USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1123 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 91 THR OG1 : rot 125:sc= 1.19 USER MOD Set 1.2: A 116 THR OG1 : rot -163:sc= 1.05 USER MOD Set 2.1: A 89 GLN : amide:sc= -0.303 X(o=0.53,f=0.58) USER MOD Set 2.2: A 117 THR OG1 : rot 70:sc= 0.538 USER MOD Set 2.3: A 119 THR OG1 : rot 140:sc= 0.293 USER MOD Set 3.1: A 35 CYS SG : rot 180:sc= 0.701 USER MOD Set 3.2: A 96 GLN :FLIP amide:sc= 1.27 F(o=0.52,f=2) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 161:sc= 1.41 (180deg=0.346) USER MOD Single : A 3 HIS : no HD1:sc= -0.125 X(o=-0.12,f=-0.043) USER MOD Single : A 7 TYR OH : rot -38:sc= 1.23 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0938 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 GLN : amide:sc= -1.47 K(o=-1.5,f=-2.9) USER MOD Single : A 16 ASN : amide:sc= -0.046 X(o=-0.046,f=0) USER MOD Single : A 17 HIS : no HD1:sc= -0.406 X(o=-0.41,f=-0.018) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -109:sc= -1.63 (180deg=-1.95) USER MOD Single : A 23 HIS : no HD1:sc= -0.0138 X(o=-0.014,f=-0.014) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -0.625 K(o=-0.63,f=-1.6) USER MOD Single : A 36 THR OG1 : rot 41:sc= 1.16 USER MOD Single : A 39 SER OG : rot 180:sc= 0.055 USER MOD Single : A 48 HIS : no HE2:sc= 0.551 K(o=0.55,f=-1.7!) USER MOD Single : A 49 ASN : amide:sc= -0.264 X(o=-0.26,f=0.03) USER MOD Single : A 55 TYR OH : rot 35:sc= 1.16 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HD1:sc= -0.0927 X(o=-0.093,f=0) USER MOD Single : A 62 CYS SG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot -162:sc= 1.29 USER MOD Single : A 73 GLN : amide:sc= -0.285 X(o=-0.28,f=-0.32) USER MOD Single : A 74 MET CE :methyl 167:sc= -0.0796 (180deg=-0.482) USER MOD Single : A 84 CYS SG : rot -53:sc= -0.366 USER MOD Single : A 86 SER OG : rot 122:sc= 1.39 USER MOD Single : A 87 MET CE :methyl 170:sc= -0.0877 (180deg=-0.185) USER MOD Single : A 88 TYR OH : rot 147:sc= 1.26 USER MOD Single : A 94 GLN : amide:sc= 0.718 K(o=0.72,f=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 GLN : amide:sc= -0.243 X(o=-0.24,f=-0.11) USER MOD Single : A 112 CYS SG : rot 180:sc= -0.133 USER MOD Single : A 115 TYR OH : rot -174:sc= 1.22 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 50:sc= 0.938 USER MOD Single : A 130 HIS : no HD1:sc= -0.0435 X(o=-0.044,f=-0.38) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 139 HIS : no HD1:sc= -1.55 K(o=-1.5,f=-2.2!) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -0.321 K(o=-0.32,f=-1.7) USER MOD Single : A 148 ASN :FLIP amide:sc= 0 F(o=-1.6!,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.616 -3.977 8.873 1.00 0.00 N ATOM 2 CA MET A 1 -16.440 -3.693 7.439 1.00 0.00 C ATOM 3 C MET A 1 -15.354 -2.635 7.314 1.00 0.00 C ATOM 4 O MET A 1 -15.630 -1.453 7.538 1.00 0.00 O ATOM 5 CB MET A 1 -17.744 -3.226 6.758 1.00 0.00 C ATOM 6 CG MET A 1 -18.878 -4.250 6.822 1.00 0.00 C ATOM 7 SD MET A 1 -19.615 -4.448 8.464 1.00 0.00 S ATOM 8 CE MET A 1 -20.633 -5.905 8.142 1.00 0.00 C ATOM 0 H1 MET A 1 -17.538 -4.434 9.026 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.857 -4.610 9.197 1.00 0.00 H new ATOM 0 H3 MET A 1 -16.578 -3.087 9.410 1.00 0.00 H new ATOM 0 HA MET A 1 -16.154 -4.611 6.925 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.076 -2.301 7.228 1.00 0.00 H new ATOM 0 HB3 MET A 1 -17.534 -2.995 5.713 1.00 0.00 H new ATOM 0 HG2 MET A 1 -19.658 -3.955 6.120 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.498 -5.216 6.489 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.170 -6.181 9.049 1.00 0.00 H new ATOM 0 HE2 MET A 1 -21.349 -5.681 7.351 1.00 0.00 H new ATOM 0 HE3 MET A 1 -19.996 -6.733 7.831 1.00 0.00 H new ATOM 18 N ALA A 2 -14.117 -3.041 7.017 1.00 0.00 N ATOM 19 CA ALA A 2 -12.963 -2.154 7.022 1.00 0.00 C ATOM 20 C ALA A 2 -12.683 -1.711 5.591 1.00 0.00 C ATOM 21 O ALA A 2 -12.367 -2.539 4.743 1.00 0.00 O ATOM 22 CB ALA A 2 -11.764 -2.879 7.643 1.00 0.00 C ATOM 0 H ALA A 2 -13.892 -4.003 6.765 1.00 0.00 H new ATOM 0 HA ALA A 2 -13.157 -1.266 7.624 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -10.900 -2.215 7.647 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -12.004 -3.168 8.666 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -11.535 -3.770 7.058 1.00 0.00 H new ATOM 28 N HIS A 3 -12.816 -0.419 5.305 1.00 0.00 N ATOM 29 CA HIS A 3 -12.410 0.134 4.022 1.00 0.00 C ATOM 30 C HIS A 3 -10.920 0.477 4.075 1.00 0.00 C ATOM 31 O HIS A 3 -10.481 1.236 4.955 1.00 0.00 O ATOM 32 CB HIS A 3 -13.286 1.343 3.671 1.00 0.00 C ATOM 33 CG HIS A 3 -14.641 0.930 3.137 1.00 0.00 C ATOM 34 ND1 HIS A 3 -15.868 1.306 3.644 1.00 0.00 N ATOM 35 CD2 HIS A 3 -14.876 0.104 2.063 1.00 0.00 C ATOM 36 CE1 HIS A 3 -16.818 0.706 2.907 1.00 0.00 C ATOM 37 NE2 HIS A 3 -16.264 -0.035 1.930 1.00 0.00 N ATOM 0 H HIS A 3 -13.205 0.267 5.952 1.00 0.00 H new ATOM 0 HA HIS A 3 -12.553 -0.597 3.227 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -13.420 1.962 4.558 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -12.776 1.956 2.928 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -14.126 -0.355 1.435 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -17.880 0.805 3.076 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -16.757 -0.589 1.230 1.00 0.00 H new ATOM 45 N ILE A 4 -10.139 -0.110 3.164 1.00 0.00 N ATOM 46 CA ILE A 4 -8.700 0.097 3.026 1.00 0.00 C ATOM 47 C ILE A 4 -8.319 0.440 1.579 1.00 0.00 C ATOM 48 O ILE A 4 -9.151 0.432 0.663 1.00 0.00 O ATOM 49 CB ILE A 4 -7.898 -1.116 3.563 1.00 0.00 C ATOM 50 CG1 ILE A 4 -7.963 -2.369 2.661 1.00 0.00 C ATOM 51 CG2 ILE A 4 -8.338 -1.463 4.994 1.00 0.00 C ATOM 52 CD1 ILE A 4 -6.776 -3.305 2.897 1.00 0.00 C ATOM 0 H ILE A 4 -10.509 -0.767 2.477 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.431 0.956 3.641 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.854 -0.802 3.562 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -8.892 -2.906 2.852 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.981 -2.063 1.615 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -7.764 -2.317 5.354 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -8.163 -0.607 5.646 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -9.399 -1.711 4.998 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -6.861 -4.173 2.243 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.847 -2.777 2.680 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.773 -3.633 3.936 1.00 0.00 H new ATOM 64 N PHE A 5 -7.036 0.746 1.394 1.00 0.00 N ATOM 65 CA PHE A 5 -6.381 0.955 0.104 1.00 0.00 C ATOM 66 C PHE A 5 -5.505 -0.249 -0.257 1.00 0.00 C ATOM 67 O PHE A 5 -5.597 -1.310 0.369 1.00 0.00 O ATOM 68 CB PHE A 5 -5.588 2.271 0.226 1.00 0.00 C ATOM 69 CG PHE A 5 -5.234 3.004 -1.052 1.00 0.00 C ATOM 70 CD1 PHE A 5 -6.217 3.240 -2.026 1.00 0.00 C ATOM 71 CD2 PHE A 5 -3.937 3.517 -1.243 1.00 0.00 C ATOM 72 CE1 PHE A 5 -5.904 3.951 -3.193 1.00 0.00 C ATOM 73 CE2 PHE A 5 -3.619 4.229 -2.409 1.00 0.00 C ATOM 74 CZ PHE A 5 -4.607 4.450 -3.376 1.00 0.00 C ATOM 0 H PHE A 5 -6.394 0.860 2.178 1.00 0.00 H new ATOM 0 HA PHE A 5 -7.098 1.039 -0.712 1.00 0.00 H new ATOM 0 HB2 PHE A 5 -6.163 2.951 0.854 1.00 0.00 H new ATOM 0 HB3 PHE A 5 -4.660 2.055 0.756 1.00 0.00 H new ATOM 0 HD1 PHE A 5 -7.221 2.871 -1.875 1.00 0.00 H new ATOM 0 HD2 PHE A 5 -3.182 3.361 -0.487 1.00 0.00 H new ATOM 0 HE1 PHE A 5 -6.659 4.114 -3.948 1.00 0.00 H new ATOM 0 HE2 PHE A 5 -2.618 4.605 -2.560 1.00 0.00 H new ATOM 0 HZ PHE A 5 -4.368 5.009 -4.269 1.00 0.00 H new ATOM 84 N VAL A 6 -4.660 -0.100 -1.275 1.00 0.00 N ATOM 85 CA VAL A 6 -3.571 -1.016 -1.566 1.00 0.00 C ATOM 86 C VAL A 6 -2.337 -0.211 -1.990 1.00 0.00 C ATOM 87 O VAL A 6 -2.467 0.827 -2.639 1.00 0.00 O ATOM 88 CB VAL A 6 -4.046 -2.065 -2.592 1.00 0.00 C ATOM 89 CG1 VAL A 6 -4.343 -1.511 -3.986 1.00 0.00 C ATOM 90 CG2 VAL A 6 -3.039 -3.187 -2.738 1.00 0.00 C ATOM 0 H VAL A 6 -4.719 0.679 -1.931 1.00 0.00 H new ATOM 0 HA VAL A 6 -3.270 -1.582 -0.684 1.00 0.00 H new ATOM 0 HB VAL A 6 -4.986 -2.429 -2.178 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -4.670 -2.321 -4.638 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -5.130 -0.759 -3.919 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -3.441 -1.057 -4.397 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -3.403 -3.910 -3.468 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -2.086 -2.779 -3.075 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -2.902 -3.681 -1.776 1.00 0.00 H new ATOM 100 N TYR A 7 -1.145 -0.732 -1.676 1.00 0.00 N ATOM 101 CA TYR A 7 0.153 -0.113 -1.944 1.00 0.00 C ATOM 102 C TYR A 7 0.402 0.146 -3.436 1.00 0.00 C ATOM 103 O TYR A 7 1.129 1.075 -3.800 1.00 0.00 O ATOM 104 CB TYR A 7 1.268 -1.019 -1.376 1.00 0.00 C ATOM 105 CG TYR A 7 1.876 -0.516 -0.080 1.00 0.00 C ATOM 106 CD1 TYR A 7 1.046 -0.310 1.033 1.00 0.00 C ATOM 107 CD2 TYR A 7 3.257 -0.258 0.029 1.00 0.00 C ATOM 108 CE1 TYR A 7 1.557 0.241 2.216 1.00 0.00 C ATOM 109 CE2 TYR A 7 3.785 0.260 1.226 1.00 0.00 C ATOM 110 CZ TYR A 7 2.932 0.548 2.312 1.00 0.00 C ATOM 111 OH TYR A 7 3.422 1.145 3.432 1.00 0.00 O ATOM 0 H TYR A 7 -1.058 -1.634 -1.209 1.00 0.00 H new ATOM 0 HA TYR A 7 0.157 0.861 -1.456 1.00 0.00 H new ATOM 0 HB2 TYR A 7 0.861 -2.017 -1.211 1.00 0.00 H new ATOM 0 HB3 TYR A 7 2.057 -1.116 -2.121 1.00 0.00 H new ATOM 0 HD1 TYR A 7 0.002 -0.579 0.977 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.911 -0.458 -0.807 1.00 0.00 H new ATOM 0 HE1 TYR A 7 0.901 0.430 3.052 1.00 0.00 H new ATOM 0 HE2 TYR A 7 4.847 0.438 1.314 1.00 0.00 H new ATOM 0 HH TYR A 7 2.775 1.803 3.762 1.00 0.00 H new ATOM 121 N GLY A 8 -0.138 -0.717 -4.294 1.00 0.00 N ATOM 122 CA GLY A 8 0.180 -0.782 -5.713 1.00 0.00 C ATOM 123 C GLY A 8 0.213 -2.229 -6.206 1.00 0.00 C ATOM 124 O GLY A 8 -0.152 -2.502 -7.346 1.00 0.00 O ATOM 0 H GLY A 8 -0.830 -1.410 -4.009 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -0.560 -0.218 -6.281 1.00 0.00 H new ATOM 0 HA3 GLY A 8 1.146 -0.311 -5.894 1.00 0.00 H new ATOM 128 N THR A 9 0.597 -3.131 -5.305 1.00 0.00 N ATOM 129 CA THR A 9 0.804 -4.562 -5.428 1.00 0.00 C ATOM 130 C THR A 9 -0.459 -5.310 -5.873 1.00 0.00 C ATOM 131 O THR A 9 -0.519 -5.803 -7.003 1.00 0.00 O ATOM 132 CB THR A 9 1.331 -5.042 -4.065 1.00 0.00 C ATOM 133 OG1 THR A 9 0.669 -4.354 -3.015 1.00 0.00 O ATOM 134 CG2 THR A 9 2.829 -4.760 -3.928 1.00 0.00 C ATOM 0 H THR A 9 0.794 -2.830 -4.351 1.00 0.00 H new ATOM 0 HA THR A 9 1.526 -4.778 -6.216 1.00 0.00 H new ATOM 0 HB THR A 9 1.146 -6.114 -4.003 1.00 0.00 H new ATOM 0 HG1 THR A 9 1.010 -4.668 -2.152 1.00 0.00 H new ATOM 0 HG21 THR A 9 3.177 -5.109 -2.956 1.00 0.00 H new ATOM 0 HG22 THR A 9 3.371 -5.282 -4.716 1.00 0.00 H new ATOM 0 HG23 THR A 9 3.007 -3.688 -4.014 1.00 0.00 H new ATOM 142 N LEU A 10 -1.452 -5.467 -4.986 1.00 0.00 N ATOM 143 CA LEU A 10 -2.648 -6.279 -5.234 1.00 0.00 C ATOM 144 C LEU A 10 -3.622 -5.472 -6.122 1.00 0.00 C ATOM 145 O LEU A 10 -4.751 -5.171 -5.734 1.00 0.00 O ATOM 146 CB LEU A 10 -3.310 -6.803 -3.927 1.00 0.00 C ATOM 147 CG LEU A 10 -2.355 -7.404 -2.866 1.00 0.00 C ATOM 148 CD1 LEU A 10 -1.984 -6.364 -1.806 1.00 0.00 C ATOM 149 CD2 LEU A 10 -2.968 -8.581 -2.102 1.00 0.00 C ATOM 0 H LEU A 10 -1.445 -5.028 -4.066 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.354 -7.184 -5.766 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -3.857 -5.980 -3.467 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.044 -7.563 -4.196 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.487 -7.739 -3.434 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.313 -6.814 -1.074 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -1.487 -5.519 -2.283 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.888 -6.017 -1.305 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.249 -8.957 -1.374 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -3.868 -8.250 -1.585 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -3.224 -9.376 -2.803 1.00 0.00 H new ATOM 161 N LYS A 11 -3.156 -5.046 -7.301 1.00 0.00 N ATOM 162 CA LYS A 11 -3.854 -4.207 -8.274 1.00 0.00 C ATOM 163 C LYS A 11 -3.471 -4.674 -9.671 1.00 0.00 C ATOM 164 O LYS A 11 -4.330 -5.201 -10.365 1.00 0.00 O ATOM 165 CB LYS A 11 -3.535 -2.720 -8.020 1.00 0.00 C ATOM 166 CG LYS A 11 -4.181 -1.710 -8.990 1.00 0.00 C ATOM 167 CD LYS A 11 -3.411 -1.463 -10.306 1.00 0.00 C ATOM 168 CE LYS A 11 -3.584 -0.006 -10.775 1.00 0.00 C ATOM 169 NZ LYS A 11 -2.348 0.577 -11.347 1.00 0.00 N ATOM 0 H LYS A 11 -2.220 -5.296 -7.619 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.935 -4.304 -8.173 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -3.849 -2.471 -7.006 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.454 -2.590 -8.060 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -5.183 -2.060 -9.237 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -4.295 -0.758 -8.472 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -2.353 -1.680 -10.160 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.772 -2.143 -11.077 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -4.377 0.036 -11.522 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -3.908 0.604 -9.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -2.531 1.557 -11.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -1.595 0.567 -10.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -2.049 0.017 -12.171 1.00 0.00 H new ATOM 183 N ARG A 12 -2.203 -4.506 -10.079 1.00 0.00 N ATOM 184 CA ARG A 12 -1.763 -4.892 -11.412 1.00 0.00 C ATOM 185 C ARG A 12 -1.528 -6.400 -11.460 1.00 0.00 C ATOM 186 O ARG A 12 -2.346 -7.091 -12.051 1.00 0.00 O ATOM 187 CB ARG A 12 -0.565 -4.029 -11.844 1.00 0.00 C ATOM 188 CG ARG A 12 -0.026 -4.389 -13.233 1.00 0.00 C ATOM 189 CD ARG A 12 -1.062 -4.302 -14.370 1.00 0.00 C ATOM 190 NE ARG A 12 -0.393 -4.387 -15.675 1.00 0.00 N ATOM 191 CZ ARG A 12 -0.939 -4.525 -16.889 1.00 0.00 C ATOM 192 NH1 ARG A 12 -2.241 -4.714 -17.072 1.00 0.00 N ATOM 193 NH2 ARG A 12 -0.156 -4.486 -17.956 1.00 0.00 N ATOM 0 H ARG A 12 -1.469 -4.103 -9.496 1.00 0.00 H new ATOM 0 HA ARG A 12 -2.537 -4.694 -12.153 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -0.861 -2.980 -11.838 1.00 0.00 H new ATOM 0 HB3 ARG A 12 0.235 -4.139 -11.112 1.00 0.00 H new ATOM 0 HG2 ARG A 12 0.807 -3.726 -13.467 1.00 0.00 H new ATOM 0 HG3 ARG A 12 0.373 -5.403 -13.201 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -1.788 -5.109 -14.272 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -1.615 -3.365 -14.297 1.00 0.00 H new ATOM 0 HE ARG A 12 0.625 -4.334 -15.653 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -2.868 -4.759 -16.269 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -2.614 -4.814 -18.016 1.00 0.00 H new ATOM 0 HH21 ARG A 12 0.849 -4.352 -17.846 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -0.558 -4.590 -18.888 1.00 0.00 H new ATOM 207 N GLY A 13 -0.457 -6.909 -10.837 1.00 0.00 N ATOM 208 CA GLY A 13 -0.129 -8.334 -10.937 1.00 0.00 C ATOM 209 C GLY A 13 1.017 -8.815 -10.043 1.00 0.00 C ATOM 210 O GLY A 13 1.495 -9.936 -10.207 1.00 0.00 O ATOM 0 H GLY A 13 0.188 -6.363 -10.266 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -1.021 -8.911 -10.695 1.00 0.00 H new ATOM 0 HA3 GLY A 13 0.124 -8.558 -11.973 1.00 0.00 H new ATOM 214 N GLN A 14 1.468 -7.980 -9.099 1.00 0.00 N ATOM 215 CA GLN A 14 2.658 -8.170 -8.258 1.00 0.00 C ATOM 216 C GLN A 14 2.754 -9.546 -7.572 1.00 0.00 C ATOM 217 O GLN A 14 1.728 -10.209 -7.388 1.00 0.00 O ATOM 218 CB GLN A 14 2.668 -7.050 -7.208 1.00 0.00 C ATOM 219 CG GLN A 14 3.594 -5.888 -7.581 1.00 0.00 C ATOM 220 CD GLN A 14 2.986 -4.876 -8.543 1.00 0.00 C ATOM 221 OE1 GLN A 14 2.623 -3.790 -8.128 1.00 0.00 O ATOM 222 NE2 GLN A 14 2.900 -5.171 -9.830 1.00 0.00 N ATOM 0 H GLN A 14 0.987 -7.106 -8.889 1.00 0.00 H new ATOM 0 HA GLN A 14 3.529 -8.130 -8.912 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.654 -6.672 -7.078 1.00 0.00 H new ATOM 0 HB3 GLN A 14 2.980 -7.462 -6.248 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.890 -5.370 -6.669 1.00 0.00 H new ATOM 0 HG3 GLN A 14 4.502 -6.293 -8.027 1.00 0.00 H new ATOM 0 HE21 GLN A 14 3.207 -6.084 -10.166 1.00 0.00 H new ATOM 0 HE22 GLN A 14 2.527 -4.485 -10.486 1.00 0.00 H new ATOM 231 N PRO A 15 3.946 -9.913 -7.042 1.00 0.00 N ATOM 232 CA PRO A 15 4.229 -11.229 -6.452 1.00 0.00 C ATOM 233 C PRO A 15 3.277 -11.620 -5.316 1.00 0.00 C ATOM 234 O PRO A 15 3.175 -12.792 -4.951 1.00 0.00 O ATOM 235 CB PRO A 15 5.691 -11.172 -5.969 1.00 0.00 C ATOM 236 CG PRO A 15 6.011 -9.682 -5.881 1.00 0.00 C ATOM 237 CD PRO A 15 5.150 -9.086 -6.987 1.00 0.00 C ATOM 0 HA PRO A 15 4.074 -12.006 -7.201 1.00 0.00 H new ATOM 0 HB2 PRO A 15 5.808 -11.660 -5.001 1.00 0.00 H new ATOM 0 HB3 PRO A 15 6.358 -11.680 -6.665 1.00 0.00 H new ATOM 0 HG2 PRO A 15 5.756 -9.271 -4.904 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.071 -9.486 -6.043 1.00 0.00 H new ATOM 0 HD2 PRO A 15 4.901 -8.047 -6.772 1.00 0.00 H new ATOM 0 HD3 PRO A 15 5.676 -9.097 -7.941 1.00 0.00 H new ATOM 245 N ASN A 16 2.560 -10.648 -4.761 1.00 0.00 N ATOM 246 CA ASN A 16 1.845 -10.753 -3.509 1.00 0.00 C ATOM 247 C ASN A 16 0.371 -11.036 -3.752 1.00 0.00 C ATOM 248 O ASN A 16 -0.290 -11.513 -2.841 1.00 0.00 O ATOM 249 CB ASN A 16 2.022 -9.431 -2.744 1.00 0.00 C ATOM 250 CG ASN A 16 3.474 -8.972 -2.797 1.00 0.00 C ATOM 251 OD1 ASN A 16 4.375 -9.642 -2.308 1.00 0.00 O ATOM 252 ND2 ASN A 16 3.726 -7.925 -3.567 1.00 0.00 N ATOM 0 H ASN A 16 2.462 -9.730 -5.195 1.00 0.00 H new ATOM 0 HA ASN A 16 2.244 -11.581 -2.923 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.377 -8.666 -3.175 1.00 0.00 H new ATOM 0 HB3 ASN A 16 1.713 -9.561 -1.707 1.00 0.00 H new ATOM 0 HD21 ASN A 16 4.690 -7.659 -3.766 1.00 0.00 H new ATOM 0 HD22 ASN A 16 2.956 -7.385 -3.961 1.00 0.00 H new ATOM 259 N HIS A 17 -0.156 -10.763 -4.957 1.00 0.00 N ATOM 260 CA HIS A 17 -1.593 -10.631 -5.213 1.00 0.00 C ATOM 261 C HIS A 17 -2.393 -11.824 -4.681 1.00 0.00 C ATOM 262 O HIS A 17 -3.453 -11.632 -4.086 1.00 0.00 O ATOM 263 CB HIS A 17 -1.830 -10.405 -6.721 1.00 0.00 C ATOM 264 CG HIS A 17 -3.212 -9.899 -7.085 1.00 0.00 C ATOM 265 ND1 HIS A 17 -3.488 -8.778 -7.843 1.00 0.00 N ATOM 266 CD2 HIS A 17 -4.413 -10.498 -6.799 1.00 0.00 C ATOM 267 CE1 HIS A 17 -4.823 -8.688 -7.972 1.00 0.00 C ATOM 268 NE2 HIS A 17 -5.426 -9.721 -7.360 1.00 0.00 N ATOM 0 H HIS A 17 0.416 -10.626 -5.790 1.00 0.00 H new ATOM 0 HA HIS A 17 -1.959 -9.762 -4.666 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -1.091 -9.692 -7.086 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -1.654 -11.344 -7.246 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -4.550 -11.411 -6.238 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -5.339 -7.896 -8.495 1.00 0.00 H new ATOM 0 HE2 HIS A 17 -6.429 -9.902 -7.315 1.00 0.00 H new ATOM 276 N LYS A 18 -1.880 -13.051 -4.833 1.00 0.00 N ATOM 277 CA LYS A 18 -2.607 -14.256 -4.445 1.00 0.00 C ATOM 278 C LYS A 18 -3.069 -14.282 -2.987 1.00 0.00 C ATOM 279 O LYS A 18 -4.027 -14.990 -2.705 1.00 0.00 O ATOM 280 CB LYS A 18 -1.837 -15.525 -4.848 1.00 0.00 C ATOM 281 CG LYS A 18 -0.490 -15.792 -4.161 1.00 0.00 C ATOM 282 CD LYS A 18 -0.591 -16.279 -2.707 1.00 0.00 C ATOM 283 CE LYS A 18 0.695 -16.982 -2.270 1.00 0.00 C ATOM 284 NZ LYS A 18 0.745 -18.407 -2.660 1.00 0.00 N ATOM 0 H LYS A 18 -0.956 -13.231 -5.226 1.00 0.00 H new ATOM 0 HA LYS A 18 -3.537 -14.234 -5.013 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -2.484 -16.383 -4.662 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -1.663 -15.484 -5.923 1.00 0.00 H new ATOM 0 HG2 LYS A 18 0.056 -16.536 -4.741 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.100 -14.876 -4.182 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -0.787 -15.432 -2.050 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -1.434 -16.962 -2.607 1.00 0.00 H new ATOM 0 HE2 LYS A 18 1.550 -16.464 -2.705 1.00 0.00 H new ATOM 0 HE3 LYS A 18 0.793 -16.905 -1.