -8.378 -34.701 2.444 1.00 0.00 C ATOM 917 C LYS A 58 -8.190 -34.961 3.954 1.00 0.00 C ATOM 918 O LYS A 58 -9.006 -35.657 4.571 1.00 0.00 O ATOM 919 CB LYS A 58 -7.830 -35.917 1.655 1.00 0.00 C ATOM 920 CG LYS A 58 -7.886 -35.786 0.125 1.00 0.00 C ATOM 921 CD LYS A 58 -9.310 -35.572 -0.425 1.00 0.00 C ATOM 922 CE LYS A 58 -9.303 -35.368 -1.943 1.00 0.00 C ATOM 923 NZ LYS A 58 -10.666 -35.216 -2.497 1.00 0.00 N ATOM 0 H LYS A 58 -6.854 -33.590 1.488 1.00 0.00 H new ATOM 0 HA LYS A 58 -9.439 -34.579 2.227 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.795 -36.085 1.951 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -8.393 -36.803 1.948 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -7.257 -34.950 -0.183 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -7.464 -36.685 -0.324 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -9.930 -36.433 -0.176 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -9.760 -34.704 0.057 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -8.714 -34.483 -2.185 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -8.813 -36.217 -2.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -10.609 -35.081 -3.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -11.222 -36.070 -2.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -11.127 -34.390 -2.064 1.00 0.00 H new ATOM 937 N GLU A 59 -7.088 -34.409 4.521 1.00 0.00 N ATOM 938 CA GLU A 59 -6.748 -34.548 5.956 1.00 0.00 C ATOM 939 C GLU A 59 -7.898 -34.017 6.846 1.00 0.00 C ATOM 940 O GLU A 59 -8.194 -32.830 6.794 1.00 0.00 O ATOM 941 CB GLU A 59 -5.434 -33.782 6.290 1.00 0.00 C ATOM 942 CG GLU A 59 -4.164 -34.344 5.626 1.00 0.00 C ATOM 943 CD GLU A 59 -3.876 -35.800 6.024 1.00 0.00 C ATOM 944 OE1 GLU A 59 -3.490 -36.038 7.185 1.00 0.00 O ATOM 945 OE2 GLU A 59 -4.038 -36.706 5.184 1.00 0.00 O ATOM 0 H GLU A 59 -6.412 -33.856 3.995 1.00 0.00 H new ATOM 0 HA GLU A 59 -6.601 -35.608 6.161 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -5.552 -32.741 5.989 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -5.293 -33.788 7.371 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -4.269 -34.283 4.543 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -3.311 -33.722 5.900 1.00 0.00 H new ATOM 952 N PRO A 60 -8.555 -34.883 7.682 1.00 0.00 N ATOM 953 CA PRO A 60 -9.732 -34.467 8.494 1.00 0.00 C ATOM 954 C PRO A 60 -9.363 -33.446 9.597 1.00 0.00 C ATOM 955 O PRO A 60 -10.194 -32.626 9.998 1.00 0.00 O ATOM 956 CB PRO A 60 -10.245 -35.804 9.089 1.00 0.00 C ATOM 957 CG PRO A 60 -9.043 -36.701 9.113 1.00 0.00 C ATOM 958 CD PRO A 60 -8.210 -36.316 7.909 1.00 0.00 C ATOM 0 HA PRO A 60 -10.484 -33.948 7.900 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -10.651 -35.661 10.090 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -11.042 -36.228 8.479 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -8.478 -36.571 10.036 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -9.338 -37.749 9.064 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -7.145 -36.446 8.101 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -8.454 -36.929 7.041 1.00 0.00 H new ATOM 966 N ASP A 61 -8.099 -33.493 10.044 1.00 0.00 N ATOM 967 CA ASP A 61 -7.572 -32.637 11.127 1.00 0.00 C ATOM 968 C ASP A 61 -6.892 -31.367 10.565 1.00 0.00 C ATOM 969 O ASP A 61 -6.360 -30.567 11.343 1.00 0.00 O ATOM 970 CB ASP A 61 -6.547 -33.440 11.982 1.00 0.00 C ATOM 971 CG ASP A 61 -7.128 -34.733 12.588 1.00 0.00 C ATOM 972 OD1 ASP A 61 -7.309 -35.717 11.842 1.00 0.00 O ATOM 973 OD2 ASP A 61 -7.405 -34.778 13.804 1.00 0.00 O ATOM 0 H ASP A 61 -7.403 -34.133 9.662 1.00 0.00 H new ATOM 0 HA ASP A 61 -8.412 -32.327 11.748 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -5.688 -33.694 11.361 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -6.181 -32.804 12.788 1.00 0.00 H new ATOM 978 N LEU A 62 -6.912 -31.192 9.220 1.00 0.00 N ATOM 979 CA LEU A 62 -6.227 -30.068 8.545 1.00 0.00 C ATOM 980 C LEU A 62 -6.806 -28.714 8.989 1.00 0.00 C ATOM 981 O LEU A 62 -7.972 -28.405 8.701 1.00 0.00 O ATOM 982 CB LEU A 62 -6.338 -30.157 7.003 1.00 0.00 C ATOM 983 CG LEU A 62 -5.521 -29.070 6.228 1.00 0.00 C ATOM 984 CD1 LEU A 62 -4.018 -29.415 6.209 1.00 0.00 C ATOM 985 CD2 LEU A 62 -6.074 -28.828 4.809 1.00 0.00 C ATOM 0 H LEU A 62 -7.399 -31.821 8.581 1.00 0.00 H new ATOM 0 HA LEU A 62 -5.178 -30.141 8.834 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -6.000 -31.143 6.684 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.388 -30.073 6.722 1.00 0.00 H new ATOM 0 HG LEU A 62 -5.637 -28.130 6.768 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -3.474 -28.643 5.664 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.644 -29.469 7.231 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.872 -30.377 5.718 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.475 -28.066 4.310 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.030 -29.756 4.238 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.109 -28.491 4.874 1.00 0.00 H new ATOM 997 N TYR A 63 -5.980 -27.926 9.679 1.00 0.00 N ATOM 998 CA TYR A 63 -6.331 -26.577 10.120 1.00 0.00 C ATOM 999 C TYR A 63 -5.053 -25.733 10.219 1.00 0.00 C ATOM 1000 O TYR A 63 -4.193 -26.006 11.051 1.00 0.00 O ATOM 1001 CB TYR A 63 -7.078 -26.673 11.487 1.00 0.00 C ATOM 1002 CG TYR A 63 -7.229 -25.359 12.275 1.00 0.00 C ATOM 1003 CD1 TYR A 63 -7.711 -24.191 11.677 1.00 0.00 C ATOM 1004 CD2 TYR A 63 -6.898 -25.303 13.633 1.00 0.00 C ATOM 1005 CE1 TYR A 63 -7.844 -23.022 12.400 1.00 0.00 C ATOM 1006 CE2 TYR A 63 -7.033 -24.140 14.356 1.00 0.00 C ATOM 1007 CZ TYR A 63 -7.507 -23.003 13.739 1.00 0.00 C ATOM 1008 OH TYR A 63 -7.636 -21.839 14.465 1.00 0.00 O ATOM 0 H TYR A 63 -5.039 -28.210 9.950 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.996 -26.091 9.406 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -8.073 -27.079 11.305 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.550 -27.390 12.116 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -7.984 -24.203 10.632 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -6.529 -26.191 14.124 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -8.210 -22.126 11.920 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.768 -24.119 15.403 1.00 0.00 H new ATOM 0 HH TYR A 63 -6.940 -21.805 15.154 1.00 0.00 H new ATOM 1018 N GLY A 64 -4.953 -24.691 9.384 1.00 0.00 N ATOM 1019 CA GLY A 64 -3.843 -23.742 9.453 1.00 0.00 C ATOM 1020 C GLY A 64 -4.237 -22.529 10.265 1.00 0.00 C ATOM 1021 O GLY A 64 -5.031 -21.705 9.796 1.00 0.00 O ATOM 0 H GLY A 64 -5.632 -24.486 8.651 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.973 -24.222 9.902 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.554 -23.436 8.447 1.00 0.00 H new ATOM 1025 N GLU A 65 -3.739 -22.442 11.505 1.00 0.00 N ATOM 1026 CA GLU A 65 -3.994 -21.288 12.375 1.00 0.00 C ATOM 1027 C GLU A 65 -2.886 -20.256 12.191 1.00 0.00 C ATOM 1028 O GLU A 65 -1.777 -20.426 12.716 1.00 0.00 O ATOM 1029 CB GLU A 65 -4.079 -21.739 13.852 1.00 0.00 C ATOM 1030 CG GLU A 65 -4.333 -20.592 14.855 1.00 0.00 C ATOM 1031 CD GLU A 65 -4.503 -21.077 16.298 1.00 0.00 C ATOM 1032 OE1 GLU A 65 -3.485 -21.414 16.940 1.00 0.00 O ATOM 1033 OE2 GLU A 65 -5.650 -21.139 16.794 1.00 0.00 O ATOM 0 H GLU A 65 -3.154 -23.162 11.930 1.00 0.00 H new ATOM 0 HA GLU A 65 -4.947 -20.835 12.103 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -4.878 -22.474 13.949 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.149 -22.241 14.120 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -3.501 -19.889 14.811 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.228 -20.047 14.554 1.00 0.00 H new ATOM 1040 N LEU A 66 -3.176 -19.192 11.425 1.00 0.00 N ATOM 1041 CA LEU A 66 -2.226 -18.100 