USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 931 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 87 LYS NZ :NH3+ 146:sc= 1.36 (180deg=1.16) USER MOD Set 1.2: A 89 HIS : no HD1:sc= 0.934 K(o=3.2,f=-3.4!) USER MOD Set 1.3: A 119 THR OG1 : rot 62:sc= 0.945 USER MOD Set 2.1: A 73 CYS SG : rot 176:sc= 0.353 USER MOD Set 2.2: A 97 TYR OH : rot -53:sc= 0.247 USER MOD Set 3.1: A 53 HIS : no HD1:sc= -0.406 X(o=0.23,f=0.04) USER MOD Set 3.2: A 94 SER OG : rot -170:sc= 0.631 USER MOD Set 4.1: A 28 HIS : no HD1:sc= 1.08 K(o=2.3,f=-4.7!) USER MOD Set 4.2: A 40 SER OG : rot -133:sc= 1.19 USER MOD Set 5.1: A 22 TYR OH : rot -70:sc= 0.993 USER MOD Set 5.2: A 102 HIS : no HE2:sc= -0.318 X(o=1.8,f=2.3) USER MOD Set 5.3: A 105 SER OG : rot 166:sc= 1.17 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -149:sc= 0.731 (180deg=0.201) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -174:sc= 1.24 (180deg=1.16) USER MOD Single : A 29 SER OG : rot 76:sc= 1.17 USER MOD Single : A 33 SER OG : rot 180:sc= -0.0222 USER MOD Single : A 41 LYS NZ :NH3+ 174:sc= 1.88 (180deg=1.75) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -178:sc= 1.3 (180deg=1.23) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -161:sc= 2.73 (180deg=1.82) USER MOD Single : A 61 SER OG : rot 74:sc= 1.22 USER MOD Single : A 64 MET CE :methyl -166:sc= -0.246 (180deg=-0.423) USER MOD Single : A 65 GLN : amide:sc= 1.22 K(o=1.2,f=-0.41) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 0.892 K(o=0.89,f=-0.18) USER MOD Single : A 69 CYS SG : rot 20:sc= 0.441 USER MOD Single : A 71 CYS SG : rot -140:sc= -0.347 USER MOD Single : A 80 SER OG : rot 160:sc= -0.205 USER MOD Single : A 81 HIS : no HE2:sc= 0.453 K(o=0.45,f=-1.9!) USER MOD Single : A 82 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 83 SER OG : rot -94:sc= 0.0568 USER MOD Single : A 84 GLN : amide:sc= -0.136 X(o=-0.14,f=-0.14) USER MOD Single : A 86 LYS NZ :NH3+ 158:sc= 1.26 (180deg=0.435) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 MET CE :methyl 176:sc= 0 (180deg=-0.0196) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 10:sc= 0.129 USER MOD Single : A 108 LYS NZ :NH3+ 136:sc= 2.49 (180deg=0.62) USER MOD Single : A 110 LYS NZ :NH3+ 179:sc= 1.32 (180deg=1.31) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -0.178 X(o=-0.18,f=-0.34) USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.251 -9.845 4.234 1.00 10.00 N ATOM 2 CA MET A 1 0.042 -9.138 4.352 1.00 10.00 C ATOM 3 C MET A 1 0.440 -8.506 3.022 1.00 10.00 C ATOM 4 O MET A 1 -0.077 -8.922 1.990 1.00 10.00 O ATOM 5 CB MET A 1 1.161 -10.054 4.888 1.00 10.00 C ATOM 6 CG MET A 1 1.700 -11.100 3.898 1.00 10.00 C ATOM 7 SD MET A 1 0.567 -12.442 3.448 1.00 10.00 S ATOM 8 CE MET A 1 1.682 -13.398 2.369 1.00 10.00 C ATOM 0 H1 MET A 1 -1.752 -9.807 5.145 1.00 10.00 H new ATOM 0 H2 MET A 1 -1.830 -9.389 3.501 1.00 10.00 H new ATOM 0 H3 MET A 1 -1.081 -10.838 3.974 1.00 10.00 H new ATOM 0 HA MET A 1 -0.093 -8.341 5.084 1.00 10.00 H new ATOM 0 HB2 MET A 1 1.992 -9.428 5.215 1.00 10.00 H new ATOM 0 HB3 MET A 1 0.788 -10.574 5.770 1.00 10.00 H new ATOM 0 HG2 MET A 1 1.999 -10.585 2.985 1.00 10.00 H new ATOM 0 HG3 MET A 1 2.601 -11.542 4.324 1.00 10.00 H new ATOM 0 HE1 MET A 1 1.158 -14.275 1.990 1.00 10.00 H new ATOM 0 HE2 MET A 1 2.001 -12.776 1.533 1.00 10.00 H new ATOM 0 HE3 MET A 1 2.555 -13.716 2.938 1.00 10.00 H new ATOM 20 N ALA A 2 1.384 -7.568 3.040 1.00 10.00 N ATOM 21 CA ALA A 2 2.047 -6.999 1.873 1.00 10.00 C ATOM 22 C ALA A 2 3.474 -6.635 2.293 1.00 10.00 C ATOM 23 O ALA A 2 3.906 -6.983 3.397 1.00 10.00 O ATOM 24 CB ALA A 2 1.267 -5.771 1.386 1.00 10.00 C ATOM 0 H ALA A 2 1.723 -7.165 3.914 1.00 10.00 H new ATOM 0 HA ALA A 2 2.081 -7.707 1.045 1.00 10.00 H new ATOM 0 HB1 ALA A 2 1.764 -5.347 0.514 1.00 10.00 H new ATOM 0 HB2 ALA A 2 0.253 -6.067 1.118 1.00 10.00 H new ATOM 0 HB3 ALA A 2 1.229 -5.025 2.180 1.00 10.00 H new ATOM 30 N VAL A 3 4.256 -6.025 1.400 1.00 10.00 N ATOM 31 CA VAL A 3 5.507 -5.402 1.798 1.00 10.00 C ATOM 32 C VAL A 3 5.180 -4.182 2.673 1.00 10.00 C ATOM 33 O VAL A 3 4.188 -3.492 2.443 1.00 10.00 O ATOM 34 CB VAL A 3 6.365 -5.049 0.568 1.00 10.00 C ATOM 35 CG1 VAL A 3 6.971 -6.328 -0.036 1.00 10.00 C ATOM 36 CG2 VAL A 3 5.612 -4.287 -0.538 1.00 10.00 C ATOM 0 H VAL A 3 4.042 -5.952 0.405 1.00 10.00 H new ATOM 0 HA VAL A 3 6.110 -6.095 2.384 1.00 10.00 H new ATOM 0 HB VAL A 3 7.139 -4.378 0.939 1.00 10.00 H new ATOM 0 HG11 VAL A 3 7.576 -6.069 -0.905 1.00 10.00 H new ATOM 0 HG12 VAL A 3 7.597 -6.821 0.708 1.00 10.00 H new ATOM 0 HG13 VAL A 3 6.170 -7.002 -0.340 1.00 10.00 H new ATOM 0 HG21 VAL A 3 6.292 -4.080 -1.365 1.00 10.00 H new ATOM 0 HG22 VAL A 3 4.780 -4.893 -0.896 1.00 10.00 H new ATOM 0 HG23 VAL A 3 5.231 -3.348 -0.138 1.00 10.00 H new ATOM 46 N ALA A 4 6.020 -3.941 3.678 1.00 10.00 N ATOM 47 CA ALA A 4 5.865 -2.875 4.654 1.00 10.00 C ATOM 48 C ALA A 4 7.241 -2.585 5.254 1.00 10.00 C ATOM 49 O ALA A 4 8.189 -3.330 5.006 1.00 10.00 O ATOM 50 CB ALA A 4 4.882 -3.315 5.752 1.00 10.00 C ATOM 0 H ALA A 4 6.855 -4.505 3.837 1.00 10.00 H new ATOM 0 HA ALA A 4 5.467 -1.976 4.183 1.00 10.00 H new ATOM 0 HB1 ALA A 4 4.769 -2.513 6.482 1.00 10.00 H new ATOM 0 HB2 ALA A 4 3.913 -3.538 5.305 1.00 10.00 H new ATOM 0 HB3 ALA A 4 5.266 -4.206 6.249 1.00 10.00 H new ATOM 56 N ASP A 5 7.323 -1.553 6.088 1.00 10.00 N ATOM 57 CA ASP A 5 8.485 -1.216 6.906 1.00 10.00 C ATOM 58 C ASP A 5 7.961 -0.492 8.148 1.00 10.00 C ATOM 59 O ASP A 5 6.908 0.156 8.094 1.00 10.00 O ATOM 60 CB ASP A 5 9.458 -0.315 6.132 1.00 10.00 C ATOM 61 CG ASP A 5 10.688 0.025 6.978 1.00 10.00 C ATOM 62 OD1 ASP A 5 10.602 1.031 7.729 1.00 10.00 O ATOM 63 OD2 ASP A 5 11.643 -0.771 6.935 1.00 10.00 O ATOM 0 H ASP A 5 6.550 -0.901 6.218 1.00 10.00 H new ATOM 0 HA ASP A 5 9.033 -2.117 7.180 1.00 10.00 H new ATOM 0 HB2 ASP A 5 9.771 -0.815 5.215 1.00 10.00 H new ATOM 0 HB3 ASP A 5 8.951 0.604 5.837 1.00 10.00 H new ATOM 68 N LEU A 6 8.650 -0.622 9.281 1.00 10.00 