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 1.640 -18.825 -2.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -0.052 -18.914 -2.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 0.682 -18.486 -3.695 1.00 0.00 H new ATOM 298 N VAL A 19 -2.466 -13.512 -2.075 1.00 0.00 N ATOM 299 CA VAL A 19 -2.874 -13.534 -0.674 1.00 0.00 C ATOM 300 C VAL A 19 -4.339 -13.115 -0.525 1.00 0.00 C ATOM 301 O VAL A 19 -5.071 -13.747 0.237 1.00 0.00 O ATOM 302 CB VAL A 19 -1.926 -12.697 0.208 1.00 0.00 C ATOM 303 CG1 VAL A 19 -0.492 -13.251 0.164 1.00 0.00 C ATOM 304 CG2 VAL A 19 -1.931 -11.204 -0.107 1.00 0.00 C ATOM 0 H VAL A 19 -1.700 -12.872 -2.283 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.797 -14.560 -0.315 1.00 0.00 H new ATOM 0 HB VAL A 19 -2.320 -12.791 1.220 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.153 -12.640 0.795 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -0.488 -14.279 0.527 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -0.124 -13.227 -0.862 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -1.238 -10.689 0.558 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.624 -11.049 -1.141 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -2.935 -10.805 0.037 1.00 0.00 H new ATOM 314 N MET A 20 -4.799 -12.105 -1.279 1.00 0.00 N ATOM 315 CA MET A 20 -6.191 -11.671 -1.190 1.00 0.00 C ATOM 316 C MET A 20 -7.146 -12.652 -1.866 1.00 0.00 C ATOM 317 O MET A 20 -8.359 -12.534 -1.692 1.00 0.00 O ATOM 318 CB MET A 20 -6.401 -10.251 -1.738 1.00 0.00 C ATOM 319 CG MET A 20 -6.246 -10.060 -3.256 1.00 0.00 C ATOM 320 SD MET A 20 -7.128 -8.629 -3.957 1.00 0.00 S ATOM 321 CE MET A 20 -6.913 -7.378 -2.661 1.00 0.00 C ATOM 0 H MET A 20 -4.232 -11.583 -1.947 1.00 0.00 H new ATOM 0 HA MET A 20 -6.427 -11.652 -0.126 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.401 -9.923 -1.455 1.00 0.00 H new ATOM 0 HB3 MET A 20 -5.695 -9.587 -1.239 1.00 0.00 H new ATOM 0 HG2 MET A 20 -5.185 -9.960 -3.486 1.00 0.00 H new ATOM 0 HG3 MET A 20 -6.597 -10.962 -3.756 1.00 0.00 H new ATOM 0 HE1 MET A 20 -7.865 -7.206 -2.160 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.179 -7.728 -1.935 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.565 -6.447 -3.108 1.00 0.00 H new ATOM 331 N LEU A 21 -6.640 -13.597 -2.658 1.00 0.00 N ATOM 332 CA LEU A 21 -7.470 -14.574 -3.347 1.00 0.00 C ATOM 333 C LEU A 21 -7.819 -15.736 -2.416 1.00 0.00 C ATOM 334 O LEU A 21 -8.545 -16.636 -2.843 1.00 0.00 O ATOM 335 CB LEU A 21 -6.752 -15.102 -4.600 1.00 0.00 C ATOM 336 CG LEU A 21 -6.301 -14.038 -5.613 1.00 0.00 C ATOM 337 CD1 LEU A 21 -5.614 -14.736 -6.788 1.00 0.00 C ATOM 338 CD2 LEU A 21 -7.450 -13.172 -6.138 1.00 0.00 C ATOM 0 H LEU A 21 -5.642 -13.703 -2.838 1.00 0.00 H new ATOM 0 HA LEU A 21 -8.393 -14.081 -3.652 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.876 -15.668 -4.282 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -7.416 -15.801 -5.108 1.00 0.00 H new ATOM 0 HG LEU A 21 -5.617 -13.367 -5.093 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.289 -13.991 -7.514 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -4.749 -15.291 -6.426 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -6.314 -15.424 -7.262 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.061 -12.443 -6.848 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.185 -13.805 -6.634 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -7.923 -12.651 -5.305 1.00 0.00 H new ATOM 350 N ASP A 22 -7.279 -15.778 -1.192 1.00 0.00 N ATOM 351 CA ASP A 22 -7.503 -16.851 -0.231 1.00 0.00 C ATOM 352 C ASP A 22 -8.450 -16.322 0.834 1.00 0.00 C ATOM 353 O ASP A 22 -8.028 -15.637 1.768 1.00 0.00 O ATOM 354 CB ASP A 22 -6.197 -17.328 0.426 1.00 0.00 C ATOM 355 CG ASP A 22 -5.166 -17.867 -0.561 1.00 0.00 C ATOM 356 OD1 ASP A 22 -5.559 -18.607 -1.487 1.00 0.00 O ATOM 357 OD2 ASP A 22 -3.953 -17.581 -0.408 1.00 0.00 O ATOM 0 H ASP A 22 -6.661 -15.047 -0.840 1.00 0.00 H new ATOM 0 HA ASP A 22 -7.925 -17.711 -0.752 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -5.756 -16.498 0.979 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -6.431 -18.106 1.152 1.00 0.00 H new ATOM 362 N HIS A 23 -9.735 -16.650 0.719 1.00 0.00 N ATOM 363 CA HIS A 23 -10.744 -16.208 1.678 1.00 0.00 C ATOM 364 C HIS A 23 -10.458 -16.714 3.106 1.00 0.00 C ATOM 365 O HIS A 23 -10.952 -16.139 4.074 1.00 0.00 O ATOM 366 CB HIS A 23 -12.132 -16.620 1.176 1.00 0.00 C ATOM 367 CG HIS A 23 -13.253 -16.195 2.090 1.00 0.00 C ATOM 368 ND1 HIS A 23 -14.123 -17.043 2.737 1.00 0.00 N ATOM 369 CD2 HIS A 23 -13.528 -14.917 2.502 1.00 0.00 C ATOM 370 CE1 HIS A 23 -14.903 -16.293 3.536 1.00 0.00 C ATOM 371 NE2 HIS A 23 -14.592 -14.988 3.407 1.00 0.00 N ATOM 0 H HIS A 23 -10.104 -17.226 -0.037 1.00 0.00 H new ATOM 0 HA HIS A 23 -10.708 -15.121 1.748 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -12.295 -16.188 0.189 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -12.160 -17.703 1.059 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -13.017 -14.020 2.186 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -15.670 -16.682 4.189 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -15.045 -14.204 3.878 1.00 0.00 H new ATOM 379 N SER A 24 -9.626 -17.752 3.259 1.00 0.00 N ATOM 380 CA SER A 24 -9.081 -18.190 4.544 1.00 0.00 C ATOM 381 C SER A 24 -8.353 -17.023 5.223 1.00 0.00 C ATOM 382 O SER A 24 -8.654 -16.697 6.373 1.00 0.00 O ATOM 383 CB SER A 24 -8.145 -19.397 4.338 1.00 0.00 C ATOM 384 OG SER A 24 -7.798 -20.026 5.564 1.00 0.00 O ATOM 0 H SER A 24 -9.308 -18.321 2.474 1.00 0.00 H new ATOM 0 HA SER A 24 -9.894 -18.508 5.197 1.00 0.00 H new ATOM 0 HB2 SER A 24 -8.630 -20.122 3.685 1.00 0.00 H new ATOM 0 HB3 SER A 24 -7.238 -19.068 3.831 1.00 0.00 H new ATOM 0 HG SER A 24 -7.206 -20.786 5.386 1.00 0.00 H new ATOM 390 N HIS A 25 -7.419 -16.385 4.506 1.00 0.00 N ATOM 391 CA HIS A 25 -6.604 -15.296 5.027 1.00 0.00 C ATOM 392 C HIS A 25 -7.444 -14.034 5.226 1.00 0.00 C ATOM 393 O HIS A 25 -7.080 -13.188 6.036 1.00 0.00 O ATOM 394 CB HIS A 25 -5.411 -15.038 4.091 1.00 0.00 C ATOM 395 CG HIS A 25 -4.554 -16.258 3.822 1.00 0.00 C ATOM 396 ND1 HIS A 25 -3.933 -16.566 2.632 1.00 0.00 N ATOM 397 CD2 HIS A 25 -4.352 -17.314 4.670 1.00 0.00 C ATOM 398 CE1 HIS A 25 -3.407 -17.798 2.751 1.00 0.00 C ATOM 399 NE2 HIS A 25 -3.621 -18.286 3.982 1.00 0.00 N ATOM 0 H HIS A 25 -7.211 -16.619 3.535 1.00 0.00 H new ATOM 0 HA HIS A 25 -6.215 -15.583 6.004 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -5.785 -14.655 3.142 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -4.786 -14.258 4.525 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -4.697 -17.383 5.691 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -2.885 -18.322 1.964 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -3.311 -19.188 4.344 1.00 0.00 H new ATOM 407 N GLY A 26 -8.588 -13.918 4.551 1.00 0.00 N ATOM 408 CA GLY A 26 -9.622 -12.952 4.868 1.00 0.00 C ATOM 409 C GLY A 26 -10.371 -12.517 3.625 1.00 0.00 C ATOM 410 O GLY A 26 -10.069 -12.949 2.511 1.00 0.00 O ATOM 0 H GLY A 26 -8.820 -14.509 3.753 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.321 -13.386 5.583 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.174 -12.082 5.348 1.00 0.00 H new ATOM 414 N LEU A 27 -11.369 -11.665 3.833 1.00 0.00 N ATOM 415 CA LEU A 27 -12.186 -11.109 2.770 1.00 0.00 C ATOM 416 C LEU A 27 -11.503 -9.889 2.161 1.00 0.00 C ATOM 417 O LEU A 27 -10.968 -9.068 2.911 1.00 0.00 O ATOM 418 CB LEU A 27 -13.529 -10.696 3.382 1.00 0.00 C ATOM 419 CG LEU A 27 -14.559 -10.184 2.364 1.00 0.00 C ATOM 420 CD1 LEU A 27 -14.972 -11.337 1.455 1.00 0.00 C ATOM 421 CD2 LEU A 27 -15.806 -9.673 3.083 1.00 0.00 C ATOM 0 H LEU A 27 -11.634 -11.338 4.762 1.00 0.00 H new ATOM 0 HA LEU A 27 -12.331 -11.848 1.982 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.952 -11.551 3.910 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -13.352 -9.918 4.125 1.00 0.00 H new ATOM 0 HG LEU A 27 -14.112 -9.374 1.787 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.703 -10.983 0.728 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -14.096 -11.719 0.931 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -15.412 -12.134 2.055 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -16.527 -9.313 2.349 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -16.250 -10.483 3.661 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -15.532 -8.857 3.752 1.00 0.00 H new ATOM 433 N ALA A 28 -11.626 -9.726 0.843 1.00 0.00 N ATOM 434 CA ALA A 28 -11.399 -8.482 0.127 1.00 0.00 C ATOM 435 C ALA A 28 -12.421 -8.397 -1.004 1.00 0.00 C ATOM 436 O ALA A 28 -12.723 -9.417 -1.626 1.00 0.00 O ATOM 437 CB ALA A 28 -9.976 -8.446 -0.440 1.00 0.00 C ATOM 0 H ALA A 28 -11.898 -10.491 0.226 1.00 0.00 H new ATOM 0 HA ALA A 28 -11.512 -7.634 0.802 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -9.821 -7.508 -0.974 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -9.257 -8.523 0.376 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.836 -9.281 -1.126 1.00 0.00 H new ATOM 443 N ALA A 29 -12.943 -7.206 -1.283 1.00 0.00 N ATOM 444 CA ALA A 29 -13.931 -6.946 -2.317 1.00 0.00 C ATOM 445 C ALA A 29 -13.627 -5.574 -2.933 1.00 0.00 C ATOM 446 O ALA A 29 -13.329 -4.621 -2.209 1.00 0.00 O ATOM 447 CB ALA A 29 -15.325 -7.031 -1.688 1.00 0.00 C ATOM 0 H ALA A 29 -12.676 -6.364 -0.773 1.00 0.00 H new ATOM 0 HA ALA A 29 -13.895 -7.682 -3.120 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -16.080 -6.838 -2.450 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -15.476 -8.027 -1.271 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -15.412 -6.288 -0.895 1.00 0.00 H new ATOM 453 N PHE A 30 -13.601 -5.510 -4.265 1.00 0.00 N ATOM 454 CA PHE A 30 -13.179 -4.379 -5.086 1.00 0.00 C ATOM 455 C PHE A 30 -14.234 -3.270 -5.063 1.00 0.00 C ATOM 456 O PHE A 30 -15.156 -3.256 -5.888 1.00 0.00 O ATOM 457 CB PHE A 30 -12.920 -4.892 -6.515 1.00 0.00 C ATOM 458 CG PHE A 30 -12.688 -3.840 -7.588 1.00 0.00 C ATOM 459 CD1 PHE A 30 -11.639 -2.909 -7.472 1.00 0.00 C ATOM 460 CD2 PHE A 30 -13.515 -3.811 -8.730 1.00 0.00 C ATOM 461 CE1 PHE A 30 -11.407 -1.983 -8.504 1.00 0.00 C ATOM 462 CE2 PHE A 30 -13.277 -2.884 -9.760 1.00 0.00 C ATOM 463 CZ PHE A 30 -12.217 -1.971 -9.649 1.00 0.00 C ATOM 0 H PHE A 30 -13.895 -6.303 -4.836 1.00 0.00 H new ATOM 0 HA PHE A 30 -12.261 -3.945 -4.689 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -12.050 -5.548 -6.488 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -13.771 -5.503 -6.816 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -11.013 -2.906 -6.592 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -14.337 -4.506 -8.814 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -10.597 -1.274 -8.414 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -13.909 -2.875 -10.636 1.00 0.00 H new ATOM 0 HZ PHE A 30 -12.026 -1.263 -10.441 1.00 0.00 H new ATOM 473 N ARG A 31 -14.071 -2.297 -4.165 1.00 0.00 N ATOM 474 CA ARG A 31 -14.902 -1.096 -4.135 1.00 0.00 C ATOM 475 C ARG A 31 -14.229 0.007 -4.932 1.00 0.00 C ATOM 476 O ARG A 31 -13.945 1.080 -4.405 1.00 0.00 O ATOM 477 CB ARG A 31 -15.217 -0.669 -2.695 1.00 0.00 C ATOM 478 CG ARG A 31 -16.099 -1.660 -1.937 1.00 0.00 C ATOM 479 CD ARG A 31 -17.474 -1.822 -2.588 1.00 0.00 C ATOM 480 NE ARG A 31 -18.289 -2.776 -1.834 1.00 0.00 N ATOM 481 CZ ARG A 31 -19.517 -3.178 -2.151 1.00 0.00 C ATOM 482 NH1 ARG A 31 -20.142 -2.692 -3.217 1.00 0.00 N ATOM 483 NH2 ARG A 31 -20.081 -4.093 -1.375 1.00 0.00 N ATOM 0 H ARG A 31 -13.357 -2.321 -3.437 1.00 0.00 H new ATOM 0 HA ARG A 31 -15.862 -1.313 -4.602 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.281 -0.540 -2.151 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.711 0.302 -2.714 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -15.602 -2.629 -1.896 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -16.223 -1.321 -0.908 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -17.979 -0.857 -2.630 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -17.358 -2.166 -3.616 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.877 -3.169 -0.987 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -19.681 -2.000 -3.807 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -21.083 -3.011 -3.446 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.574 -4.461 -0.570 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -21.022 -4.429 -1.583 1.00 0.00 H new ATOM 497 N GLY A 32 -14.032 -0.244 -6.220 1.00 0.00 N ATOM 498 CA GLY A 32 -13.520 0.768 -7.109 1.00 0.00 C ATOM 499 C GLY A 32 -12.068 1.087 -6.799 1.00 0.00 C ATOM 500 O GLY A 32 -11.298 0.235 -6.341 1.00 0.00 O ATOM 0 H GLY A 32 -14.222 -1.143 -6.664 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -13.608 0.428 -8.141 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -14.121 1.673 -7.019 1.00 0.00 H new ATOM 504 N ARG A 33 -11.652 2.299 -7.151 1.00 0.00 N ATOM 505 CA ARG A 33 -10.232 2.637 -7.257 1.00 0.00 C ATOM 506 C ARG A 33 -9.948 4.057 -6.808 1.00 0.00 C ATOM 507 O ARG A 33 -10.873 4.843 -6.626 1.00 0.00 O ATOM 508 CB ARG A 33 -9.750 2.338 -8.674 1.00 0.00 C ATOM 509 CG ARG A 33 -10.303 3.263 -9.758 1.00 0.00 C ATOM 510 CD ARG A 33 -10.052 2.611 -11.118 1.00 0.00 C ATOM 511 NE ARG A 33 -10.091 3.602 -12.208 1.00 0.00 N ATOM 512 CZ ARG A 33 -11.180 3.943 -12.902 1.00 0.00 C ATOM 513 NH1 ARG A 33 -12.299 3.241 -12.804 1.00 0.00 N ATOM 514 NH2 ARG A 33 -11.143 5.019 -13.672 1.00 0.00 N ATOM 0 H ARG A 33 -12.282 3.071 -7.370 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.660 2.012 -6.571 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -8.662 2.396 -8.690 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -10.019 1.311 -8.923 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -11.370 3.429 -9.608 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -9.818 4.238 -9.709 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -9.082 2.114 -11.111 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -10.803 1.841 -11.298 1.00 0.00 H new ATOM 0 HE ARG A 33 -9.216 4.065 -12.452 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -12.338 2.426 -12.191 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -13.122 3.515 -13.341 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -10.290 5.576 -13.730 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -11.967 5.291 -14.208 1.00 0.00 H new ATOM 528 N GLY A 34 -8.672 4.400 -6.629 1.00 0.00 N ATOM 529 CA GLY A 34 -8.328 5.647 -5.981 1.00 0.00 C ATOM 530 C GLY A 34 -6.852 5.958 -5.991 1.00 0.00 C ATOM 531 O GLY A 34 -6.013 5.170 -6.434 1.00 0.00 O ATOM 0 H GLY A 34 -7.875 3.834 -6.922 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -8.863 6.459 -6.472 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -8.675 5.616 -4.948 1.00 0.00 H new ATOM 