11.224 1.00 0.00 C ATOM 1042 C LEU A 66 -2.259 -17.188 12.446 1.00 0.00 C ATOM 1043 O LEU A 66 -3.311 -16.675 12.841 1.00 0.00 O ATOM 1044 CB LEU A 66 -2.497 -17.338 9.903 1.00 0.00 C ATOM 1045 CG LEU A 66 -1.384 -16.319 9.452 1.00 0.00 C ATOM 1046 CD1 LEU A 66 -1.331 -16.207 7.915 1.00 0.00 C ATOM 1047 CD2 LEU A 66 -1.582 -14.916 10.074 1.00 0.00 C ATOM 0 H LEU A 66 -4.063 -19.070 10.937 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.220 -18.507 11.122 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.636 -18.069 9.107 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.437 -16.796 10.006 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.436 -16.713 9.818 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.555 -15.497 7.628 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -1.106 -17.184 7.487 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.295 -15.861 7.542 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.789 -14.251 9.732 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.549 -14.516 9.768 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.548 -14.992 11.161 1.00 0.00 H new ATOM 1059 N LEU A 67 -1.082 -17.003 13.012 1.00 0.00 N ATOM 1060 CA LEU A 67 -0.871 -16.301 14.280 1.00 0.00 C ATOM 1061 C LEU A 67 -0.071 -15.013 14.033 1.00 0.00 C ATOM 1062 O LEU A 67 -0.257 -14.013 14.726 1.00 0.00 O ATOM 1063 CB LEU A 67 -0.143 -17.285 15.241 1.00 0.00 C ATOM 1064 CG LEU A 67 1.086 -18.060 14.612 1.00 0.00 C ATOM 1065 CD1 LEU A 67 2.439 -17.495 15.055 1.00 0.00 C ATOM 1066 CD2 LEU A 67 0.999 -19.581 14.841 1.00 0.00 C ATOM 0 H LEU A 67 -0.215 -17.344 12.596 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.813 -15.996 14.736 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.207 -16.727 16.110 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.866 -18.016 15.602 1.00 0.00 H new ATOM 0 HG LEU A 67 1.021 -17.894 13.537 1.00 0.00 H new ATOM 0 HD11 LEU A 67 3.242 -18.068 14.591 1.00 0.00 H new ATOM 0 HD12 LEU A 67 2.515 -16.451 14.750 1.00 0.00 H new ATOM 0 HD13 LEU A 67 2.524 -17.563 16.139 1.00 0.00 H new ATOM 0 HD21 LEU A 67 1.865 -20.067 14.391 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.983 -19.787 15.911 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.088 -19.966 14.383 1.00 0.00 H new ATOM 1078 N THR A 68 0.827 -15.065 13.034 1.00 0.00 N ATOM 1079 CA THR A 68 1.666 -13.933 12.612 1.00 0.00 C ATOM 1080 C THR A 68 1.932 -14.057 11.104 1.00 0.00 C ATOM 1081 O THR A 68 2.214 -15.150 10.625 1.00 0.00 O ATOM 1082 CB THR A 68 3.042 -13.920 13.380 1.00 0.00 C ATOM 1083 OG1 THR A 68 2.823 -13.850 14.796 1.00 0.00 O ATOM 1084 CG2 THR A 68 3.949 -12.743 12.955 1.00 0.00 C ATOM 0 H THR A 68 0.992 -15.911 12.488 1.00 0.00 H new ATOM 0 HA THR A 68 1.142 -13.005 12.840 1.00 0.00 H new ATOM 0 HB THR A 68 3.550 -14.849 13.120 1.00 0.00 H new ATOM 0 HG1 THR A 68 3.686 -13.844 15.261 1.00 0.00 H new ATOM 0 HG21 THR A 68 4.883 -12.783 13.515 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.162 -12.815 11.888 1.00 0.00 H new ATOM 0 HG23 THR A 68 3.442 -11.800 13.161 1.00 0.00 H new ATOM 1092 N ARG A 69 1.804 -12.952 10.355 1.00 0.00 N ATOM 1093 CA ARG A 69 2.306 -12.866 8.973 1.00 0.00 C ATOM 1094 C ARG A 69 2.977 -11.499 8.775 1.00 0.00 C ATOM 1095 O ARG A 69 2.448 -10.459 9.197 1.00 0.00 O ATOM 1096 CB ARG A 69 1.202 -13.147 7.909 1.00 0.00 C ATOM 1097 CG ARG A 69 0.063 -12.116 7.818 1.00 0.00 C ATOM 1098 CD ARG A 69 -0.954 -12.465 6.711 1.00 0.00 C ATOM 1099 NE ARG A 69 -1.933 -11.383 6.504 1.00 0.00 N ATOM 1100 CZ ARG A 69 -1.752 -10.333 5.694 1.00 0.00 C ATOM 1101 NH1 ARG A 69 -0.640 -10.204 4.973 1.00 0.00 N ATOM 1102 NH2 ARG A 69 -2.686 -9.405 5.609 1.00 0.00 N ATOM 0 H ARG A 69 1.354 -12.098 10.685 1.00 0.00 H new ATOM 0 HA ARG A 69 3.045 -13.653 8.820 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.679 -13.217 6.931 1.00 0.00 H new ATOM 0 HB3 ARG A 69 0.764 -14.123 8.120 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -0.452 -12.061 8.777 1.00 0.00 H new ATOM 0 HG3 ARG A 69 0.483 -11.129 7.624 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -0.424 -12.658 5.778 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -1.478 -13.383 6.976 1.00 0.00 H new ATOM 0 HE ARG A 69 -2.814 -11.438 7.016 1.00 0.00 H new ATOM 0 HH11 ARG A 69 0.092 -10.912 5.033 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -0.520 -9.397 4.361 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -3.541 -9.490 6.159 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -2.553 -8.603 4.993 1.00 0.00 H new ATOM 1116 N VAL A 70 4.173 -11.531 8.173 1.00 0.00 N ATOM 1117 CA VAL A 70 5.057 -10.371 8.019 1.00 0.00 C ATOM 1118 C VAL A 70 5.336 -10.136 6.528 1.00 0.00 C ATOM 1119 O VAL A 70 5.719 -11.061 5.808 1.00 0.00 O ATOM 1120 CB VAL A 70 6.404 -10.582 8.825 1.00 0.00 C ATOM 1121 CG1 VAL A 70 6.134 -10.633 10.352 1.00 0.00 C ATOM 1122 CG2 VAL A 70 7.160 -11.858 8.367 1.00 0.00 C ATOM 0 H VAL A 70 4.561 -12.384 7.771 1.00 0.00 H new ATOM 0 HA VAL A 70 4.565 -9.488 8.428 1.00 0.00 H new ATOM 0 HB VAL A 70 7.042 -9.725 8.611 1.00 0.00 H new ATOM 0 HG11 VAL A 70 7.075 -10.779 10.883 1.00 0.00 H new ATOM 0 HG12 VAL A 70 5.678 -9.696 10.672 1.00 0.00 H new ATOM 0 HG13 VAL A 70 5.460 -11.460 10.575 1.00 0.00 H new ATOM 0 HG21 VAL A 70 8.078 -11.964 8.945 1.00 0.00 H new ATOM 0 HG22 VAL A 70 6.528 -12.732 8.525 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.406 -11.775 7.308 1.00 0.00 H new ATOM 1132 N ILE A 71 5.121 -8.904 6.058 1.00 0.00 N ATOM 1133 CA ILE A 71 5.380 -8.541 4.647 1.00 0.00 C ATOM 1134 C ILE A 71 6.614 -7.630 4.539 1.00 0.00 C ATOM 1135 O ILE A 71 6.732 -6.623 5.247 1.00 0.00 O ATOM 1136 CB ILE A 71 4.131 -7.877 3.944 1.00 0.00 C ATOM 1137 CG1 ILE A 71 4.502 -7.429 2.485 1.00 0.00 C ATOM 1138 CG2 ILE A 71 3.554 -6.714 4.778 1.00 0.00 C ATOM 1139 CD1 ILE A 71 3.349 -6.929 1.653 1.00 0.00 C ATOM 0 H ILE A 71 4.768 -8.135 6.628 1.00 0.00 H new ATOM 0 HA ILE A 71 5.578 -9.472 4.116 1.00 0.00 H new ATOM 0 HB ILE A 71 3.341 -8.625 3.876 1.00 0.00 H new ATOM 0 HG12 ILE A 71 5.254 -6.642 2.544 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.962 -8.272 1.969 1.00 0.00 H new ATOM 0 HG21 ILE A 71 2.697 -6.285 4.259 1.00 0.00 H new ATOM 0 HG22 ILE A 71 3.239 -7.086 5.753 1.00 0.00 H new ATOM 0 HG23 ILE A 71 4.318 -5.948 4.912 1.00 0.00 H new ATOM 0 HD11 ILE A 71 3.710 -6.645 0.664 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.603 -7.717 1.554 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.899 -6.062 2.138 1.00 0.00 H new ATOM 1151 N VAL A 72 7.535 -8.023 3.653 1.00 0.00 N ATOM 1152 CA VAL A 72 8.717 -7.246 3.282 1.00 0.00 C ATOM 1153 C VAL A 72 8.689 -7.056 1.743 1.00 0.00 C ATOM 1154 O VAL A 72 9.096 -7.939 0.972 1.00 0.00 O ATOM 1155 CB VAL A 72 10.041 -7.944 3.817 1.00 0.00 C ATOM 1156 CG1 VAL A 72 10.051 -9.474 3.531 1.00 0.00 C ATOM 1157 CG2 VAL A 72 11.317 -7.243 3.277 1.00 0.00 C ATOM 0 H VAL A 72 7.475 -8.915 3.162 1.00 0.00 H new ATOM 0 HA VAL A 72 8.709 -6.261 3.749 1.00 0.00 H new ATOM 0 HB VAL A 72 10.047 -7.829 4.901 1.00 0.00 H new ATOM 0 HG11 VAL A 72 10.974 -9.910 3.914 1.00 0.00 H new ATOM 0 HG12 VAL A 72 9.198 -9.942 4.023 1.00 0.00 H new ATOM 0 HG13 VAL A 72 9.988 -9.644 2.456 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.202 -7.749 3.665 1.00 0.00 H new ATOM 0 HG22 VAL A 72 11.322 -7.286 2.188 1.00 0.00 H new ATOM 0 HG23 VAL A 72 11.324 -6.202 3.599 1.00 0.00 H new ATOM 1167 N GLY A 73 8.123 -5.901 1.327 1.00 0.00 N ATOM 1168 CA GLY A 73 7.969 -5.533 -0.084 1.00 0.00 C ATOM 1169 C GLY A 73 7.113 -6.520 -0.893 1.00 0.00 C ATOM 1170 O GLY A 73 5.907 -6.651 -0.657 1.00 0.00 O ATOM 0 H GLY A 73 7.760 -5.198 1.971 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.519 -4.542 -0.144 1.00 0.00 H new ATOM 0 HA3 GLY A 73 8.956 -5.463 -0.541 1.00 0.00 H new ATOM 1174 N ASN A 74 7.777 -7.246 -1.807 1.00 0.00 N ATOM 1175 CA ASN A 74 7.133 -8.135 -2.809 1.00 0.00 C ATOM 1176 C ASN A 74 6.912 -9.569 -2.251 1.00 0.00 C ATOM 1177 O ASN A 74 6.335 -10.440 -2.923 1.00 0.00 O ATOM 1178 CB ASN A 74 8.043 -8.165 -4.073 1.00 0.00 C ATOM 1179 CG ASN A 74 7.454 -8.901 -5.277 1.00 0.00 C ATOM 1180 OD1 ASN A 74 6.826 -8.297 -6.138 1.00 0.00 O ATOM 1181 ND2 ASN A 74 7.676 -10.208 -5.353 1.00 0.00 N ATOM 0 H ASN A 74 8.794 -7.237 -1.878 1.00 0.00 H new ATOM 0 HA ASN A 74 6.145 -7.747 -3.059 1.00 0.00 H new ATOM 0 HB2 ASN A 74 8.265 -7.139 -4.367 1.00 0.00 H new ATOM 0 HB3 ASN A 74 8.991 -8.633 -3.808 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.319 -10.741 -6.146 1.00 0.00 H new ATOM 0 HD22 ASN A 74 8.203 -10.679 -4.618 1.00 0.00 H new ATOM 1188 N VAL A 75 7.340 -9.792 -1.003 1.00 0.00 N ATOM 1189 CA VAL A 75 7.371 -11.124 -0.364 1.00 0.00 C ATOM 1190 C VAL A 75 6.668 -11.061 1.012 1.00 0.00 C ATOM 1191 O VAL A 75 6.809 -10.074 1.734 1.00 0.00 O ATOM 1192 CB VAL A 75 8.868 -11.606 -0.186 1.00 0.00 C ATOM 1193 CG1 VAL A 75 8.958 -12.931 0.599 1.00 0.00 C ATOM 1194 CG2 VAL A 75 9.594 -11.736 -1.554 1.00 0.00 C ATOM 0 H VAL A 75 7.680 -9.046 -0.396 1.00 0.00 H new ATOM 0 HA VAL A 75 6.846 -11.836 -1.000 1.00 0.00 H new ATOM 0 HB VAL A 75 9.375 -10.837 0.397 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.003 -13.225 0.698 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.523 -12.797 1.590 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.411 -13.708 0.065 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.619 -12.069 -1.392 1.00 0.00 H new ATOM 0 HG22 VAL A 75 9.071 -12.462 -2.176 1.00 0.00 H new ATOM 0 HG23 VAL A 75 9.602 -10.768 -2.055 1.00 0.00 H new ATOM 1204 N VAL A 76 5.888 -12.112 1.354 1.00 0.00 N ATOM 1205 CA VAL A 76 5.273 -12.269 2.695 1.00 0.00 C ATOM 1206 C VAL A 76 5.669 -13.640 3.287 1.00 0.00 C ATOM 1207 O VAL A 76 5.634 -14.651 2.577 1.00 0.00 O ATOM 1208 CB VAL A 76 3.689 -12.172 2.658 1.00 0.00 C ATOM 1209 CG1 VAL A 76 3.076 -12.191 4.089 1.00 0.00 C ATOM 1210 CG2 VAL A 76 3.200 -10.931 1.876 1.00 0.00 C ATOM 0 H VAL A 76 5.667 -12.873 0.712 1.00 0.00 H new ATOM 0 HA VAL A 76 5.644 -11.451 3.313 1.00 0.00 H new ATOM 0 HB VAL A 76 3.339 -13.058 2.128 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.990 -12.123 4.021 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.350 -13.119 4.590 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.458 -11.344 4.660 1.00 0.00 H new ATOM 0 HG21 VAL A 76 2.110 -10.906 1.877 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.584 -10.028 2.350 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.561 -10.983 0.849 1.00 0.00 H new ATOM 1220 N ILE A 77 6.069 -13.658 4.577 1.00 0.00 N ATOM 1221 CA ILE A 77 6.181 -14.894 5.369 1.00 0.00 C ATOM 1222 C ILE A 77 4.925 -15.013 6.241 1.00 0.00 C ATOM 1223 O ILE A 77 4.733 -14.247 7.190 1.00 0.00 O ATOM 1224 CB ILE A 77 7.502 -14.957 6.254 1.00 0.00 C ATOM 1225 CG1 ILE A 77 8.730 -15.369 5.368 1.00 0.00 C ATOM 1226 CG2 ILE A 77 7.356 -15.882 7.503 1.00 0.00 C ATOM 1227 CD1 ILE A 77 9.924 -15.939 6.119 1.00 0.00 C ATOM 0 H ILE A 77 6.322 -12.816 5.094 1.00 0.00 H new ATOM 0 HA ILE A 77 6.257 -15.738 4.683 1.00 0.00 H new ATOM 0 HB ILE A 77 7.675 -13.956 6.648 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.397 -16.107 4.639 1.00 0.00 H new ATOM 0 HG13 ILE A 77 9.060 -14.494 4.808 1.00 0.00 H new ATOM 0 HG21 ILE A 77 8.289 -15.883 8.066 1.00 0.00 H new ATOM 0 HG22 ILE A 77 6.550 -15.512 8.137 1.00 0.00 H new ATOM 0 HG23 ILE A 77 7.126 -16.897 7.179 1.00 0.00 H new ATOM 0 HD11 ILE A 77 10.714 -16.189 5.411 1.00 0.00 H new ATOM 0 HD12 ILE A 77 10.294 -15.199 6.829 1.00 0.00 H new ATOM 0 HD13 ILE A 77 9.621 -16.837 6.657 1.00 0.00 H new ATOM 1239 N ASP A 78 4.059 -15.943 5.858 1.00 0.00 N ATOM 1240 CA ASP A 78 2.873 -16.326 6.624 1.00 0.00 C ATOM 1241 C ASP A 78 3.269 -17.440 7.594 1.00 0.00 C ATOM 1242 O ASP A 78 3.574 -18.551 7.172 1.00 0.00 O ATOM 1243 CB ASP A 78 1.741 -16.794 5.664 1.00 0.00 C ATOM 1244 CG ASP A 78 1.330 -15.694 4.668 1.00 0.00 C ATOM 1245 OD1 ASP A 78 2.102 -15.440 3.711 1.00 0.00 O ATOM 1246 OD2 ASP A 78 0.261 -15.060 4.851 1.00 0.00 O ATOM 0 H ASP A 78 4.161 -16.465 4.988 1.00 0.00 H new ATOM 0 HA ASP A 78 2.493 -15.473 7.186 1.00 0.00 H new ATOM 0 HB2 ASP A 78 2.075 -17.674 5.114 1.00 0.00 H new ATOM 0 HB3 ASP A 78 0.872 -17.095 6.249 1.00 0.00 H new ATOM 1251 N HIS A 79 3.308 -17.116 8.893 1.00 0.00 N ATOM 1252 CA HIS A 79 3.639 -18.084 9.945 1.00 0.00 C ATOM 1253 C HIS A 79 2.334 -18.585 10.572 1.00 0.00 C ATOM 1254 O HIS A 79 1.622 -17.853 11.279 1.00 0.00 O ATOM 1255 CB HIS A 79 4.569 -17.466 11.023 1.00 0.00 C ATOM 1256 CG HIS A 79 4.935 -18.407 12.162 1.00 0.00 C ATOM 1257 ND1 HIS A 79 4.713 -19.779 12.143 1.00 0.00 N ATOM 1258 CD2 HIS A 79 5.504 -18.155 13.366 1.00 0.00 C ATOM 1259 CE1 HIS A 79 5.121 -20.313 13.276 1.00 0.00 C ATOM 1260 NE2 HIS A 79 5.603 -19.352 14.034 1.00 0.00 N ATOM 0 H HIS A 79 3.112 -16.178 9.243 1.00 0.00 H new ATOM 0 HA HIS A 79 4.185 -18.918 9.504 1.00 0.00 H new ATOM 0 HB2 HIS A 79 5.486 -17.127 10.541 1.00 0.00 H new ATOM 0 HB3 HIS A 79 4.083 -16.584 11.440 1.00 0.00 H new ATOM 0 HD1 HIS A 79 4.297 -20.295 11.368 1.00 0.00 H new ATOM 0 HD2 HIS A 79 5.821 -17.190 13.733 1.00 0.00 H new ATOM 0 HE1 HIS A 79 5.069 -21.360 13.538 1.00 0.00 H new ATOM 1269 N GLU A 80 2.046 -19.847 10.280 1.00 0.00 N ATOM 1270 CA GLU A 80 0.856 -20.564 10.727 1.00 0.00 C ATOM 1271 C GLU A 80 1.271 -21.902 11.357 1.00 0.00 C ATOM 1272 O GLU A 80 2.389 -22.389 11.145 1.00 0.00 O ATOM 1273 CB GLU A 80 -0.161 -20.765 9.535 1.00 0.00 C ATOM 1274 CG GLU A 80 0.445 -20.753 8.105 1.00 0.00 C ATOM 1275 CD GLU A 80 1.559 -21.795 7.870 1.00 0.00 C ATOM 1276 OE1 GLU A 80 1.250 -23.002 7.792 1.00 0.00 O ATOM 1277 OE2 GLU A 80 2.747 -21.404 7.783 1.00 0.00 O ATOM 0 H GLU A 80 2.659 -20.423 9.702 1.00 0.00 H new ATOM 0 HA GLU A 80 0.341 -19.973 11.485 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.676 -21.715 9.681 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.916 -19.981 9.593 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.354 -20.926 7.385 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.846 -19.760 7.903 1.00 0.00 H new ATOM 1284 N THR A 81 0.378 -22.452 12.174 1.00 0.00 N ATOM 1285 CA THR A 81 0.521 -23.793 12.742 1.00 0.00 C ATOM 1286 C THR A 81 -0.479 -24.741 12.055 1.00 0.00 C ATOM 1287 O THR A 81 -1.696 -24.605 12.240 1.00 0.00 O ATOM 1288 CB THR A 81 0.275 -23.768 14.282 1.00 0.00 C ATOM 1289 OG1 THR A 81 1.088 -22.748 14.880 1.00 0.00 O ATOM 1290 CG2 THR A 81 0.605 -25.112 14.945 1.00 0.00 C ATOM 0 H THR A 81 -0.476 -21.976 12.465 1.00 0.00 H new ATOM 0 HA THR A 81 1.537 -24.149 12.570 1.00 0.00 H new ATOM 0 HB THR A 81 -0.784 -23.564 14.438 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.010 -23.071 14.962 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.418 -25.045 16.017 1.00 0.00 H new ATOM 0 HG22 THR A 81 -0.022 -25.893 14.515 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.654 -25.354 14.774 1.00 0.00 H new ATOM 1298 N VAL A 82 0.044 -25.671 11.237 1.00 0.00 N ATOM 1299 CA VAL A 82 -0.765 -26.685 10.547 1.00 0.00 C ATOM 1300 C VAL A 82 -1.067 -27.861 11.494 1.00 0.00 C ATOM 1301 O VAL A 82 -0.202 -28.695 11.766 1.00 0.00 O ATOM 1302 CB VAL A 82 -0.046 -27.222 9.252 1.00 0.00 C ATOM 1303 CG1 VAL A 82 -0.849 -28.373 8.589 1.00 0.00 C ATOM 1304 CG2 VAL A 82 0.216 -26.080 8.248 1.00 0.00 C ATOM 0 H VAL A 82 1.042 -25.739 11.037 1.00 0.00 H new ATOM 0 HA VAL A 82 -1.698 -26.208 10.245 1.00 0.00 H new ATOM 0 HB VAL A 82 0.918 -27.629 9.559 