N ATOM 69 CA LEU A 6 8.233 -0.045 10.555 1.00 10.00 C ATOM 70 C LEU A 6 8.055 1.476 10.492 1.00 10.00 C ATOM 71 O LEU A 6 7.258 2.013 11.274 1.00 10.00 O ATOM 72 CB LEU A 6 9.263 -0.397 11.640 1.00 10.00 C ATOM 73 CG LEU A 6 9.414 -1.903 11.916 1.00 10.00 C ATOM 74 CD1 LEU A 6 10.565 -2.103 12.902 1.00 10.00 C ATOM 75 CD2 LEU A 6 8.136 -2.531 12.489 1.00 10.00 C ATOM 0 H LEU A 6 9.527 -1.140 9.339 1.00 10.00 H new ATOM 0 HA LEU A 6 7.259 -0.472 10.796 1.00 10.00 H new ATOM 0 HB2 LEU A 6 10.233 0.004 11.345 1.00 10.00 H new ATOM 0 HB3 LEU A 6 8.980 0.102 12.567 1.00 10.00 H new ATOM 0 HG LEU A 6 9.615 -2.400 10.967 1.00 10.00 H new ATOM 0 HD11 LEU A 6 10.686 -3.166 13.109 1.00 10.00 H new ATOM 0 HD12 LEU A 6 11.486 -1.710 12.471 1.00 10.00 H new ATOM 0 HD13 LEU A 6 10.345 -1.575 13.830 1.00 10.00 H new ATOM 0 HD21 LEU A 6 8.300 -3.594 12.664 1.00 10.00 H new ATOM 0 HD22 LEU A 6 7.881 -2.043 13.430 1.00 10.00 H new ATOM 0 HD23 LEU A 6 7.318 -2.402 11.780 1.00 10.00 H new ATOM 87 N ALA A 7 8.775 2.171 9.609 1.00 10.00 N ATOM 88 CA ALA A 7 8.634 3.610 9.430 1.00 10.00 C ATOM 89 C ALA A 7 7.228 4.000 8.958 1.00 10.00 C ATOM 90 O ALA A 7 6.800 5.126 9.202 1.00 10.00 O ATOM 91 CB ALA A 7 9.680 4.111 8.431 1.00 10.00 C ATOM 0 H ALA A 7 9.473 1.747 8.998 1.00 10.00 H new ATOM 0 HA ALA A 7 8.792 4.080 10.400 1.00 10.00 H new ATOM 0 HB1 ALA A 7 9.571 5.188 8.300 1.00 10.00 H new ATOM 0 HB2 ALA A 7 10.679 3.890 8.808 1.00 10.00 H new ATOM 0 HB3 ALA A 7 9.536 3.612 7.473 1.00 10.00 H new ATOM 97 N LEU A 8 6.516 3.090 8.279 1.00 10.00 N ATOM 98 CA LEU A 8 5.174 3.347 7.762 1.00 10.00 C ATOM 99 C LEU A 8 4.132 3.297 8.880 1.00 10.00 C ATOM 100 O LEU A 8 3.051 3.858 8.731 1.00 10.00 O ATOM 101 CB LEU A 8 4.799 2.315 6.680 1.00 10.00 C ATOM 102 CG LEU A 8 5.773 2.218 5.488 1.00 10.00 C ATOM 103 CD1 LEU A 8 5.264 1.154 4.506 1.00 10.00 C ATOM 104 CD2 LEU A 8 5.942 3.554 4.750 1.00 10.00 C ATOM 0 H LEU A 8 6.861 2.152 8.074 1.00 10.00 H new ATOM 0 HA LEU A 8 5.181 4.346 7.326 1.00 10.00 H new ATOM 0 HB2 LEU A 8 4.727 1.333 7.148 1.00 10.00 H new ATOM 0 HB3 LEU A 8 3.808 2.559 6.298 1.00 10.00 H new ATOM 0 HG LEU A 8 6.750 1.944 5.886 1.00 10.00 H new ATOM 0 HD11 LEU A 8 5.949 1.081 3.661 1.00 10.00 H new ATOM 0 HD12 LEU A 8 5.207 0.190 5.011 1.00 10.00 H new ATOM 0 HD13 LEU A 8 4.274 1.434 4.147 1.00 10.00 H new ATOM 0 HD21 LEU A 8 6.638 3.426 3.921 1.00 10.00 H new ATOM 0 HD22 LEU A 8 4.976 3.882 4.366 1.00 10.00 H new ATOM 0 HD23 LEU A 8 6.332 4.303 5.439 1.00 10.00 H new ATOM 116 N ILE A 9 4.430 2.601 9.984 1.00 10.00 N ATOM 117 CA ILE A 9 3.494 2.389 11.082 1.00 10.00 C ATOM 118 C ILE A 9 3.562 3.624 12.000 1.00 10.00 C ATOM 119 O ILE A 9 4.649 3.909 12.528 1.00 10.00 O ATOM 120 CB ILE A 9 3.843 1.056 11.790 1.00 10.00 C ATOM 121 CG1 ILE A 9 3.423 -0.116 10.868 1.00 10.00 C ATOM 122 CG2 ILE A 9 3.178 0.942 13.176 1.00 10.00 C ATOM 123 CD1 ILE A 9 3.923 -1.489 11.327 1.00 10.00 C ATOM 0 H ILE A 9 5.340 2.166 10.136 1.00 10.00 H new ATOM 0 HA ILE A 9 2.463 2.291 10.742 1.00 10.00 H new ATOM 0 HB ILE A 9 4.918 1.021 11.967 1.00 10.00 H new ATOM 0 HG12 ILE A 9 2.335 -0.141 10.804 1.00 10.00 H new ATOM 0 HG13 ILE A 9 3.797 0.076 9.862 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.452 -0.009 13.634 1.00 10.00 H new ATOM 0 HG22 ILE A 9 3.517 1.761 13.811 1.00 10.00 H new ATOM 0 HG23 ILE A 9 2.095 0.993 13.065 1.00 10.00 H new ATOM 0 HD11 ILE A 9 3.585 -2.252 10.626 1.00 10.00 H new ATOM 0 HD12 ILE A 9 5.012 -1.486 11.363 1.00 10.00 H new ATOM 0 HD13 ILE A 9 3.528 -1.707 12.319 1.00 10.00 H new ATOM 135 N PRO A 10 2.434 4.334 12.236 1.00 10.00 N ATOM 136 CA PRO A 10 2.360 5.447 13.177 1.00 10.00 C ATOM 137 C PRO A 10 2.942 5.055 14.530 1.00 10.00 C ATOM 138 O PRO A 10 2.673 3.959 15.034 1.00 10.00 O ATOM 139 CB PRO A 10 0.874 5.812 13.299 1.00 10.00 C ATOM 140 CG PRO A 10 0.294 5.356 11.965 1.00 10.00 C ATOM 141 CD PRO A 10 1.121 4.114 11.640 1.00 10.00 C ATOM 0 HA PRO A 10 2.943 6.298 12.826 1.00 10.00 H new ATOM 0 HB2 PRO A 10 0.402 5.303 14.139 1.00 10.00 H new ATOM 0 HB3 PRO A 10 0.733 6.882 13.455 1.00 10.00 H new ATOM 0 HG2 PRO A 10 -0.768 5.125 12.044 1.00 10.00 H new ATOM 0 HG3 PRO A 10 0.397 6.122 11.197 1.00 10.00 H new ATOM 0 HD2 PRO A 10 0.654 3.217 12.047 1.00 10.00 H new ATOM 0 HD3 PRO A 10 1.201 3.970 10.562 1.00 10.00 H new ATOM 149 N ASP A 11 3.704 5.949 15.153 1.00 10.00 N ATOM 150 CA ASP A 11 4.500 5.606 16.334 1.00 10.00 C ATOM 151 C ASP A 11 3.685 5.707 17.628 1.00 10.00 C ATOM 152 O ASP A 11 3.862 4.925 18.560 1.00 10.00 O ATOM 153 CB ASP A 11 5.739 6.508 16.386 1.00 10.00 C ATOM 154 CG ASP A 11 6.887 5.791 17.093 1.00 10.00 C ATOM 155 OD1 ASP A 11 7.353 4.759 16.547 1.00 10.00 O ATOM 156 OD2 ASP A 11 7.317 6.227 18.176 1.00 10.00 O ATOM 0 H ASP A 11 3.789 6.922 14.860 1.00 10.00 H new ATOM 0 HA ASP A 11 4.813 4.565 16.250 1.00 10.00 H new ATOM 0 HB2 ASP A 11 6.040 6.782 15.375 1.00 10.00 H new ATOM 0 HB3 ASP A 11 5.502 7.434 16.910 1.00 10.00 H new ATOM 161 N VAL A 12 2.680 6.583 17.633 1.00 10.00 N ATOM 162 CA VAL A 12 1.747 6.815 18.727 1.00 10.00 C ATOM 163 C VAL A 12 0.370 6.987 18.084 1.00 10.00 C ATOM 164 O VAL A 12 0.262 7.723 17.100 1.00 10.00 O ATOM 165 CB VAL A 12 2.176 8.081 19.498 1.00 10.00 C ATOM 166 CG1 VAL A 12 1.244 8.411 20.674 1.00 10.00 C ATOM 167 CG2 VAL A 12 3.603 7.964 20.038 1.00 10.00 C ATOM 0 H VAL A 12 2.488 7.180 16.829 1.00 10.00 H new ATOM 0 HA VAL A 12 1.728 5.992 19.442 1.00 10.00 H new ATOM 0 HB VAL A 12 2.119 8.887 18.767 1.00 10.00 H new ATOM 0 HG11 VAL A 12 1.598 9.311 21.177 1.00 10.00 H new ATOM 0 HG12 VAL A 12 0.233 8.577 20.302 1.00 10.00 H new ATOM 0 HG13 VAL A 12 1.239 7.580 21.379 1.00 10.00 H new ATOM 0 HG21 VAL A 12 3.865 8.876 20.574 1.00 10.00 H new ATOM 0 HG22 VAL A 12 3.667 7.113 20.717 1.00 10.00 H new ATOM 0 HG23 VAL A 12 4.295 7.819 19.209 1.00 10.00 H new ATOM 177 N ASP A 13 -0.662 6.365 18.650 1.00 10.00 N ATOM 178 CA ASP A 13 -2.060 6.583 18.250 1.00 10.00 C ATOM 179 C ASP A 13 -2.929 6.370 19.487 1.00 10.00 C ATOM 180 O ASP A 13 -3.092 5.233 19.952 1.00 10.00 O ATOM 181 CB ASP A 13 -2.475 5.669 17.086 1.00 10.00 C ATOM 182 CG ASP A 13 -3.762 6.167 16.403 1.00 10.00 C ATOM 183 OD1 ASP A 13 -4.620 6.729 17.121 1.00 10.00 O ATOM 184 OD2 ASP A 13 -3.847 5.994 15.168 1.00 10.00 O ATOM 0 H ASP A 13 -0.556 5.689 19.406 1.00 10.00 H new ATOM 0 HA ASP A 13 -2.188 7.599 17.876 1.00 10.00 H new ATOM 0 HB2 ASP A 13 -1.669 5.623 16.354 1.00 10.00 H new ATOM 0 HB3 ASP A 13 -2.628 4.655 17.456 1.00 10.00 H new ATOM 189 N ILE A 14 -3.309 7.478 20.131 1.00 10.00 N ATOM 190 CA ILE A 14 -3.954 7.523 21.442 1.00 10.00 C ATOM 191 C ILE A 14 -4.995 8.653 21.477 1.00 10.00 C ATOM 192 O ILE A 14 -5.074 9.462 20.552 1.00 10.00 O ATOM 193 CB ILE A 14 -2.888 7.710 22.558 1.00 10.00 C ATOM 194 CG1 ILE A 14 -2.189 9.092 22.473 1.00 10.00 C ATOM 195 CG2 ILE A 14 -1.847 6.573 22.562 1.00 10.00 C ATOM 196 CD1 ILE A 14 -1.310 9.410 23.684 1.00 10.00 C ATOM 0 H ILE A 14 -3.168 8.407 19.734 1.00 10.00 H new ATOM 0 HA ILE A 14 -4.469 6.579 21.621 1.00 10.00 H new ATOM 0 HB ILE A 14 -3.429 7.669 23.504 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -1.577 9.125 21.572 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -2.948 9.868 22.372 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -1.123 6.746 23.358 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -2.349 5.620 22.729 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -1.332 6.548 21.602 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -0.854 10.391 23.555 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -1.921 9.410 24.587 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -0.528 8.656 23.774 1.00 10.00 H new ATOM 208 N ASP A 15 -5.679 8.797 22.611 1.00 10.00 N ATOM 209 CA ASP A 15 -6.480 9.966 22.990 1.00 10.00 C ATOM 210 C ASP A 15 -6.234 10.185 24.486 1.00 10.00 C ATOM 211 O ASP A 15 -5.861 9.245 25.193 1.00 10.00 O ATOM 212 CB ASP A 15 -7.976 9.752 22.680 1.00 10.00 C ATOM 213 CG ASP A 15 -8.857 11.005 22.873 1.00 10.00 C ATOM 214 OD1 ASP A 15 -8.315 12.086 23.199 1.00 10.00 O ATOM 215 OD2 ASP A 15 -10.092 10.870 22.657 1.00 10.00 O ATOM 0 H ASP A 15 -5.692 8.069 23.326 1.00 10.00 H new ATOM 0 HA ASP A 15 -6.188 10.845 22.416 1.00 10.00 H new ATOM 0 HB2 ASP A 15 -8.075 9.409 21.650 1.00 10.00 H new ATOM 0 HB3 ASP A 15 -8.356 8.955 23.319 1.00 10.00 H new ATOM 220 N SER A 16 -6.367 11.429 24.940 1.00 10.00 N ATOM 221 CA SER A 16 -6.095 11.874 26.299 1.00 10.00 C ATOM 222 C SER A 16 -7.185 12.836 26.810 1.00 10.00 C ATOM 223 O SER A 16 -7.039 13.347 27.920 1.00 10.00 O ATOM 224 CB SER A 16 -4.719 12.559 26.335 1.00 10.00 C ATOM 225 OG SER A 16 -3.687 11.817 25.707 1.00 10.00 O ATOM 0 H SER A 16 -6.683 12.189 24.338 1.00 10.00 H new ATOM 0 HA SER A 16 -6.096 11.005 26.957 1.00 10.00 H new ATOM 0 HB2 SER A 16 -4.797 13.533 25.852 1.00 10.00 H new ATOM 0 HB3 SER A 16 -4.442 12.739 27.374 1.00 10.00 H new ATOM 0 HG SER A 16 -2.844 12.313 25.767 1.00 10.00 H new ATOM 231 N ASP A 17 -8.238 13.112 26.023 1.00 10.00 N ATOM 232 CA ASP A 17 -9.311 14.067 26.377 1.00 10.00 C ATOM 233 C ASP A 17 -10.038 13.707 27.687 1.00 10.00 C ATOM 234 O ASP A 17 -10.646 14.544 28.348 1.00 10.00 O ATOM 235 CB ASP A 17 -10.315 14.151 25.221 1.00 10.00 C ATOM 236 CG ASP A 17 -11.449 15.147 25.511 1.00 10.00 C ATOM 237 OD1 ASP A 17 -11.153 16.362 25.489 1.00 10.00 O ATOM 238 OD2 ASP A 17 -12.598 14.663 25.649 1.00 10.00 O ATOM 0 H ASP A 17 -8.373 12.675 25.111 1.00 10.00 H new ATOM 0 HA ASP A 17 -8.840 15.035 26.545 1.00 10.00 H new ATOM 0 HB2 ASP A 17 -9.795 14.450 24.311 1.00 10.00 H new ATOM 0 HB3 ASP A 17 -10.739 13.164 25.037 1.00 10.00 H new ATOM 243 N GLY A 18 -9.914 12.448 28.111 1.00 10.00 N ATOM 244 CA GLY A 18 -10.333 11.930 29.395 1.00 10.00 C ATOM 245 C GLY A 18 -9.414 10.758 29.732 1.00 10.00 C ATOM 246 O GLY A 18 -8.435 10.502 29.029 1.00 10.00 O ATOM 0 H GLY A 18 -9.492 11.728 27.525 1.00 10.00 H new ATOM 0 HA2 GLY A 18 -10.268 12.703 30.161 1.00 10.00 H new ATOM 0 HA3 GLY A 18 -11.373 11.605 29.358 1.00 10.00 H new ATOM 250 N VAL A 19 -9.694 10.052 30.828 1.00 10.00 N ATOM 251 CA VAL A 19 -8.973 8.831 31.162 1.00 10.00 C ATOM 252 C VAL A 19 -9.249 7.793 30.067 1.00 10.00 C ATOM 253 O VAL A 19 -10.405 7.456 29.816 1.00 10.00 O ATOM 254 CB VAL A 19 -9.366 8.302 32.561 1.00 10.00 C ATOM 255 CG1 VAL A 19 -8.419 7.162 32.978 1.00 10.00 C ATOM 256 CG2 VAL A 19 -9.323 9.395 33.643 1.00 10.00 C ATOM 0 H VAL A 19 -10.418 10.309 31.499 1.00 10.00 H new ATOM 0 HA VAL A 19 -7.904 9.039 31.206 1.00 10.00 H new ATOM 0 HB VAL A 19 -10.393 7.945 32.482 1.00 10.00 H new ATOM 0 HG11 VAL A 19 -8.703 6.795 33.964 1.00 10.00 H new ATOM 0 HG12 VAL A 19 -8.488 6.349 32.255 1.00 10.00 H new ATOM 0 HG13 VAL A 19 -7.395 7.533 33.010 1.00 10.00 H new ATOM 0 HG21 VAL A 19 -9.608 8.967 34.604 1.00 10.00 H new ATOM 0 HG22 VAL A 19 -8.313 9.800 33.711 1.00 10.00 H new ATOM 0 HG23 VAL A 19 -10.017 10.194 33.381 1.00 10.00 H new ATOM 266 N PHE A 20 -8.191 7.245 29.468 1.00 10.00 N ATOM 267 CA PHE A 20 -8.285 6.171 28.480 1.00 10.00 C ATOM 268 C PHE A 20 -7.155 5.185 28.751 1.00 10.00 C ATOM 269 O PHE A 20 -6.065 5.578 29.177 1.00 10.00 O ATOM 270 CB PHE A 20 -8.199 6.712 27.044 1.00 10.00 C ATOM 271 CG PHE A 20 -9.365 7.591 26.618 1.00 10.00 C ATOM 272 CD1 PHE A 20 -10.657 7.045 26.494 1.00 10.00 C ATOM 273 CD2 PHE A 20 -9.161 8.957 26.343 1.00 10.00 C ATOM 274 CE1 PHE A 20 -11.741 7.864 26.123 1.00 10.00 C ATOM 275 CE2 PHE A 20 -10.238 9.770 25.946 1.00 10.00 C ATOM 276 CZ PHE A 20 -11.529 9.227 25.847 1.00 10.00 C ATOM 0 H PHE A 20 -7.233 7.539 29.658 1.00 10.00 H new ATOM 0 HA PHE A 20 -9.253 5.678 28.571 1.00 10.00 H new ATOM 0 HB2 PHE A 20 -7.276 7.283 26.942 1.00 10.00 H new ATOM 0 HB3 PHE A 20 -8.130 5.868 26.357 1.00 10.00 H new ATOM 0 HD1 PHE A 20 -10.817 5.994 26.684 1.00 10.00 H new ATOM 0 HD2 PHE A 20 -8.173 9.382 26.437 1.00 10.00 H new ATOM 0 HE1 PHE A 20 -12.734 7.446 26.050 1.00 10.00 H new