535 N CYS A 35 -6.542 7.124 -5.444 1.00 0.00 N ATOM 536 CA CYS A 35 -5.191 7.623 -5.259 1.00 0.00 C ATOM 537 C CYS A 35 -5.091 8.374 -3.934 1.00 0.00 C ATOM 538 O CYS A 35 -6.109 8.783 -3.380 1.00 0.00 O ATOM 539 CB CYS A 35 -4.809 8.508 -6.444 1.00 0.00 C ATOM 540 SG CYS A 35 -5.905 9.931 -6.614 1.00 0.00 S ATOM 0 H CYS A 35 -7.253 7.772 -5.105 1.00 0.00 H new ATOM 0 HA CYS A 35 -4.488 6.791 -5.219 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -3.783 8.855 -6.320 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -4.838 7.918 -7.360 1.00 0.00 H new ATOM 0 HG CYS A 35 -5.532 10.646 -7.633 1.00 0.00 H new ATOM 546 N THR A 36 -3.888 8.600 -3.414 1.00 0.00 N ATOM 547 CA THR A 36 -3.707 9.510 -2.297 1.00 0.00 C ATOM 548 C THR A 36 -3.656 10.922 -2.874 1.00 0.00 C ATOM 549 O THR A 36 -2.606 11.352 -3.336 1.00 0.00 O ATOM 550 CB THR A 36 -2.477 9.125 -1.457 1.00 0.00 C ATOM 551 OG1 THR A 36 -1.247 9.291 -2.122 1.00 0.00 O ATOM 552 CG2 THR A 36 -2.559 7.679 -0.963 1.00 0.00 C ATOM 0 H THR A 36 -3.029 8.165 -3.750 1.00 0.00 H new ATOM 0 HA THR A 36 -4.537 9.453 -1.593 1.00 0.00 H new ATOM 0 HB THR A 36 -2.502 9.821 -0.618 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.264 10.123 -2.639 1.00 0.00 H new ATOM 0 HG21 THR A 36 -1.672 7.445 -0.374 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.448 7.556 -0.345 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.615 7.005 -1.818 1.00 0.00 H new ATOM 560 N VAL A 37 -4.777 11.642 -2.889 1.00 0.00 N ATOM 561 CA VAL A 37 -4.763 13.064 -3.245 1.00 0.00 C ATOM 562 C VAL A 37 -3.937 13.885 -2.257 1.00 0.00 C ATOM 563 O VAL A 37 -3.439 14.960 -2.585 1.00 0.00 O ATOM 564 CB VAL A 37 -6.182 13.640 -3.326 1.00 0.00 C ATOM 565 CG1 VAL A 37 -6.710 13.407 -4.744 1.00 0.00 C ATOM 566 CG2 VAL A 37 -7.108 13.112 -2.208 1.00 0.00 C ATOM 0 H VAL A 37 -5.699 11.270 -2.661 1.00 0.00 H new ATOM 0 HA VAL A 37 -4.300 13.131 -4.229 1.00 0.00 H new ATOM 0 HB VAL A 37 -6.158 14.714 -3.141 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -7.720 13.809 -4.827 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -6.060 13.908 -5.461 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.727 12.338 -4.955 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.098 13.554 -2.317 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -7.185 12.027 -2.281 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -6.695 13.381 -1.236 1.00 0.00 H new ATOM 576 N GLU A 38 -3.810 13.392 -1.031 1.00 0.00 N ATOM 577 CA GLU A 38 -2.744 13.791 -0.144 1.00 0.00 C ATOM 578 C GLU A 38 -1.455 13.179 -0.673 1.00 0.00 C ATOM 579 O GLU A 38 -1.333 11.954 -0.766 1.00 0.00 O ATOM 580 CB GLU A 38 -3.066 13.367 1.303 1.00 0.00 C ATOM 581 CG GLU A 38 -3.152 14.601 2.211 1.00 0.00 C ATOM 582 CD GLU A 38 -4.343 14.590 3.165 1.00 0.00 C ATOM 583 OE1 GLU A 38 -4.261 13.975 4.253 1.00 0.00 O ATOM 584 OE2 GLU A 38 -5.346 15.286 2.861 1.00 0.00 O ATOM 0 H GLU A 38 -4.448 12.704 -0.631 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.630 14.875 -0.117 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -4.009 12.822 1.328 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.296 12.689 1.671 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.234 14.675 2.794 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -3.207 15.494 1.588 1.00 0.00 H new ATOM 591 N SER A 39 -0.511 14.037 -1.055 1.00 0.00 N ATOM 592 CA SER A 39 0.823 13.609 -1.440 1.00 0.00 C ATOM 593 C SER A 39 1.415 12.828 -0.263 1.00 0.00 C ATOM 594 O SER A 39 1.262 13.288 0.874 1.00 0.00 O ATOM 595 CB SER A 39 1.693 14.839 -1.744 1.00 0.00 C ATOM 596 OG SER A 39 0.968 15.876 -2.382 1.00 0.00 O ATOM 0 H SER A 39 -0.654 15.046 -1.105 1.00 0.00 H new ATOM 0 HA SER A 39 0.786 12.984 -2.332 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.118 15.217 -0.814 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.528 14.541 -2.378 1.00 0.00 H new ATOM 0 HG SER A 39 1.564 16.635 -2.552 1.00 0.00 H new ATOM 602 N PHE A 40 2.109 11.712 -0.494 1.00 0.00 N ATOM 603 CA PHE A 40 2.957 11.155 0.556 1.00 0.00 C ATOM 604 C PHE A 40 4.338 10.907 -0.044 1.00 0.00 C ATOM 605 O PHE A 40 4.403 10.553 -1.224 1.00 0.00 O ATOM 606 CB PHE A 40 2.383 9.812 1.009 1.00 0.00 C ATOM 607 CG PHE A 40 1.251 9.901 2.012 1.00 0.00 C ATOM 608 CD1 PHE A 40 -0.082 9.986 1.570 1.00 0.00 C ATOM 609 CD2 PHE A 40 1.535 9.894 3.391 1.00 0.00 C ATOM 610 CE1 PHE A 40 -1.138 10.066 2.501 1.00 0.00 C ATOM 611 CE2 PHE A 40 0.485 10.036 4.321 1.00 0.00 C ATOM 612 CZ PHE A 40 -0.848 10.110 3.875 1.00 0.00 C ATOM 0 H PHE A 40 2.102 11.191 -1.371 1.00 0.00 H new ATOM 0 HA PHE A 40 3.010 11.839 1.403 1.00 0.00 H new ATOM 0 HB2 PHE A 40 2.028 9.272 0.131 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.187 9.219 1.444 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.298 9.990 0.512 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.553 9.780 3.735 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -2.162 10.093 2.160 1.00 0.00 H new ATOM 0 HE2 PHE A 40 0.704 10.088 5.377 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.651 10.201 4.592 1.00 0.00 H new ATOM 622 N PRO A 41 5.420 10.938 0.753 1.00 0.00 N ATOM 623 CA PRO A 41 6.765 10.562 0.346 1.00 0.00 C ATOM 624 C PRO A 41 6.906 9.046 0.308 1.00 0.00 C ATOM 625 O PRO A 41 6.905 8.363 1.335 1.00 0.00 O ATOM 626 CB PRO A 41 7.729 11.173 1.358 1.00 0.00 C ATOM 627 CG PRO A 41 6.862 11.399 2.592 1.00 0.00 C ATOM 628 CD PRO A 41 5.450 11.562 2.060 1.00 0.00 C ATOM 0 HA PRO A 41 6.983 10.929 -0.657 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.563 10.504 1.571 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.155 12.107 0.992 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.929 10.556 3.280 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.181 12.285 3.141 1.00 0.00 H new ATOM 0 HD2 PRO A 41 4.728 11.093 2.729 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.182 12.616 1.991 1.00 0.00 H new ATOM 636 N LEU A 42 7.058 8.532 -0.902 1.00 0.00 N ATOM 637 CA LEU A 42 7.188 7.120 -1.192 1.00 0.00 C ATOM 638 C LEU A 42 8.644 6.842 -1.488 1.00 0.00 C ATOM 639 O LEU A 42 9.067 6.943 -2.639 1.00 0.00 O ATOM 640 CB LEU A 42 6.303 6.828 -2.400 1.00 0.00 C ATOM 641 CG LEU A 42 6.316 5.394 -2.952 1.00 0.00 C ATOM 642 CD1 LEU A 42 6.018 4.397 -1.844 1.00 0.00 C ATOM 643 CD2 LEU A 42 5.286 5.222 -4.076 1.00 0.00 C ATOM 0 H LEU A 42 7.095 9.113 -1.739 1.00 0.00 H new ATOM 0 HA LEU A 42 6.878 6.486 -0.361 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.276 7.078 -2.134 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.597 7.502 -3.205 1.00 0.00 H new ATOM 0 HG LEU A 42 7.311 5.206 -3.356 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.031 3.386 -2.251 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.774 4.484 -1.064 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.035 4.606 -1.422 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.319 4.197 -4.446 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.289 5.437 -3.692 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.517 5.909 -4.890 1.00 0.00 H new ATOM 655 N VAL A 43 9.440 6.583 -0.463 1.00 0.00 N ATOM 656 CA VAL A 43 10.813 6.261 -0.559 1.00 0.00 C ATOM 657 C VAL A 43 10.926 4.767 -0.830 1.00 0.00 C ATOM 658 O VAL A 43 9.999 4.005 -0.568 1.00 0.00 O ATOM 659 CB VAL A 43 11.371 6.712 0.795 1.00 0.00 C ATOM 660 CG1 VAL A 43 12.807 6.501 0.820 1.00 0.00 C ATOM 661 CG2 VAL A 43 11.148 8.209 1.091 1.00 0.00 C ATOM 0 H VAL A 43 9.106 6.599 0.501 1.00 0.00 H new ATOM 0 HA VAL A 43 11.369 6.740 -1.365 1.00 0.00 H new ATOM 0 HB VAL A 43 10.839 6.124 1.542 1.00 0.00 H new ATOM 0 HG11 VAL A 43 13.205 6.821 1.783 1.00 0.00 H new ATOM 0 HG12 VAL A 43 13.022 5.443 0.673 1.00 0.00 H new ATOM 0 HG13 VAL A 43 13.274 7.080 0.023 1.00 0.00 H new ATOM 0 HG21 VAL A 43 11.569 8.454 2.066 1.00 0.00 H new ATOM 0 HG22 VAL A 43 11.637 8.808 0.323 1.00 0.00 H new ATOM 0 HG23 VAL A 43 10.079 8.424 1.093 1.00 0.00 H new ATOM 671 N ILE A 44 12.075 4.340 -1.335 1.00 0.00 N ATOM 672 CA ILE A 44 12.406 2.950 -1.598 1.00 0.00 C ATOM 673 C ILE A 44 13.788 2.761 -1.001 1.00 0.00 C ATOM 674 O ILE A 44 14.738 3.451 -1.384 1.00 0.00 O ATOM 675 CB ILE A 44 12.349 2.645 -3.109 1.00 0.00 C ATOM 676 CG1 ILE A 44 10.977 3.058 -3.679 1.00 0.00 C ATOM 677 CG2 ILE A 44 12.646 1.158 -3.391 1.00 0.00 C ATOM 678 CD1 ILE A 44 10.883 2.796 -5.170 1.00 0.00 C ATOM 0 H ILE A 44 12.831 4.979 -1.582 1.00 0.00 H new ATOM 0 HA ILE A 44 11.696 2.253 -1.153 1.00 0.00 H new ATOM 0 HB ILE A 44 13.122 3.229 -3.609 1.00 0.00 H new ATOM 0 HG12 ILE A 44 10.189 2.509 -3.163 1.00 0.00 H new ATOM 0 HG13 ILE A 44 10.807 4.117 -3.485 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.598 0.975 -4.464 1.00 0.00 H new ATOM 0 HG22 ILE A 44 13.642 0.910 -3.024 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.908 0.537 -2.884 1.00 0.00 H new ATOM 0 HD11 ILE A 44 9.901 3.101 -5.532 1.00 0.00 H new ATOM 0 HD12 ILE A 44 11.654 3.366 -5.689 1.00 0.00 H new ATOM 0 HD13 ILE A 44 11.027 1.733 -5.362 1.00 0.00 H new ATOM 690 N ALA A 45 13.896 1.866 -0.027 1.00 0.00 N ATOM 691 CA ALA A 45 15.139 1.575 0.660 1.00 0.00 C ATOM 692 C ALA A 45 15.184 0.094 1.000 1.00 0.00 C ATOM 693 O ALA A 45 14.306 -0.682 0.616 1.00 0.00 O ATOM 694 CB ALA A 45 15.246 2.441 1.915 1.00 0.00 C ATOM 0 H ALA A 45 13.107 1.315 0.310 1.00 0.00 H new ATOM 0 HA ALA A 45 15.990 1.807 0.019 1.00 0.00 H new ATOM 0 HB1 ALA A 45 16.181 2.221 2.430 1.00 0.00 H new ATOM 0 HB2 ALA A 45 15.226 3.494 1.633 1.00 0.00 H new ATOM 0 HB3 ALA A 45 14.407 2.227 2.578 1.00 0.00 H new ATOM 700 N GLY A 46 16.204 -0.268 1.760 1.00 0.00 N ATOM 701 CA GLY A 46 16.452 -1.598 2.250 1.00 0.00 C ATOM 702 C GLY A 46 16.836 -2.547 1.113 1.00 0.00 C ATOM 703 O GLY A 46 16.853 -2.188 -0.068 1.00 0.00 O ATOM 0 H GLY A 46 16.914 0.399 2.063 1.00 0.00 H new ATOM 0 HA2 GLY A 46 17.252 -1.572 2.990 1.00 0.00 H new ATOM 0 HA3 GLY A 46 15.562 -1.974 2.755 1.00 0.00 H new ATOM 707 N GLU A 47 17.166 -3.782 1.480 1.00 0.00 N ATOM 708 CA GLU A 47 17.896 -4.692 0.601 1.00 0.00 C ATOM 709 C GLU A 47 17.053 -5.281 -0.535 1.00 0.00 C ATOM 710 O GLU A 47 17.609 -5.917 -1.429 1.00 0.00 O ATOM 711 CB GLU A 47 18.517 -5.791 1.472 1.00 0.00 C ATOM 712 CG GLU A 47 19.802 -6.340 0.855 1.00 0.00 C ATOM 713 CD GLU A 47 20.371 -7.435 1.738 1.00 0.00 C ATOM 714 OE1 GLU A 47 21.150 -7.119 2.671 1.00 0.00 O ATOM 715 OE2 GLU A 47 20.018 -8.610 1.517 1.00 0.00 O ATOM 0 H GLU A 47 16.936 -4.179 2.391 1.00 0.00 H new ATOM 0 HA GLU A 47 18.669 -4.119 0.088 1.00 0.00 H new ATOM 0 HB2 GLU A 47 18.731 -5.393 2.464 1.00 0.00 H new ATOM 0 HB3 GLU A 47 17.800 -6.602 1.602 1.00 0.00 H new ATOM 0 HG2 GLU A 47 19.599 -6.733 -0.141 1.00 0.00 H new ATOM 0 HG3 GLU A 47 20.531 -5.538 0.739 1.00 0.00 H new ATOM 722 N HIS A 48 15.732 -5.070 -0.534 1.00 0.00 N ATOM 723 CA HIS A 48 14.823 -5.630 -1.508 1.00 0.00 C ATOM 724 C HIS A 48 13.872 -4.557 -2.042 1.00 0.00 C ATOM 725 O HIS A 48 12.696 -4.843 -2.275 1.00 0.00 O ATOM 726 CB HIS A 48 14.051 -6.785 -0.869 1.00 0.00 C ATOM 727 CG HIS A 48 14.825 -8.039 -0.638 1.00 0.00 C ATOM 728 ND1 HIS A 48 14.906 -9.121 -1.484 1.00 0.00 N ATOM 729 CD2 HIS A 48 15.424 -8.360 0.540 1.00 0.00 C ATOM 730 CE1 HIS A 48 15.574 -10.077 -0.825 1.00 0.00 C ATOM 731 NE2 HIS A 48 15.873 -9.676 0.429 1.00 0.00 N ATOM 0 H HIS A 48 15.267 -4.490 0.165 1.00 0.00 H new ATOM 0 HA HIS A 48 15.391 -6.011 -2.357 1.00 0.00 H new ATOM 0 HB2 HIS A 48 13.654 -6.445 0.087 1.00 0.00 H new ATOM 0 HB3 HIS A 48 13.197 -7.020 -1.504 1.00 0.00 H new ATOM 0 HD1 HIS A 48 14.530 -9.183 -2.430 1.00 0.00 H new ATOM 0 HD2 HIS A 48 15.532 -7.716 1.401 1.00 0.00 H new ATOM 0 HE1 HIS A 48 15.838 -11.038 -1.241 1.00 0.00 H new ATOM 739 N ASN A 49 14.349 -3.334 -2.295 1.00 0.00 N ATOM 740 CA ASN A 49 13.546 -2.276 -2.923 1.00 0.00 C ATOM 741 C ASN A 49 12.176 -2.155 -2.239 1.00 0.00 C ATOM 742 O ASN A 49 11.128 -2.322 -2.868 1.00 0.00 O ATOM 743 CB ASN A 49 13.339 -2.528 -4.429 1.00 0.00 C ATOM 744 CG ASN A 49 14.607 -2.728 -5.232 1.00 0.00 C ATOM 745 OD1 ASN A 49 14.852 -3.809 -5.738 1.00 0.00 O ATOM 746 ND2 ASN A 49 15.438 -1.725 -5.398 1.00 0.00 N ATOM 0 H ASN A 49 15.302 -3.048 -2.071 1.00 0.00 H new ATOM 0 HA ASN A 49 14.101 -1.345 -2.802 1.00 0.00 H new ATOM 0 HB2 ASN A 49 12.709 -3.409 -4.550 1.00 0.00 H new ATOM 0 HB3 ASN A 49 12.791 -1.685 -4.850 1.00 0.00 H new ATOM 0 HD21 ASN A 49 16.287 -1.852 -5.950 1.00 0.00 H new ATOM 0 HD22 ASN A 49 15.235 -0.819 -4.975 1.00 0.00 H new ATOM 753 N ILE A 50 12.194 -1.839 -0.948 1.00 0.00 N ATOM 754 CA ILE A 50 11.137 -2.030 0.040 1.00 0.00 C ATOM 755 C ILE A 50 10.538 -0.635 0.192 1.00 0.00 C ATOM 756 O ILE A 50 11.212 0.231 0.750 1.00 0.00 O ATOM 757 CB ILE A 50 11.657 -2.664 1.364 1.00 0.00 C ATOM 758 CG1 ILE A 50 12.143 -4.109 1.107 1.00 0.00 C ATOM 759 CG2 ILE A 50 10.573 -2.658 2.449 1.00 0.00 C ATOM 760 CD1 ILE A 50 12.677 -4.820 2.358 1.00 0.00 C ATOM 0 H ILE A 50 13.018 -1.406 -0.531 1.00 0.00 H new ATOM 0 HA ILE A 50 10.383 -2.753 -0.269 1.00 0.00 H new ATOM 0 HB ILE A 50 12.493 -2.061 1.720 1.00 0.00 H new ATOM 0 HG12 ILE A 50 11.318 -4.691 0.695 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.928 -4.088 0.351 1.00 0.00 H new ATOM 0 HG21 ILE A 50 10.968 -3.107 3.360 1.00 0.00 H new ATOM 0 HG22 ILE A 50 10.268 -1.632 2.653 1.00 0.00 H new ATOM 0 HG23 ILE A 50 9.712 -3.231 2.106 1.00 0.00 H new ATOM 0 HD11 ILE A 50 12.998 -5.828 2.095 1.00 0.00 H new ATOM 0 HD12 ILE A 50 13.523 -4.263 2.760 1.00 0.00 H new ATOM 0 HD13 ILE A 50 11.889 -4.875 3.109 1.00 0.00 H new ATOM 772 N PRO A 51 9.516 -0.285 -0.615 1.00 0.00 N ATOM 773 CA PRO A 51 8.945 1.045 -0.579 1.00 0.00 C ATOM 774 C PRO A 51 8.416 1.297 0.831 1.00 0.00 C ATOM 775 O PRO A 51 7.587 0.547 1.362 1.00 0.00 O ATOM 776 CB PRO A 51 7.863 1.079 -1.648 1.00 0.00 C ATOM 777 CG PRO A 51 7.352 -0.349 -1.644 1.00 0.00 C ATOM 778 CD PRO A 51 8.569 -1.190 -1.257 1.00 0.00 C ATOM 0 HA PRO A 51 9.663 1.837 -0.791 1.00 0.00 H new ATOM 0 HB2 PRO A 51 7.075 1.792 -1.406 1.00 0.00 H new ATOM 0 HB3 PRO A 51 8.263 1.364 -2.621 1.00 0.00 H new ATOM 0 HG2 PRO A 51 6.538 -0.477 -0.931 1.00 0.00 H new ATOM 0 HG3 PRO A 51 6.967 -0.635 -2.623 1.00 0.00 H new ATOM 0 HD2 PRO A 51 8.284 -1.995 -0.580 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.014 -1.655 -2.137 1.00 0.00 H new ATOM 786 N TRP A 52 8.957 2.324 1.468 1.00 0.00 N ATOM 787 CA TRP A 52 8.548 2.756 2.782 1.00 0.00 C ATOM 788 C TRP A 52 7.701 3.991 2.555 1.00 0.00 C ATOM 789 O TRP A 52 8.176 5.013 2.055 1.00 0.00 O ATOM 790 CB TRP A 52 9.765 3.045 3.655 1.00 0.00 C ATOM 791 CG TRP A 52 10.604 1.850 3.973 1.00 0.00 C ATOM 792 CD1 TRP A 52 11.695 1.479 3.274 1.00 0.00 C ATOM 793 CD2 TRP A 52 10.412 0.819 4.993 1.00 0.00 C ATOM 794 NE1 TRP A 52 12.204 0.309 3.791 1.00 0.00 N ATOM 795 CE2 TRP A 52 11.469 -0.128 4.869 1.00 0.00 C ATOM 796 CE3 TRP A 52 9.446 0.560 5.992 1.00 0.00 C ATOM 797 CZ2 TRP A 52 11.586 -1.240 5.709 1.00 0.00 C ATOM 798 CZ3 TRP A 52 9.554 -0.559 6.844 1.00 0.00 C ATOM 799 CH2 TRP A 52 10.626 -1.459 6.713 1.00 0.00 C ATOM 0 H TRP A 52 9.709 2.888 1.071 1.00 0.00 H new ATOM 0 HA TRP A 52 7.981 1.991 3.312 1.00 0.00 H new ATOM 0 HB2 TRP A 52 10.387 3.786 3.153 1.00 0.00 H new ATOM 0 HB3 TRP A 52 9.427 3.493 4.589 1.00 0.00 H new ATOM 0 HD1 TRP A 52 12.108 2.019 2.434 1.00 0.00 H new ATOM 0 HE1 TRP A 52 13.023 -0.173 3.421 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.608 1.232 6.105 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 12.410 -1.927 5.587 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 8.806 -0.726 7.605 1.00 0.00 H new ATOM 0 HH2 TRP A 52 10.711 -2.308 7.375 1.00 0.00 H new ATOM 810 N LEU A 53 6.426 3.894 2.898 1.00 0.00 N ATOM 811 CA LEU A 53 5.532 5.029 2.885 1.00 0.00 C ATOM 812 C LEU A 53 5.772 5.786 4.180 1.00 0.00 C ATOM 813 O LEU A 53 5.303 5.417 5.261 1.00 0.00 O ATOM 814 CB LEU A 53 4.089 4.549 2.771 1.00 0.00 C ATOM 815 CG LEU A 53 3.277 5.372 1.784 1.00 0.00 C ATOM 816 CD1 LEU A 53 1.818 4.958 1.904 1.00 0.00 C ATOM 817 CD2 LEU A 53 3.355 6.873 1.852 1.00 0.00 C ATOM 0 H LEU A 53 5.986 3.022 3.193 1.00 0.00 H new ATOM 0 HA LEU A 53 5.716 5.682 2.032 1.00 0.00 H new ATOM 0 HB2 LEU A 53 4.081 3.504 2.461 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.616 4.594 3.752 1.00 0.00 H new ATOM 0 HG LEU A 53 3.740 5.143 0.824 1.00 0.00 H new ATOM 0 HD11 LEU A 53 1.217 5.537 1.203 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.721 3.897 1.675 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.470 5.143 2.920 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.718 7.306 1.081 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.019 7.211 2.832 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.385 7.191 1.692 1.00 0.00 H new ATOM 829 N LEU A 54 6.627 6.783 4.097 1.00 0.00 N ATOM 830 CA LEU A 54 6.889 7.705 5.163 1.00 0.00 C ATOM 831 C LEU A 54 5.594 8.468 5.368 1.00 0.00 C ATOM 832 O LEU A 54 5.076 9.083 4.433 1.00 0.00 O ATOM 833 CB LEU A 54 8.074 8.577 4.731 1.00 0.00 C ATOM 834 CG LEU A 54 9.398 7.911 5.063 1.00 0.00 C ATOM 835 CD1 LEU A 54 9.619 6.639 4.288 1.00 0.00 C ATOM 836 CD2 LEU A 54 10.560 8.886 4.869 1.00 0.00 C ATOM 0 H LEU A 54 7.172 6.973 3.256 1.00 0.00 H new ATOM 0 HA LEU A 54 7.170 7.248 6.112 1.00 0.00 H new ATOM 0 HB2 LEU A 54 8.018 8.766 3.659 1.00 0.00 H new ATOM 0 HB3 LEU A 54 8.016 9.545 5.228 1.00 0.00 H new ATOM 0 HG LEU A 54 9.355 7.628 6.115 