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -0.323 -28.718 7.699 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.951 -29.199 9.293 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.838 -28.012 8.308 1.00 0.00 H new ATOM 0 HG21 VAL A 82 0.713 -26.480 7.364 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -0.732 -25.626 7.958 1.00 0.00 H new ATOM 0 HG23 VAL A 82 0.852 -25.326 8.712 1.00 0.00 H new ATOM 1314 N THR A 83 -2.299 -27.885 12.001 1.00 0.00 N ATOM 1315 CA THR A 83 -2.836 -28.997 12.785 1.00 0.00 C ATOM 1316 C THR A 83 -2.984 -30.251 11.899 1.00 0.00 C ATOM 1317 O THR A 83 -3.528 -30.179 10.788 1.00 0.00 O ATOM 1318 CB THR A 83 -4.208 -28.601 13.421 1.00 0.00 C ATOM 1319 OG1 THR A 83 -4.043 -27.408 14.214 1.00 0.00 O ATOM 1320 CG2 THR A 83 -4.805 -29.727 14.291 1.00 0.00 C ATOM 0 H THR A 83 -2.963 -27.120 11.877 1.00 0.00 H new ATOM 0 HA THR A 83 -2.140 -29.227 13.592 1.00 0.00 H new ATOM 0 HB THR A 83 -4.907 -28.421 12.604 1.00 0.00 H new ATOM 0 HG1 THR A 83 -4.856 -27.248 14.737 1.00 0.00 H new ATOM 0 HG21 THR A 83 -5.757 -29.399 14.708 1.00 0.00 H new ATOM 0 HG22 THR A 83 -4.964 -30.615 13.679 1.00 0.00 H new ATOM 0 HG23 THR A 83 -4.116 -29.964 15.102 1.00 0.00 H new ATOM 1328 N ARG A 84 -2.447 -31.380 12.391 1.00 0.00 N ATOM 1329 CA ARG A 84 -2.462 -32.681 11.702 1.00 0.00 C ATOM 1330 C ARG A 84 -2.896 -33.750 12.730 1.00 0.00 C ATOM 1331 O ARG A 84 -3.458 -33.407 13.784 1.00 0.00 O ATOM 1332 CB ARG A 84 -1.054 -33.006 11.113 1.00 0.00 C ATOM 1333 CG ARG A 84 -0.486 -31.966 10.117 1.00 0.00 C ATOM 1334 CD ARG A 84 0.911 -32.349 9.587 1.00 0.00 C ATOM 1335 NE ARG A 84 0.894 -33.628 8.838 1.00 0.00 N ATOM 1336 CZ ARG A 84 1.975 -34.323 8.438 1.00 0.00 C ATOM 1337 NH1 ARG A 84 3.204 -33.901 8.715 1.00 0.00 N ATOM 1338 NH2 ARG A 84 1.808 -35.454 7.766 1.00 0.00 N ATOM 0 H ARG A 84 -1.981 -31.414 13.298 1.00 0.00 H new ATOM 0 HA ARG A 84 -3.161 -32.663 10.866 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -0.351 -33.112 11.939 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.105 -33.972 10.611 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -1.172 -31.861 9.277 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -0.430 -30.994 10.606 1.00 0.00 H new ATOM 0 HD2 ARG A 84 1.282 -31.555 8.939 1.00 0.00 H new ATOM 0 HD3 ARG A 84 1.606 -32.429 10.423 1.00 0.00 H new ATOM 0 HE ARG A 84 -0.020 -34.017 8.605 1.00 0.00 H new ATOM 0 HH11 ARG A 84 3.340 -33.037 9.239 1.00 0.00 H new ATOM 0 HH12 ARG A 84 4.011 -34.441 8.403 1.00 0.00 H new ATOM 0 HH21 ARG A 84 0.867 -35.789 7.557 1.00 0.00 H new ATOM 0 HH22 ARG A 84 2.620 -35.989 7.458 1.00 0.00 H new ATOM 1352 N ASN A 85 -2.641 -35.041 12.440 1.00 0.00 N ATOM 1353 CA ASN A 85 -3.020 -36.138 13.347 1.00 0.00 C ATOM 1354 C ASN A 85 -1.825 -37.073 13.583 1.00 0.00 C ATOM 1355 O ASN A 85 -1.657 -38.076 12.884 1.00 0.00 O ATOM 1356 CB ASN A 85 -4.234 -36.909 12.767 1.00 0.00 C ATOM 1357 CG ASN A 85 -4.894 -37.842 13.785 1.00 0.00 C ATOM 1358 OD1 ASN A 85 -4.585 -39.029 13.855 1.00 0.00 O ATOM 1359 ND2 ASN A 85 -5.785 -37.292 14.596 1.00 0.00 N ATOM 0 H ASN A 85 -2.175 -35.348 11.586 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.311 -35.721 14.311 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -4.973 -36.193 12.406 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -3.909 -37.492 11.906 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -6.242 -37.858 15.311 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -6.014 -36.302 14.506 1.00 0.00 H new ATOM 1366 N PHE A 86 -0.953 -36.700 14.529 1.00 0.00 N ATOM 1367 CA PHE A 86 0.134 -37.583 14.992 1.00 0.00 C ATOM 1368 C PHE A 86 -0.393 -38.417 16.178 1.00 0.00 C ATOM 1369 O PHE A 86 -1.069 -37.869 17.055 1.00 0.00 O ATOM 1370 CB PHE A 86 1.406 -36.778 15.420 1.00 0.00 C ATOM 1371 CG PHE A 86 2.068 -35.900 14.342 1.00 0.00 C ATOM 1372 CD1 PHE A 86 1.718 -35.988 12.992 1.00 0.00 C ATOM 1373 CD2 PHE A 86 3.044 -34.961 14.702 1.00 0.00 C ATOM 1374 CE1 PHE A 86 2.314 -35.173 12.045 1.00 0.00 C ATOM 1375 CE2 PHE A 86 3.639 -34.148 13.748 1.00 0.00 C ATOM 1376 CZ PHE A 86 3.271 -34.253 12.424 1.00 0.00 C ATOM 0 H PHE A 86 -0.977 -35.791 14.992 1.00 0.00 H new ATOM 0 HA PHE A 86 0.435 -38.230 14.168 1.00 0.00 H new ATOM 0 HB2 PHE A 86 1.136 -36.138 16.260 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.150 -37.487 15.785 1.00 0.00 H new ATOM 0 HD1 PHE A 86 0.970 -36.703 12.682 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.337 -34.869 15.737 1.00 0.00 H new ATOM 0 HE1 PHE A 86 2.029 -35.257 11.007 1.00 0.00 H new ATOM 0 HE2 PHE A 86 4.392 -33.432 14.043 1.00 0.00 H new ATOM 0 HZ PHE A 86 3.731 -33.616 11.683 1.00 0.00 H new ATOM 1386 N PRO A 87 -0.073 -39.752 16.242 1.00 0.00 N ATOM 1387 CA PRO A 87 -0.507 -40.636 17.365 1.00 0.00 C ATOM 1388 C PRO A 87 0.253 -40.354 18.689 1.00 0.00 C ATOM 1389 O PRO A 87 0.122 -41.106 19.660 1.00 0.00 O ATOM 1390 CB PRO A 87 -0.223 -42.054 16.817 1.00 0.00 C ATOM 1391 CG PRO A 87 0.929 -41.864 15.879 1.00 0.00 C ATOM 1392 CD PRO A 87 0.710 -40.514 15.225 1.00 0.00 C ATOM 0 HA PRO A 87 -1.550 -40.481 17.639 1.00 0.00 H new ATOM 0 HB2 PRO A 87 0.028 -42.748 17.619 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -1.092 -42.463 16.302 1.00 0.00 H new ATOM 0 HG2 PRO A 87 1.878 -41.890 16.415 1.00 0.00 H new ATOM 0 HG3 PRO A 87 0.962 -42.659 15.134 1.00 0.00 H new ATOM 0 HD2 PRO A 87 1.655 -40.022 14.996 1.00 0.00 H new ATOM 0 HD3 PRO A 87 0.164 -40.607 14.286 1.00 0.00 H new ATOM 1400 N GLU A 88 1.052 -39.270 18.699 1.00 0.00 N ATOM 1401 CA GLU A 88 1.667 -38.710 19.913 1.00 0.00 C ATOM 1402 C GLU A 88 0.603 -37.917 20.706 1.00 0.00 C ATOM 1403 O GLU A 88 0.651 -37.852 21.940 1.00 0.00 O ATOM 1404 CB GLU A 88 2.849 -37.776 19.528 1.00 0.00 C ATOM 1405 CG GLU A 88 3.761 -38.307 18.407 1.00 0.00 C ATOM 1406 CD GLU A 88 4.292 -39.727 18.676 1.00 0.00 C ATOM 1407 OE1 GLU A 88 5.144 -39.881 19.582 1.00 0.00 O ATOM 1408 OE2 GLU A 88 3.862 -40.689 17.995 1.00 0.00 O ATOM 0 H GLU A 88 1.290 -38.754 17.852 1.00 0.00 H new ATOM 0 HA GLU A 88 2.050 -39.521 20.532 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.445 -36.812 19.220 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.456 -37.599 20.416 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.209 -38.305 17.467 1.00 0.00 H new ATOM 0 HG3 GLU A 88 4.605 -37.628 18.282 1.00 0.00 H new ATOM 1415 N GLY A 89 -0.339 -37.303 19.962 1.00 0.00 N ATOM 1416 CA GLY A 89 -1.477 -36.601 20.550 1.00 0.00 C ATOM 1417 C GLY A 89 -2.238 -35.805 19.502 1.00 0.00 C ATOM 1418 O GLY A 89 -3.075 -36.360 18.780 1.00 0.00 O ATOM 0 H GLY A 89 -0.325 -37.285 18.942 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.147 -37.321 21.020 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.127 -35.931 21.335 1.00 0.00 H new ATOM 1422 N LYS A 90 -1.948 -34.496 19.426 1.00 0.00 N ATOM 1423 CA LYS A 90 -2.511 -33.597 18.424 1.00 0.00 C ATOM 1424 C LYS A 90 -1.812 -33.805 17.067 1.00 0.00 C ATOM 1425 O LYS A 90 -2.308 -34.554 16.220 1.00 0.00 O ATOM 1426 CB LYS A 90 -2.406 -32.138 18.929 1.00 0.00 C ATOM 1427 CG LYS A 90 -2.950 -31.056 17.970 1.00 0.00 C ATOM 1428 CD LYS A 90 -4.436 -31.232 17.611 1.00 0.00 C ATOM 1429 CE LYS A 90 -5.355 -31.329 18.843 1.00 0.00 C ATOM 1430 NZ LYS A 90 -6.786 -31.161 18.484 1.00 0.00 N ATOM 0 H LYS A 90 -1.307 -34.033 20.070 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.567 -33.820 18.270 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.942 -32.061 19.875 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.359 -31.920 19.137 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.810 -30.076 18.426 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.361 -31.068 17.053 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -4.755 -30.392 16.994 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.552 -32.133 17.008 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.213 -32.296 19.326 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -5.071 -30.566 19.