ATOM 0 HE2 PHE A 20 -10.072 10.812 25.717 1.00 10.00 H new ATOM 0 HZ PHE A 20 -12.359 9.855 25.559 1.00 10.00 H new ATOM 286 N LYS A 21 -7.451 3.886 28.628 1.00 10.00 N ATOM 287 CA LYS A 21 -6.442 2.834 28.733 1.00 10.00 C ATOM 288 C LYS A 21 -5.483 2.932 27.543 1.00 10.00 C ATOM 289 O LYS A 21 -5.860 3.391 26.473 1.00 10.00 O ATOM 290 CB LYS A 21 -7.105 1.448 28.766 1.00 10.00 C ATOM 291 CG LYS A 21 -8.076 1.273 29.948 1.00 10.00 C ATOM 292 CD LYS A 21 -8.648 -0.152 29.957 1.00 10.00 C ATOM 293 CE LYS A 21 -9.702 -0.374 31.056 1.00 10.00 C ATOM 294 NZ LYS A 21 -11.058 0.086 30.664 1.00 10.00 N ATOM 0 H LYS A 21 -8.394 3.539 28.454 1.00 10.00 H new ATOM 0 HA LYS A 21 -5.886 2.966 29.661 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -7.645 1.287 27.833 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -6.331 0.682 28.822 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -7.558 1.471 30.886 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -8.887 1.998 29.873 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -9.095 -0.364 28.986 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -7.833 -0.863 30.095 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -9.742 -1.435 31.304 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -9.393 0.153 31.959 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -11.701 0.005 31.477 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -11.013 1.078 30.356 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -11.412 -0.503 29.883 1.00 10.00 H new ATOM 308 N TYR A 22 -4.264 2.422 27.700 1.00 10.00 N ATOM 309 CA TYR A 22 -3.305 2.292 26.616 1.00 10.00 C ATOM 310 C TYR A 22 -2.470 1.034 26.836 1.00 10.00 C ATOM 311 O TYR A 22 -2.471 0.433 27.920 1.00 10.00 O ATOM 312 CB TYR A 22 -2.447 3.567 26.482 1.00 10.00 C ATOM 313 CG TYR A 22 -1.051 3.489 27.076 1.00 10.00 C ATOM 314 CD1 TYR A 22 -0.858 3.712 28.447 1.00 10.00 C ATOM 315 CD2 TYR A 22 0.053 3.184 26.255 1.00 10.00 C ATOM 316 CE1 TYR A 22 0.429 3.645 29.003 1.00 10.00 C ATOM 317 CE2 TYR A 22 1.347 3.127 26.800 1.00 10.00 C ATOM 318 CZ TYR A 22 1.540 3.383 28.175 1.00 10.00 C ATOM 319 OH TYR A 22 2.799 3.408 28.687 1.00 10.00 O ATOM 0 H TYR A 22 -3.914 2.084 28.597 1.00 10.00 H new ATOM 0 HA TYR A 22 -3.829 2.184 25.666 1.00 10.00 H new ATOM 0 HB2 TYR A 22 -2.358 3.813 25.424 1.00 10.00 H new ATOM 0 HB3 TYR A 22 -2.978 4.392 26.957 1.00 10.00 H new ATOM 0 HD1 TYR A 22 -1.705 3.937 29.079 1.00 10.00 H new ATOM 0 HD2 TYR A 22 -0.096 2.993 25.202 1.00 10.00 H new ATOM 0 HE1 TYR A 22 0.568 3.794 30.064 1.00 10.00 H new ATOM 0 HE2 TYR A 22 2.191 2.888 26.169 1.00 10.00 H new ATOM 0 HH TYR A 22 3.045 4.331 28.906 1.00 10.00 H new ATOM 329 N VAL A 23 -1.765 0.617 25.792 1.00 10.00 N ATOM 330 CA VAL A 23 -0.874 -0.522 25.786 1.00 10.00 C ATOM 331 C VAL A 23 0.370 -0.129 24.975 1.00 10.00 C ATOM 332 O VAL A 23 0.291 0.583 23.965 1.00 10.00 O ATOM 333 CB VAL A 23 -1.658 -1.756 25.292 1.00 10.00 C ATOM 334 CG1 VAL A 23 -2.265 -1.579 23.896 1.00 10.00 C ATOM 335 CG2 VAL A 23 -0.853 -3.056 25.363 1.00 10.00 C ATOM 0 H VAL A 23 -1.805 1.089 24.889 1.00 10.00 H new ATOM 0 HA VAL A 23 -0.507 -0.807 26.772 1.00 10.00 H new ATOM 0 HB VAL A 23 -2.485 -1.841 25.997 1.00 10.00 H new ATOM 0 HG11 VAL A 23 -2.801 -2.486 23.615 1.00 10.00 H new ATOM 0 HG12 VAL A 23 -2.956 -0.736 23.904 1.00 10.00 H new ATOM 0 HG13 VAL A 23 -1.470 -1.389 23.175 1.00 10.00 H new ATOM 0 HG21 VAL A 23 -1.464 -3.883 25.001 1.00 10.00 H new ATOM 0 HG22 VAL A 23 0.039 -2.966 24.743 1.00 10.00 H new ATOM 0 HG23 VAL A 23 -0.560 -3.247 26.395 1.00 10.00 H new ATOM 345 N LEU A 24 1.529 -0.562 25.472 1.00 10.00 N ATOM 346 CA LEU A 24 2.825 -0.379 24.847 1.00 10.00 C ATOM 347 C LEU A 24 3.119 -1.713 24.168 1.00 10.00 C ATOM 348 O LEU A 24 3.177 -2.740 24.846 1.00 10.00 O ATOM 349 CB LEU A 24 3.857 -0.028 25.935 1.00 10.00 C ATOM 350 CG LEU A 24 5.149 0.615 25.401 1.00 10.00 C ATOM 351 CD1 LEU A 24 6.115 0.836 26.573 1.00 10.00 C ATOM 352 CD2 LEU A 24 5.870 -0.197 24.324 1.00 10.00 C ATOM 0 H LEU A 24 1.585 -1.069 26.356 1.00 10.00 H new ATOM 0 HA LEU A 24 2.857 0.433 24.120 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.396 0.653 26.650 1.00 10.00 H new ATOM 0 HB3 LEU A 24 4.116 -0.936 26.480 1.00 10.00 H new ATOM 0 HG LEU A 24 4.846 1.550 24.929 1.00 10.00 H new ATOM 0 HD11 LEU A 24 7.035 1.292 26.206 1.00 10.00 H new ATOM 0 HD12 LEU A 24 5.652 1.495 27.307 1.00 10.00 H new ATOM 0 HD13 LEU A 24 6.346 -0.122 27.040 1.00 10.00 H new ATOM 0 HD21 LEU A 24 6.768 0.334 24.008 1.00 10.00 H new ATOM 0 HD22 LEU A 24 6.147 -1.171 24.727 1.00 10.00 H new ATOM 0 HD23 LEU A 24 5.209 -0.333 23.468 1.00 10.00 H new ATOM 364 N ILE A 25 3.274 -1.713 22.849 1.00 10.00 N ATOM 365 CA ILE A 25 3.371 -2.933 22.061 1.00 10.00 C ATOM 366 C ILE A 25 4.691 -2.862 21.296 1.00 10.00 C ATOM 367 O ILE A 25 5.062 -1.802 20.781 1.00 10.00 O ATOM 368 CB ILE A 25 2.112 -3.075 21.168 1.00 10.00 C ATOM 369 CG1 ILE A 25 0.823 -3.126 22.026 1.00 10.00 C ATOM 370 CG2 ILE A 25 2.202 -4.338 20.306 1.00 10.00 C ATOM 371 CD1 ILE A 25 -0.484 -3.367 21.254 1.00 10.00 C ATOM 0 H ILE A 25 3.336 -0.860 22.294 1.00 10.00 H new ATOM 0 HA ILE A 25 3.388 -3.836 22.671 1.00 10.00 H new ATOM 0 HB ILE A 25 2.067 -2.200 20.520 1.00 10.00 H new ATOM 0 HG12 ILE A 25 0.935 -3.915 22.769 1.00 10.00 H new ATOM 0 HG13 ILE A 25 0.734 -2.186 22.570 1.00 10.00 H new ATOM 0 HG21 ILE A 25 1.309 -4.420 19.686 1.00 10.00 H new ATOM 0 HG22 ILE A 25 3.083 -4.280 19.667 1.00 10.00 H new ATOM 0 HG23 ILE A 25 2.278 -5.214 20.951 1.00 10.00 H new ATOM 0 HD11 ILE A 25 -1.321 -3.384 21.952 1.00 10.00 H new ATOM 0 HD12 ILE A 25 -0.632 -2.566 20.530 1.00 10.00 H new ATOM 0 HD13 ILE A 25 -0.427 -4.322 20.732 1.00 10.00 H new ATOM 383 N ARG A 26 5.431 -3.967 21.268 1.00 10.00 N ATOM 384 CA ARG A 26 6.573 -4.108 20.384 1.00 10.00 C ATOM 385 C ARG A 26 6.035 -4.675 19.087 1.00 10.00 C ATOM 386 O ARG A 26 5.271 -5.633 19.117 1.00 10.00 O ATOM 387 CB ARG A 26 7.625 -5.014 