1.00 0.00 H new ATOM 0 HD11 LEU A 54 10.580 6.206 4.565 1.00 0.00 H new ATOM 0 HD12 LEU A 54 8.823 5.931 4.517 1.00 0.00 H new ATOM 0 HD13 LEU A 54 9.614 6.858 3.220 1.00 0.00 H new ATOM 0 HD21 LEU A 54 11.498 8.387 5.113 1.00 0.00 H new ATOM 0 HD22 LEU A 54 10.585 9.220 3.832 1.00 0.00 H new ATOM 0 HD23 LEU A 54 10.426 9.747 5.524 1.00 0.00 H new ATOM 848 N TYR A 55 5.037 8.378 6.574 1.00 0.00 N ATOM 849 CA TYR A 55 3.765 8.997 6.886 1.00 0.00 C ATOM 850 C TYR A 55 3.934 10.520 6.930 1.00 0.00 C ATOM 851 O TYR A 55 4.123 11.095 8.003 1.00 0.00 O ATOM 852 CB TYR A 55 3.207 8.408 8.191 1.00 0.00 C ATOM 853 CG TYR A 55 1.776 8.830 8.482 1.00 0.00 C ATOM 854 CD1 TYR A 55 0.725 8.510 7.599 1.00 0.00 C ATOM 855 CD2 TYR A 55 1.492 9.559 9.646 1.00 0.00 C ATOM 856 CE1 TYR A 55 -0.603 8.870 7.891 1.00 0.00 C ATOM 857 CE2 TYR A 55 0.180 9.970 9.920 1.00 0.00 C ATOM 858 CZ TYR A 55 -0.885 9.595 9.067 1.00 0.00 C ATOM 859 OH TYR A 55 -2.165 9.929 9.394 1.00 0.00 O ATOM 0 H TYR A 55 5.458 7.875 7.355 1.00 0.00 H new ATOM 0 HA TYR A 55 3.032 8.782 6.109 1.00 0.00 H new ATOM 0 HB2 TYR A 55 3.253 7.320 8.139 1.00 0.00 H new ATOM 0 HB3 TYR A 55 3.844 8.715 9.021 1.00 0.00 H new ATOM 0 HD1 TYR A 55 0.943 7.980 6.684 1.00 0.00 H new ATOM 0 HD2 TYR A 55 2.287 9.805 10.334 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -1.402 8.593 7.219 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -0.020 10.578 10.790 1.00 0.00 H new ATOM 0 HH TYR A 55 -2.772 9.211 9.116 1.00 0.00 H new ATOM 869 N LEU A 56 3.879 11.183 5.772 1.00 0.00 N ATOM 870 CA LEU A 56 4.040 12.634 5.646 1.00 0.00 C ATOM 871 C LEU A 56 3.057 13.174 4.607 1.00 0.00 C ATOM 872 O LEU A 56 3.410 13.260 3.432 1.00 0.00 O ATOM 873 CB LEU A 56 5.495 13.046 5.330 1.00 0.00 C ATOM 874 CG LEU A 56 5.980 14.228 6.197 1.00 0.00 C ATOM 875 CD1 LEU A 56 7.153 13.787 7.070 1.00 0.00 C ATOM 876 CD2 LEU A 56 6.408 15.420 5.338 1.00 0.00 C ATOM 0 H LEU A 56 3.718 10.718 4.879 1.00 0.00 H new ATOM 0 HA LEU A 56 3.811 13.083 6.613 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.153 12.191 5.487 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.571 13.317 4.277 1.00 0.00 H new ATOM 0 HG LEU A 56 5.145 14.541 6.824 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.489 14.626 7.679 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.836 12.971 7.720 1.00 0.00 H new ATOM 0 HD13 LEU A 56 7.972 13.448 6.435 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.743 16.232 5.983 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.223 15.120 4.680 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.563 15.758 4.738 1.00 0.00 H new ATOM 888 N PRO A 57 1.812 13.485 4.986 1.00 0.00 N ATOM 889 CA PRO A 57 0.887 14.108 4.055 1.00 0.00 C ATOM 890 C PRO A 57 1.489 15.432 3.566 1.00 0.00 C ATOM 891 O PRO A 57 2.110 16.164 4.344 1.00 0.00 O ATOM 892 CB PRO A 57 -0.404 14.306 4.843 1.00 0.00 C ATOM 893 CG PRO A 57 0.061 14.387 6.294 1.00 0.00 C ATOM 894 CD PRO A 57 1.275 13.466 6.335 1.00 0.00 C ATOM 0 HA PRO A 57 0.693 13.510 3.165 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -0.923 15.215 4.538 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.096 13.478 4.691 1.00 0.00 H new ATOM 0 HG2 PRO A 57 0.323 15.407 6.575 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -0.716 14.056 6.983 1.00 0.00 H new ATOM 0 HD2 PRO A 57 2.012 13.817 7.057 1.00 0.00 H new ATOM 0 HD3 PRO A 57 0.993 12.456 6.633 1.00 0.00 H new ATOM 902 N GLY A 58 1.316 15.752 2.287 1.00 0.00 N ATOM 903 CA GLY A 58 1.776 17.015 1.725 1.00 0.00 C ATOM 904 C GLY A 58 3.278 17.054 1.452 1.00 0.00 C ATOM 905 O GLY A 58 3.841 18.140 1.297 1.00 0.00 O ATOM 0 H GLY A 58 0.853 15.143 1.613 1.00 0.00 H new ATOM 0 HA2 GLY A 58 1.241 17.205 0.794 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.519 17.823 2.410 1.00 0.00 H new ATOM 909 N LYS A 59 3.960 15.909 1.363 1.00 0.00 N ATOM 910 CA LYS A 59 5.265 15.811 0.732 1.00 0.00 C ATOM 911 C LYS A 59 5.168 14.700 -0.313 1.00 0.00 C ATOM 912 O LYS A 59 4.344 13.806 -0.161 1.00 0.00 O ATOM 913 CB LYS A 59 6.276 15.534 1.852 1.00 0.00 C ATOM 914 CG LYS A 59 7.724 15.413 1.380 1.00 0.00 C ATOM 915 CD LYS A 59 8.385 16.774 1.123 1.00 0.00 C ATOM 916 CE LYS A 59 8.819 17.395 2.454 1.00 0.00 C ATOM 917 NZ LYS A 59 9.613 18.621 2.258 1.00 0.00 N ATOM 0 H LYS A 59 3.614 15.023 1.731 1.00 0.00 H new ATOM 0 HA LYS A 59 5.590 16.714 0.215 1.00 0.00 H new ATOM 0 HB2 LYS A 59 6.213 16.335 2.588 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.994 14.612 2.359 1.00 0.00 H new ATOM 0 HG2 LYS A 59 8.301 14.871 2.129 1.00 0.00 H new ATOM 0 HG3 LYS A 59 7.754 14.822 0.465 1.00 0.00 H new ATOM 0 HD2 LYS A 59 9.248 16.652 0.469 1.00 0.00 H new ATOM 0 HD3 LYS A 59 7.688 17.437 0.611 1.00 0.00 H new ATOM 0 HE2 LYS A 59 7.937 17.626 3.051 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.405 16.670 3.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 9.886 19.009 3.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.468 18.397 1.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 9.046 19.323 1.742 1.00 0.00 H new ATOM 931 N GLY A 60 6.023 14.690 -1.332 1.00 0.00 N ATOM 932 CA GLY A 60 6.079 13.581 -2.275 1.00 0.00 C ATOM 933 C GLY A 60 5.036 13.786 -3.361 1.00 0.00 C ATOM 934 O GLY A 60 4.933 14.899 -3.875 1.00 0.00 O ATOM 0 H GLY A 60 6.687 15.440 -1.525 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.073 13.516 -2.718 1.00 0.00 H new ATOM 0 HA3 GLY A 60 5.899 12.639 -1.756 1.00 0.00 H new ATOM 938 N HIS A 61 4.308 12.742 -3.757 1.00 0.00 N ATOM 939 CA HIS A 61 3.380 12.792 -4.886 1.00 0.00 C ATOM 940 C HIS A 61 2.099 12.005 -4.565 1.00 0.00 C ATOM 941 O HIS A 61 2.056 11.296 -3.556 1.00 0.00 O ATOM 942 CB HIS A 61 4.029 12.208 -6.151 1.00 0.00 C ATOM 943 CG HIS A 61 5.450 12.585 -6.514 1.00 0.00 C ATOM 944 ND1 HIS A 61 5.838 13.188 -7.691 1.00 0.00 N ATOM 945 CD2 HIS A 61 6.594 12.185 -5.874 1.00 0.00 C ATOM 946 CE1 HIS A 61 7.182 13.177 -7.738 1.00 0.00 C ATOM 947 NE2 HIS A 61 7.691 12.592 -6.639 1.00 0.00 N ATOM 0 H HIS A 61 4.346 11.831 -3.300 1.00 0.00 H new ATOM 0 HA HIS A 61 3.128 13.837 -5.064 1.00 0.00 H new ATOM 0 HB2 HIS A 61 3.994 11.122 -6.062 1.00 0.00 H new ATOM 0 HB3 HIS A 61 3.395 12.479 -6.996 1.00 0.00 H new ATOM 0 HD2 HIS A 61 6.640 11.647 -4.939 1.00 0.00 H new ATOM 0 HE1 HIS A 61 7.772 13.582 -8.547 1.00 0.00 H new ATOM 0 HE2 HIS A 61 8.677 12.470 -6.410 1.00 0.00 H new ATOM 955 N CYS A 62 1.077 12.099 -5.428 1.00 0.00 N ATOM 956 CA CYS A 62 -0.191 11.387 -5.271 1.00 0.00 C ATOM 957 C CYS A 62 -0.075 9.940 -5.727 1.00 0.00 C ATOM 958 O CYS A 62 -0.002 9.665 -6.922 1.00 0.00 O ATOM 959 CB CYS A 62 -1.330 12.064 -6.050 1.00 0.00 C ATOM 960 SG CYS A 62 -1.525 13.810 -5.619 1.00 0.00 S ATOM 0 H CYS A 62 1.113 12.681 -6.265 1.00 0.00 H new ATOM 0 HA CYS A 62 -0.426 11.415 -4.207 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -1.136 11.977 -7.119 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -2.264 11.538 -5.852 1.00 0.00 H new ATOM 0 HG CYS A 62 -2.499 14.322 -6.311 1.00 0.00 H new ATOM 966 N VAL A 63 -0.076 9.011 -4.783 1.00 0.00 N ATOM 967 CA VAL A 63 0.240 7.615 -5.018 1.00 0.00 C ATOM 968 C VAL A 63 -1.053 6.891 -5.392 1.00 0.00 C ATOM 969 O VAL A 63 -2.003 6.847 -4.605 1.00 0.00 O ATOM 970 CB VAL A 63 0.971 7.116 -3.760 1.00 0.00 C ATOM 971 CG1 VAL A 63 1.228 5.607 -3.720 1.00 0.00 C ATOM 972 CG2 VAL A 63 2.291 7.915 -3.605 1.00 0.00 C ATOM 0 H VAL A 63 -0.302 9.215 -3.810 1.00 0.00 H new ATOM 0 HA VAL A 63 0.911 7.428 -5.856 1.00 0.00 H new ATOM 0 HB VAL A 63 0.306 7.294 -2.915 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.747 5.351 -2.797 1.00 0.00 H new ATOM 0 HG12 VAL A 63 0.278 5.075 -3.762 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.842 5.320 -4.573 1.00 0.00 H new ATOM 0 HG21 VAL A 63 2.821 7.572 -2.716 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.916 7.758 -4.484 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.064 8.976 -3.506 1.00 0.00 H new ATOM 982 N THR A 64 -1.123 6.364 -6.616 1.00 0.00 N ATOM 983 CA THR A 64 -2.303 5.638 -7.069 1.00 0.00 C ATOM 984 C THR A 64 -2.360 4.272 -6.365 1.00 0.00 C ATOM 985 O THR A 64 -1.344 3.747 -5.887 1.00 0.00 O ATOM 986 CB THR A 64 -2.363 5.515 -8.610 1.00 0.00 C ATOM 987 OG1 THR A 64 -1.510 4.504 -9.108 1.00 0.00 O ATOM 988 CG2 THR A 64 -2.067 6.810 -9.371 1.00 0.00 C ATOM 0 H THR A 64 -0.376 6.428 -7.308 1.00 0.00 H new ATOM 0 HA THR A 64 -3.191 6.207 -6.794 1.00 0.00 H new ATOM 0 HB THR A 64 -3.405 5.253 -8.793 1.00 0.00 H new ATOM 0 HG1 THR A 64 -1.585 4.464 -10.084 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.133 6.625 -10.443 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.794 7.572 -9.089 1.00 0.00 H new ATOM 0 HG23 THR A 64 -1.064 7.156 -9.123 1.00 0.00 H new ATOM 996 N GLY A 65 -3.536 3.655 -6.377 1.00 0.00 N ATOM 997 CA GLY A 65 -3.779 2.326 -5.844 1.00 0.00 C ATOM 998 C GLY A 65 -5.168 1.888 -6.281 1.00 0.00 C ATOM 999 O GLY A 65 -5.684 2.377 -7.286 1.00 0.00 O ATOM 0 H GLY A 65 -4.373 4.084 -6.772 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -3.027 1.626 -6.209 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -3.707 2.333 -4.756 1.00 0.00 H new ATOM 1003 N GLU A 66 -5.761 0.962 -5.544 1.00 0.00 N ATOM 1004 CA GLU A 66 -7.103 0.424 -5.737 1.00 0.00 C ATOM 1005 C GLU A 66 -7.761 0.380 -4.346 1.00 0.00 C ATOM 1006 O GLU A 66 -7.077 0.632 -3.347 1.00 0.00 O ATOM 1007 CB GLU A 66 -7.020 -0.971 -6.388 1.00 0.00 C ATOM 1008 CG GLU A 66 -8.099 -1.198 -7.450 1.00 0.00 C ATOM 1009 CD GLU A 66 -7.654 -0.794 -8.865 1.00 0.00 C ATOM 1010 OE1 GLU A 66 -7.231 0.366 -9.062 1.00 0.00 O ATOM 1011 OE2 GLU A 66 -7.694 -1.650 -9.777 1.00 0.00 O ATOM 0 H GLU A 66 -5.290 0.538 -4.744 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.700 1.041 -6.408 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.037 -1.096 -6.843 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.113 -1.733 -5.615 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -8.381 -2.251 -7.452 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.989 -0.630 -7.181 1.00 0.00 H new ATOM 1018 N ILE A 67 -9.057 0.083 -4.242 1.00 0.00 N ATOM 1019 CA ILE A 67 -9.797 0.218 -2.989 1.00 0.00 C ATOM 1020 C ILE A 67 -10.480 -1.112 -2.684 1.00 0.00 C ATOM 1021 O ILE A 67 -11.178 -1.674 -3.530 1.00 0.00 O ATOM 1022 CB ILE A 67 -10.779 1.405 -3.109 1.00 0.00 C ATOM 1023 CG1 ILE A 67 -9.998 2.729 -3.288 1.00 0.00 C ATOM 1024 CG2 ILE A 67 -11.697 1.527 -1.885 1.00 0.00 C ATOM 1025 CD1 ILE A 67 -10.907 3.941 -3.494 1.00 0.00 C ATOM 0 H ILE A 67 -9.621 -0.257 -5.021 1.00 0.00 H new ATOM 0 HA ILE A 67 -9.138 0.442 -2.150 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.402 1.213 -3.982 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -9.373 2.896 -2.411 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -9.328 2.636 -4.143 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -12.368 2.375 -2.017 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.283 0.614 -1.777 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -11.093 1.678 -0.991 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -10.298 4.837 -3.613 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -11.513 3.793 -4.388 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -11.559 4.058 -2.628 1.00 0.00 H new ATOM 1037 N TYR A 68 -10.267 -1.624 -1.468 1.00 0.00 N ATOM 1038 CA TYR A 68 -10.838 -2.883 -1.017 1.00 0.00 C ATOM 1039 C TYR A 68 -11.603 -2.721 0.294 1.00 0.00 C ATOM 1040 O TYR A 68 -11.025 -2.352 1.317 1.00 0.00 O ATOM 1041 CB TYR A 68 -9.753 -3.963 -0.935 1.00 0.00 C ATOM 1042 CG TYR A 68 -9.126 -4.239 -2.282 1.00 0.00 C ATOM 1043 CD1 TYR A 68 -9.854 -4.964 -3.242 1.00 0.00 C ATOM 1044 CD2 TYR A 68 -7.861 -3.715 -2.606 1.00 0.00 C ATOM 1045 CE1 TYR A 68 -9.316 -5.190 -4.518 1.00 0.00 C ATOM 1046 CE2 TYR A 68 -7.310 -3.961 -3.873 1.00 0.00 C ATOM 1047 CZ TYR A 68 -8.025 -4.716 -4.832 1.00 0.00 C ATOM 1048 OH TYR A 68 -7.452 -5.056 -6.020 1.00 0.00 O ATOM 0 H TYR A 68 -9.686 -1.166 -0.766 1.00 0.00 H new ATOM 0 HA TYR A 68 -11.571 -3.210 -1.754 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.981 -3.648 -0.233 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -10.186 -4.883 -0.541 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -10.833 -5.349 -2.996 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -7.316 -3.126 -1.883 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -9.890 -5.726 -5.259 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -6.333 -3.571 -4.118 1.00 0.00 H new ATOM 0 HH TYR A 68 -6.485 -4.902 -5.973 1.00 0.00 H new ATOM 1058 N GLU A 69 -12.898 -3.041 0.252 1.00 0.00 N ATOM 1059 CA GLU A 69 -13.686 -3.430 1.412 1.00 0.00 C ATOM 1060 C GLU A 69 -13.109 -4.770 1.866 1.00 0.00 C ATOM 1061 O GLU A 69 -13.147 -5.742 1.109 1.00 0.00 O ATOM 1062 CB GLU A 69 -15.167 -3.531 0.991 1.00 0.00 C ATOM 1063 CG GLU A 69 -16.153 -4.038 2.061 1.00 0.00 C ATOM 1064 CD GLU A 69 -17.598 -4.163 1.536 1.00 0.00 C ATOM 1065 OE1 GLU A 69 -17.838 -4.471 0.346 1.00 0.00 O ATOM 1066 OE2 GLU A 69 -18.570 -3.995 2.319 1.00 0.00 O ATOM 0 H GLU A 69 -13.437 -3.035 -0.614 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.643 -2.713 2.232 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.496 -2.545 0.663 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.232 -4.192 0.127 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -15.819 -5.010 2.424 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -16.139 -3.357 2.912 1.00 0.00 H new ATOM 1073 N VAL A 70 -12.532 -4.827 3.062 1.00 0.00 N ATOM 1074 CA VAL A 70 -11.974 -6.044 3.636 1.00 0.00 C ATOM 1075 C VAL A 70 -12.687 -6.353 4.953 1.00 0.00 C ATOM 1076 O VAL A 70 -13.390 -5.504 5.523 1.00 0.00 O ATOM 1077 CB VAL A 70 -10.436 -5.949 3.764 1.00 0.00 C ATOM 1078 CG1 VAL A 70 -9.744 -5.689 2.418 1.00 0.00 C ATOM 1079 CG2 VAL A 70 -9.943 -4.920 4.787 1.00 0.00 C ATOM 0 H VAL A 70 -12.438 -4.013 3.670 1.00 0.00 H new ATOM 0 HA VAL A 70 -12.150 -6.887 2.968 1.00 0.00 H new ATOM 0 HB VAL A 70 -10.155 -6.935 4.133 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.666 -5.632 2.568 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.972 -6.502 1.729 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -10.103 -4.748 2.000 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -8.853 -4.922 4.809 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.298 -3.929 4.506 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.327 -5.176 5.775 1.00 0.00 H new ATOM 1089 N ASP A 71 -12.509 -7.577 5.450 1.00 0.00 N ATOM 1090 CA ASP A 71 -12.949 -7.929 6.794 1.00 0.00 C ATOM 1091 C ASP A 71 -11.784 -7.729 7.744 1.00 0.00 C ATOM 1092 O ASP A 71 -10.621 -7.603 7.348 1.00 0.00 O ATOM 1093 CB ASP A 71 -13.430 -9.387 6.915 1.00 0.00 C ATOM 1094 CG ASP A 71 -14.921 -9.568 6.670 1.00 0.00 C ATOM 1095 OD1 ASP A 71 -15.719 -8.736 7.148 1.00 0.00 O ATOM 1096 OD2 ASP A 71 -15.295 -10.639 6.143 1.00 0.00 O ATOM 0 H ASP A 71 -12.063 -8.339 4.940 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.796 -7.288 7.037 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -12.878 -10.001 6.204 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -13.188 -9.757 7.911 1.00 0.00 H new ATOM 1101 N GLU A 72 -12.100 -7.842 9.027 1.00 0.00 N ATOM 1102 CA GLU A 72 -11.121 -7.945 10.088 1.00 0.00 C ATOM 1103 C GLU A 72 -10.152 -9.081 9.820 1.00 0.00 C ATOM 1104 O GLU A 72 -8.978 -8.931 10.118 1.00 0.00 O ATOM 1105 CB GLU A 72 -11.804 -8.184 11.438 1.00 0.00 C ATOM 1106 CG GLU A 72 -11.586 -6.975 12.336 1.00 0.00 C ATOM 1107 CD GLU A 72 -12.127 -7.252 13.734 1.00 0.00 C ATOM 1108 OE1 GLU A 72 -11.570 -8.154 14.412 1.00 0.00 O ATOM 1109 OE2 GLU A 72 -13.178 -6.672 14.089 1.00 0.00 O ATOM 0 H GLU A 72 -13.064 -7.865 9.360 1.00 0.00 H new ATOM 0 HA GLU A 72 -10.574 -7.003 10.120 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -12.871 -8.355 11.293 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -11.398 -9.079 11.910 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -10.523 -6.740 12.390 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.084 -6.103 11.912 1.00 0.00 H new ATOM 1116 N GLN A 73 -10.615 -10.209 9.275 1.00 0.00 N ATOM 1117 CA GLN A 73 -9.745 -11.352 9.063 1.00 0.00 C ATOM 1118 C GLN A 73 -8.563 -10.981 8.159 1.00 0.00 C ATOM 1119 O GLN A 73 -7.430 -11.367 8.442 1.00 0.00 O ATOM 1120 CB GLN A 73 -10.558 -12.538 8.530 1.00 0.00 C ATOM 1121 CG GLN A 73 -9.764 -13.853 8.507 1.00 0.00 C ATOM 1122 CD GLN A 73 -9.145 -14.169 9.864 1.00 0.00 C ATOM 1123 OE1 GLN A 73 -9.807 -14.697 10.760 1.00 0.00 O ATOM 1124 NE2 GLN A 73 -7.904 -13.765 10.061 1.00 0.00 N ATOM 0 H GLN A 73 -11.581 -10.348 8.977 1.00 0.00 H new ATOM 0 HA GLN A 73 -9.313 -11.660 10.015 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -11.447 -12.668 9.148 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -10.902 -12.311 7.521 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.423 -14.669 8.210 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.977 -13.789 7.756 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -7.382 -13.331 9.300 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -7.467 -13.886 10.975 1.00 0.00 H new ATOM 1133 N MET A 74 -8.822 -10.190 7.115 1.00 0.00 N ATOM 1134 CA MET A 74 -7.788 -9.694 6.223 1.00 0.00 C ATOM 1135 C MET A 74 -6.959 -8.634 6.941 1.00 0.00 C ATOM 1136 O MET A 74 -5.735 -8.681 6.902 1.00 0.00 O ATOM 1137 CB MET A 