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -7.370 -31.233 19.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.927 -30.228 18.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -7.065 -31.904 17.812 1.00 0.00 H new ATOM 1444 N GLY A 91 -0.642 -33.180 16.874 1.00 0.00 N ATOM 1445 CA GLY A 91 0.104 -33.333 15.627 1.00 0.00 C ATOM 1446 C GLY A 91 0.276 -32.045 14.855 1.00 0.00 C ATOM 1447 O GLY A 91 0.458 -32.070 13.635 1.00 0.00 O ATOM 0 H GLY A 91 -0.199 -32.570 17.561 1.00 0.00 H new ATOM 0 HA2 GLY A 91 1.088 -33.745 15.852 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.408 -34.058 14.995 1.00 0.00 H new ATOM 1451 N GLU A 92 0.299 -30.921 15.571 1.00 0.00 N ATOM 1452 CA GLU A 92 0.332 -29.593 14.955 1.00 0.00 C ATOM 1453 C GLU A 92 1.795 -29.194 14.707 1.00 0.00 C ATOM 1454 O GLU A 92 2.668 -29.529 15.497 1.00 0.00 O ATOM 1455 CB GLU A 92 -0.392 -28.542 15.868 1.00 0.00 C ATOM 1456 CG GLU A 92 0.397 -28.017 17.120 1.00 0.00 C ATOM 1457 CD GLU A 92 0.387 -28.893 18.400 1.00 0.00 C ATOM 1458 OE1 GLU A 92 0.156 -30.122 18.338 1.00 0.00 O ATOM 1459 OE2 GLU A 92 0.619 -28.326 19.496 1.00 0.00 O ATOM 0 H GLU A 92 0.295 -30.904 16.591 1.00 0.00 H new ATOM 0 HA GLU A 92 -0.198 -29.618 14.003 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.657 -27.683 15.251 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.325 -28.984 16.217 1.00 0.00 H new ATOM 0 HG2 GLU A 92 1.435 -27.869 16.824 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.003 -27.037 17.381 1.00 0.00 H new ATOM 1466 N VAL A 93 2.079 -28.540 13.561 1.00 0.00 N ATOM 1467 CA VAL A 93 3.458 -28.175 13.184 1.00 0.00 C ATOM 1468 C VAL A 93 3.555 -26.673 12.848 1.00 0.00 C ATOM 1469 O VAL A 93 2.747 -26.145 12.078 1.00 0.00 O ATOM 1470 CB VAL A 93 3.976 -29.071 11.987 1.00 0.00 C ATOM 1471 CG1 VAL A 93 4.082 -30.557 12.421 1.00 0.00 C ATOM 1472 CG2 VAL A 93 3.082 -28.932 10.727 1.00 0.00 C ATOM 0 H VAL A 93 1.372 -28.255 12.883 1.00 0.00 H new ATOM 0 HA VAL A 93 4.106 -28.366 14.040 1.00 0.00 H new ATOM 0 HB VAL A 93 4.970 -28.712 11.721 1.00 0.00 H new ATOM 0 HG11 VAL A 93 4.440 -31.156 11.584 1.00 0.00 H new ATOM 0 HG12 VAL A 93 4.780 -30.644 13.254 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.101 -30.916 12.731 1.00 0.00 H new ATOM 0 HG21 VAL A 93 3.475 -29.564 9.931 1.00 0.00 H new ATOM 0 HG22 VAL A 93 2.065 -29.241 10.967 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.078 -27.893 10.397 1.00 0.00 H new ATOM 1482 N ASP A 94 4.533 -25.986 13.467 1.00 0.00 N ATOM 1483 CA ASP A 94 4.819 -24.564 13.188 1.00 0.00 C ATOM 1484 C ASP A 94 5.591 -24.441 11.868 1.00 0.00 C ATOM 1485 O ASP A 94 6.743 -24.846 11.798 1.00 0.00 O ATOM 1486 CB ASP A 94 5.627 -23.909 14.342 1.00 0.00 C ATOM 1487 CG ASP A 94 4.769 -23.616 15.583 1.00 0.00 C ATOM 1488 OD1 ASP A 94 3.977 -22.645 15.541 1.00 0.00 O ATOM 1489 OD2 ASP A 94 4.875 -24.338 16.592 1.00 0.00 O ATOM 0 H ASP A 94 5.145 -26.397 14.171 1.00 0.00 H new ATOM 0 HA ASP A 94 3.869 -24.036 13.106 1.00 0.00 H new ATOM 0 HB2 ASP A 94 6.449 -24.568 14.622 1.00 0.00 H new ATOM 0 HB3 ASP A 94 6.071 -22.979 13.986 1.00 0.00 H new ATOM 1494 N VAL A 95 4.939 -23.894 10.838 1.00 0.00 N ATOM 1495 CA VAL A 95 5.506 -23.715 9.486 1.00 0.00 C ATOM 1496 C VAL A 95 5.641 -22.198 9.196 1.00 0.00 C ATOM 1497 O VAL A 95 4.967 -21.374 9.827 1.00 0.00 O ATOM 1498 CB VAL A 95 4.573 -24.411 8.410 1.00 0.00 C ATOM 1499 CG1 VAL A 95 5.178 -24.389 6.987 1.00 0.00 C ATOM 1500 CG2 VAL A 95 4.199 -25.852 8.834 1.00 0.00 C ATOM 0 H VAL A 95 3.981 -23.554 10.916 1.00 0.00 H new ATOM 0 HA VAL A 95 6.490 -24.180 9.431 1.00 0.00 H new ATOM 0 HB VAL A 95 3.658 -23.819 8.370 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.495 -24.880 6.294 1.00 0.00 H new ATOM 0 HG12 VAL A 95 5.334 -23.357 6.674 1.00 0.00 H new ATOM 0 HG13 VAL A 95 6.133 -24.915 6.989 1.00 0.00 H new ATOM 0 HG21 VAL A 95 3.559 -26.300 8.074 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.106 -26.447 8.941 1.00 0.00 H new ATOM 0 HG23 VAL A 95 3.668 -25.825 9.786 1.00 0.00 H new ATOM 1510 N ALA A 96 6.548 -21.842 8.273 1.00 0.00 N ATOM 1511 CA ALA A 96 6.720 -20.466 7.782 1.00 0.00 C ATOM 1512 C ALA A 96 6.717 -20.494 6.245 1.00 0.00 C ATOM 1513 O ALA A 96 7.704 -20.907 5.617 1.00 0.00 O ATOM 1514 CB ALA A 96 8.014 -19.847 8.342 1.00 0.00 C ATOM 0 H ALA A 96 7.189 -22.508 7.842 1.00 0.00 H new ATOM 0 HA ALA A 96 5.898 -19.838 8.126 1.00 0.00 H new ATOM 0 HB1 ALA A 96 8.123 -18.829 7.967 1.00 0.00 H new ATOM 0 HB2 ALA A 96 7.967 -19.829 9.431 1.00 0.00 H new ATOM 0 HB3 ALA A 96 8.869 -20.444 8.025 1.00 0.00 H new ATOM 1520 N CYS A 97 5.590 -20.085 5.657 1.00 0.00 N ATOM 1521 CA CYS A 97 5.345 -20.143 4.211 1.00 0.00 C ATOM 1522 C CYS A 97 5.667 -18.783 3.569 1.00 0.00 C ATOM 1523 O CYS A 97 4.981 -17.792 3.809 1.00 0.00 O ATOM 1524 CB CYS A 97 3.882 -20.557 3.952 1.00 0.00 C ATOM 1525 SG CYS A 97 3.473 -22.209 4.567 1.00 0.00 S ATOM 0 H CYS A 97 4.806 -19.697 6.182 1.00 0.00 H new ATOM 0 HA CYS A 97 5.996 -20.889 3.756 1.00 0.00 H new ATOM 0 HB2 CYS A 97 3.220 -19.830 4.422 1.00 0.00 H new ATOM 0 HB3 CYS A 97 3.688 -20.520 2.880 1.00 0.00 H new ATOM 0 HG CYS A 97 3.196 -22.144 5.835 1.00 0.00 H new ATOM 1531 N ILE A 98 6.731 -18.764 2.760 1.00 0.00 N ATOM 1532 CA ILE A 98 7.268 -17.556 2.114 1.00 0.00 C ATOM 1533 C ILE A 98 6.860 -17.524 0.616 1.00 0.00 C ATOM 1534 O ILE A 98 7.309 -18.350 -0.188 1.00 0.00 O ATOM 1535 CB ILE A 98 8.838 -17.490 2.304 1.00 0.00 C ATOM 1536 CG1 ILE A 98 9.450 -16.269 1.547 1.00 0.00 C ATOM 1537 CG2 ILE A 98 9.531 -18.822 1.916 1.00 0.00 C ATOM 1538 CD1 ILE A 98 10.957 -16.096 1.684 1.00 0.00 C ATOM 0 H ILE A 98 7.257 -19.607 2.529 1.00 0.00 H new ATOM 0 HA ILE A 98 6.843 -16.671 2.587 1.00 0.00 H new ATOM 0 HB ILE A 98 9.028 -17.342 3.367 1.00 0.00 H new ATOM 0 HG12 ILE A 98 9.208 -16.363 0.488 1.00 0.00 H new ATOM 0 HG13 ILE A 98 8.964 -15.362 1.906 1.00 0.00 H new ATOM 0 HG21 ILE A 98 10.607 -18.729 2.063 1.00 0.00 H new ATOM 0 HG22 ILE A 98 9.148 -19.627 2.542 1.00 0.00 H new ATOM 0 HG23 ILE A 98 9.326 -19.047 0.869 1.00 0.00 H new ATOM 0 HD11 ILE A 98 11.275 -15.219 1.120 1.00 0.00 H new ATOM 0 HD12 ILE A 98 11.214 -15.964 2.735 1.00 0.00 H new ATOM 0 HD13 ILE A 98 11.462 -16.981 1.295 1.00 0.00 H new ATOM 1550 N TYR A 99 5.972 -16.577 0.254 1.00 0.00 N ATOM 1551 CA TYR A 99 5.451 -16.440 -1.125 1.00 0.00 C ATOM 1552 C TYR A 99 6.079 -15.234 -1.829 1.00 0.00 C ATOM 1553 O TYR A 99 6.163 -14.142 -1.256 1.00 0.00 O ATOM 1554 CB TYR A 99 3.910 -16.279 -1.139 1.00 0.00 C ATOM 1555 CG TYR A 99 3.161 -17.373 -0.370 1.00 0.00 C ATOM 1556 CD1 TYR A 99 2.820 -18.577 -0.981 1.00 0.00 C ATOM 1557 CD2 TYR A 99 2.806 -17.199 0.965 1.00 0.00 C ATOM 1558 CE1 TYR A 99 2.154 -19.569 -0.290 1.00 0.00 C ATOM 1559 CE2 TYR A 99 2.139 -18.187 1.664 1.00 0.00 C ATOM 1560 CZ TYR A 99 1.814 -19.371 1.032 1.00 0.00 C ATOM 1561 OH TYR A 99 1.144 -20.357 1.722 1.00 0.00 O ATOM 0 H TYR A 99 5.596 -15.887 0.904 1.00 0.00 H new ATOM 0 HA TYR A 99 5.717 -17.355 -1.655 1.00 0.00 H new ATOM 0 HB2 TYR A 99 3.653 -15.309 -0.713 1.00 0.00 H new ATOM 0 HB3 TYR A 99 3.565 -16.275 -2.173 1.00 0.00 H new ATOM 0 HD1 TYR A 99 3.082 -18.738 -2.016 1.00 0.00 H new ATOM 0 HD2 TYR A 99 3.057 -16.274 1.464 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.900 -20.496 -0.782 1.00 0.00 H new ATOM 0 HE2 TYR A 99 1.873 -18.034 2.700 1.00 0.00 H new ATOM 0 HH TYR A 99 0.981 -20.060 2.641 1.00 0.00 H new ATOM 1571 N GLU A 100 6.515 -15.459 -3.069 1.00 0.00 N ATOM 1572 CA GLU A 