21.031 1.00 10.00 C ATOM 388 CG ARG A 26 8.822 -5.256 20.098 1.00 10.00 C ATOM 389 CD ARG A 26 9.984 -5.926 20.839 1.00 10.00 C ATOM 390 NE ARG A 26 10.646 -4.971 21.738 1.00 10.00 N ATOM 391 CZ ARG A 26 11.401 -5.227 22.802 1.00 10.00 C ATOM 392 NH1 ARG A 26 11.677 -6.481 23.186 1.00 10.00 N ATOM 393 NH2 ARG A 26 11.907 -4.198 23.462 1.00 10.00 N ATOM 0 H ARG A 26 5.254 -4.782 21.855 1.00 10.00 H new ATOM 0 HA ARG A 26 7.071 -3.158 20.192 1.00 10.00 H new ATOM 0 HB2 ARG A 26 7.973 -4.561 21.959 1.00 10.00 H new ATOM 0 HB3 ARG A 26 7.170 -5.969 21.294 1.00 10.00 H new ATOM 0 HG2 ARG A 26 8.512 -5.883 19.262 1.00 10.00 H new ATOM 0 HG3 ARG A 26 9.155 -4.307 19.678 1.00 10.00 H new ATOM 0 HD2 ARG A 26 9.614 -6.776 21.412 1.00 10.00 H new ATOM 0 HD3 ARG A 26 10.704 -6.315 20.120 1.00 10.00 H new ATOM 0 HE ARG A 26 10.509 -3.985 21.517 1.00 10.00 H new ATOM 0 HH11 ARG A 26 11.305 -7.270 22.657 1.00 10.00 H new ATOM 0 HH12 ARG A 26 12.259 -6.647 24.007 1.00 10.00 H new ATOM 0 HH21 ARG A 26 11.713 -3.247 23.150 1.00 10.00 H new ATOM 0 HH22 ARG A 26 12.491 -4.356 24.283 1.00 10.00 H new ATOM 407 N VAL A 27 6.431 -4.106 17.963 1.00 10.00 N ATOM 408 CA VAL A 27 6.030 -4.528 16.638 1.00 10.00 C ATOM 409 C VAL A 27 7.303 -4.998 15.937 1.00 10.00 C ATOM 410 O VAL A 27 8.369 -4.397 16.105 1.00 10.00 O ATOM 411 CB VAL A 27 5.264 -3.384 15.936 1.00 10.00 C ATOM 412 CG1 VAL A 27 5.987 -2.026 15.968 1.00 10.00 C ATOM 413 CG2 VAL A 27 4.933 -3.746 14.483 1.00 10.00 C ATOM 0 H VAL A 27 7.065 -3.307 17.950 1.00 10.00 H new ATOM 0 HA VAL A 27 5.324 -5.359 16.635 1.00 10.00 H new ATOM 0 HB VAL A 27 4.347 -3.269 16.514 1.00 10.00 H new ATOM 0 HG11 VAL A 27 5.382 -1.279 15.454 1.00 10.00 H new ATOM 0 HG12 VAL A 27 6.140 -1.719 17.003 1.00 10.00 H new ATOM 0 HG13 VAL A 27 6.952 -2.116 15.470 1.00 10.00 H new ATOM 0 HG21 VAL A 27 4.394 -2.921 14.016 1.00 10.00 H new ATOM 0 HG22 VAL A 27 5.857 -3.932 13.935 1.00 10.00 H new ATOM 0 HG23 VAL A 27 4.312 -4.642 14.464 1.00 10.00 H new ATOM 423 N HIS A 28 7.189 -6.081 15.177 1.00 10.00 N ATOM 424 CA HIS A 28 8.277 -6.801 14.543 1.00 10.00 C ATOM 425 C HIS A 28 7.994 -6.808 13.047 1.00 10.00 C ATOM 426 O HIS A 28 6.852 -7.029 12.647 1.00 10.00 O ATOM 427 CB HIS A 28 8.306 -8.252 15.052 1.00 10.00 C ATOM 428 CG HIS A 28 8.304 -8.417 16.551 1.00 10.00 C ATOM 429 ND1 HIS A 28 9.382 -8.248 17.383 1.00 10.00 N ATOM 430 CD2 HIS A 28 7.254 -8.835 17.326 1.00 10.00 C ATOM 431 CE1 HIS A 28 9.002 -8.580 18.625 1.00 10.00 C ATOM 432 NE2 HIS A 28 7.708 -8.918 18.652 1.00 10.00 N ATOM 0 H HIS A 28 6.281 -6.501 14.978 1.00 10.00 H new ATOM 0 HA HIS A 28 9.234 -6.330 14.767 1.00 10.00 H new ATOM 0 HB2 HIS A 28 7.442 -8.778 14.645 1.00 10.00 H new ATOM 0 HB3 HIS A 28 9.194 -8.741 14.652 1.00 10.00 H new ATOM 0 HD2 HIS A 28 6.256 -9.060 16.979 1.00 10.00 H new ATOM 0 HE1 HIS A 28 9.653 -8.575 19.487 1.00 10.00 H new ATOM 0 HE2 HIS A 28 7.161 -9.183 19.471 1.00 10.00 H new ATOM 440 N SER A 29 9.011 -6.557 12.225 1.00 10.00 N ATOM 441 CA SER A 29 8.888 -6.632 10.778 1.00 10.00 C ATOM 442 C SER A 29 8.578 -8.073 10.371 1.00 10.00 C ATOM 443 O SER A 29 9.207 -9.005 10.871 1.00 10.00 O ATOM 444 CB SER A 29 10.186 -6.172 10.104 1.00 10.00 C ATOM 445 OG SER A 29 10.642 -4.944 10.631 1.00 10.00 O ATOM 0 H SER A 29 9.943 -6.296 12.548 1.00 10.00 H new ATOM 0 HA SER A 29 8.079 -5.976 10.457 1.00 10.00 H new ATOM 0 HB2 SER A 29 10.955 -6.933 10.238 1.00 10.00 H new ATOM 0 HB3 SER A 29 10.022 -6.069 9.031 1.00 10.00 H new ATOM 0 HG SER A 29 11.041 -5.095 11.513 1.00 10.00 H new ATOM 451 N ALA A 30 7.647 -8.250 9.434 1.00 10.00 N ATOM 452 CA ALA A 30 7.419 -9.508 8.730 1.00 10.00 C ATOM 453 C ALA A 30 6.937 -9.201 7.301 1.00 10.00 C ATOM 454 O ALA A 30 5.831 -9.596 6.912 1.00 10.00 O ATOM 455 CB ALA A 30 6.428 -10.352 9.530 1.00 10.00 C ATOM 0 H ALA A 30 7.017 -7.505 9.138 1.00 10.00 H new ATOM 0 HA ALA A 30 8.337 -10.088 8.642 1.00 10.00 H new ATOM 0 HB1 ALA A 30 6.251 -11.294 9.012 1.00 10.00 H new ATOM 0 HB2 ALA A 30 6.838 -10.554 10.520 1.00 10.00 H new ATOM 0 HB3 ALA A 30 5.487 -9.811 9.630 1.00 10.00 H new ATOM 461 N PRO A 31 7.696 -8.402 6.533 1.00 10.00 N ATOM 462 CA PRO A 31 7.242 -7.867 5.261 1.00 10.00 C ATOM 463 C PRO A 31 6.988 -9.034 4.306 1.00 10.00 C ATOM 464 O PRO A 31 7.826 -9.935 4.178 1.00 10.00 O ATOM 465 CB PRO A 31 8.346 -6.911 4.784 1.00 10.00 C ATOM 466 CG PRO A 31 9.332 -6.817 5.952 1.00 10.00 C ATOM 467 CD PRO A 31 9.099 -8.102 6.734 1.00 10.00 C ATOM 0 HA PRO A 31 6.304 -7.315 5.325 1.00 10.00 H new ATOM 0 HB2 PRO A 31 8.834 -7.291 3.887 1.00 10.00 H new ATOM 0 HB3 PRO A 31 7.937 -5.932 4.534 1.00 10.00 H new ATOM 0 HG2 PRO A 31 10.361 -6.744 5.601 1.00 10.00 H new ATOM 0 HG3 PRO A 31 9.142 -5.936 6.565 1.00 10.00 H new ATOM 0 HD2 PRO A 31 9.733 -8.909 6.368 1.00 10.00 H new ATOM 0 HD3 PRO A 31 9.329 -7.970 7.791 1.00 10.00 H new ATOM 475 N ARG A 32 5.822 -9.026 3.650 1.00 10.00 N ATOM 476 CA ARG A 32 5.261 -10.127 2.858 1.00 10.00 C ATOM 477 C ARG A 32 5.441 -11.519 3.493 1.00 10.00 C ATOM 478 O ARG A 32 5.531 -12.501 2.763 1.00 10.00 O ATOM 479 CB ARG A 32 5.635 -9.981 1.363 1.00 10.00 C ATOM 480 CG ARG A 32 7.124 -9.956 0.970 1.00 10.00 C ATOM 481 CD ARG A 32 7.818 -11.318 1.080 1.00 10.00 C ATOM 482 NE ARG A 32 9.185 -11.278 0.527 1.00 10.00 N ATOM 483 CZ ARG A 32 9.945 -12.348 0.252 1.00 10.00 C ATOM 484 NH1 ARG A 32 9.468 -13.577 0.441 1.00 10.00 N ATOM 485 NH2 ARG A 32 11.179 -12.174 -0.226 1.00 10.00 N ATOM 0 H ARG A 32 5.212 -8.208 3.658 1.00 10.00 H new ATOM 0 HA ARG A 32 4.175 -10.040 2.878 1.00 10.00 H new ATOM 0 HB2 ARG A 32 5.165 -10.803 0.823 1.00 10.00 H new ATOM 0 HB3 ARG A 32 5.182 -9.059 0.998 1.00 10.00 H new ATOM 0 HG2 ARG A 32 7.213 -9.595 -0.055 1.00 10.00 H new ATOM 0 HG3 ARG A 32 7.646 -9.241 1.606 1.00 10.00 H new ATOM 0 HD2 ARG A 32 7.857 -11.624 2.126 1.00 10.00 H new ATOM 0 HD3 ARG A 32 7.232 -12.069 0.550 1.00 10.00 H new ATOM 0 HE ARG A 32 9.586 -10.359 0.338 1.00 10.00 H new ATOM 0 HH11 ARG