74 -8.456 -9.150 4.958 1.00 0.00 C ATOM 1138 CG MET A 74 -7.518 -8.368 4.035 1.00 0.00 C ATOM 1139 SD MET A 74 -6.003 -9.241 3.570 1.00 0.00 S ATOM 1140 CE MET A 74 -6.732 -10.752 2.913 1.00 0.00 C ATOM 0 H MET A 74 -9.761 -9.878 6.869 1.00 0.00 H new ATOM 0 HA MET A 74 -7.106 -10.493 5.932 1.00 0.00 H new ATOM 0 HB2 MET A 74 -8.884 -9.983 4.400 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.284 -8.503 5.248 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.061 -8.105 3.127 1.00 0.00 H new ATOM 0 HG3 MET A 74 -7.245 -7.434 4.525 1.00 0.00 H new ATOM 0 HE1 MET A 74 -5.974 -11.315 2.369 1.00 0.00 H new ATOM 0 HE2 MET A 74 -7.114 -11.358 3.734 1.00 0.00 H new ATOM 0 HE3 MET A 74 -7.550 -10.498 2.238 1.00 0.00 H new ATOM 1150 N LEU A 75 -7.607 -7.692 7.632 1.00 0.00 N ATOM 1151 CA LEU A 75 -6.885 -6.659 8.391 1.00 0.00 C ATOM 1152 C LEU A 75 -5.951 -7.242 9.467 1.00 0.00 C ATOM 1153 O LEU A 75 -4.980 -6.610 9.874 1.00 0.00 O ATOM 1154 CB LEU A 75 -7.897 -5.700 9.035 1.00 0.00 C ATOM 1155 CG LEU A 75 -7.388 -4.249 9.162 1.00 0.00 C ATOM 1156 CD1 LEU A 75 -7.184 -3.576 7.798 1.00 0.00 C ATOM 1157 CD2 LEU A 75 -8.421 -3.424 9.934 1.00 0.00 C ATOM 0 H LEU A 75 -8.623 -7.621 7.684 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.249 -6.124 7.685 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -8.813 -5.703 8.444 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -8.156 -6.072 10.026 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.428 -4.290 9.676 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -6.825 -2.557 7.945 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -6.451 -4.139 7.220 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.131 -3.553 7.258 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.069 -2.397 10.028 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -9.370 -3.435 9.397 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -8.561 -3.852 10.927 1.00 0.00 H new ATOM 1169 N ARG A 76 -6.267 -8.430 9.972 1.00 0.00 N ATOM 1170 CA ARG A 76 -5.447 -9.217 10.896 1.00 0.00 C ATOM 1171 C ARG A 76 -4.323 -9.936 10.158 1.00 0.00 C ATOM 1172 O ARG A 76 -3.225 -10.039 10.692 1.00 0.00 O ATOM 1173 CB ARG A 76 -6.338 -10.231 11.621 1.00 0.00 C ATOM 1174 CG ARG A 76 -7.266 -9.559 12.641 1.00 0.00 C ATOM 1175 CD ARG A 76 -8.345 -10.560 13.046 1.00 0.00 C ATOM 1176 NE ARG A 76 -9.239 -10.019 14.085 1.00 0.00 N ATOM 1177 CZ ARG A 76 -9.399 -10.496 15.324 1.00 0.00 C ATOM 1178 NH1 ARG A 76 -8.800 -11.619 15.712 1.00 0.00 N ATOM 1179 NH2 ARG A 76 -10.147 -9.803 16.180 1.00 0.00 N ATOM 0 H ARG A 76 -7.144 -8.896 9.739 1.00 0.00 H new ATOM 0 HA ARG A 76 -4.990 -8.543 11.621 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -6.937 -10.775 10.890 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.712 -10.965 12.129 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -6.699 -9.238 13.515 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -7.720 -8.666 12.210 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.932 -10.834 12.170 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -7.874 -11.472 13.412 1.00 0.00 H new ATOM 0 HE ARG A 76 -9.791 -9.199 13.834 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -8.206 -12.132 15.060 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -8.934 -11.967 16.661 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -10.583 -8.929 15.885 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -10.284 -10.146 17.131 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.586 -10.462 8.964 1.00 0.00 N ATOM 1194 CA PHE A 77 -3.567 -11.095 8.135 1.00 0.00 C ATOM 1195 C PHE A 77 -2.497 -10.088 7.700 1.00 0.00 C ATOM 1196 O PHE A 77 -1.314 -10.371 7.866 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.228 -11.783 6.931 1.00 0.00 C ATOM 1198 CG PHE A 77 -3.233 -12.210 5.875 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -2.463 -13.371 6.059 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -3.006 -11.387 4.755 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -1.465 -13.706 5.134 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -1.998 -11.716 3.833 1.00 0.00 C ATOM 1203 CZ PHE A 77 -1.225 -12.875 4.023 1.00 0.00 C ATOM 0 H PHE A 77 -5.516 -10.460 8.544 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.057 -11.856 8.726 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -4.780 -12.657 7.277 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -4.954 -11.103 6.485 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -2.641 -14.006 6.914 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -3.607 -10.502 4.605 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -0.879 -14.603 5.273 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.817 -11.079 2.979 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.448 -13.128 3.317 1.00 0.00 H new ATOM 1213 N LEU A 78 -2.879 -8.928 7.152 1.00 0.00 N ATOM 1214 CA LEU A 78 -1.915 -7.933 6.656 1.00 0.00 C ATOM 1215 C LEU A 78 -0.943 -7.526 7.762 1.00 0.00 C ATOM 1216 O LEU A 78 0.248 -7.359 7.527 1.00 0.00 O ATOM 1217 CB LEU A 78 -2.629 -6.679 6.127 1.00 0.00 C ATOM 1218 CG LEU A 78 -3.466 -6.896 4.857 1.00 0.00 C ATOM 1219 CD1 LEU A 78 -4.179 -5.593 4.477 1.00 0.00 C ATOM 1220 CD2 LEU A 78 -2.632 -7.388 3.667 1.00 0.00 C ATOM 0 H LEU A 78 -3.855 -8.653 7.040 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.363 -8.396 5.838 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.280 -6.292 6.911 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.882 -5.912 5.925 1.00 0.00 H new ATOM 0 HG LEU A 78 -4.192 -7.676 5.086 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -4.771 -5.752 3.576 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -4.834 -5.286 5.292 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.439 -4.814 4.292 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -3.279 -7.523 2.800 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.861 -6.653 3.434 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -2.162 -8.338 3.920 1.00 0.00 H new ATOM 1232 N ASP A 79 -1.447 -7.446 8.990 1.00 0.00 N ATOM 1233 CA ASP A 79 -0.709 -7.108 10.201 1.00 0.00 C ATOM 1234 C ASP A 79 0.501 -8.028 10.441 1.00 0.00 C ATOM 1235 O ASP A 79 1.431 -7.636 11.145 1.00 0.00 O ATOM 1236 CB ASP A 79 -1.688 -7.192 11.387 1.00 0.00 C ATOM 1237 CG ASP A 79 -2.106 -5.869 12.004 1.00 0.00 C ATOM 1238 OD1 ASP A 79 -2.167 -4.839 11.300 1.00 0.00 O ATOM 1239 OD2 ASP A 79 -2.597 -5.890 13.160 1.00 0.00 O ATOM 0 H ASP A 79 -2.434 -7.625 9.176 1.00 0.00 H new ATOM 0 HA ASP A 79 -0.304 -6.102 10.092 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -2.585 -7.714 11.055 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -1.232 -7.805 12.165 1.00 0.00 H new ATOM 1244 N ASP A 80 0.503 -9.243 9.884 1.00 0.00 N ATOM 1245 CA ASP A 80 1.621 -10.198 9.925 1.00 0.00 C ATOM 1246 C ASP A 80 2.534 -10.077 8.700 1.00 0.00 C ATOM 1247 O ASP A 80 3.741 -10.331 8.777 1.00 0.00 O ATOM 1248 CB ASP A 80 1.036 -11.615 9.950 1.00 0.00 C ATOM 1249 CG ASP A 80 2.094 -12.711 9.993 1.00 0.00 C ATOM 1250 OD1 ASP A 80 2.560 -13.032 11.111 1.00 0.00 O ATOM 1251 OD2 ASP A 80 2.365 -13.337 8.945 1.00 0.00 O ATOM 0 H ASP A 80 -0.302 -9.604 9.373 1.00 0.00 H new ATOM 0 HA ASP A 80 2.218 -9.984 10.812 1.00 0.00 H new ATOM 0 HB2 ASP A 80 0.385 -11.715 10.819 1.00 0.00 H new ATOM 0 HB3 ASP A 80 0.413 -11.757 9.067 1.00 0.00 H new ATOM 1256 N PHE A 81 1.957 -9.698 7.557 1.00 0.00 N ATOM 1257 CA PHE A 81 2.607 -9.735 6.261 1.00 0.00 C ATOM 1258 C PHE A 81 3.667 -8.641 6.188 1.00 0.00 C ATOM 1259 O PHE A 81 4.786 -8.901 5.740 1.00 0.00 O ATOM 1260 CB PHE A 81 1.545 -9.594 5.160 1.00 0.00 C ATOM 1261 CG PHE A 81 2.097 -9.518 3.748 1.00 0.00 C ATOM 1262 CD1 PHE A 81 3.000 -10.492 3.278 1.00 0.00 C ATOM 1263 CD2 PHE A 81 1.725 -8.452 2.908 1.00 0.00 C ATOM 1264 CE1 PHE A 81 3.542 -10.389 1.986 1.00 0.00 C ATOM 1265 CE2 PHE A 81 2.255 -8.359 1.611 1.00 0.00 C ATOM 1266 CZ PHE A 81 3.165 -9.325 1.149 1.00 0.00 C ATOM 0 H PHE A 81 0.999 -9.349 7.515 1.00 0.00 H new ATOM 0 HA PHE A 81 3.115 -10.688 6.114 1.00 0.00 H new ATOM 0 HB2 PHE A 81 0.862 -10.441 5.223 1.00 0.00 H new ATOM 0 HB3 PHE A 81 0.958 -8.696 5.354 1.00 0.00 H new ATOM 0 HD1 PHE A 81 3.276 -11.321 3.913 1.00 0.00 H new ATOM 0 HD2 PHE A 81 1.031 -7.704 3.262 1.00 0.00 H new ATOM 0 HE1 PHE A 81 4.248 -11.127 1.636 1.00 0.00 H new ATOM 0 HE2 PHE A 81 1.963 -7.543 0.967 1.00 0.00 H new ATOM 0 HZ PHE A 81 3.574 -9.250 0.152 1.00 0.00 H new ATOM 1276 N GLU A 82 3.355 -7.436 6.656 1.00 0.00 N ATOM 1277 CA GLU A 82 4.285 -6.310 6.727 1.00 0.00 C ATOM 1278 C GLU A 82 5.018 -6.216 8.072 1.00 0.00 C ATOM 1279 O GLU A 82 5.580 -5.169 8.372 1.00 0.00 O ATOM 1280 CB GLU A 82 3.588 -4.999 6.325 1.00 0.00 C ATOM 1281 CG GLU A 82 2.154 -4.765 6.825 1.00 0.00 C ATOM 1282 CD GLU A 82 1.183 -4.748 5.639 1.00 0.00 C ATOM 1283 OE1 GLU A 82 0.955 -5.794 4.986 1.00 0.00 O ATOM 1284 OE2 GLU A 82 0.800 -3.640 5.219 1.00 0.00 O ATOM 0 H GLU A 82 2.424 -7.208 7.006 1.00 0.00 H new ATOM 0 HA GLU A 82 5.073 -6.495 5.997 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.204 -4.171 6.676 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.575 -4.947 5.236 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.872 -5.550 7.526 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.098 -3.820 7.365 1.00 0.00 H new ATOM 1291 N ASP A 83 5.001 -7.278 8.889 1.00 0.00 N ATOM 1292 CA ASP A 83 5.598 -7.335 10.233 1.00 0.00 C ATOM 1293 C ASP A 83 5.280 -6.090 11.062 1.00 0.00 C ATOM 1294 O ASP A 83 6.139 -5.544 11.763 1.00 0.00 O ATOM 1295 CB ASP A 83 7.108 -7.639 10.247 1.00 0.00 C ATOM 1296 CG ASP A 83 7.440 -8.468 11.496 1.00 0.00 C ATOM 1297 OD1 ASP A 83 7.266 -7.985 12.644 1.00 0.00 O ATOM 1298 OD2 ASP A 83 7.781 -9.658 11.332 1.00 0.00 O ATOM 0 H ASP A 83 4.554 -8.155 8.623 1.00 0.00 H new ATOM 0 HA ASP A 83 5.119 -8.192 10.706 1.00 0.00 H new ATOM 0 HB2 ASP A 83 7.390 -8.185 9.347 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.679 -6.710 10.249 1.00 0.00 H new ATOM 1303 N CYS A 84 4.073 -5.555 10.954 1.00 0.00 N ATOM 1304 CA CYS A 84 3.671 -4.503 11.865 1.00 0.00 C ATOM 1305 C CYS A 84 3.599 -5.117 13.274 1.00 0.00 C ATOM 1306 O CYS A 84 3.433 -6.325 13.419 1.00 0.00 O ATOM 1307 CB CYS A 84 2.368 -3.840 11.392 1.00 0.00 C ATOM 1308 SG CYS A 84 0.911 -4.623 12.129 1.00 0.00 S ATOM 0 H CYS A 84 3.373 -5.825 10.263 1.00 0.00 H new ATOM 0 HA CYS A 84 4.395 -3.689 11.890 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.383 -2.782 11.652 1.00 0.00 H new ATOM 0 HB3 CYS A 84 2.303 -3.900 10.306 1.00 0.00 H new ATOM 0 HG CYS A 84 0.956 -5.905 11.921 1.00 0.00 H new ATOM 1314 N PRO A 85 3.672 -4.303 14.345 1.00 0.00 N ATOM 1315 CA PRO A 85 4.081 -2.910 14.342 1.00 0.00 C ATOM 1316 C PRO A 85 5.598 -2.716 14.159 1.00 0.00 C ATOM 1317 O PRO A 85 6.065 -1.580 14.153 1.00 0.00 O ATOM 1318 CB PRO A 85 3.618 -2.393 15.709 1.00 0.00 C ATOM 1319 CG PRO A 85 3.731 -3.619 16.615 1.00 0.00 C ATOM 1320 CD PRO A 85 3.394 -4.778 15.686 1.00 0.00 C ATOM 0 HA PRO A 85 3.645 -2.371 13.501 1.00 0.00 H new ATOM 0 HB2 PRO A 85 4.246 -1.575 16.062 1.00 0.00 H new ATOM 0 HB3 PRO A 85 2.596 -2.016 15.670 1.00 0.00 H new ATOM 0 HG2 PRO A 85 4.732 -3.718 17.034 1.00 0.00 H new ATOM 0 HG3 PRO A 85 3.038 -3.563 17.455 1.00 0.00 H new ATOM 0 HD2 PRO A 85 3.995 -5.656 15.922 1.00 0.00 H new ATOM 0 HD3 PRO A 85 2.349 -5.070 15.789 1.00 0.00 H new ATOM 1328 N SER A 86 6.377 -3.801 14.094 1.00 0.00 N ATOM 1329 CA SER A 86 7.827 -3.808 14.012 1.00 0.00 C ATOM 1330 C SER A 86 8.332 -3.005 12.812 1.00 0.00 C ATOM 1331 O SER A 86 9.042 -2.014 13.014 1.00 0.00 O ATOM 1332 CB SER A 86 8.337 -5.256 13.956 1.00 0.00 C ATOM 1333 OG SER A 86 7.446 -6.157 14.585 1.00 0.00 O ATOM 0 H SER A 86 5.985 -4.743 14.098 1.00 0.00 H new ATOM 0 HA SER A 86 8.220 -3.325 14.906 1.00 0.00 H new ATOM 0 HB2 SER A 86 8.477 -5.551 12.916 1.00 0.00 H new ATOM 0 HB3 SER A 86 9.313 -5.315 14.438 1.00 0.00 H new ATOM 0 HG SER A 86 7.167 -6.843 13.943 1.00 0.00 H new ATOM 1339 N MET A 87 7.992 -3.425 11.586 1.00 0.00 N ATOM 1340 CA MET A 87 8.506 -2.814 10.368 1.00 0.00 C ATOM 1341 C MET A 87 7.609 -1.630 10.013 1.00 0.00 C ATOM 1342 O MET A 87 8.016 -0.480 10.191 1.00 0.00 O ATOM 1343 CB MET A 87 8.592 -3.831 9.217 1.00 0.00 C ATOM 1344 CG MET A 87 9.640 -4.938 9.376 1.00 0.00 C ATOM 1345 SD MET A 87 9.563 -6.286 8.149 1.00 0.00 S ATOM 1346 CE MET A 87 9.203 -5.396 6.610 1.00 0.00 C ATOM 0 H MET A 87 7.351 -4.200 11.418 1.00 0.00 H new ATOM 0 HA MET A 87 9.524 -2.462 10.534 1.00 0.00 H new ATOM 0 HB2 MET A 87 7.614 -4.298 9.097 1.00 0.00 H new ATOM 0 HB3 MET A 87 8.802 -3.289 8.295 1.00 0.00 H new ATOM 0 HG2 MET A 87 10.630 -4.485 9.328 1.00 0.00 H new ATOM 0 HG3 MET A 87 9.536 -5.371 10.371 1.00 0.00 H new ATOM 0 HE1 MET A 87 9.306 -6.075 5.764 1.00 0.00 H new ATOM 0 HE2 MET A 87 8.184 -5.010 6.643 1.00 0.00 H new ATOM 0 HE3 MET A 87 9.902 -4.567 6.497 1.00 0.00 H new ATOM 1356 N TYR A 88 6.403 -1.888 9.503 1.00 0.00 N ATOM 1357 CA TYR A 88 5.421 -0.849 9.218 1.00 0.00 C ATOM 1358 C TYR A 88 4.562 -0.643 10.469 1.00 0.00 C ATOM 1359 O TYR A 88 4.660 -1.400 11.431 1.00 0.00 O ATOM 1360 CB TYR A 88 4.584 -1.278 8.003 1.00 0.00 C ATOM 1361 CG TYR A 88 5.390 -1.268 6.716 1.00 0.00 C ATOM 1362 CD1 TYR A 88 6.232 -2.351 6.403 1.00 0.00 C ATOM 1363 CD2 TYR A 88 5.343 -0.151 5.859 1.00 0.00 C ATOM 1364 CE1 TYR A 88 7.060 -2.300 5.273 1.00 0.00 C ATOM 1365 CE2 TYR A 88 6.151 -0.104 4.709 1.00 0.00 C ATOM 1366 CZ TYR A 88 7.027 -1.176 4.425 1.00 0.00 C ATOM 1367 OH TYR A 88 7.858 -1.136 3.354 1.00 0.00 O ATOM 0 H TYR A 88 6.082 -2.829 9.276 1.00 0.00 H new ATOM 0 HA TYR A 88 5.899 0.099 8.973 1.00 0.00 H new ATOM 0 HB2 TYR A 88 4.187 -2.279 8.173 1.00 0.00 H new ATOM 0 HB3 TYR A 88 3.729 -0.610 7.899 1.00 0.00 H new ATOM 0 HD1 TYR A 88 6.240 -3.226 7.036 1.00 0.00 H new ATOM 0 HD2 TYR A 88 4.683 0.673 6.086 1.00 0.00 H new ATOM 0 HE1 TYR A 88 7.724 -3.123 5.053 1.00 0.00 H new ATOM 0 HE2 TYR A 88 6.102 0.747 4.046 1.00 0.00 H new ATOM 0 HH TYR A 88 7.422 -0.656 2.619 1.00 0.00 H new ATOM 1377 N GLN A 89 3.694 0.363 10.474 1.00 0.00 N ATOM 1378 CA GLN A 89 2.608 0.527 11.430 1.00 0.00 C ATOM 1379 C GLN A 89 1.364 0.911 10.625 1.00 0.00 C ATOM 1380 O GLN A 89 1.453 1.674 9.659 1.00 0.00 O ATOM 1381 CB GLN A 89 2.969 1.576 12.501 1.00 0.00 C ATOM 1382 CG GLN A 89 3.977 1.075 13.559 1.00 0.00 C ATOM 1383 CD GLN A 89 5.350 1.747 13.480 1.00 0.00 C ATOM 1384 OE1 GLN A 89 5.600 2.735 14.169 1.00 0.00 O ATOM 1385 NE2 GLN A 89 6.278 1.235 12.690 1.00 0.00 N ATOM 0 H GLN A 89 3.730 1.115 9.785 1.00 0.00 H new ATOM 0 HA GLN A 89 2.420 -0.395 11.980 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.383 2.456 12.008 1.00 0.00 H new ATOM 0 HB3 GLN A 89 2.056 1.893 13.006 1.00 0.00 H new ATOM 0 HG2 GLN A 89 3.559 1.242 14.552 1.00 0.00 H new ATOM 0 HG3 GLN A 89 4.104 -0.001 13.444 1.00 0.00 H new ATOM 0 HE21 GLN A 89 6.067 0.416 12.120 1.00 0.00 H new ATOM 0 HE22 GLN A 89 7.205 1.659 12.650 1.00 0.00 H new ATOM 1394 N ARG A 90 0.208 0.346 10.975 1.00 0.00 N ATOM 1395 CA ARG A 90 -1.061 0.606 10.298 1.00 0.00 C ATOM 1396 C ARG A 90 -1.565 1.985 10.691 1.00 0.00 C ATOM 1397 O ARG A 90 -1.715 2.228 11.889 1.00 0.00 O ATOM 1398 CB ARG A 90 -2.078 -0.472 10.693 1.00 0.00 C ATOM 1399 CG ARG A 90 -3.406 -0.310 9.924 1.00 0.00 C ATOM 1400 CD ARG A 90 -4.532 0.237 10.803 1.00 0.00 C ATOM 1401 NE ARG A 90 -4.797 -0.650 11.937 1.00 0.00 N ATOM 1402 CZ ARG A 90 -4.881 -0.381 13.238 1.00 0.00 C ATOM 1403 NH1 ARG A 90 -4.798 0.864 13.696 1.00 0.00 N ATOM 1404 NH2 ARG A 90 -5.003 -1.392 14.082 1.00 0.00 N ATOM 0 H ARG A 90 0.127 -0.314 11.748 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.921 0.577 9.217 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.659 -1.458 10.493 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.269 -0.418 11.765 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.252 0.360 9.078 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -3.705 -1.275 9.516 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.263 1.228 11.168 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -5.438 0.352 10.208 1.00 0.00 H new ATOM 0 HE ARG A 90 -4.940 -1.630 11.691 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -4.667 1.639 13.046 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -4.865 1.044 14.698 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -5.031 -2.349 13.731 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -5.069 -1.214 15.084 1.00 0.00 H new ATOM 1418 N THR A 91 -1.940 2.835 9.735 1.00 0.00 N ATOM 1419 CA THR A 91 -2.339 4.203 10.040 1.00 0.00 C ATOM 1420 C THR A 91 -3.640 4.546 9.305 1.00 0.00 C ATOM 1421 O THR A 91 -3.988 3.936 8.290 1.00 0.00 O ATOM 1422 CB THR A 91 -1.178 5.152 9.675 1.00 0.00 C ATOM 1423 OG1 THR A 91 0.080 4.585 9.990 1.00 0.00 O ATOM 1424 CG2 THR A 91 -1.258 6.470 10.444 1.00 0.00 C ATOM 0 H THR A 91 -1.975 2.597 8.744 1.00 0.00 H new ATOM 0 HA THR A 91 -2.543 4.318 11.104 1.00 0.00 H new ATOM 0 HB THR A 91 -1.272 5.322 8.603 1.00 0.00 H new ATOM 0 HG1 THR A 91 0.647 4.584 9.191 1.00 0.00 H new ATOM 0 HG21 THR A 91 -0.423 7.109 10.158 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.196 6.972 10.209 1.00 0.00 H new ATOM 0 HG23 THR A 91 -1.212 6.270 11.515 1.00 0.00 H new ATOM 1432 N ALA A 92 -4.379 5.522 9.828 1.00 0.00 N ATOM 1433 CA ALA A 92 -5.510 6.167 9.174 1.00 0.00 C ATOM 1434 C