100 6.947 -14.408 -3.993 1.00 0.00 C ATOM 1573 C GLU A 100 5.799 -14.123 -4.979 1.00 0.00 C ATOM 1574 O GLU A 100 5.360 -15.023 -5.715 1.00 0.00 O ATOM 1575 CB GLU A 100 8.205 -14.876 -4.754 1.00 0.00 C ATOM 1576 CG GLU A 100 8.769 -13.854 -5.754 1.00 0.00 C ATOM 1577 CD GLU A 100 9.880 -14.439 -6.641 1.00 0.00 C ATOM 1578 OE1 GLU A 100 9.555 -15.137 -7.625 1.00 0.00 O ATOM 1579 OE2 GLU A 100 11.076 -14.203 -6.371 1.00 0.00 O ATOM 0 H GLU A 100 6.579 -16.396 -3.468 1.00 0.00 H new ATOM 0 HA GLU A 100 7.192 -13.498 -3.446 1.00 0.00 H new ATOM 0 HB2 GLU A 100 8.981 -15.121 -4.029 1.00 0.00 H new ATOM 0 HB3 GLU A 100 7.968 -15.795 -5.290 1.00 0.00 H new ATOM 0 HG2 GLU A 100 7.961 -13.487 -6.387 1.00 0.00 H new ATOM 0 HG3 GLU A 100 9.161 -12.996 -5.208 1.00 0.00 H new ATOM 1586 N VAL A 101 5.317 -12.876 -4.975 1.00 0.00 N ATOM 1587 CA VAL A 101 4.139 -12.446 -5.746 1.00 0.00 C ATOM 1588 C VAL A 101 4.558 -11.512 -6.897 1.00 0.00 C ATOM 1589 O VAL A 101 5.048 -10.413 -6.652 1.00 0.00 O ATOM 1590 CB VAL A 101 3.119 -11.721 -4.796 1.00 0.00 C ATOM 1591 CG1 VAL A 101 1.885 -11.187 -5.572 1.00 0.00 C ATOM 1592 CG2 VAL A 101 2.679 -12.662 -3.644 1.00 0.00 C ATOM 0 H VAL A 101 5.738 -12.124 -4.429 1.00 0.00 H new ATOM 0 HA VAL A 101 3.660 -13.325 -6.178 1.00 0.00 H new ATOM 0 HB VAL A 101 3.630 -10.860 -4.366 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.205 -10.693 -4.878 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.212 -10.474 -6.329 1.00 0.00 H new ATOM 0 HG13 VAL A 101 1.371 -12.018 -6.054 1.00 0.00 H new ATOM 0 HG21 VAL A 101 1.973 -12.141 -2.998 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.202 -13.549 -4.061 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.552 -12.958 -3.063 1.00 0.00 H new ATOM 1602 N GLU A 102 4.352 -11.951 -8.151 1.00 0.00 N ATOM 1603 CA GLU A 102 4.646 -11.141 -9.347 1.00 0.00 C ATOM 1604 C GLU A 102 3.348 -10.903 -10.150 1.00 0.00 C ATOM 1605 O GLU A 102 2.643 -11.860 -10.488 1.00 0.00 O ATOM 1606 CB GLU A 102 5.724 -11.844 -10.215 1.00 0.00 C ATOM 1607 CG GLU A 102 6.203 -11.054 -11.449 1.00 0.00 C ATOM 1608 CD GLU A 102 6.752 -9.656 -11.111 1.00 0.00 C ATOM 1609 OE1 GLU A 102 7.917 -9.562 -10.659 1.00 0.00 O ATOM 1610 OE2 GLU A 102 6.028 -8.651 -11.307 1.00 0.00 O ATOM 0 H GLU A 102 3.978 -12.876 -8.364 1.00 0.00 H new ATOM 0 HA GLU A 102 5.040 -10.172 -9.041 1.00 0.00 H new ATOM 0 HB2 GLU A 102 6.588 -12.060 -9.586 1.00 0.00 H new ATOM 0 HB3 GLU A 102 5.327 -12.802 -10.551 1.00 0.00 H new ATOM 0 HG2 GLU A 102 6.979 -11.626 -11.958 1.00 0.00 H new ATOM 0 HG3 GLU A 102 5.373 -10.950 -12.148 1.00 0.00 H new ATOM 1617 N ASN A 103 3.052 -9.615 -10.434 1.00 0.00 N ATOM 1618 CA ASN A 103 1.825 -9.159 -11.152 1.00 0.00 C ATOM 1619 C ASN A 103 0.526 -9.526 -10.384 1.00 0.00 C ATOM 1620 O ASN A 103 -0.537 -9.710 -10.992 1.00 0.00 O ATOM 1621 CB ASN A 103 1.778 -9.692 -12.619 1.00 0.00 C ATOM 1622 CG ASN A 103 2.903 -9.145 -13.507 1.00 0.00 C ATOM 1623 OD1 ASN A 103 2.781 -8.064 -14.078 1.00 0.00 O ATOM 1624 ND2 ASN A 103 3.981 -9.899 -13.657 1.00 0.00 N ATOM 0 H ASN A 103 3.665 -8.844 -10.169 1.00 0.00 H new ATOM 0 HA ASN A 103 1.880 -8.071 -11.196 1.00 0.00 H new ATOM 0 HB2 ASN A 103 1.835 -10.780 -12.603 1.00 0.00 H new ATOM 0 HB3 ASN A 103 0.817 -9.430 -13.061 1.00 0.00 H new ATOM 0 HD21 ASN A 103 4.741 -9.587 -14.261 1.00 0.00 H new ATOM 0 HD22 ASN A 103 4.051 -10.792 -13.168 1.00 0.00 H new ATOM 1631 N GLY A 104 0.620 -9.581 -9.038 1.00 0.00 N ATOM 1632 CA GLY A 104 -0.525 -9.907 -8.170 1.00 0.00 C ATOM 1633 C GLY A 104 -0.818 -11.410 -8.071 1.00 0.00 C ATOM 1634 O GLY A 104 -1.742 -11.833 -7.363 1.00 0.00 O ATOM 0 H GLY A 104 1.485 -9.402 -8.529 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -0.334 -9.517 -7.170 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -1.412 -9.397 -8.547 1.00 0.00 H new ATOM 1638 N ARG A 105 -0.009 -12.211 -8.773 1.00 0.00 N ATOM 1639 CA ARG A 105 -0.135 -13.672 -8.828 1.00 0.00 C ATOM 1640 C ARG A 105 1.139 -14.256 -8.230 1.00 0.00 C ATOM 1641 O ARG A 105 2.226 -13.749 -8.500 1.00 0.00 O ATOM 1642 CB ARG A 105 -0.297 -14.161 -10.295 1.00 0.00 C ATOM 1643 CG ARG A 105 -1.520 -13.601 -11.050 1.00 0.00 C ATOM 1644 CD ARG A 105 -2.871 -14.066 -10.469 1.00 0.00 C ATOM 1645 NE ARG A 105 -4.002 -13.476 -11.220 1.00 0.00 N ATOM 1646 CZ ARG A 105 -5.130 -14.107 -11.583 1.00 0.00 C ATOM 1647 NH1 ARG A 105 -5.338 -15.383 -11.284 1.00 0.00 N ATOM 1648 NH2 ARG A 105 -6.047 -13.448 -12.270 1.00 0.00 N ATOM 0 H ARG A 105 0.768 -11.855 -9.330 1.00 0.00 H new ATOM 0 HA ARG A 105 -1.017 -13.993 -8.274 1.00 0.00 H new ATOM 0 HB2 ARG A 105 0.603 -13.896 -10.850 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -0.361 -15.249 -10.292 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -1.481 -12.512 -11.030 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -1.460 -13.903 -12.096 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -2.932 -15.154 -10.507 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -2.938 -13.779 -9.419 1.00 0.00 H new ATOM 0 HE ARG A 105 -3.916 -12.495 -11.487 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -4.632 -15.907 -10.767 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -6.204 -15.840 -11.571 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -5.894 -12.471 -12.519 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -6.908 -13.917 -12.551 1.00 0.00 H new ATOM 1662 N ILE A 106 1.013 -15.305 -7.421 1.00 0.00 N ATOM 1663 CA ILE A 106 2.174 -15.957 -6.803 1.00 0.00 C ATOM 1664 C ILE A 106 2.989 -16.662 -7.891 1.00 0.00 C ATOM 1665 O ILE A 106 2.560 -17.684 -8.424 1.00 0.00 O ATOM 1666 CB ILE A 106 1.732 -16.980 -5.702 1.00 0.00 C ATOM 1667 CG1 ILE A 106 0.840 -16.272 -4.644 1.00 0.00 C ATOM 1668 CG2 ILE A 106 2.955 -17.656 -5.029 1.00 0.00 C ATOM 1669 CD1 ILE A 106 0.182 -17.206 -3.655 1.00 0.00 C ATOM 0 H ILE A 106 0.117 -15.726 -7.175 1.00 0.00 H new ATOM 0 HA ILE A 106 2.787 -15.198 -6.317 1.00 0.00 H new ATOM 0 HB ILE A 106 1.151 -17.767 -6.183 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.449 -15.553 -4.096 1.00 0.00 H new ATOM 0 HG13 ILE A 106 0.065 -15.705 -5.161 1.00 0.00 H new ATOM 0 HG21 ILE A 106 2.610 -18.359 -4.271 1.00 0.00 H new ATOM 0 HG22 ILE A 106 3.536 -18.189 -5.782 1.00 0.00 H new ATOM 0 HG23 ILE A 106 3.580 -16.895 -4.561 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.421 -16.628 -2.954 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.457 -17.910 -4.189 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.948 -17.755 -3.108 1.00 0.00 H new ATOM 1681 N ALA A 107 4.140 -16.075 -8.238 1.00 0.00 N ATOM 1682 CA ALA A 107 5.012 -16.588 -9.304 1.00 0.00 C ATOM 1683 C ALA A 107 5.828 -17.785 -8.807 1.00 0.00 C ATOM 1684 O ALA A 107 6.136 -18.705 -9.575 1.00 0.00 O ATOM 1685 CB ALA A 107 5.937 -15.469 -9.801 1.00 0.00 C ATOM 0 H ALA A 107 4.494 -15.231 -7.788 1.00 0.00 H new ATOM 0 HA ALA A 107 4.392 -16.927 -10.134 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.582 -15.854 -10.591 1.00 0.00 H new ATOM 0 HB2 ALA A 107 5.337 -14.647 -10.191 1.00 0.00 H new ATOM 0 HB3 ALA A 107 6.551 -15.110 -8.975 1.00 0.00 H new ATOM 1691 N LYS A 108 6.161 -17.759 -7.506 1.00 0.00 N ATOM 1692 CA LYS A 108 6.945 -18.808 -6.835 1.00 0.00 C ATOM 1693 C LYS A 108 6.507 -18.856 -5.370 1.00 0.00 C ATOM 1694 O LYS A 108 6.367 -17.809 -4.740 1.00 0.00 O ATOM 1695 CB LYS A 108 8.481 -18.525 -6.918 1.00 0.00 C ATOM 1696 CG LYS A 108 9.103 -18.643 -8.332 1.00 0.00 C ATOM 1697 CD LYS A 108 10.593 -18.242 -8.392 1.00 0.00 C ATOM 1698 CE LYS A 108 11.507 -19.163 -7.568 1.00 0.00 C ATOM 1699 NZ LYS A 108 12.925 -18.748 -7.657 1.00 0.00 N ATOM 0 H LYS A 108 5.889 -16.999 -6.883 1.00 0.00 H new ATOM 0 HA LYS A 108 6.765 -19.762 -7.331 1.00 0.00 H new ATOM 0 HB2 LYS A 108 8.669 -17.520 -6.540 1.00 0.00 H new ATOM 0 HB3 LYS A 108 8.997 -19.218 -6.253 1.00 0.00 H new ATOM 0 HG2 LYS A 108 8.998 -19.671 -8.680 1.00 0.00 H new ATOM 0 HG3 LYS A 108 8.539 -18.014 -9.021 1.00 0.00 H new ATOM 0 HD2 LYS A 108 10.922 -18.251 -9.431 1.00 0.00 H new ATOM 0 HD3 LYS A 108 10.701 -17.219 -8.032 1.00 0.00 H new ATOM 0 HE2 LYS A 108 11.189 -19.153 -6.525 1.00 0.00 H new ATOM 0 HE3 LYS A 108 11.405 -20.189 -7.