A 32 8.521 -13.707 0.796 1.00 10.00 H new ATOM 0 HH12 ARG A 32 10.050 -14.388 0.230 1.00 10.00 H new ATOM 0 HH21 ARG A 32 11.538 -11.232 -0.380 1.00 10.00 H new ATOM 0 HH22 ARG A 32 11.763 -12.983 -0.437 1.00 10.00 H new ATOM 499 N SER A 33 5.495 -11.586 4.828 1.00 10.00 N ATOM 500 CA SER A 33 5.793 -12.782 5.611 1.00 10.00 C ATOM 501 C SER A 33 7.005 -13.574 5.085 1.00 10.00 C ATOM 502 O SER A 33 6.989 -14.802 5.094 1.00 10.00 O ATOM 503 CB SER A 33 4.519 -13.624 5.766 1.00 10.00 C ATOM 504 OG SER A 33 3.470 -12.837 6.306 1.00 10.00 O ATOM 0 H SER A 33 5.324 -10.769 5.415 1.00 10.00 H new ATOM 0 HA SER A 33 6.110 -12.470 6.606 1.00 10.00 H new ATOM 0 HB2 SER A 33 4.220 -14.025 4.797 1.00 10.00 H new ATOM 0 HB3 SER A 33 4.715 -14.476 6.417 1.00 10.00 H new ATOM 0 HG SER A 33 2.663 -13.386 6.398 1.00 10.00 H new ATOM 510 N GLY A 34 8.060 -12.896 4.609 1.00 10.00 N ATOM 511 CA GLY A 34 9.259 -13.593 4.149 1.00 10.00 C ATOM 512 C GLY A 34 10.431 -12.713 3.717 1.00 10.00 C ATOM 513 O GLY A 34 11.439 -13.259 3.276 1.00 10.00 O ATOM 0 H GLY A 34 8.103 -11.880 4.535 1.00 10.00 H new ATOM 0 HA2 GLY A 34 9.601 -14.249 4.949 1.00 10.00 H new ATOM 0 HA3 GLY A 34 8.983 -14.231 3.309 1.00 10.00 H new ATOM 517 N ALA A 35 10.320 -11.378 3.732 1.00 10.00 N ATOM 518 CA ALA A 35 11.460 -10.514 3.436 1.00 10.00 C ATOM 519 C ALA A 35 12.601 -10.759 4.444 1.00 10.00 C ATOM 520 O ALA A 35 12.320 -11.084 5.596 1.00 10.00 O ATOM 521 CB ALA A 35 11.022 -9.047 3.466 1.00 10.00 C ATOM 0 H ALA A 35 9.456 -10.880 3.945 1.00 10.00 H new ATOM 0 HA ALA A 35 11.832 -10.750 2.439 1.00 10.00 H new ATOM 0 HB1 ALA A 35 11.876 -8.408 3.245 1.00 10.00 H new ATOM 0 HB2 ALA A 35 10.244 -8.884 2.720 1.00 10.00 H new ATOM 0 HB3 ALA A 35 10.633 -8.803 4.455 1.00 10.00 H new ATOM 527 N PRO A 36 13.871 -10.526 4.061 1.00 10.00 N ATOM 528 CA PRO A 36 15.036 -10.701 4.931 1.00 10.00 C ATOM 529 C PRO A 36 15.188 -9.533 5.933 1.00 10.00 C ATOM 530 O PRO A 36 16.255 -8.936 6.045 1.00 10.00 O ATOM 531 CB PRO A 36 16.215 -10.864 3.957 1.00 10.00 C ATOM 532 CG PRO A 36 15.819 -9.959 2.793 1.00 10.00 C ATOM 533 CD PRO A 36 14.307 -10.163 2.718 1.00 10.00 C ATOM 0 HA PRO A 36 14.958 -11.569 5.585 1.00 10.00 H new ATOM 0 HB2 PRO A 36 17.158 -10.554 4.408 1.00 10.00 H new ATOM 0 HB3 PRO A 36 16.338 -11.900 3.640 1.00 10.00 H new ATOM 0 HG2 PRO A 36 16.079 -8.917 2.981 1.00 10.00 H new ATOM 0 HG3 PRO A 36 16.314 -10.249 1.866 1.00 10.00 H new ATOM 0 HD2 PRO A 36 13.809 -9.254 2.381 1.00 10.00 H new ATOM 0 HD3 PRO A 36 14.056 -10.947 2.004 1.00 10.00 H new ATOM 541 N ALA A 37 14.114 -9.174 6.637 1.00 10.00 N ATOM 542 CA ALA A 37 14.082 -8.105 7.619 1.00 10.00 C ATOM 543 C ALA A 37 13.174 -8.543 8.765 1.00 10.00 C ATOM 544 O ALA A 37 12.030 -8.929 8.537 1.00 10.00 O ATOM 545 CB ALA A 37 13.553 -6.828 6.957 1.00 10.00 C ATOM 0 H ALA A 37 13.213 -9.640 6.531 1.00 10.00 H new ATOM 0 HA ALA A 37 15.079 -7.899 8.007 1.00 10.00 H new ATOM 0 HB1 ALA A 37 13.527 -6.022 7.690 1.00 10.00 H new ATOM 0 HB2 ALA A 37 14.208 -6.547 6.132 1.00 10.00 H new ATOM 0 HB3 ALA A 37 12.547 -7.005 6.577 1.00 10.00 H new ATOM 551 N ALA A 38 13.688 -8.456 9.992 1.00 10.00 N ATOM 552 CA ALA A 38 13.005 -8.856 11.220 1.00 10.00 C ATOM 553 C ALA A 38 13.349 -7.876 12.355 1.00 10.00 C ATOM 554 O ALA A 38 13.367 -8.245 13.528 1.00 10.00 O ATOM 555 CB ALA A 38 13.386 -10.305 11.557 1.00 10.00 C ATOM 0 H ALA A 38 14.625 -8.092 10.163 1.00 10.00 H new ATOM 0 HA ALA A 38 11.924 -8.818 11.086 1.00 10.00 H new ATOM 0 HB1 ALA A 38 12.880 -10.611 12.473 1.00 10.00 H new ATOM 0 HB2 ALA A 38 13.084 -10.960 10.740 1.00 10.00 H new ATOM 0 HB3 ALA A 38 14.465 -10.374 11.698 1.00 10.00 H new ATOM 561 N GLU A 39 13.683 -6.628 12.003 1.00 10.00 N ATOM 562 CA GLU A 39 13.891 -5.547 12.961 1.00 10.00 C ATOM 563 C GLU A 39 12.565 -5.246 13.670 1.00 10.00 C ATOM 564 O GLU A 39 11.496 -5.584 13.155 1.00 10.00 O ATOM 565 CB GLU A 39 14.428 -4.294 12.243 1.00 10.00 C ATOM 566 CG GLU A 39 15.833 -4.511 11.659 1.00 10.00 C ATOM 567 CD GLU A 39 16.404 -3.231 11.031 1.00 10.00 C ATOM 568 OE1 GLU A 39 17.043 -2.475 11.796 1.00 10.00 O ATOM 569 OE2 GLU A 39 16.190 -3.050 9.814 1.00 10.00 O ATOM 0 H GLU A 39 13.817 -6.342 11.033 1.00 10.00 H new ATOM 0 HA GLU A 39 14.631 -5.849 13.702 1.00 10.00 H new ATOM 0 HB2 GLU A 39 13.743 -4.016 11.442 1.00 10.00 H new ATOM 0 HB3 GLU A 39 14.454 -3.460 12.944 1.00 10.00 H new ATOM 0 HG2 GLU A 39 16.502 -4.857 12.446 1.00 10.00 H new ATOM 0 HG3 GLU A 39 15.794 -5.297 10.905 1.00 10.00 H new ATOM 576 N SER A 40 12.615 -4.599 14.837 1.00 10.00 N ATOM 577 CA SER A 40 11.443 -4.310 15.662 1.00 10.00 C ATOM 578 C SER A 40 11.515 -2.888 16.231 1.00 10.00 C ATOM 579 O SER A 40 12.592 -2.306 16.290 1.00 10.00 O ATOM 580 CB SER A 40 11.367 -5.326 16.809 1.00 10.00 C ATOM 581 OG SER A 40 11.522 -6.667 16.355 1.00 10.00 O ATOM 0 H SER A 40 13.487 -4.256 15.241 1.00 10.00 H new ATOM 0 HA SER A 40 10.550 -4.385 15.042 1.00 10.00 H new ATOM 0 HB2 SER A 40 12.142 -5.101 17.542 1.00 10.00 H new ATOM 0 HB3 SER A 40 10.408 -5.226 17.317 1.00 10.00 H new ATOM 0 HG SER A 40 10.828 -7.231 16.756 1.00 10.00 H new ATOM 587 N LYS A 41 10.385 -2.333 16.678 1.00 10.00 N ATOM 588 CA LYS A 41 10.326 -1.080 17.440 1.00 10.00 C ATOM 589 C LYS A 41 9.210 -1.164 18.476 1.00 10.00 C ATOM 590 O LYS A 41 8.398 -2.084 18.415 1.00 10.00 O ATOM 591 CB LYS A 41 10.169 0.148 16.511 1.00 10.00 C ATOM 592 CG LYS A 41 8.795 0.313 15.826 1.00 10.00 C ATOM 593 CD LYS A 41 8.671 1.702 15.176 1.00 10.00 C ATOM 594 CE LYS A 41 7.295 1.914 14.522 1.00 10.00 C ATOM 595 NZ LYS A 41 7.076 3.328 14.144 1.00 10.00 N ATOM 0 H LYS A 41 9.468 -2.749 16.518 1.00 10.00 H new ATOM 0 HA LYS A 41 11.271 -0.942 17.965 1.00 10.00 H new ATOM 0 HB2 LYS A 41 10.371 1.047 17.094 1.00 10.00 H new ATOM 0 HB3 LYS A 41 10.934 0.092 15.736 1.00 10.00 H new ATOM 0 HG2 LYS A 41 8.666 -0.460 15.069 1.00 10.00 H new ATOM 0 HG3 LYS A 41 8.000 0.177 16.559 1.00 10.00 H new ATOM 0 HD2 LYS A 41 8.835 