ALA A 92 -5.033 7.347 8.322 1.00 0.00 C ATOM 1435 O ALA A 92 -4.140 8.094 8.740 1.00 0.00 O ATOM 1436 CB ALA A 92 -6.468 6.656 10.256 1.00 0.00 C ATOM 0 H ALA A 92 -4.197 5.899 10.758 1.00 0.00 H new ATOM 0 HA ALA A 92 -6.013 5.458 8.516 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.325 7.143 9.790 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.811 5.808 10.849 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -5.954 7.367 10.903 1.00 0.00 H new ATOM 1442 N LEU A 93 -5.617 7.512 7.133 1.00 0.00 N ATOM 1443 CA LEU A 93 -5.253 8.541 6.166 1.00 0.00 C ATOM 1444 C LEU A 93 -6.351 8.797 5.130 1.00 0.00 C ATOM 1445 O LEU A 93 -7.377 8.108 5.128 1.00 0.00 O ATOM 1446 CB LEU A 93 -3.972 8.113 5.446 1.00 0.00 C ATOM 1447 CG LEU A 93 -4.069 7.091 4.335 1.00 0.00 C ATOM 1448 CD1 LEU A 93 -2.656 6.964 3.812 1.00 0.00 C ATOM 1449 CD2 LEU A 93 -4.952 5.880 4.682 1.00 0.00 C ATOM 0 H LEU A 93 -6.378 6.914 6.810 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.106 9.471 6.716 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.511 9.009 5.031 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.286 7.721 6.197 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.669 7.367 3.468 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.633 6.239 2.999 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.316 7.932 3.445 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.999 6.630 4.615 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -4.973 5.191 3.837 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -4.544 5.371 5.555 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -5.965 6.219 4.899 1.00 0.00 H new ATOM 1461 N GLN A 94 -6.089 9.727 4.208 1.00 0.00 N ATOM 1462 CA GLN A 94 -7.003 10.106 3.140 1.00 0.00 C ATOM 1463 C GLN A 94 -6.670 9.436 1.795 1.00 0.00 C ATOM 1464 O GLN A 94 -5.499 9.332 1.415 1.00 0.00 O ATOM 1465 CB GLN A 94 -6.974 11.644 3.009 1.00 0.00 C ATOM 1466 CG GLN A 94 -8.057 12.265 2.106 1.00 0.00 C ATOM 1467 CD GLN A 94 -9.368 12.507 2.851 1.00 0.00 C ATOM 1468 OE1 GLN A 94 -9.572 13.551 3.466 1.00 0.00 O ATOM 1469 NE2 GLN A 94 -10.288 11.558 2.835 1.00 0.00 N ATOM 0 H GLN A 94 -5.212 10.247 4.188 1.00 0.00 H new ATOM 0 HA GLN A 94 -8.002 9.758 3.401 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -7.068 12.076 4.005 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -5.997 11.938 2.626 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -7.692 13.209 1.702 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -8.241 11.606 1.258 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -10.118 10.692 2.324 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -11.168 11.692 3.333 1.00 0.00 H new ATOM 1478 N VAL A 95 -7.712 9.058 1.039 1.00 0.00 N ATOM 1479 CA VAL A 95 -7.655 8.516 -0.323 1.00 0.00 C ATOM 1480 C VAL A 95 -8.781 9.182 -1.143 1.00 0.00 C ATOM 1481 O VAL A 95 -9.896 9.291 -0.647 1.00 0.00 O ATOM 1482 CB VAL A 95 -7.776 6.973 -0.224 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -8.027 6.285 -1.569 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -6.509 6.353 0.392 1.00 0.00 C ATOM 0 H VAL A 95 -8.670 9.127 1.383 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.717 8.731 -0.834 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.644 6.805 0.414 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -8.100 5.208 -1.419 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.958 6.655 -1.999 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -7.202 6.502 -2.248 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.624 5.271 0.448 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -5.647 6.594 -0.229 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.358 6.754 1.394 1.00 0.00 H new ATOM 1494 N GLN A 96 -8.530 9.647 -2.371 1.00 0.00 N ATOM 1495 CA GLN A 96 -9.536 10.014 -3.350 1.00 0.00 C ATOM 1496 C GLN A 96 -10.097 8.739 -3.947 1.00 0.00 C ATOM 1497 O GLN A 96 -9.349 7.785 -4.167 1.00 0.00 O ATOM 1498 CB GLN A 96 -8.919 10.889 -4.454 1.00 0.00 C ATOM 1499 CG GLN A 96 -9.839 11.104 -5.672 1.00 0.00 C ATOM 1500 CD GLN A 96 -9.313 12.091 -6.715 1.00 0.00 C ATOM 1501 OE1 GLN A 96 -10.032 13.161 -7.015 1.00 0.00 O flip ATOM 1502 NE2 GLN A 96 -8.300 11.854 -7.353 1.00 0.00 N flip ATOM 0 H GLN A 96 -7.579 9.780 -2.716 1.00 0.00 H new ATOM 0 HA GLN A 96 -10.329 10.589 -2.872 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -8.660 11.860 -4.032 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -7.990 10.430 -4.790 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -10.006 10.142 -6.156 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -10.808 11.455 -5.318 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -7.738 11.032 -7.131 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -8.015 12.478 -8.108 1.00 0.00 H new ATOM 1511 N VAL A 97 -11.386 8.743 -4.257 1.00 0.00 N ATOM 1512 CA VAL A 97 -12.086 7.598 -4.805 1.00 0.00 C ATOM 1513 C VAL A 97 -12.458 7.895 -6.249 1.00 0.00 C ATOM 1514 O VAL A 97 -13.563 8.326 -6.568 1.00 0.00 O ATOM 1515 CB VAL A 97 -13.182 7.165 -3.835 1.00 0.00 C ATOM 1516 CG1 VAL A 97 -14.158 8.160 -3.338 1.00 0.00 C ATOM 1517 CG2 VAL A 97 -13.900 5.856 -4.184 1.00 0.00 C ATOM 0 H VAL A 97 -11.983 9.560 -4.131 1.00 0.00 H new ATOM 0 HA VAL A 97 -11.472 6.701 -4.887 1.00 0.00 H new ATOM 0 HB VAL A 97 -12.521 7.000 -2.984 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -14.860 7.674 -2.661 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -13.631 8.952 -2.807 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -14.702 8.588 -4.180 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -14.658 5.644 -3.429 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -14.376 5.951 -5.160 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -13.177 5.041 -4.211 1.00 0.00 H new ATOM 1527 N LEU A 98 -11.447 7.668 -7.097 1.00 0.00 N ATOM 1528 CA LEU A 98 -11.477 7.781 -8.550 1.00 0.00 C ATOM 1529 C LEU A 98 -12.733 7.134 -9.107 1.00 0.00 C ATOM 1530 O LEU A 98 -13.334 7.657 -10.046 1.00 0.00 O ATOM 1531 CB LEU A 98 -10.257 7.063 -9.160 1.00 0.00 C ATOM 1532 CG LEU A 98 -9.167 7.982 -9.713 1.00 0.00 C ATOM 1533 CD1 LEU A 98 -8.366 8.649 -8.591 1.00 0.00 C ATOM 1534 CD2 LEU A 98 -8.226 7.126 -10.562 1.00 0.00 C ATOM 0 H LEU A 98 -10.528 7.382 -6.758 1.00 0.00 H new ATOM 0 HA LEU A 98 -11.461 8.840 -8.806 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.816 6.421 -8.398 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.603 6.413 -9.963 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.631 8.773 -10.301 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.601 9.294 -9.024 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.035 9.245 -7.971 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.890 7.883 -7.979 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -7.435 7.753 -10.973 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.785 6.345 -9.942 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.786 6.669 -11.377 1.00 0.00 H new ATOM 1546 N GLU A 99 -13.104 5.973 -8.582 1.00 0.00 N ATOM 1547 CA GLU A 99 -14.313 5.281 -8.967 1.00 0.00 C ATOM 1548 C GLU A 99 -14.789 4.492 -7.752 1.00 0.00 C ATOM 1549 O GLU A 99 -13.967 4.055 -6.943 1.00 0.00 O ATOM 1550 CB GLU A 99 -13.971 4.346 -10.129 1.00 0.00 C ATOM 1551 CG GLU A 99 -15.129 4.123 -11.098 1.00 0.00 C ATOM 1552 CD GLU A 99 -15.098 5.130 -12.256 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -14.320 4.926 -13.224 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -15.836 6.129 -12.215 1.00 0.00 O ATOM 0 H GLU A 99 -12.562 5.485 -7.869 1.00 0.00 H new ATOM 0 HA GLU A 99 -15.100 5.964 -9.287 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -13.124 4.758 -10.678 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -13.654 3.383 -9.728 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.082 3.109 -11.495 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -16.074 4.212 -10.563 1.00 0.00 H new ATOM 1561 N TRP A 100 -16.090 4.250 -7.658 1.00 0.00 N ATOM 1562 CA TRP A 100 -16.731 3.452 -6.622 1.00 0.00 C ATOM 1563 C TRP A 100 -17.579 2.404 -7.320 1.00 0.00 C ATOM 1564 O TRP A 100 -18.269 2.711 -8.296 1.00 0.00 O ATOM 1565 CB TRP A 100 -17.597 4.336 -5.707 1.00 0.00 C ATOM 1566 CG TRP A 100 -18.155 3.659 -4.482 1.00 0.00 C ATOM 1567 CD1 TRP A 100 -19.460 3.423 -4.188 1.00 0.00 C ATOM 1568 CD2 TRP A 100 -17.407 3.174 -3.327 1.00 0.00 C ATOM 1569 NE1 TRP A 100 -19.559 2.824 -2.947 1.00 0.00 N ATOM 1570 CE2 TRP A 100 -18.328 2.716 -2.340 1.00 0.00 C ATOM 1571 CE3 TRP A 100 -16.038 3.115 -2.997 1.00 0.00 C ATOM 1572 CZ2 TRP A 100 -17.917 2.283 -1.070 1.00 0.00 C ATOM 1573 CZ3 TRP A 100 -15.613 2.697 -1.721 1.00 0.00 C ATOM 1574 CH2 TRP A 100 -16.547 2.285 -0.754 1.00 0.00 C ATOM 0 H TRP A 100 -16.758 4.622 -8.333 1.00 0.00 H new ATOM 0 HA TRP A 100 -15.982 2.977 -5.988 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -17.000 5.190 -5.387 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -18.428 4.729 -6.293 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -20.295 3.667 -4.828 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -20.434 2.502 -2.533 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -15.302 3.395 -3.736 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -18.645 1.952 -0.344 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -14.560 2.693 -1.483 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -16.214 1.972 0.225 1.00 0.00 H new ATOM 1585 N GLU A 101 -17.538 1.175 -6.810 1.00 0.00 N ATOM 1586 CA GLU A 101 -18.378 0.094 -7.288 1.00 0.00 C ATOM 1587 C GLU A 101 -19.369 -0.320 -6.200 1.00 0.00 C ATOM 1588 O GLU A 101 -19.000 -0.976 -5.219 1.00 0.00 O ATOM 1589 CB GLU A 101 -17.525 -1.096 -7.761 1.00 0.00 C ATOM 1590 CG GLU A 101 -16.516 -0.814 -8.888 1.00 0.00 C ATOM 1591 CD GLU A 101 -17.099 -0.211 -10.172 1.00 0.00 C ATOM 1592 OE1 GLU A 101 -18.338 -0.278 -10.378 1.00 0.00 O ATOM 1593 OE2 GLU A 101 -16.296 0.305 -10.980 1.00 0.00 O ATOM 0 H GLU A 101 -16.915 0.906 -6.049 1.00 0.00 H new ATOM 0 HA GLU A 101 -18.947 0.444 -8.149 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -16.977 -1.485 -6.903 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -18.197 -1.886 -8.095 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -15.753 -0.137 -8.505 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -16.015 -1.748 -9.143 1.00 0.00 H new ATOM 1600 N GLY A 102 -20.640 0.041 -6.385 1.00 0.00 N ATOM 1601 CA GLY A 102 -21.733 -0.354 -5.511 1.00 0.00 C ATOM 1602 C GLY A 102 -22.444 0.835 -4.909 1.00 0.00 C ATOM 1603 O GLY A 102 -22.181 1.994 -5.243 1.00 0.00 O ATOM 0 H GLY A 102 -20.939 0.628 -7.164 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -22.447 -0.954 -6.075 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -21.346 -0.986 -4.712 1.00 0.00 H new ATOM 1607 N ASP A 103 -23.391 0.519 -4.036 1.00 0.00 N ATOM 1608 CA ASP A 103 -24.011 1.511 -3.180 1.00 0.00 C ATOM 1609 C ASP A 103 -23.091 1.803 -1.991 1.00 0.00 C ATOM 1610 O ASP A 103 -22.070 1.138 -1.785 1.00 0.00 O ATOM 1611 CB ASP A 103 -25.388 1.015 -2.721 1.00 0.00 C ATOM 1612 CG ASP A 103 -26.178 2.119 -2.012 1.00 0.00 C ATOM 1613 OD1 ASP A 103 -26.221 3.257 -2.543 1.00 0.00 O ATOM 1614 OD2 ASP A 103 -26.704 1.880 -0.902 1.00 0.00 O ATOM 0 H ASP A 103 -23.747 -0.428 -3.904 1.00 0.00 H new ATOM 0 HA ASP A 103 -24.160 2.440 -3.731 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -25.953 0.659 -3.583 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -25.264 0.166 -2.048 1.00 0.00 H new ATOM 1619 N GLY A 104 -23.444 2.798 -1.189 1.00 0.00 N ATOM 1620 CA GLY A 104 -22.678 3.223 -0.043 1.00 0.00 C ATOM 1621 C GLY A 104 -21.582 4.168 -0.490 1.00 0.00 C ATOM 1622 O GLY A 104 -20.440 3.957 -0.115 1.00 0.00 O ATOM 0 H GLY A 104 -24.296 3.342 -1.328 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -23.328 3.718 0.679 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -22.245 2.358 0.459 1.00 0.00 H new ATOM 1626 N ASP A 105 -21.977 5.292 -1.094 1.00 0.00 N ATOM 1627 CA ASP A 105 -21.299 6.227 -1.997 1.00 0.00 C ATOM 1628 C ASP A 105 -20.851 7.462 -1.199 1.00 0.00 C ATOM 1629 O ASP A 105 -21.654 8.352 -0.896 1.00 0.00 O ATOM 1630 CB ASP A 105 -22.256 6.667 -3.116 1.00 0.00 C ATOM 1631 CG ASP A 105 -21.769 7.926 -3.854 1.00 0.00 C ATOM 1632 OD1 ASP A 105 -20.544 8.114 -4.028 1.00 0.00 O ATOM 1633 OD2 ASP A 105 -22.649 8.759 -4.175 1.00 0.00 O ATOM 0 H ASP A 105 -22.931 5.616 -0.934 1.00 0.00 H new ATOM 0 HA ASP A 105 -20.434 5.734 -2.441 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.370 5.853 -3.832 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -23.241 6.858 -2.691 1.00 0.00 H new ATOM 1638 N PRO A 106 -19.640 7.399 -0.625 1.00 0.00 N ATOM 1639 CA PRO A 106 -19.085 8.359 0.321 1.00 0.00 C ATOM 1640 C PRO A 106 -18.662 9.698 -0.320 1.00 0.00 C ATOM 1641 O PRO A 106 -18.013 10.497 0.362 1.00 0.00 O ATOM 1642 CB PRO A 106 -17.913 7.589 0.965 1.00 0.00 C ATOM 1643 CG PRO A 106 -17.366 6.773 -0.202 1.00 0.00 C ATOM 1644 CD PRO A 106 -18.598 6.452 -1.022 1.00 0.00 C ATOM 0 HA PRO A 106 -19.823 8.687 1.053 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -17.161 8.264 1.374 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -18.248 6.951 1.783 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -16.636 7.340 -0.780 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -16.866 5.867 0.142 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -18.385 6.539 -2.087 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -18.922 5.427 -0.844 1.00 0.00 H new ATOM 1652 N GLY A 107 -18.904 9.946 -1.612 1.00 0.00 N ATOM 1653 CA GLY A 107 -18.237 11.006 -2.355 1.00 0.00 C ATOM 1654 C GLY A 107 -16.811 10.583 -2.704 1.00 0.00 C ATOM 1655 O GLY A 107 -16.462 9.429 -2.506 1.00 0.00 O ATOM 0 H GLY A 107 -19.571 9.412 -2.168 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -18.793 11.227 -3.266 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -18.219 11.921 -1.762 1.00 0.00 H new ATOM 1659 N ASP A 108 -15.994 11.511 -3.183 1.00 0.00 N ATOM 1660 CA ASP A 108 -14.678 11.356 -3.842 1.00 0.00 C ATOM 1661 C ASP A 108 -13.463 11.529 -2.950 1.00 0.00 C ATOM 1662 O ASP A 108 -12.362 11.445 -3.485 1.00 0.00 O ATOM 1663 CB ASP A 108 -14.607 12.427 -4.925 1.00 0.00 C ATOM 1664 CG ASP A 108 -13.482 12.317 -5.950 1.00 0.00 C ATOM 1665 OD1 ASP A 108 -13.448 11.361 -6.755 1.00 0.00 O ATOM 1666 OD2 ASP A 108 -12.707 13.294 -6.072 1.00 0.00 O ATOM 0 H ASP A 108 -16.251 12.496 -3.120 1.00 0.00 H new ATOM 0 HA ASP A 108 -14.631 10.328 -4.202 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -15.555 12.424 -5.464 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -14.522 13.397 -4.434 1.00 0.00 H new ATOM 1671 N SER A 109 -13.572 11.698 -1.630 1.00 0.00 N ATOM 1672 CA SER A 109 -12.470 11.268 -0.790 1.00 0.00 C ATOM 1673 C SER A 109 -12.889 10.525 0.477 1.00 0.00 C ATOM 1674 O SER A 109 -13.633 11.035 1.329 1.00 0.00 O ATOM 1675 CB SER A 109 -11.512 12.399 -0.503 1.00 0.00 C ATOM 1676 OG SER A 109 -12.130 13.571 -0.005 1.00 0.00 O ATOM 0 H SER A 109 -14.371 12.108 -1.146 1.00 0.00 H new ATOM 0 HA SER A 109 -11.937 10.521 -1.378 1.00 0.00 H new ATOM 0 HB2 SER A 109 -10.771 12.058 0.220 1.00 0.00 H new ATOM 0 HB3 SER A 109 -10.975 12.646 -1.419 1.00 0.00 H new ATOM 0 HG SER A 109 -11.449 14.256 0.158 1.00 0.00 H new ATOM 1682 N VAL A 110 -12.381 9.302 0.590 1.00 0.00 N ATOM 1683 CA VAL A 110 -12.641 8.390 1.685 1.00 0.00 C ATOM 1684 C VAL A 110 -11.482 8.466 2.678 1.00 0.00 C ATOM 1685 O VAL A 110 -10.334 8.767 2.326 1.00 0.00 O ATOM 1686 CB VAL A 110 -12.862 6.952 1.152 1.00 0.00 C ATOM 1687 CG1 VAL A 110 -14.004 6.867 0.156 1.00 0.00 C ATOM 1688 CG2 VAL A 110 -11.622 6.330 0.485 1.00 0.00 C ATOM 0 H VAL A 110 -11.752 8.909 -0.110 1.00 0.00 H new ATOM 0 HA VAL A 110 -13.556 8.676 2.203 1.00 0.00 H new ATOM 0 HB VAL A 110 -13.099 6.386 2.053 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -14.114 5.837 -0.184 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -14.928 7.192 0.634 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -13.791 7.511 -0.698 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -11.861 5.324 0.140 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -11.320 6.943 -0.364 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -10.806 6.282 1.206 1.00 0.00 H new ATOM 1698 N GLN A 111 -11.780 8.146 3.930 1.00 0.00 N ATOM 1699 CA GLN A 111 -10.800 7.824 4.951 1.00 0.00 C ATOM 1700 C GLN A 111 -10.537 6.319 4.812 1.00 0.00 C ATOM 1701 O GLN A 111 -11.486 5.538 4.848 1.00 0.00 O ATOM 1702 CB GLN A 111 -11.399 8.253 6.306 1.00 0.00 C ATOM 1703 CG GLN A 111 -10.509 8.015 7.533 1.00 0.00 C ATOM 1704 CD GLN A 111 -10.805 6.638 8.112 1.00 0.00 C ATOM 1705 OE1 GLN A 111 -11.762 6.428 8.858 1.00 0.00 O ATOM 1706 NE2 GLN A 111 -10.034 5.647 7.725 1.00 0.00 N ATOM 0 H GLN A 111 -12.741 8.103 4.271 1.00 0.00 H new ATOM 0 HA GLN A 111 -9.844 8.340 4.860 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -11.640 9.315 6.256 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -12.338 7.719 6.452 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -9.458 8.086 7.253 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -10.692 8.784 8.283 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -9.243 5.828 7.107 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -10.227 4.697 8.043 1.00 0.00 H new ATOM 1715 N CYS A 112 -9.278 