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 13.512 -19.392 -7.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 13.235 -18.782 -8.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 13.026 -17.778 -7.296 1.00 0.00 H new ATOM 1713 N ALA A 109 6.274 -20.059 -4.839 1.00 0.00 N ATOM 1714 CA ALA A 109 5.883 -20.249 -3.432 1.00 0.00 C ATOM 1715 C ALA A 109 6.766 -21.312 -2.800 1.00 0.00 C ATOM 1716 O ALA A 109 6.953 -22.383 -3.367 1.00 0.00 O ATOM 1717 CB ALA A 109 4.414 -20.659 -3.339 1.00 0.00 C ATOM 0 H ALA A 109 6.350 -20.929 -5.367 1.00 0.00 H new ATOM 0 HA ALA A 109 6.012 -19.309 -2.896 1.00 0.00 H new ATOM 0 HB1 ALA A 109 4.140 -20.796 -2.293 1.00 0.00 H new ATOM 0 HB2 ALA A 109 3.790 -19.881 -3.779 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.262 -21.594 -3.879 1.00 0.00 H new ATOM 1723 N TRP A 110 7.289 -21.005 -1.616 1.00 0.00 N ATOM 1724 CA TRP A 110 8.209 -21.876 -0.875 1.00 0.00 C ATOM 1725 C TRP A 110 7.703 -21.944 0.574 1.00 0.00 C ATOM 1726 O TRP A 110 7.096 -20.982 1.056 1.00 0.00 O ATOM 1727 CB TRP A 110 9.680 -21.312 -0.933 1.00 0.00 C ATOM 1728 CG TRP A 110 10.047 -20.583 -2.226 1.00 0.00 C ATOM 1729 CD1 TRP A 110 10.109 -21.115 -3.477 1.00 0.00 C ATOM 1730 CD2 TRP A 110 10.392 -19.190 -2.382 1.00 0.00 C ATOM 1731 NE1 TRP A 110 10.440 -20.156 -4.395 1.00 0.00 N ATOM 1732 CE2 TRP A 110 10.634 -18.968 -3.745 1.00 0.00 C ATOM 1733 CE3 TRP A 110 10.515 -18.115 -1.503 1.00 0.00 C ATOM 1734 CZ2 TRP A 110 10.979 -17.717 -4.251 1.00 0.00 C ATOM 1735 CZ3 TRP A 110 10.873 -16.875 -2.001 1.00 0.00 C ATOM 1736 CH2 TRP A 110 11.101 -16.685 -3.365 1.00 0.00 C ATOM 0 H TRP A 110 7.085 -20.130 -1.133 1.00 0.00 H new ATOM 0 HA TRP A 110 8.234 -22.872 -1.316 1.00 0.00 H new ATOM 0 HB2 TRP A 110 9.823 -20.628 -0.096 1.00 0.00 H new ATOM 0 HB3 TRP A 110 10.375 -22.139 -0.791 1.00 0.00 H new ATOM 0 HD1 TRP A 110 9.922 -22.152 -3.713 1.00 0.00 H new ATOM 0 HE1 TRP A 110 10.528 -20.303 -5.401 1.00 0.00 H new ATOM 0 HE3 TRP A 110 10.333 -18.249 -0.447 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 11.144 -17.568 -5.308 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 10.978 -16.040 -1.324 1.00 0.00 H new ATOM 0 HH2 TRP A 110 11.379 -15.706 -3.726 1.00 0.00 H new ATOM 1747 N PHE A 111 7.912 -23.069 1.266 1.00 0.00 N ATOM 1748 CA PHE A 111 7.583 -23.170 2.703 1.00 0.00 C ATOM 1749 C PHE A 111 8.634 -24.011 3.422 1.00 0.00 C ATOM 1750 O PHE A 111 9.199 -24.949 2.841 1.00 0.00 O ATOM 1751 CB PHE A 111 6.148 -23.737 2.933 1.00 0.00 C ATOM 1752 CG PHE A 111 5.968 -25.233 2.655 1.00 0.00 C ATOM 1753 CD1 PHE A 111 5.756 -25.706 1.365 1.00 0.00 C ATOM 1754 CD2 PHE A 111 6.007 -26.165 3.700 1.00 0.00 C ATOM 1755 CE1 PHE A 111 5.592 -27.059 1.127 1.00 0.00 C ATOM 1756 CE2 PHE A 111 5.843 -27.512 3.456 1.00 0.00 C ATOM 1757 CZ PHE A 111 5.633 -27.960 2.170 1.00 0.00 C ATOM 0 H PHE A 111 8.304 -23.920 0.863 1.00 0.00 H new ATOM 0 HA PHE A 111 7.593 -22.164 3.124 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.863 -23.542 3.967 1.00 0.00 H new ATOM 0 HB3 PHE A 111 5.454 -23.183 2.301 1.00 0.00 H new ATOM 0 HD1 PHE A 111 5.719 -25.010 0.540 1.00 0.00 H new ATOM 0 HD2 PHE A 111 6.168 -25.823 4.712 1.00 0.00 H new ATOM 0 HE1 PHE A 111 5.431 -27.411 0.119 1.00 0.00 H new ATOM 0 HE2 PHE A 111 5.879 -28.217 4.274 1.00 0.00 H new ATOM 0 HZ PHE A 111 5.501 -29.015 1.979 1.00 0.00 H new ATOM 1767 N LYS A 112 8.901 -23.659 4.688 1.00 0.00 N ATOM 1768 CA LYS A 112 9.778 -24.436 5.568 1.00 0.00 C ATOM 1769 C LYS A 112 8.983 -24.865 6.811 1.00 0.00 C ATOM 1770 O LYS A 112 8.353 -24.031 7.466 1.00 0.00 O ATOM 1771 CB LYS A 112 11.059 -23.634 5.958 1.00 0.00 C ATOM 1772 CG LYS A 112 10.833 -22.344 6.784 1.00 0.00 C ATOM 1773 CD LYS A 112 12.159 -21.726 7.298 1.00 0.00 C ATOM 1774 CE LYS A 112 11.939 -20.515 8.224 1.00 0.00 C ATOM 1775 NZ LYS A 112 11.294 -19.370 7.526 1.00 0.00 N ATOM 0 H LYS A 112 8.513 -22.825 5.129 1.00 0.00 H new ATOM 0 HA LYS A 112 10.121 -25.324 5.036 1.00 0.00 H new ATOM 0 HB2 LYS A 112 11.716 -24.293 6.525 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.588 -23.367 5.043 1.00 0.00 H new ATOM 0 HG2 LYS A 112 10.309 -21.611 6.171 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.188 -22.569 7.633 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.725 -22.488 7.834 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.765 -21.419 6.446 1.00 0.00 H new ATOM 0 HE2 LYS A 112 11.320 -20.816 9.069 1.00 0.00 H new ATOM 0 HE3 LYS A 112 12.898 -20.194 8.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 10.526 -18.992 8.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.999 -18.625 7.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 10.905 -19.692 6.617 1.00 0.00 H new ATOM 1789 N ILE A 113 8.997 -26.172 7.126 1.00 0.00 N ATOM 1790 CA ILE A 113 8.343 -26.702 8.332 1.00 0.00 C ATOM 1791 C ILE A 113 9.362 -26.671 9.478 1.00 0.00 C ATOM 1792 O ILE A 113 10.477 -27.197 9.349 1.00 0.00 O ATOM 1793 CB ILE A 113 7.771 -28.156 8.110 1.00 0.00 C ATOM 1794 CG1 ILE A 113 6.557 -28.116 7.124 1.00 0.00 C ATOM 1795 CG2 ILE A 113 7.355 -28.835 9.454 1.00 0.00 C ATOM 1796 CD1 ILE A 113 6.091 -29.479 6.637 1.00 0.00 C ATOM 0 H ILE A 113 9.457 -26.883 6.558 1.00 0.00 H new ATOM 0 HA ILE A 113 7.483 -26.079 8.578 1.00 0.00 H new ATOM 0 HB ILE A 113 8.569 -28.757 7.675 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.723 -27.616 7.616 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.828 -27.509 6.260 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.967 -29.834 9.252 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.223 -28.908 10.109 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.584 -28.238 9.940 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.247 -29.354 5.959 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.907 -29.977 6.113 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.785 -30.085 7.490 1.00 0.00 H new ATOM 1808 N GLY A 114 8.959 -26.011 10.568 1.00 0.00 N ATOM 1809 CA GLY A 114 9.808 -25.817 11.746 1.00 0.00 C ATOM 1810 C GLY A 114 10.167 -27.127 12.442 1.00 0.00 C ATOM 1811 O GLY A 114 11.304 -27.604 12.331 1.00 0.00 O ATOM 0 H GLY A 114 8.032 -25.595 10.658 1.00 0.00 H new ATOM 0 HA2 GLY A 114 10.724 -25.307 11.447 1.00 0.00 H new ATOM 0 HA3 GLY A 114 9.296 -25.164 12.453 1.00 0.00 H new ATOM 1815 N GLU A 115 9.182 -27.707 13.148 1.00 0.00 N ATOM 1816 CA GLU A 115 9.338 -29.005 13.836 1.00 0.00 C ATOM 1817 C GLU A 115 7.943 -29.612 14.127 1.00 0.00 C ATOM 1818 O GLU A 115 6.926 -28.924 13.938 1.00 0.00 O ATOM 1819 CB GLU A 115 10.148 -28.819 15.158 1.00 0.00 C ATOM 1820 CG GLU A 115 9.356 -28.162 16.301 1.00 0.00 C ATOM 1821 CD GLU A 115 10.175 -28.008 17.593 1.00 0.00 C ATOM 1822 OE1 GLU A 115 10.954 -27.033 17.706 1.00 0.00 O ATOM 1823 OE2 GLU A 115 10.023 -28.851 18.509 1.00 0.00 O ATOM 0 H GLU A 115 8.257 -27.293 13.259 1.00 0.00 H new ATOM 0 HA GLU A 115 9.890 -29.690 13.193 1.00 0.00 H new ATOM 0 HB2 GLU A 115 10.504 -29.794 15.492 1.00 0.00 H new ATOM 0 HB3 GLU A 115 11.029 -28.213 14.948 1.00 0.00 H new ATOM 0 HG2 GLU A 115 9.011 -27.180 15.978 1.00 0.00 H new ATOM 0 HG3 GLU A 115 8.468 -28.759 16.510 1.00 0.00 H new ATOM 1830 N PRO A 116 7.858 -30.908 14.580 1.00 0.00 N ATOM 1831 CA PRO A 116 6.617 -31.457 15.175 1.00 0.00 C ATOM 1832 C