2.471 15.931 1.00 10.00 H new ATOM 0 HD3 LYS A 41 9.451 1.821 14.424 1.00 10.00 H new ATOM 0 HE2 LYS A 41 7.213 1.284 13.636 1.00 10.00 H new ATOM 0 HE3 LYS A 41 6.513 1.597 15.212 1.00 10.00 H new ATOM 0 HZ1 LYS A 41 6.184 3.412 13.616 1.00 10.00 H new ATOM 0 HZ2 LYS A 41 7.027 3.913 15.002 1.00 10.00 H new ATOM 0 HZ3 LYS A 41 7.863 3.654 13.547 1.00 10.00 H new ATOM 609 N GLU A 42 9.105 -0.169 19.349 1.00 10.00 N ATOM 610 CA GLU A 42 7.990 -0.018 20.271 1.00 10.00 C ATOM 611 C GLU A 42 7.011 0.988 19.671 1.00 10.00 C ATOM 612 O GLU A 42 7.447 1.948 19.032 1.00 10.00 O ATOM 613 CB GLU A 42 8.501 0.505 21.623 1.00 10.00 C ATOM 614 CG GLU A 42 9.200 -0.561 22.485 1.00 10.00 C ATOM 615 CD GLU A 42 10.590 -0.984 21.986 1.00 10.00 C ATOM 616 OE1 GLU A 42 11.416 -0.082 21.761 1.00 10.00 O ATOM 617 OE2 GLU A 42 10.822 -2.220 21.886 1.00 10.00 O ATOM 0 H GLU A 42 9.805 0.567 19.436 1.00 10.00 H new ATOM 0 HA GLU A 42 7.499 -0.978 20.429 1.00 10.00 H new ATOM 0 HB2 GLU A 42 9.196 1.325 21.444 1.00 10.00 H new ATOM 0 HB3 GLU A 42 7.661 0.916 22.183 1.00 10.00 H new ATOM 0 HG2 GLU A 42 9.295 -0.180 23.502 1.00 10.00 H new ATOM 0 HG3 GLU A 42 8.563 -1.444 22.533 1.00 10.00 H new ATOM 624 N ILE A 43 5.721 0.833 19.952 1.00 10.00 N ATOM 625 CA ILE A 43 4.652 1.758 19.588 1.00 10.00 C ATOM 626 C ILE A 43 3.696 1.925 20.773 1.00 10.00 C ATOM 627 O ILE A 43 3.571 1.041 21.627 1.00 10.00 O ATOM 628 CB ILE A 43 3.903 1.279 18.319 1.00 10.00 C ATOM 629 CG1 ILE A 43 3.386 -0.176 18.426 1.00 10.00 C ATOM 630 CG2 ILE A 43 4.794 1.472 17.083 1.00 10.00 C ATOM 631 CD1 ILE A 43 2.458 -0.613 17.287 1.00 10.00 C ATOM 0 H ILE A 43 5.376 0.021 20.464 1.00 10.00 H new ATOM 0 HA ILE A 43 5.089 2.728 19.351 1.00 10.00 H new ATOM 0 HB ILE A 43 3.011 1.897 18.217 1.00 10.00 H new ATOM 0 HG12 ILE A 43 4.242 -0.850 18.457 1.00 10.00 H new ATOM 0 HG13 ILE A 43 2.856 -0.290 19.372 1.00 10.00 H new ATOM 0 HG21 ILE A 43 4.262 1.133 16.194 1.00 10.00 H new ATOM 0 HG22 ILE A 43 5.044 2.528 16.976 1.00 10.00 H new ATOM 0 HG23 ILE A 43 5.710 0.892 17.200 1.00 10.00 H new ATOM 0 HD11 ILE A 43 2.147 -1.645 17.447 1.00 10.00 H new ATOM 0 HD12 ILE A 43 1.579 0.032 17.266 1.00 10.00 H new ATOM 0 HD13 ILE A 43 2.987 -0.537 16.337 1.00 10.00 H new ATOM 643 N VAL A 44 3.015 3.064 20.830 1.00 10.00 N ATOM 644 CA VAL A 44 2.065 3.388 21.890 1.00 10.00 C ATOM 645 C VAL A 44 0.680 3.360 21.245 1.00 10.00 C ATOM 646 O VAL A 44 0.473 4.017 20.219 1.00 10.00 O ATOM 647 CB VAL A 44 2.414 4.774 22.475 1.00 10.00 C ATOM 648 CG1 VAL A 44 1.566 5.120 23.705 1.00 10.00 C ATOM 649 CG2 VAL A 44 3.888 4.896 22.896 1.00 10.00 C ATOM 0 H VAL A 44 3.108 3.800 20.130 1.00 10.00 H new ATOM 0 HA VAL A 44 2.097 2.680 22.718 1.00 10.00 H new ATOM 0 HB VAL A 44 2.204 5.467 21.660 1.00 10.00 H new ATOM 0 HG11 VAL A 44 1.850 6.104 24.078 1.00 10.00 H new ATOM 0 HG12 VAL A 44 0.511 5.127 23.430 1.00 10.00 H new ATOM 0 HG13 VAL A 44 1.733 4.375 24.483 1.00 10.00 H new ATOM 0 HG21 VAL A 44 4.070 5.892 23.299 1.00 10.00 H new ATOM 0 HG22 VAL A 44 4.112 4.150 23.658 1.00 10.00 H new ATOM 0 HG23 VAL A 44 4.529 4.732 22.029 1.00 10.00 H new ATOM 659 N ARG A 45 -0.271 2.606 21.801 1.00 10.00 N ATOM 660 CA ARG A 45 -1.625 2.445 21.262 1.00 10.00 C ATOM 661 C ARG A 45 -2.604 2.686 22.408 1.00 10.00 C ATOM 662 O ARG A 45 -2.359 2.186 23.504 1.00 10.00 O ATOM 663 CB ARG A 45 -1.806 1.012 20.719 1.00 10.00 C ATOM 664 CG ARG A 45 -0.854 0.535 19.607 1.00 10.00 C ATOM 665 CD ARG A 45 -1.152 1.141 18.230 1.00 10.00 C ATOM 666 NE ARG A 45 -0.485 2.436 18.094 1.00 10.00 N ATOM 667 CZ ARG A 45 0.333 2.805 17.110 1.00 10.00 C ATOM 668 NH1 ARG A 45 0.362 2.194 15.927 1.00 10.00 N ATOM 669 NH2 ARG A 45 1.180 3.784 17.344 1.00 10.00 N ATOM 0 H ARG A 45 -0.118 2.077 22.660 1.00 10.00 H new ATOM 0 HA ARG A 45 -1.800 3.148 20.447 1.00 10.00 H new ATOM 0 HB2 ARG A 45 -1.712 0.323 21.558 1.00 10.00 H new ATOM 0 HB3 ARG A 45 -2.826 0.923 20.346 1.00 10.00 H new ATOM 0 HG2 ARG A 45 0.170 0.783 19.888 1.00 10.00 H new ATOM 0 HG3 ARG A 45 -0.911 -0.551 19.535 1.00 10.00 H new ATOM 0 HD2 ARG A 45 -0.813 0.465 17.446 1.00 10.00 H new ATOM 0 HD3 ARG A 45 -2.228 1.262 18.103 1.00 10.00 H new ATOM 0 HE ARG A 45 -0.664 3.124 18.825 1.00 10.00 H new ATOM 0 HH11 ARG A 45 -0.260 1.407 15.744 1.00 10.00 H new ATOM 0 HH12 ARG A 45 1.007 2.513 15.204 1.00 10.00 H new ATOM 0 HH21 ARG A 45 1.197 4.236 18.258 1.00 10.00 H new ATOM 0 HH22 ARG A 45 1.820 4.091 16.611 1.00 10.00 H new ATOM 683 N GLY A 46 -3.691 3.415 22.180 1.00 10.00 N ATOM 684 CA GLY A 46 -4.562 3.871 23.260 1.00 10.00 C ATOM 685 C GLY A 46 -5.888 4.374 22.713 1.00 10.00 C ATOM 686 O GLY A 46 -6.320 5.472 23.042 1.00 10.00 O ATOM 0 H GLY A 46 -3.993 3.705 21.250 1.00 10.00 H new ATOM 0 HA2 GLY A 46 -4.739 3.054 23.959 1.00 10.00 H new ATOM 0 HA3 GLY A 46 -4.069 4.667 23.818 1.00 10.00 H new ATOM 690 N TYR A 47 -6.490 3.617 21.798 1.00 10.00 N ATOM 691 CA TYR A 47 -7.720 4.005 21.135 1.00 10.00 C ATOM 692 C TYR A 47 -8.871 4.053 22.135 1.00 10.00 C ATOM 693 O TYR A 47 -9.063 3.119 22.909 1.00 10.00 O ATOM 694 CB TYR A 47 -8.061 3.008 20.029 1.00 10.00 C ATOM 695 CG TYR A 47 -7.000 2.840 18.961 1.00 10.00 C ATOM 696 CD1 TYR A 47 -6.900 3.766 17.906 1.00 10.00 C ATOM 697 CD2 TYR A 47 -6.139 1.727 19.002 1.00 10.00 C ATOM 698 CE1 TYR A 47 -5.952 3.575 16.887 1.00 10.00 C ATOM 699 CE2 TYR A 47 -5.182 1.535 17.993 1.00 10.00 C ATOM 700 CZ TYR A 47 -5.088 2.464 16.929 1.00 10.00 C ATOM 701 OH TYR A 47 -4.173 2.278 15.940 1.00 10.00 O ATOM 0 H TYR A 47 -6.130 2.711 21.498 1.00 10.00 H new ATOM 0 HA TYR A 47 -7.576 4.995 20.702 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -8.252 2.036 20.484 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -8.988 3.324 19.551 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -7.554 4.625 17.880 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -6.215 1.018 19.813 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -5.886 4.280 16.072 