5.901 4.659 1.00 0.00 N ATOM 1716 CA CYS A 112 -8.873 4.494 4.584 1.00 0.00 C ATOM 1717 C CYS A 112 -7.960 4.137 5.761 1.00 0.00 C ATOM 1718 O CYS A 112 -7.535 5.013 6.521 1.00 0.00 O ATOM 1719 CB CYS A 112 -8.181 4.217 3.234 1.00 0.00 C ATOM 1720 SG CYS A 112 -9.433 3.892 1.960 1.00 0.00 S ATOM 0 H CYS A 112 -8.492 6.547 4.582 1.00 0.00 H new ATOM 0 HA CYS A 112 -9.759 3.863 4.648 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -7.569 5.072 2.946 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -7.512 3.362 3.326 1.00 0.00 H new ATOM 0 HG CYS A 112 -8.846 3.661 0.823 1.00 0.00 H new ATOM 1726 N PHE A 113 -7.641 2.850 5.919 1.00 0.00 N ATOM 1727 CA PHE A 113 -6.399 2.421 6.560 1.00 0.00 C ATOM 1728 C PHE A 113 -5.362 2.231 5.465 1.00 0.00 C ATOM 1729 O PHE A 113 -5.727 1.731 4.402 1.00 0.00 O ATOM 1730 CB PHE A 113 -6.587 1.143 7.384 1.00 0.00 C ATOM 1731 CG PHE A 113 -7.589 1.263 8.518 1.00 0.00 C ATOM 1732 CD1 PHE A 113 -7.201 1.830 9.750 1.00 0.00 C ATOM 1733 CD2 PHE A 113 -8.912 0.815 8.348 1.00 0.00 C ATOM 1734 CE1 PHE A 113 -8.118 1.918 10.816 1.00 0.00 C ATOM 1735 CE2 PHE A 113 -9.840 0.956 9.394 1.00 0.00 C ATOM 1736 CZ PHE A 113 -9.447 1.498 10.632 1.00 0.00 C ATOM 0 H PHE A 113 -8.234 2.081 5.607 1.00 0.00 H new ATOM 0 HA PHE A 113 -6.068 3.180 7.268 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -6.906 0.341 6.718 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -5.623 0.849 7.798 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -6.194 2.199 9.877 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -9.214 0.363 7.415 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -7.801 2.307 11.772 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -10.864 0.646 9.246 1.00 0.00 H new ATOM 0 HZ PHE A 113 -10.162 1.591 11.436 1.00 0.00 H new ATOM 1746 N VAL A 114 -4.119 2.643 5.721 1.00 0.00 N ATOM 1747 CA VAL A 114 -2.898 2.468 4.940 1.00 0.00 C ATOM 1748 C VAL A 114 -1.764 2.223 5.937 1.00 0.00 C ATOM 1749 O VAL A 114 -1.594 2.992 6.882 1.00 0.00 O ATOM 1750 CB VAL A 114 -2.640 3.675 3.997 1.00 0.00 C ATOM 1751 CG1 VAL A 114 -1.200 3.710 3.478 1.00 0.00 C ATOM 1752 CG2 VAL A 114 -3.512 3.595 2.754 1.00 0.00 C ATOM 0 H VAL A 114 -3.925 3.165 6.576 1.00 0.00 H new ATOM 0 HA VAL A 114 -2.980 1.614 4.268 1.00 0.00 H new ATOM 0 HB VAL A 114 -2.860 4.557 4.598 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -1.070 4.572 2.823 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -0.512 3.787 4.320 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -0.992 2.797 2.921 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.310 4.453 2.112 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -3.290 2.676 2.212 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -4.562 3.599 3.045 1.00 0.00 H new ATOM 1762 N TYR A 115 -1.014 1.133 5.775 1.00 0.00 N ATOM 1763 CA TYR A 115 0.210 0.910 6.540 1.00 0.00 C ATOM 1764 C TYR A 115 1.286 1.868 6.026 1.00 0.00 C ATOM 1765 O TYR A 115 1.381 2.118 4.824 1.00 0.00 O ATOM 1766 CB TYR A 115 0.653 -0.558 6.435 1.00 0.00 C ATOM 1767 CG TYR A 115 -0.288 -1.564 7.087 1.00 0.00 C ATOM 1768 CD1 TYR A 115 -1.455 -1.974 6.413 1.00 0.00 C ATOM 1769 CD2 TYR A 115 0.051 -2.179 8.311 1.00 0.00 C ATOM 1770 CE1 TYR A 115 -2.305 -2.946 6.972 1.00 0.00 C ATOM 1771 CE2 TYR A 115 -0.776 -3.179 8.859 1.00 0.00 C ATOM 1772 CZ TYR A 115 -1.973 -3.542 8.206 1.00 0.00 C ATOM 1773 OH TYR A 115 -2.829 -4.434 8.771 1.00 0.00 O ATOM 0 H TYR A 115 -1.236 0.387 5.116 1.00 0.00 H new ATOM 0 HA TYR A 115 0.035 1.111 7.597 1.00 0.00 H new ATOM 0 HB2 TYR A 115 0.761 -0.815 5.381 1.00 0.00 H new ATOM 0 HB3 TYR A 115 1.639 -0.658 6.890 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -1.700 -1.537 5.456 1.00 0.00 H new ATOM 0 HD2 TYR A 115 0.950 -1.881 8.831 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -3.209 -3.235 6.457 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -0.494 -3.668 9.780 1.00 0.00 H new ATOM 0 HH TYR A 115 -2.502 -4.682 9.661 1.00 0.00 H new ATOM 1783 N THR A 116 2.094 2.411 6.928 1.00 0.00 N ATOM 1784 CA THR A 116 3.146 3.391 6.677 1.00 0.00 C ATOM 1785 C THR A 116 4.288 3.091 7.647 1.00 0.00 C ATOM 1786 O THR A 116 4.285 2.051 8.304 1.00 0.00 O ATOM 1787 CB THR A 116 2.559 4.812 6.834 1.00 0.00 C ATOM 1788 OG1 THR A 116 1.929 5.014 8.081 1.00 0.00 O ATOM 1789 CG2 THR A 116 1.488 5.132 5.789 1.00 0.00 C ATOM 0 H THR A 116 2.029 2.164 7.916 1.00 0.00 H new ATOM 0 HA THR A 116 3.541 3.333 5.663 1.00 0.00 H new ATOM 0 HB THR A 116 3.430 5.457 6.722 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.353 5.805 8.032 1.00 0.00 H new ATOM 0 HG21 THR A 116 1.113 6.143 5.950 1.00 0.00 H new ATOM 0 HG22 THR A 116 1.920 5.060 4.791 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.666 4.422 5.881 1.00 0.00 H new ATOM 1797 N THR A 117 5.274 3.969 7.749 1.00 0.00 N ATOM 1798 CA THR A 117 6.248 3.941 8.822 1.00 0.00 C ATOM 1799 C THR A 117 6.350 5.358 9.373 1.00 0.00 C ATOM 1800 O THR A 117 6.271 6.349 8.634 1.00 0.00 O ATOM 1801 CB THR A 117 7.575 3.325 8.329 1.00 0.00 C ATOM 1802 OG1 THR A 117 8.648 3.621 9.196 1.00 0.00 O ATOM 1803 CG2 THR A 117 7.989 3.785 6.933 1.00 0.00 C ATOM 0 H THR A 117 5.419 4.727 7.082 1.00 0.00 H new ATOM 0 HA THR A 117 5.948 3.292 9.645 1.00 0.00 H new ATOM 0 HB THR A 117 7.373 2.254 8.306 1.00 0.00 H new ATOM 0 HG1 THR A 117 8.534 3.131 10.037 1.00 0.00 H new ATOM 0 HG21 THR A 117 8.930 3.309 6.657 1.00 0.00 H new ATOM 0 HG22 THR A 117 7.218 3.507 6.215 1.00 0.00 H new ATOM 0 HG23 THR A 117 8.115 4.868 6.929 1.00 0.00 H new ATOM 1811 N ALA A 118 6.533 5.428 10.691 1.00 0.00 N ATOM 1812 CA ALA A 118 6.892 6.624 11.436 1.00 0.00 C ATOM 1813 C ALA A 118 8.357 6.554 11.904 1.00 0.00 C ATOM 1814 O ALA A 118 8.845 7.473 12.563 1.00 0.00 O ATOM 1815 CB ALA A 118 5.925 6.744 12.614 1.00 0.00 C ATOM 0 H ALA A 118 6.429 4.611 11.293 1.00 0.00 H new ATOM 0 HA ALA A 118 6.811 7.509 10.805 1.00 0.00 H new ATOM 0 HB1 ALA A 118 6.168 7.634 13.195 1.00 0.00 H new ATOM 0 HB2 ALA A 118 4.904 6.822 12.240 1.00 0.00 H new ATOM 0 HB3 ALA A 118 6.013 5.862 13.248 1.00 0.00 H new ATOM 1821 N THR A 119 9.056 5.471 11.566 1.00 0.00 N ATOM 1822 CA THR A 119 10.270 4.974 12.202 1.00 0.00 C ATOM 1823 C THR A 119 11.431 4.879 11.207 1.00 0.00 C ATOM 1824 O THR A 119 12.418 4.164 11.409 1.00 0.00 O ATOM 1825 CB THR A 119 9.907 3.645 12.897 1.00 0.00 C ATOM 1826 OG1 THR A 119 8.938 2.891 12.183 1.00 0.00 O ATOM 1827 CG2 THR A 119 9.257 3.981 14.229 1.00 0.00 C ATOM 0 H THR A 119 8.767 4.879 10.787 1.00 0.00 H new ATOM 0 HA THR A 119 10.639 5.667 12.958 1.00 0.00 H new ATOM 0 HB THR A 119 10.827 3.065 12.978 1.00 0.00 H new ATOM 0 HG1 THR A 119 9.174 1.940 12.216 1.00 0.00 H new ATOM 0 HG21 THR A 119 8.988 3.059 14.745 1.00 0.00 H new ATOM 0 HG22 THR A 119 9.956 4.550 14.842 1.00 0.00 H new ATOM 0 HG23 THR A 119 8.360 4.575 14.056 1.00 0.00 H new ATOM 1835 N TYR A 120 11.307 5.623 10.112 1.00 0.00 N ATOM 1836 CA TYR A 120 12.229 5.645 8.998 1.00 0.00 C ATOM 1837 C TYR A 120 13.587 6.241 9.393 1.00 0.00 C ATOM 1838 O TYR A 120 13.650 7.104 10.279 1.00 0.00 O ATOM 1839 CB TYR A 120 11.581 6.446 7.853 1.00 0.00 C ATOM 1840 CG TYR A 120 10.825 7.691 8.305 1.00 0.00 C ATOM 1841 CD1 TYR A 120 11.491 8.921 8.461 1.00 0.00 C ATOM 1842 CD2 TYR A 120 9.447 7.606 8.594 1.00 0.00 C ATOM 1843 CE1 TYR A 120 10.788 10.055 8.911 1.00 0.00 C ATOM 1844 CE2 TYR A 120 8.733 8.739 9.018 1.00 0.00 C ATOM 1845 CZ TYR A 120 9.407 9.968 9.196 1.00 0.00 C ATOM 1846 OH TYR A 120 8.734 11.069 9.629 1.00 0.00 O ATOM 0 H TYR A 120 10.519 6.256 9.978 1.00 0.00 H new ATOM 0 HA TYR A 120 12.427 4.624 8.673 1.00 0.00 H new ATOM 0 HB2 TYR A 120 12.358 6.743 7.149 1.00 0.00 H new ATOM 0 HB3 TYR A 120 10.894 5.794 7.313 1.00 0.00 H new ATOM 0 HD1 TYR A 120 12.544 8.995 8.235 1.00 0.00 H new ATOM 0 HD2 TYR A 120 8.936 6.661 8.488 1.00 0.00 H new ATOM 0 HE1 TYR A 120 11.306 10.994 9.039 1.00 0.00 H new ATOM 0 HE2 TYR A 120 7.672 8.671 9.207 1.00 0.00 H new ATOM 0 HH TYR A 120 7.793 10.840 9.778 1.00 0.00 H new ATOM 1856 N ALA A 121 14.655 5.818 8.703 1.00 0.00 N ATOM 1857 CA ALA A 121 16.031 6.267 8.937 1.00 0.00 C ATOM 1858 C ALA A 121 16.197 7.767 8.630 1.00 0.00 C ATOM 1859 O ALA A 121 15.407 8.315 7.857 1.00 0.00 O ATOM 1860 CB ALA A 121 16.978 5.448 8.048 1.00 0.00 C ATOM 0 H ALA A 121 14.582 5.137 7.948 1.00 0.00 H new ATOM 0 HA ALA A 121 16.271 6.116 9.989 1.00 0.00 H new ATOM 0 HB1 ALA A 121 18.005 5.774 8.214 1.00 0.00 H new ATOM 0 HB2 ALA A 121 16.888 4.391 8.297 1.00 0.00 H new ATOM 0 HB3 ALA A 121 16.714 5.598 7.001 1.00 0.00 H new ATOM 1866 N PRO A 122 17.226 8.449 9.170 1.00 0.00 N ATOM 1867 CA PRO A 122 17.391 9.879 8.951 1.00 0.00 C ATOM 1868 C PRO A 122 17.853 10.221 7.536 1.00 0.00 C ATOM 1869 O PRO A 122 17.411 11.225 6.979 1.00 0.00 O ATOM 1870 CB PRO A 122 18.339 10.361 10.048 1.00 0.00 C ATOM 1871 CG PRO A 122 19.147 9.126 10.430 1.00 0.00 C ATOM 1872 CD PRO A 122 18.184 7.970 10.158 1.00 0.00 C ATOM 0 HA PRO A 122 16.437 10.401 9.019 1.00 0.00 H new ATOM 0 HB2 PRO A 122 18.985 11.162 9.689 1.00 0.00 H new ATOM 0 HB3 PRO A 122 17.789 10.754 10.903 1.00 0.00 H new ATOM 0 HG2 PRO A 122 20.055 9.040 9.833 1.00 0.00 H new ATOM 0 HG3 PRO A 122 19.454 9.155 11.475 1.00 0.00 H new ATOM 0 HD2 PRO A 122 18.721 7.098 9.785 1.00 0.00 H new ATOM 0 HD3 PRO A 122 17.677 7.665 11.073 1.00 0.00 H new ATOM 1880 N GLU A 123 18.674 9.379 6.910 1.00 0.00 N ATOM 1881 CA GLU A 123 19.036 9.559 5.506 1.00 0.00 C ATOM 1882 C GLU A 123 17.837 9.412 4.573 1.00 0.00 C ATOM 1883 O GLU A 123 17.834 10.011 3.495 1.00 0.00 O ATOM 1884 CB GLU A 123 20.176 8.621 5.069 1.00 0.00 C ATOM 1885 CG GLU A 123 20.158 7.210 5.685 1.00 0.00 C ATOM 1886 CD GLU A 123 21.185 7.146 6.814 1.00 0.00 C ATOM 1887 OE1 GLU A 123 20.944 7.831 7.822 1.00 0.00 O ATOM 1888 OE2 GLU A 123 22.295 6.579 6.608 1.00 0.00 O ATOM 0 H GLU A 123 19.101 8.566 7.353 1.00 0.00 H new ATOM 0 HA GLU A 123 19.398 10.584 5.425 1.00 0.00 H new ATOM 0 HB2 GLU A 123 20.145 8.523 3.984 1.00 0.00 H new ATOM 0 HB3 GLU A 123 21.126 9.094 5.319 1.00 0.00 H new ATOM 0 HG2 GLU A 123 19.164 6.979 6.067 1.00 0.00 H new ATOM 0 HG3 GLU A 123 20.388 6.464 4.924 1.00 0.00 H new ATOM 1895 N TRP A 124 16.811 8.649 4.960 1.00 0.00 N ATOM 1896 CA TRP A 124 15.674 8.418 4.080 1.00 0.00 C ATOM 1897 C TRP A 124 14.820 9.679 3.894 1.00 0.00 C ATOM 1898 O TRP A 124 13.989 9.715 2.991 1.00 0.00 O ATOM 1899 CB TRP A 124 14.828 7.248 4.587 1.00 0.00 C ATOM 1900 CG TRP A 124 15.440 5.874 4.636 1.00 0.00 C ATOM 1901 CD1 TRP A 124 16.673 5.479 4.235 1.00 0.00 C ATOM 1902 CD2 TRP A 124 14.789 4.668 5.117 1.00 0.00 C ATOM 1903 NE1 TRP A 124 16.817 4.115 4.444 1.00 0.00 N ATOM 1904 CE2 TRP A 124 15.703 3.578 5.054 1.00 0.00 C ATOM 1905 CE3 TRP A 124 13.470 4.390 5.520 1.00 0.00 C ATOM 1906 CZ2 TRP A 124 15.358 2.289 5.487 1.00 0.00 C ATOM 1907 CZ3 TRP A 124 13.113 3.098 5.964 1.00 0.00 C ATOM 1908 CH2 TRP A 124 14.065 2.059 5.986 1.00 0.00 C ATOM 0 H TRP A 124 16.749 8.188 5.867 1.00 0.00 H new ATOM 0 HA TRP A 124 16.070 8.158 3.098 1.00 0.00 H new ATOM 0 HB2 TRP A 124 14.494 7.496 5.594 1.00 0.00 H new ATOM 0 HB3 TRP A 124 13.938 7.190 3.961 1.00 0.00 H new ATOM 0 HD1 TRP A 124 17.428 6.127 3.816 1.00 0.00 H new ATOM 0 HE1 TRP A 124 17.643 3.577 4.180 1.00 0.00 H new ATOM 0 HE3 TRP A 124 12.725 5.171 5.490 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 16.077 1.484 5.437 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 12.102 2.904 6.290 1.00 0.00 H new ATOM 0 HH2 TRP A 124 13.802 1.090 6.385 1.00 0.00 H new ATOM 1919 N LEU A 125 15.034 10.745 4.674 1.00 0.00 N ATOM 1920 CA LEU A 125 14.421 12.036 4.378 1.00 0.00 C ATOM 1921 C LEU A 125 14.976 12.616 3.073 1.00 0.00 C ATOM 1922 O LEU A 125 14.257 13.357 2.397 1.00 0.00 O ATOM 1923 CB LEU A 125 14.621 13.037 5.535 1.00 0.00 C ATOM 1924 CG LEU A 125 13.704 12.886 6.764 1.00 0.00 C ATOM 1925 CD1 LEU A 125 12.215 12.840 6.393 1.00 0.00 C ATOM 1926 CD2 LEU A 125 14.059 11.682 7.634 1.00 0.00 C ATOM 0 H LEU A 125 15.623 10.736 5.507 1.00 0.00 H new ATOM 0 HA LEU A 125 13.350 11.868 4.260 1.00 0.00 H new ATOM 0 HB2 LEU A 125 15.654 12.960 5.873 1.00 0.00 H new ATOM 0 HB3 LEU A 125 14.490 14.043 5.137 1.00 0.00 H new ATOM 0 HG LEU A 125 13.882 13.787 7.351 1.00 0.00 H new ATOM 0 HD11 LEU A 125 11.618 12.733 7.298 1.00 0.00 H new ATOM 0 HD12 LEU A 125 11.938 13.763 5.883 1.00 0.00 H new ATOM 0 HD13 LEU A 125 12.030 11.992 5.734 1.00 0.00 H new ATOM 0 HD21 LEU A 125 13.376 11.632 8.482 1.00 0.00 H new ATOM 0 HD22 LEU A 125 13.973 10.769 7.045 1.00 0.00 H new ATOM 0 HD23 LEU A 125 15.082 11.784 7.997 1.00 0.00 H new ATOM 1938 N PHE A 126 16.222 12.301 2.709 1.00 0.00 N ATOM 1939 CA PHE A 126 16.868 12.763 1.481 1.00 0.00 C ATOM 1940 C PHE A 126 16.648 11.797 0.317 1.00 0.00 C ATOM 1941 O PHE A 126 16.984 12.137 -0.817 1.00 0.00 O ATOM 1942 CB PHE A 126 18.380 12.910 1.703 1.00 0.00 C ATOM 1943 CG PHE A 126 18.765 13.645 2.970 1.00 0.00 C ATOM 1944 CD1 PHE A 126 18.360 14.975 3.186 1.00 0.00 C ATOM 1945 CD2 PHE A 126 19.511 12.974 3.953 1.00 0.00 C ATOM 1946 CE1 PHE A 126 18.677 15.619 4.394 1.00 0.00 C ATOM 1947 CE2 PHE A 126 19.808 13.607 5.168 1.00 0.00 C ATOM 1948 CZ PHE A 126 19.389 14.931 5.394 1.00 0.00 C ATOM 0 H PHE A 126 16.823 11.703 3.275 1.00 0.00 H new ATOM 0 HA PHE A 126 16.418 13.724 1.230 1.00 0.00 H new ATOM 0 HB2 PHE A 126 18.829 11.917 1.725 1.00 0.00 H new ATOM 0 HB3 PHE A 126 18.809 13.435 0.850 1.00 0.00 H new ATOM 0 HD1 PHE A 126 17.805 15.501 2.423 1.00 0.00 H new ATOM 0 HD2 PHE A 126 19.857 11.967 3.772 1.00 0.00 H new ATOM 0 HE1 PHE A 126 18.374 16.643 4.555 1.00 0.00 H new ATOM 0 HE2 PHE A 126 20.359 13.078 5.931 1.00 0.00 H new ATOM 0 HZ PHE A 126 19.613 15.418 6.332 1.00 0.00 H new ATOM 1958 N LEU A 127 16.133 10.589 0.574 1.00 0.00 N ATOM 1959 CA LEU A 127 15.914 9.605 -0.480 1.00 0.00 C ATOM 1960 C LEU A 127 14.894 10.158 -1.481 1.00 0.00 C ATOM 1961 O LEU A 127 13.975 10.874 -1.070 1.00 0.00 O ATOM 1962 CB LEU A 127 15.413 8.272 0.106 1.00 0.00 C ATOM 1963 CG LEU A 127 16.483 7.247 0.518 1.00 0.00 C ATOM 1964 CD1 LEU A 127 15.820 5.953 0.999 1.00 0.00 C ATOM 1965 CD2 LEU A 127 17.460 6.891 -0.602 1.00 0.00 C ATOM 0 H LEU A 127 15.861 10.274 1.505 1.00 0.00 H new ATOM 0 HA LEU A 127 16.860 9.414 -0.986 1.00 0.00 H new ATOM 0 HB2 LEU A 127 14.802 8.494 0.981 1.00 0.00 H new ATOM 0 HB3 LEU A 127 14.759 7.803 -0.629 1.00 0.00 H new ATOM 0 HG LEU A 127 17.052 7.725 1.316 1.00 0.00 H new ATOM 0 HD11 LEU A 127 16.589 5.236 1.288 1.00 0.00 H new ATOM 0 HD12 LEU A 127 15.183 6.168 1.857 1.00 0.00 H new ATOM 0 HD13 LEU A 127 15.216 5.533 0.195 1.00 0.00 H new ATOM 0 HD21 LEU A 127 18.184 6.163 -0.236 1.00 0.00 H new ATOM 0 HD22 LEU A 127 16.911 6.465 -1.442 1.00 0.00 H new ATOM 0 HD23 LEU A 127 17.983 7.790 -0.928 1.00 0.00 H new ATOM 1977 N PRO A 128 15.010 9.831 -2.779 1.00 0.00 N ATOM 1978 CA PRO A 128 14.033 10.243 -3.770 1.00 0.00 C ATOM 1979 C PRO A 128 12.686 9.588 -3.474 1.00 0.00 C ATOM 1980 O PRO A 128 12.612 8.444 -3.014 1.00 0.00 O ATOM 1981 CB PRO A 128 14.605 9.830 -5.125 1.00 0.00 C ATOM 1982 CG PRO A 128 15.514 8.654 -4.782 1.00 0.00 C ATOM 1983 CD PRO A 128 16.042 9.013 -3.394 1.00 0.00 C ATOM 0 HA PRO A 128 13.852 11.318 -3.759 1.00 0.00 H new ATOM 0 HB2 PRO A 128 13.818 9.540 -5.822 1.00 0.00 H new ATOM 0 HB3 PRO A 128 15.160 10.644 -5.592 1.00 0.00 H new ATOM 0 HG2 PRO A 128 14.967 7.711 -4.773 1.00 0.00 H new ATOM 0 HG3 PRO A 128 16.323 8.546 -5.505 1.00 0.00 H new ATOM 0 HD2 PRO A 128 16.234 8.117 -2.804 1.00 0.00 H new ATOM 0 HD3 PRO A 128 16.984 9.557 -3.462 1.00 0.00 H new ATOM 1991 N TYR A 129 11.626 10.345 -3.724 1.00 0.00 N ATOM 1992 CA TYR A 129 10.252 9.910 -3.592 1.00 0.00 C ATOM 1993 C TYR A 129 9.745 9.479 -4.965 1.00 0.00 C ATOM 1994 O TYR A 129 10.343 9.792 -6.003 1.00 0.00 O ATOM 1995 CB TYR A 129 9.419 11.055 -3.022 1.00 0.00 C ATOM 1996 CG TYR A 129 9.929 11.728 -1.756 1.00 0.00 C ATOM 1997 CD1 TYR A 129 10.631 10.990 -0.796 1.00 0.00 C ATOM 1998 CD2 TYR A 129 9.776 13.111 -1.569 1.00 0.00 C ATOM 1999 CE1 TYR A 129 11.195 11.611 0.333 1.00 0.00 C ATOM 2000 CE2 TYR A 129 10.320 13.746 -0.443 1.00 0.00 C ATOM 2001 CZ TYR A 129 11.038 13.000 0.517 1.00 0.00 C ATOM 2002 OH TYR A 129 11.602 13.632 1.584 1.00 0.00 O ATOM 0 H TYR A 129 11.708 11.313 -4.035 1.00 0.00 H new ATOM 0 HA TYR A 129 10.173 9.063 -2.911 1.00 0.00 H new ATOM 0 HB2 TYR A 129 9.322 11.818 -3.794 1.00 0.00 H new ATOM 0 HB3 TYR A 129 8.417 10.676 -2.822 1.00 0.00 H new ATOM 0 HD1 TYR A 129 10.742 9.923 -0.925 1.00 0.00 H new ATOM 0 HD2 TYR A 129 9.234 13.692 -2.300 1.00 0.00 H new ATOM 0 HE1 TYR A 129 11.746 11.027 1.055 1.00 0.00 H new ATOM 0 HE2 TYR A 129 10.189 14.810 -0.310 1.00 0.00 H new ATOM 0 HH TYR A 129 12.547 13.382 1.650 1.00 0.00 H new ATOM 2012 N HIS A 130 8.629 8.757 -4.968 1.00 0.00 N ATOM 2013 CA HIS A 130 8.038 8.193 -6.163 1.00 0.00 C ATOM 2014 C HIS A 130 6.529 8.429 -6.164 1.00 0.00 C ATOM 2015 O HIS A 130 5.924 8.698 -5.129 1.00 0.00 O ATOM 2016 CB HIS A 130 8.388 6.695 -6.240 1.00 0.00 C ATOM 2017 CG HIS A 130 9.858 6.393 -6.450 1.00 0.00 C ATOM 2018 ND1 HIS A 130 10.433 6.060 -7.654 1.00 0.00 N ATOM 2019 CD2 HIS A 130 10.854 6.373 -5.504 1.00 0.00 C ATOM 2020 CE1 HIS A 130 11.743 5.851 -7.447 1.00 0.00 C ATOM 2021 NE2 HIS A 130 12.052 6.032 -6.152 1.00 0.00 N ATOM 0 H HIS A 130 8.104 8.547 -4.119 1.00 0.00 H new ATOM 0 HA HIS A 130 8.441 8.683 -7.049 1.00 0.00 H new ATOM 0 HB2 HIS A 130 8.061 6.213 -5.319 1.00 0.00 H new ATOM 0 HB3 HIS A 130 7.820 6.245 -7.054 1.00 0.00 H new ATOM 0 HD2 HIS A 130 10.737 6.582 -4.451 1.00 0.00 H new ATOM 0 HE1 HIS A 130 12.450 5.576 -8.215 1.00 0.00 H new ATOM 0 HE2 HIS A 130 12.974 5.940 -5.725 1.00 0.00 H new ATOM 2029 N GLU A 131 5.894 8.292 -7.319 1.00 0.00 N ATOM 2030 CA GLU A 131 4.454 8.478 -7.461 1.00 0.00 C ATOM 2031 C GLU A 131 3.760 7.132 -7.637 1.00 0.00 C ATOM 2032 O GLU A 131 2.559 6.991 -7.420 1.00 0.00 O ATOM 2033 CB GLU A 131 4.246 9.398 -8.656 1.00 0.00 C ATOM 2034 CG GLU A 131 2.868 10.066 -8.674 1.00 0.00 C ATOM 2035 CD GLU A 131 2.335 10.018 -10.090 1.00 0.00 C ATOM 2036 OE1 GLU A 131 1.872 8.949 -10.539 1.00 0.00 O ATOM 2037 OE2 GLU A 131 2.535 11.027 -10.807 1.00 0.00 O ATOM 0 H GLU A 131 6.365 8.047 -8.190 1.00 0.00 H new ATOM 0 HA GLU A 131 4.016 8.928 -6.570 1.00 0.00 H new ATOM 0 HB2 GLU A 131 5.016 10.170 -8.650 1.00 0.00 H new ATOM 0 HB3 GLU A 131 4.376 8.825 -9.574 1.00 0.00 H new ATOM 0 HG2 GLU A 131 2.188 9.552 -7.995 1.00 0.00 H new ATOM 0 HG3 GLU A 131 2.942 11.098 -8.331 1.00 0.00 H new ATOM 2044 N SER A 132 4.522 6.104 -7.990 1.00 0.00 N ATOM 2045 CA SER A 132 4.016 4.765 -8.177 1.00 0.00 C ATOM 2046 C SER A 132 4.976 3.735 -7.611 1.00 0.00 C ATOM 2047 O SER A 132 6.147 4.031 -7.356 1.00 0.00 O ATOM 2048 CB SER A 132 3.674 4.573 -9.661 1.00 0.00 C ATOM 2049 OG SER A 132 4.861 4.604 -10.445 1.00 0.00 O ATOM 0 H SER A 132 5.525 6.187 -8.155 1.00 0.00 H new ATOM 0 HA SER A 132 3.095 4.615 -7.614 1.00 0.00 H new ATOM 0 HB2 SER A 132 3.160 3.623 -9.804 1.00 0.00 H new ATOM 0 HB3 SER A 132 2.992 5.357 -9.989 1.00 0.00 H new ATOM 0 HG SER A 132 4.632 4.479 -11.390 1.00 0.00 H new ATOM 2055 N TYR A 133 4.439 2.547 -7.358 1.00 0.00 N ATOM 2056 CA TYR A 133 5.112 1.373 -6.855 1.00 0.00 C ATOM 2057 C TYR A 133 4.472 0.229 -7.616 1.00 0.00 C ATOM 2058 O TYR A 133 3.316 -0.095 -7.354 1.00 0.00 O ATOM 2059 CB TYR A 133 4.912 1.248 -5.342 1.00 0.00 C ATOM 2060 CG TYR A 133 5.216 -0.119 -4.771 1.00 0.00 C ATOM 2061 CD1 TYR A 133 6.360 -0.846 -5.166 1.00 0.00 C ATOM 2062 CD2 TYR A 133 4.320 -0.668 -3.839 1.00 0.00 C ATOM 2063 CE1 TYR A 133 6.569 -2.147 -4.658 1.00 0.00 C ATOM 2064 CE2 TYR A 133 4.582 -1.916 -3.255 1.00 0.00 C ATOM 2065 CZ TYR A 133 5.698 -2.669 -3.671 1.00 0.00 C ATOM 2066 OH TYR A 133 5.947 -3.872 -3.093 1.00 0.00 O ATOM 0 H TYR A 133 3.446 2.375 -7.514 1.00 0.00 H new ATOM 0 HA TYR A 133 6.192 1.398 -7.001 1.00 0.00 H new ATOM 0 HB2 TYR A 133 5.545 1.983 -4.844 1.00 0.00 H new ATOM 0 HB3 TYR A 133 3.879 1.504 -5.104 1.00 0.00 H new ATOM 0 HD1 TYR A 133 7.071 -0.410 -5.852 1.00 0.00 H new ATOM 0 HD2 TYR A 133 3.425 -0.126 -3.571 1.00 0.00 H new ATOM 0 HE1 TYR A 133 7.393 -2.743 -5.022 1.00 0.00 H new ATOM 0 HE2 TYR A 133 3.928 -2.300 -2.486 1.00 0.00 H new ATOM 0 HH TYR A 133 5.246 -4.071 -2.438 1.00 0.00 H new ATOM 2076 N ASP A 134 5.154 -0.282 -8.631 1.00 0.00 N ATOM 2077 CA ASP A 134 4.654 -1.367 -9.467 1.00 0.00 C ATOM 2078 C ASP A 134 5.848 -2.138 -10.001 1.00 0.00 C ATOM 2079 O ASP A 134 6.833 -1.521 -10.411 1.00 0.00 O ATOM 2080 CB ASP A 134 3.868 -0.797 -10.651 1.00 0.00 C ATOM 2081 CG ASP A 134 2.971 -1.844 -11.302 1.00 0.00 C ATOM 2082 OD1 ASP A 134 3.423 -2.994 -11.498 1.00 0.00 O ATOM 2083 OD2 ASP A 134 1.849 -1.454 -11.697 1.00 0.00 O ATOM 0 H ASP A 134 6.081 0.048 -8.901 1.00 0.00 H new ATOM 0 HA ASP A 134 4.000 -2.013 -8.881 1.00 0.00 H new ATOM 0 HB2 ASP A 134 3.259 0.041 -10.311 1.00 0.00 H new ATOM 0 HB3 ASP A 134 4.564 -0.405 -11.393 1.00 0.00 H new ATOM 2088 N SER A 135 5.772 -3.468 -9.992 1.00 0.00 N ATOM 2089 CA SER A 135 6.782 -4.344 -10.582 1.00 0.00 C ATOM 2090 C SER A 135 7.110 -3.908 -12.018 1.00 0.00 C ATOM 2091 O SER A 135 8.284 -3.815 -12.387 1.00 0.00 O ATOM 2092 CB SER A 135 6.261 -5.796 -10.551 1.00 0.00 C ATOM 2093 OG SER A 135 7.166 -6.655 -9.895 1.00 0.00 O ATOM 0 H SER A 135 4.995 -3.975 -9.568 1.00 0.00 H new ATOM 0 HA SER A 135 7.704 -4.279 -10.004 1.00 0.00 H new ATOM 0 HB2 SER A 135 5.296 -5.827 -10.045 1.00 0.00 H new ATOM 0 HB3 SER A 135 6.098 -6.147 -11.570 1.00 0.00 H new ATOM 0 HG SER A 135 6.807 -7.567 -9.890 1.00 0.00 H new ATOM 2099 N GLU A 136 6.087 -3.585 -12.806 1.00 0.00 N ATOM 2100 CA GLU A 136 6.197 -3.412 -14.247 1.00 0.00 C ATOM 2101 C GLU A 136 6.548 -1.974 -14.646 1.00 0.00 C ATOM 2102 O GLU A 136 6.248 -1.524 -15.755 1.00 0.00 O ATOM 2103 CB GLU A 136 4.888 -3.911 -14.857 1.00 0.00 C ATOM 2104 CG GLU A 136 4.794 -5.445 -14.729 1.00 0.00 C ATOM 2105 CD GLU A 136 4.211 -6.100 -15.979 1.00 0.00 C ATOM 2106 OE1 GLU A 136 4.722 -5.828 -17.099 1.00 0.00 O ATOM 2107 OE2 GLU A 136 3.255 -6.891 -15.832 1.00 0.00 O ATOM 0 H GLU A 136 5.143 -3.434 -12.452 1.00 0.00 H new ATOM 0 HA GLU A 136 7.030 -3.996 -14.639 1.00 0.00 H new ATOM 0 HB2 GLU A 136 4.042 -3.444 -14.353 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.833 -3.622 -15.907 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.787 -5.852 -14.539 1.00 0.00 H new ATOM 0 HG3 GLU A 136 4.175 -5.698 -13.868 1.00 0.00 H new ATOM 2114 N GLY A 137 7.168 -1.222 -13.737 1.00 0.00 N ATOM 2115 CA GLY A 137 7.665 0.117 -14.010 1.00 0.00 C ATOM 2116 C GLY A 137 9.040 0.089 -14.700 1.00 0.00 C ATOM 2117 O GLY A 137 9.795 -0.864 -14.480 1.00 0.00 O ATOM 0 H GLY A 137 7.339 -1.533 -12.781 1.00 0.00 H new ATOM 0 HA2 GLY A 137 6.952 0.647 -14.642 1.00 0.00 H new ATOM 0 HA3 GLY A 137 7.739 0.674 -13.076 1.00 0.00 H new ATOM 2121 N PRO A 138 9.427 1.134 -15.462 1.00 0.00 N ATOM 2122 CA PRO A 138 10.751 1.255 -16.092 1.00 0.00 C ATOM 2123 C PRO A 138 11.857 1.533 -15.073 1.00 0.00 C ATOM 2124 O PRO A 138 13.037 1.287 -15.327 1.00 0.00 O ATOM 2125 CB PRO A 138 10.640 2.446 -17.051 1.00 0.00 C ATOM 2126 CG PRO A 138 9.554 3.310 -16.417 1.00 0.00 C ATOM 2127 CD PRO A 138 8.600 2.276 -15.820 1.00 0.00 C ATOM 0 HA PRO A 138 11.016 0.323 -16.591 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.584 2.984 -17.134 1.00 0.00 H new ATOM 0 HB3 PRO A 138 10.365 2.128 -18.057 1.00 0.00 H new ATOM 0 HG2 PRO A 138 9.960 3.973 -15.653 1.00 0.00 H new ATOM 0 HG3 PRO A 138 9.057 3.940 -17.155 1.00 0.00 H new ATOM 0 HD2 PRO A 138 8.087 2.676 -14.946 1.00 0.00 H new ATOM 0 HD3 PRO A 138 7.831 1.992 -16.539 1.00 0.00 H new ATOM 2135 N HIS A 139 11.472 2.075 -13.923 1.00 0.00 N ATOM 2136 CA HIS A 139 12.275 2.305 -12.747 1.00 0.00 C ATOM 2137 C HIS A 139 12.513 0.945 -12.095 1.00 0.00 C ATOM 2138 O HIS A 139 11.797 0.555 -11.165 1.00 0.00 O ATOM 2139 CB HIS A 139 11.560 3.333 -11.851 1.00 0.00 C ATOM 2140 CG HIS A 139 10.046 3.342 -11.940 1.00 0.00 C ATOM 2141 ND1 HIS A 139 9.279 4.314 -12.548 1.00 0.00 N ATOM 2142 CD2 HIS A 139 9.185 2.360 -11.530 1.00 0.00 C ATOM 2143 CE1 HIS A 139 7.988 3.947 -12.454 1.00 0.00 C ATOM 2144 NE2 HIS A 139 7.886 2.768 -11.827 1.00 0.00 N ATOM 0 H HIS A 139 10.510 2.387 -13.787 1.00 0.00 H new ATOM 0 HA HIS A 139 13.252 2.737 -12.966 1.00 0.00 H new ATOM 0 HB2 HIS A 139 11.844 3.145 -10.816 1.00 0.00 H new ATOM 0 HB3 HIS A 139 11.927 4.327 -12.106 1.00 0.00 H new ATOM 0 HD2 HIS A 139 9.464 1.430 -11.058 1.00 0.00 H new ATOM 0 HE1 HIS A 139 7.154 4.521 -12.830 1.00 0.00 H new ATOM 0 HE2 HIS A 139 7.025 2.266 -11.609 1.00 0.00 H new ATOM 2152 N GLY A 140 13.482 0.216 -12.647 1.00 0.00 N ATOM 2153 CA GLY A 140 13.849 -1.155 -12.312 1.00 0.00 C ATOM 2154 C GLY A 140 14.555 -1.227 -10.966 1.00 0.00 C ATOM 2155 O GLY A 140 15.781 -1.286 -10.894 1.00 0.00 O ATOM 0 H GLY A 140 14.069 0.595 -13.390 1.00 0.00 H new ATOM 0 HA2 GLY A 140 12.955 -1.778 -12.289 1.00 0.00 H new ATOM 0 HA3 GLY A 140 14.499 -1.559 -13.088 1.00 0.00 H new ATOM 2159 N LEU A 141 13.751 -1.138 -9.911 1.00 0.00 N ATOM 2160 CA LEU A 141 14.100 -1.175 -8.498 1.00 0.00 C ATOM 2161 C LEU A 141 12.807 -1.510 -7.764 1.00 0.00 C ATOM 2162 O LEU A 141 12.174 -0.638 -7.166 1.00 0.00 O ATOM 2163 CB LEU A 141 14.669 0.170 -8.004 1.00 0.00 C ATOM 2164 CG LEU A 141 13.953 1.430 -8.535 1.00 0.00 C ATOM 2165 CD1 LEU A 141 13.623 2.354 -7.374 1.00 0.00 C ATOM 2166 CD2 LEU A 141 14.807 2.174 -9.562 1.00 0.00 C ATOM 0 H LEU A 141 12.745 -1.028 -10.038 1.00 0.00 H new ATOM 0 HA LEU A 141 14.882 -1.912 -8.315 1.00 0.00 H new ATOM 0 HB2 LEU A 141 14.630 0.183 -6.915 1.00 0.00 H new ATOM 0 HB3 LEU A 141 15.721 0.225 -8.286 1.00 0.00 H new ATOM 0 HG LEU A 141 13.036 1.113 -9.032 1.00 0.00 H new ATOM 0 HD11 LEU A 141 13.117 3.244 -7.749 1.00 0.00 H new ATOM 0 HD12 LEU A 141 12.971 1.836 -6.671 1.00 0.00 H new ATOM 0 HD13 LEU A 141 14.543 2.646 -6.868 1.00 0.00 H new ATOM 0 HD21 LEU A 141 14.269 3.055 -9.913 1.00 0.00 H new ATOM 0 HD22 LEU A 141 15.745 2.481 -9.101 1.00 0.00 H new ATOM 0 HD23 LEU A 141 15.016 1.517 -10.406 1.00 0.00 H new ATOM 2178 N ARG A 142 12.346 -2.752 -7.886 1.00 0.00 N ATOM 2179 CA ARG A 142 11.010 -3.160 -7.450 1.00 0.00 C ATOM 2180 C ARG A 142 11.097 -4.456 -6.660 1.00 0.00 C ATOM 2181 O ARG A 142 12.190 -4.985 -6.503 1.00 0.00 O ATOM 2182 CB ARG A 142 10.044 -3.253 -8.655 1.00 0.00 C ATOM 2183 CG ARG A 142 9.951 -1.951 -9.467 1.00 0.00 C ATOM 2184 CD ARG A 142 9.354 -0.831 -8.608 1.00 0.00 C ATOM 2185 NE ARG A 142 9.950 0.483 -8.868 1.00 0.00 N ATOM 2186 CZ ARG A 142 9.686 1.557 -8.116 1.00 0.00 C ATOM 2187 NH1 ARG A 142 8.877 1.422 -7.067 1.00 0.00 N ATOM 2188 NH2 ARG A 142 10.168 2.754 -8.442 1.00 0.00 N ATOM 0 H ARG A 142 12.892 -3.511 -8.293 1.00 0.00 H new ATOM 0 HA ARG A 142 10.597 -2.402 -6.784 1.00 0.00 H new ATOM 0 HB2 ARG A 142 10.371 -4.059 -9.312 1.00 0.00 H new ATOM 0 HB3 ARG A 142 9.050 -3.519 -8.295 1.00 0.00 H new ATOM 0 HG2 ARG A 142 10.942 -1.661 -9.817 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.334 -2.109 -10.351 1.00 0.00 H new ATOM 0 HD2 ARG A 142 8.281 -0.777 -8.789 1.00 0.00 H new ATOM 0 HD3 ARG A 142 9.487 -1.080 -7.555 1.00 0.00 H new ATOM 0 HE ARG A 142 10.592 0.582 -9.654 1.00 0.00 H new ATOM 0 HH11 ARG A 142 8.471 0.512 -6.850 1.00 0.00 H new ATOM 0 HH12 ARG A 142 8.663 2.229 -6.481 1.00 0.00 H new ATOM 0 HH21 ARG A 142 10.747 2.861 -9.275 1.00 0.00 H new ATOM 0 HH22 ARG A 142 9.958 3.564 -7.859 1.00 0.00 H new ATOM 2202 N TYR A 143 9.989 -4.906 -6.063 1.00 0.00 N ATOM 2203 CA TYR A 143 10.079 -5.881 -4.985 1.00 0.00 C ATOM 2204 C TYR A 143 10.527 -7.236 -5.525 1.00 0.00 C ATOM 2205 O TYR A 143 9.866 -7.795 -6.410 1.00 0.00 O ATOM 2206 CB TYR A 143 8.767 -6.009 -4.205 1.00 0.00 C ATOM 2207 CG TYR A 143 8.972 -6.808 -2.941 1.00 0.00 C ATOM 2208 CD1 TYR A 143 9.852 -6.322 -1.958 1.00 0.00 C ATOM 2209 CD2 TYR A 143 8.323 -8.043 -2.767 1.00 0.00 C ATOM 2210 CE1 TYR A 143 10.133 -7.086 -0.816 1.00 0.00 C ATOM 2211 CE2 TYR A 143 8.587 -8.813 -1.622 1.00 0.00 C ATOM 2212 CZ TYR A 143 9.499 -8.340 -0.646 1.00 0.00 C ATOM 2213 OH TYR A 143 9.737 -9.071 0.479 1.00 0.00 O ATOM 0 H TYR A 143 9.042 -4.616 -6.305 1.00 0.00 H new ATOM 0 HA TYR A 143 10.829 -5.518 -4.283 1.00 0.00 H new ATOM 0 HB2 TYR A 143 8.388 -5.018 -3.957 1.00 0.00 H new ATOM 0 HB3 TYR A 143 8.014 -6.492 -4.828 1.00 0.00 H new ATOM 0 HD1 TYR A 143 10.315 -5.354 -2.083 1.00 0.00 H new ATOM 0 HD2 TYR A 143 7.625 -8.398 -3.510 1.00 0.00 H new ATOM 0 HE1 TYR A 143 10.827 -6.721 -0.073 1.00 0.00 H new ATOM 0 HE2 TYR A 143 8.095 -9.765 -1.486 1.00 0.00 H new ATOM 0 HH TYR A 143 9.224 -9.905 0.441 1.00 0.00 H new ATOM 2223 N ASN A 144 11.622 -7.754 -4.963 1.00 0.00 N ATOM 2224 CA ASN A 144 12.336 -8.928 -5.447 1.00 0.00 C ATOM 2225 C ASN A 144 12.335 -9.989 -4.364 1.00 0.00 C ATOM 2226 O ASN A 144 13.341 -10.174 -3.677 1.00 0.00 O ATOM 2227 CB ASN A 144 13.786 -8.605 -5.858 1.00 0.00 C ATOM 2228 CG ASN A 144 13.867 -7.733 -7.108 1.00 0.00 C ATOM 2229 OD1 ASN A 144 12.907 -7.616 -7.862 1.00 0.00 O ATOM 2230 ND2 ASN A 144 15.017 -7.167 -7.409 1.00 0.00 N ATOM 0 H ASN A 144 12.047 -7.350 -4.129 1.00 0.00 H new ATOM 0 HA ASN A 144 11.822 -9.289 -6.338 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.288 -8.098 -5.034 1.00 0.00 H new ATOM 0 HB3 ASN A 144 14.325 -9.536 -6.035 1.00 0.00 H new ATOM 0 HD21 ASN A 144 15.111 -6.630 -8.271 1.00 0.00 H new ATOM 0 HD22 ASN A 144 15.814 -7.266 -6.780 1.00 0.00 H new ATOM 2237 N PRO A 145 11.239 -10.739 -4.216 1.00 0.00 N ATOM 2238 CA PRO A 145 11.228 -11.905 -3.352 1.00 0.00 C ATOM 2239 C PRO A 145 11.966 -13.093 -3.990 1.00 0.00 C ATOM 2240 O PRO A 145 12.225 -14.081 -3.308 1.00 0.00 O ATOM 2241 CB PRO A 145 9.741 -12.184 -3.152 1.00 0.00 C ATOM 2242 CG PRO A 145 9.110 -11.758 -4.476 1.00 0.00 C ATOM 2243 CD PRO A 145 9.951 -10.553 -4.870 1.00 0.00 C ATOM 0 HA PRO A 145 11.750 -11.742 -2.409 1.00 0.00 H new ATOM 0 HB2 PRO A 145 9.556 -13.237 -2.941 1.00 0.00 H new ATOM 0 HB3 PRO A 145 9.336 -11.616 -2.315 1.00 0.00 H new ATOM 0 HG2 PRO A 145 9.161 -12.550 -5.223 1.00 0.00 H new ATOM 0 HG3 PRO A 145 8.058 -11.498 -4.359 1.00 0.00 H new ATOM 0 HD2 PRO A 145 10.067 -10.494 -5.952 1.00 0.00 H new ATOM 0 HD3 PRO A 145 9.479 -9.625 -4.548 1.00 0.00 H new ATOM 2251 N ARG A 146 12.242 -13.059 -5.306 1.00 0.00 N ATOM 2252 CA ARG A 146 12.693 -14.242 -6.043 1.00 0.00 C ATOM 2253 C ARG A 146 13.446 -13.944 -7.340 1.00 0.00 C ATOM 2254 O ARG A 146 13.844 -14.833 -8.084 1.00 0.00 O ATOM 2255 CB ARG A 146 11.445 -15.098 -6.302 1.00 0.00 C ATOM 2256 CG ARG A 146 11.807 -16.508 -6.765 1.00 0.00 C ATOM 2257 CD ARG A 146 11.230 -16.767 -8.162 1.00 0.00 C ATOM 2258 NE ARG A 146 11.790 -17.985 -8.758 1.00 0.00 N ATOM 2259 CZ ARG A 146 11.160 -19.136 -9.002 1.00 0.00 C ATOM 2260 NH1 ARG A 146 9.868 -19.291 -8.727 1.00 0.00 N ATOM 2261 NH2 ARG A 146 11.855 -20.151 -9.495 1.00 0.00 N ATOM 0 H ARG A 146 12.159 -12.219 -5.878 1.00 0.00 H new ATOM 0 HA ARG A 146 13.433 -14.766 -5.438 1.00 0.00 H new ATOM 0 HB2 ARG A 146 10.850 -15.157 -5.391 1.00 0.00 H new ATOM 0 HB3 ARG A 146 10.825 -14.616 -7.058 1.00 0.00 H new ATOM 0 HG2 ARG A 146 12.890 -16.627 -6.783 1.00 0.00 H new ATOM 0 HG3 ARG A 146 11.417 -17.242 -6.060 1.00 0.00 H new ATOM 0 HD2 ARG A 146 10.146 -16.858 -8.098 1.00 0.00 H new ATOM 0 HD3 ARG A 146 11.441 -15.915 -8.808 1.00 0.00 H new ATOM 0 HE ARG A 146 12.776 -17.948 -9.016 1.00 0.00 H new ATOM 0 HH11 ARG A 146 9.337 -18.521 -8.321 1.00 0.00 H new ATOM 0 HH12 ARG A 146 9.408 -20.180 -8.922 1.00 0.00 H new ATOM 0 HH21 ARG A 146 12.852 -20.044 -9.681 1.00 0.00 H new ATOM 0 HH22 ARG A 146 11.393 -21.039 -9.689 1.00 0.00 H new ATOM 2275 N GLU A 147 13.672 -12.682 -7.629 1.00 0.00 N ATOM 2276 CA GLU A 147 14.271 -12.220 -8.883 1.00 0.00 C ATOM 2277 C GLU A 147 15.767 -12.493 -8.985 1.00 0.00 C ATOM 2278 O GLU A 147 16.382 -12.269 -10.025 1.00 0.00 O ATOM 2279 CB GLU A 147 14.004 -10.722 -9.014 1.00 0.00 C ATOM 2280 CG GLU A 147 12.596 -10.511 -9.558 1.00 0.00 C ATOM 2281 CD GLU A 147 12.488 -11.092 -10.971 1.00 0.00 C ATOM 2282 OE1 GLU A 147 13.367 -10.770 -11.802 1.00 0.00 O ATOM 2283 OE2 GLU A 147 11.608 -11.960 -11.182 1.00 0.00 O ATOM 0 H GLU A 147 13.442 -11.921 -6.989 1.00 0.00 H new ATOM 0 HA GLU A 147 13.811 -12.782 -9.696 1.00 0.00 H new ATOM 0 HB2 GLU A 147 14.109 -10.235 -8.044 1.00 0.00 H new ATOM 0 HB3 GLU A 147 14.737 -10.267 -9.680 1.00 0.00 H new ATOM 0 HG2 GLU A 147 11.868 -10.990 -8.902 1.00 0.00 H new ATOM 0 HG3 GLU A 147 12.359 -9.447 -9.574 1.00 0.00 H new ATOM 2290 N ASN A 148 16.357 -12.962 -7.894 1.00 0.00 N ATOM 2291 CA ASN A 148 17.779 -13.262 -7.746 1.00 0.00 C ATOM 2292 C ASN A 148 17.973 -14.735 -7.362 1.00 0.00 C ATOM 2293 O ASN A 148 19.027 -15.105 -6.844 1.00 0.00 O ATOM 2294 CB ASN A 148 18.380 -12.278 -6.717 1.00 0.00 C ATOM 2295 CG ASN A 148 18.702 -10.890 -7.263 1.00 0.00 C ATOM 2296 OD1 ASN A 148 18.099 -10.455 -8.359 1.00 0.00 O flip ATOM 2297 ND2 ASN A 148 19.474 -10.157 -6.648 1.00 0.00 N flip ATOM 0 H ASN A 148 15.831 -13.154 -7.042 1.00 0.00 H new ATOM 0 HA ASN A 148 18.309 -13.126 -8.689 1.00 0.00 H new ATOM 0 HB2 ASN A 148 17.681 -12.172 -5.887 1.00 0.00 H new ATOM 0 HB3 ASN A 148 19.293 -12.713 -6.311 1.00 0.00 H new ATOM 0 HD21 ASN A 148 19.936 -10.496 -5.804 1.00 0.00 H new ATOM 0 HD22 ASN A 148 19.652 -9.210 -6.981 1.00 0.00 H new ATOM 2304 N ARG A 149 16.933 -15.561 -7.544 1.00 0.00 N ATOM 2305 CA ARG A 149 16.906 -16.978 -7.198 1.00 0.00 C ATOM 2306 C ARG A 149 18.102 -17.681 -7.816 1.00 0.00 C ATOM 2307 O ARG A 149 18.373 -17.478 -9.017 1.00 0.00 O ATOM 2308 CB ARG A 149 15.609 -17.586 -7.743 1.00 0.00 C ATOM 2309 CG ARG A 149 15.261 -18.974 -7.202 1.00 0.00 C ATOM 2310 CD ARG A 149 15.166 -18.961 -5.671 1.00 0.00 C ATOM 2311 NE ARG A 149 14.081 -19.805 -5.140 1.00 0.00 N ATOM 2312 CZ ARG A 149 13.824 -21.088 -5.420 1.00 0.00 C ATOM 2313 NH1 ARG A 149 14.621 -21.802 -6.208 1.00 0.00 N ATOM 2314 NH2 ARG A 149 12.753 -21.673 -4.910 1.00 0.00 N ATOM 0 H ARG A 149 16.055 -15.241 -7.953 1.00 0.00 H new ATOM 0 HA ARG A 149 16.950 -17.099 -6.116 1.00 0.00 H new ATOM 0 HB2 ARG A 149 14.786 -16.909 -7.516 1.00 0.00 H new ATOM 0 HB3 ARG A 149 15.683 -17.645 -8.829 1.00 0.00 H new ATOM 0 HG2 ARG A 149 14.313 -19.306 -7.626 1.00 0.00 H new ATOM 0 HG3 ARG A 149 16.019 -19.691 -7.517 1.00 0.00 H new ATOM 0 HD2 ARG A 149 16.115 -19.298 -5.254 1.00 0.00 H new ATOM 0 HD3 ARG A 149 15.016 -17.936 -5.333 1.00 0.00 H new ATOM 0 HE ARG A 149 13.448 -19.356 -4.478 1.00 0.00 H new ATOM 0 HH11 ARG A 149 15.452 -21.374 -6.616 1.00 0.00 H new ATOM 0 HH12 ARG A 149 14.402 -22.778 -6.405 1.00 0.00 H new ATOM 0 HH21 ARG A 149 12.124 -21.146 -4.304 1.00 0.00 H new ATOM 0 HH22 ARG A 149 12.556 -22.651 -5.123 1.00 0.00 H new TER 2328 ARG A 149