PRO A 116 6.362 -30.914 16.604 1.00 0.00 C ATOM 1833 O PRO A 116 7.224 -31.017 17.488 1.00 0.00 O ATOM 1834 CB PRO A 116 6.872 -32.981 15.163 1.00 0.00 C ATOM 1835 CG PRO A 116 8.358 -33.120 15.280 1.00 0.00 C ATOM 1836 CD PRO A 116 8.926 -31.959 14.487 1.00 0.00 C ATOM 0 HA PRO A 116 5.719 -31.173 14.626 1.00 0.00 H new ATOM 0 HB2 PRO A 116 6.362 -33.474 15.991 1.00 0.00 H new ATOM 0 HB3 PRO A 116 6.503 -33.437 14.244 1.00 0.00 H new ATOM 0 HG2 PRO A 116 8.677 -33.080 16.321 1.00 0.00 H new ATOM 0 HG3 PRO A 116 8.698 -34.075 14.879 1.00 0.00 H new ATOM 0 HD2 PRO A 116 9.869 -31.610 14.908 1.00 0.00 H new ATOM 0 HD3 PRO A 116 9.123 -32.239 13.452 1.00 0.00 H new ATOM 1844 N ARG A 117 5.181 -30.307 16.799 1.00 0.00 N ATOM 1845 CA ARG A 117 4.699 -29.833 18.109 1.00 0.00 C ATOM 1846 C ARG A 117 3.530 -30.718 18.569 1.00 0.00 C ATOM 1847 O ARG A 117 2.782 -31.244 17.738 1.00 0.00 O ATOM 1848 CB ARG A 117 4.276 -28.336 18.016 1.00 0.00 C ATOM 1849 CG ARG A 117 5.462 -27.357 17.873 1.00 0.00 C ATOM 1850 CD ARG A 117 6.315 -27.276 19.156 1.00 0.00 C ATOM 1851 NE ARG A 117 7.598 -26.588 18.934 1.00 0.00 N ATOM 1852 CZ ARG A 117 7.812 -25.265 18.978 1.00 0.00 C ATOM 1853 NH1 ARG A 117 6.841 -24.415 19.308 1.00 0.00 N ATOM 1854 NH2 ARG A 117 9.024 -24.802 18.689 1.00 0.00 N ATOM 0 H ARG A 117 4.523 -30.128 16.040 1.00 0.00 H new ATOM 0 HA ARG A 117 5.499 -29.905 18.846 1.00 0.00 H new ATOM 0 HB2 ARG A 117 3.609 -28.210 17.163 1.00 0.00 H new ATOM 0 HB3 ARG A 117 3.707 -28.074 18.908 1.00 0.00 H new ATOM 0 HG2 ARG A 117 6.091 -27.672 17.041 1.00 0.00 H new ATOM 0 HG3 ARG A 117 5.083 -26.365 17.628 1.00 0.00 H new ATOM 0 HD2 ARG A 117 5.754 -26.752 19.930 1.00 0.00 H new ATOM 0 HD3 ARG A 117 6.505 -28.283 19.527 1.00 0.00 H new ATOM 0 HE ARG A 117 8.405 -27.177 18.726 1.00 0.00 H new ATOM 0 HH11 ARG A 117 5.911 -24.766 19.534 1.00 0.00 H new ATOM 0 HH12 ARG A 117 7.028 -23.413 19.335 1.00 0.00 H new ATOM 0 HH21 ARG A 117 9.771 -25.450 18.439 1.00 0.00 H new ATOM 0 HH22 ARG A 117 9.207 -23.799 18.717 1.00 0.00 H new ATOM 1868 N ILE A 118 3.412 -30.905 19.898 1.00 0.00 N ATOM 1869 CA ILE A 118 2.344 -31.708 20.535 1.00 0.00 C ATOM 1870 C ILE A 118 1.872 -30.962 21.799 1.00 0.00 C ATOM 1871 O ILE A 118 2.696 -30.609 22.654 1.00 0.00 O ATOM 1872 CB ILE A 118 2.838 -33.176 20.899 1.00 0.00 C ATOM 1873 CG1 ILE A 118 3.195 -33.994 19.616 1.00 0.00 C ATOM 1874 CG2 ILE A 118 1.790 -33.950 21.739 1.00 0.00 C ATOM 1875 CD1 ILE A 118 2.011 -34.278 18.701 1.00 0.00 C ATOM 0 H ILE A 118 4.063 -30.498 20.570 1.00 0.00 H new ATOM 0 HA ILE A 118 1.519 -31.826 19.832 1.00 0.00 H new ATOM 0 HB ILE A 118 3.738 -33.057 21.502 1.00 0.00 H new ATOM 0 HG12 ILE A 118 3.952 -33.450 19.052 1.00 0.00 H new ATOM 0 HG13 ILE A 118 3.642 -34.942 19.917 1.00 0.00 H new ATOM 0 HG21 ILE A 118 2.169 -34.947 21.965 1.00 0.00 H new ATOM 0 HG22 ILE A 118 1.602 -33.414 22.669 1.00 0.00 H new ATOM 0 HG23 ILE A 118 0.861 -34.034 21.174 1.00 0.00 H new ATOM 0 HD11 ILE A 118 2.348 -34.849 17.836 1.00 0.00 H new ATOM 0 HD12 ILE A 118 1.260 -34.852 19.245 1.00 0.00 H new ATOM 0 HD13 ILE A 118 1.576 -33.336 18.366 1.00 0.00 H new ATOM 1887 N VAL A 119 0.543 -30.751 21.907 1.00 0.00 N ATOM 1888 CA VAL A 119 -0.083 -29.973 23.011 1.00 0.00 C ATOM 1889 C VAL A 119 0.119 -30.661 24.384 1.00 0.00 C ATOM 1890 O VAL A 119 0.210 -29.993 25.418 1.00 0.00 O ATOM 1891 CB VAL A 119 -1.630 -29.749 22.762 1.00 0.00 C ATOM 1892 CG1 VAL A 119 -2.263 -28.836 23.849 1.00 0.00 C ATOM 1893 CG2 VAL A 119 -1.898 -29.181 21.349 1.00 0.00 C ATOM 0 H VAL A 119 -0.132 -31.113 21.233 1.00 0.00 H new ATOM 0 HA VAL A 119 0.417 -29.005 23.026 1.00 0.00 H new ATOM 0 HB VAL A 119 -2.107 -30.727 22.831 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.325 -28.707 23.642 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.137 -29.296 24.829 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -1.771 -27.864 23.839 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -2.970 -29.039 21.211 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.388 -28.224 21.239 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.525 -29.879 20.599 1.00 0.00 H new ATOM 1903 N SER A 120 0.198 -32.003 24.377 1.00 0.00 N ATOM 1904 CA SER A 120 0.385 -32.805 25.603 1.00 0.00 C ATOM 1905 C SER A 120 1.796 -32.576 26.195 1.00 0.00 C ATOM 1906 O SER A 120 1.988 -32.626 27.416 1.00 0.00 O ATOM 1907 CB SER A 120 0.149 -34.303 25.304 1.00 0.00 C ATOM 1908 OG SER A 120 0.160 -35.083 26.492 1.00 0.00 O ATOM 0 H SER A 120 0.135 -32.562 23.526 1.00 0.00 H new ATOM 0 HA SER A 120 -0.347 -32.483 26.344 1.00 0.00 H new ATOM 0 HB2 SER A 120 -0.807 -34.427 24.796 1.00 0.00 H new ATOM 0 HB3 SER A 120 0.920 -34.665 24.624 1.00 0.00 H new ATOM 0 HG SER A 120 0.006 -36.024 26.267 1.00 0.00 H new ATOM 1914 N GLN A 121 2.768 -32.312 25.303 1.00 0.00 N ATOM 1915 CA GLN A 121 4.173 -32.045 25.664 1.00 0.00 C ATOM 1916 C GLN A 121 4.359 -30.570 26.089 1.00 0.00 C ATOM 1917 O GLN A 121 5.132 -30.267 27.001 1.00 0.00 O ATOM 1918 CB GLN A 121 5.077 -32.402 24.451 1.00 0.00 C ATOM 1919 CG GLN A 121 6.587 -32.109 24.625 1.00 0.00 C ATOM 1920 CD GLN A 121 7.467 -32.581 23.455 1.00 0.00 C ATOM 1921 OE1 GLN A 121 8.628 -32.941 23.645 1.00 0.00 O ATOM 1922 NE2 GLN A 121 6.937 -32.567 22.236 1.00 0.00 N ATOM 0 H GLN A 121 2.598 -32.278 24.298 1.00 0.00 H new ATOM 0 HA GLN A 121 4.458 -32.662 26.516 1.00 0.00 H new ATOM 0 HB2 GLN A 121 4.955 -33.463 24.231 1.00 0.00 H new ATOM 0 HB3 GLN A 121 4.718 -31.853 23.581 1.00 0.00 H new ATOM 0 HG2 GLN A 121 6.723 -31.035 24.756 1.00 0.00 H new ATOM 0 HG3 GLN A 121 6.934 -32.588 25.541 1.00 0.00 H new ATOM 0 HE21 GLN A 121 5.972 -32.265 22.103 1.00 0.00 H new ATOM 0 HE22 GLN A 121 7.495 -32.859 21.434 1.00 0.00 H new ATOM 1931 N LYS A 122 3.638 -29.665 25.413 1.00 0.00 N ATOM 1932 CA LYS A 122 3.730 -28.209 25.644 1.00 0.00 C ATOM 1933 C LYS A 122 2.574 -27.773 26.568 1.00 0.00 C ATOM 1934 O LYS A 122 1.426 -27.669 26.121 1.00 0.00 O ATOM 1935 CB LYS A 122 3.704 -27.479 24.259 1.00 0.00 C ATOM 1936 CG LYS A 122 3.994 -25.946 24.251 1.00 0.00 C ATOM 1937 CD LYS A 122 2.784 -25.061 24.658 1.00 0.00 C ATOM 1938 CE LYS A 122 3.054 -23.558 24.484 1.00 0.00 C ATOM 1939 NZ LYS A 122 3.286 -23.191 23.057 1.00 0.00 N ATOM 0 H LYS A 122 2.970 -29.920 24.686 1.00 0.00 H new ATOM 0 HA LYS A 122 4.662 -27.942 26.142 1.00 0.00 H new ATOM 0 HB2 LYS A 122 4.433 -27.963 23.609 1.00 0.00 H new ATOM 0 HB3 LYS A 122 2.723 -27.639 23.812 1.00 0.00 H new ATOM 0 HG2 LYS A 122 4.822 -25.742 24.930 1.00 0.00 H new ATOM 0 HG3 LYS A 122 4.321 -25.656 23.253 1.00 0.00 H new ATOM 0 HD2 LYS A 122 1.918 -25.341 24.058 1.00 0.00 H new ATOM 0 HD3 LYS A 122 2.529 -25.261 25.699 1.00 0.00 H new ATOM 0 HE2 LYS A 122 2.207 -22.991 24.871 1.00 0.00 H new ATOM 0 HE3 LYS A 122 3.924 -23.275 25.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 3.262 -22.156 22.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 4.215 -23.547 22.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 2.543 -23.614 22.465 1.00 0.00 H new ATOM 1953 N SER A 123 2.879 -27.529 27.854 1.00 0.00 N ATOM 1954 CA SER A 123 1.880 -27.148 28.869 1.00 0.00 C ATOM 1955 C SER A 123 2.377 -25.898 29.640 1.00 0.00 C ATOM 1956 O SER A 123 3.096 -26.044 30.658 1.00 0.00 O ATOM 1957 CB SER A 123 1.620 -28.352 29.814 1.00 0.00 C ATOM 1958 OG SER A 123 1.360 -29.534 29.075 1.00 0.00 O ATOM 1959 OXT SER A 123 2.083 -24.762 29.192 1.00 0.00 O ATOM 0 H SER A 123 3.829 -27.591 28.221 1.00 0.00 H new ATOM 0 HA SER A 123 0.934 -26.889 28.394 1.00 0.00 H new ATOM 0 HB2 SER A 123 2.485 -28.506 30.459 1.00 0.00 H new ATOM 0 HB3 SER A 123 0.773 -28.132 30.464 1.00 0.00 H new ATOM 0 HG SER A 123 1.201 -30.278 29.693 1.00 0.00 H new TER 1965 SER A 123