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.520 0.682 18.028 1.00 10.00 H new ATOM 0 HH TYR A 47 -3.656 1.465 16.121 1.00 10.00 H new ATOM 711 N LYS A 48 -9.694 5.104 22.037 1.00 10.00 N ATOM 712 CA LYS A 48 -10.819 5.326 22.941 1.00 10.00 C ATOM 713 C LYS A 48 -11.931 4.281 22.807 1.00 10.00 C ATOM 714 O LYS A 48 -12.687 4.107 23.750 1.00 10.00 O ATOM 715 CB LYS A 48 -11.353 6.761 22.768 1.00 10.00 C ATOM 716 CG LYS A 48 -12.004 7.043 21.399 1.00 10.00 C ATOM 717 CD LYS A 48 -12.120 8.548 21.111 1.00 10.00 C ATOM 718 CE LYS A 48 -12.969 9.296 22.152 1.00 10.00 C ATOM 719 NZ LYS A 48 -12.760 10.760 22.075 1.00 10.00 N ATOM 0 H LYS A 48 -9.594 5.826 21.323 1.00 10.00 H new ATOM 0 HA LYS A 48 -10.444 5.206 23.957 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -12.085 6.959 23.551 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -10.531 7.461 22.916 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -11.415 6.569 20.614 1.00 10.00 H new ATOM 0 HG3 LYS A 48 -12.996 6.592 21.370 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -11.122 8.985 21.083 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -12.558 8.690 20.123 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -14.023 9.069 21.993 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -12.714 8.943 23.151 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -13.322 11.230 22.813 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -11.752 10.975 22.217 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -13.059 11.105 21.140 1.00 10.00 H new ATOM 733 N TRP A 49 -12.101 3.670 21.625 1.00 10.00 N ATOM 734 CA TRP A 49 -13.170 2.702 21.401 1.00 10.00 C ATOM 735 C TRP A 49 -12.962 1.405 22.193 1.00 10.00 C ATOM 736 O TRP A 49 -13.937 0.706 22.432 1.00 10.00 O ATOM 737 CB TRP A 49 -13.363 2.429 19.896 1.00 10.00 C ATOM 738 CG TRP A 49 -12.138 2.149 19.066 1.00 10.00 C ATOM 739 CD1 TRP A 49 -11.619 2.992 18.144 1.00 10.00 C ATOM 740 CD2 TRP A 49 -11.268 0.968 19.052 1.00 10.00 C ATOM 741 NE1 TRP A 49 -10.489 2.436 17.582 1.00 10.00 N ATOM 742 CE2 TRP A 49 -10.191 1.217 18.148 1.00 10.00 C ATOM 743 CE3 TRP A 49 -11.248 -0.277 19.718 1.00 10.00 C ATOM 744 CZ2 TRP A 49 -9.111 0.335 17.996 1.00 10.00 C ATOM 745 CZ3 TRP A 49 -10.159 -1.162 19.594 1.00 10.00 C ATOM 746 CH2 TRP A 49 -9.074 -0.841 18.760 1.00 10.00 C ATOM 0 H TRP A 49 -11.507 3.834 20.812 1.00 10.00 H new ATOM 0 HA TRP A 49 -14.090 3.147 21.780 1.00 10.00 H new ATOM 0 HB2 TRP A 49 -14.037 1.578 19.795 1.00 10.00 H new ATOM 0 HB3 TRP A 49 -13.870 3.291 19.463 1.00 10.00 H new ATOM 0 HD1 TRP A 49 -12.029 3.957 17.886 1.00 10.00 H new ATOM 0 HE1 TRP A 49 -9.943 2.873 16.840 1.00 10.00 H new ATOM 0 HE3 TRP A 49 -12.087 -0.557 20.337 1.00 10.00 H new ATOM 0 HZ2 TRP A 49 -8.317 0.559 17.299 1.00 10.00 H new ATOM 0 HZ3 TRP A 49 -10.158 -2.092 20.143 1.00 10.00 H new ATOM 0 HH2 TRP A 49 -8.217 -1.496 18.708 1.00 10.00 H new ATOM 757 N ALA A 50 -11.723 1.069 22.568 1.00 10.00 N ATOM 758 CA ALA A 50 -11.433 -0.191 23.228 1.00 10.00 C ATOM 759 C ALA A 50 -11.998 -0.202 24.647 1.00 10.00 C ATOM 760 O ALA A 50 -11.737 0.709 25.443 1.00 10.00 O ATOM 761 CB ALA A 50 -9.923 -0.418 23.257 1.00 10.00 C ATOM 0 H ALA A 50 -10.906 1.662 22.421 1.00 10.00 H new ATOM 0 HA ALA A 50 -11.908 -0.998 22.669 1.00 10.00 H new ATOM 0 HB1 ALA A 50 -9.707 -1.364 23.753 1.00 10.00 H new ATOM 0 HB2 ALA A 50 -9.540 -0.447 22.237 1.00 10.00 H new ATOM 0 HB3 ALA A 50 -9.443 0.395 23.802 1.00 10.00 H new ATOM 767 N GLU A 51 -12.653 -1.306 25.000 1.00 10.00 N ATOM 768 CA GLU A 51 -13.106 -1.571 26.366 1.00 10.00 C ATOM 769 C GLU A 51 -11.910 -1.880 27.281 1.00 10.00 C ATOM 770 O GLU A 51 -11.861 -1.459 28.451 1.00 10.00 O ATOM 771 CB GLU A 51 -14.157 -2.704 26.372 1.00 10.00 C ATOM 772 CG GLU A 51 -13.730 -4.020 25.695 1.00 10.00 C ATOM 773 CD GLU A 51 -14.841 -5.084 25.773 1.00 10.00 C ATOM 774 OE1 GLU A 51 -15.693 -5.103 24.858 1.00 10.00 O ATOM 775 OE2 GLU A 51 -14.803 -5.859 26.760 1.00 10.00 O ATOM 0 H GLU A 51 -12.887 -2.049 24.341 1.00 10.00 H new ATOM 0 HA GLU A 51 -13.589 -0.678 26.762 1.00 10.00 H new ATOM 0 HB2 GLU A 51 -14.424 -2.920 27.406 1.00 10.00 H new ATOM 0 HB3 GLU A 51 -15.058 -2.340 25.879 1.00 10.00 H new ATOM 0 HG2 GLU A 51 -13.481 -3.829 24.651 1.00 10.00 H new ATOM 0 HG3 GLU A 51 -12.827 -4.400 26.174 1.00 10.00 H new ATOM 782 N TYR A 52 -10.896 -2.557 26.738 1.00 10.00 N ATOM 783 CA TYR A 52 -9.699 -2.990 27.435 1.00 10.00 C ATOM 784 C TYR A 52 -8.521 -2.965 26.466 1.00 10.00 C ATOM 785 O TYR A 52 -8.671 -3.091 25.259 1.00 10.00 O ATOM 786 CB TYR A 52 -9.885 -4.404 28.015 1.00 10.00 C ATOM 787 CG TYR A 52 -10.682 -4.435 29.306 1.00 10.00 C ATOM 788 CD1 TYR A 52 -10.055 -4.087 30.520 1.00 10.00 C ATOM 789 CD2 TYR A 52 -12.042 -4.799 29.300 1.00 10.00 C ATOM 790 CE1 TYR A 52 -10.785 -4.099 31.721 1.00 10.00 C ATOM 791 CE2 TYR A 52 -12.779 -4.810 30.498 1.00 10.00 C ATOM 792 CZ TYR A 52 -12.150 -4.463 31.712 1.00 10.00 C ATOM 793 OH TYR A 52 -12.849 -4.447 32.878 1.00 10.00 O ATOM 0 H TYR A 52 -10.894 -2.827 25.754 1.00 10.00 H new ATOM 0 HA TYR A 52 -9.504 -2.311 28.265 1.00 10.00 H new ATOM 0 HB2 TYR A 52 -10.386 -5.028 27.274 1.00 10.00 H new ATOM 0 HB3 TYR A 52 -8.905 -4.846 28.193 1.00 10.00 H new ATOM 0 HD1 TYR A 52 -9.011 -3.810 30.527 1.00 10.00 H new ATOM 0 HD2 TYR A 52 -12.522 -5.071 28.371 1.00 10.00 H new ATOM 0 HE1 TYR A 52 -10.303 -3.830 32.649 1.00 10.00 H new ATOM 0 HE2 TYR A 52 -13.824 -5.083 30.488 1.00 10.00 H new ATOM 0 HH TYR A 52 -13.775 -4.721 32.708 1.00 10.00 H new ATOM 803 N HIS A 53 -7.313 -2.876 27.021 1.00 10.00 N ATOM 804 CA HIS A 53 -6.054 -3.001 26.282 1.00 10.00 C ATOM 805 C HIS A 53 -5.951 -4.332 25.523 1.00 10.00 C ATOM 806 O HIS A 53 -5.273 -4.377 24.502 1.00 10.00 O ATOM 807 CB HIS A 53 -4.860 -2.783 27.236 1.00 10.00 C ATOM 808 CG HIS A 53 -5.107 -3.218 28.663 1.00 10.00 C ATOM 809 ND1 HIS A 53 -5.624 -4.454 29.052 1.00 10.00 N ATOM 810 CD2 HIS A 53 -5.101 -2.391 29.750 1.00 10.00 C ATOM 811 CE1 HIS A 53 -5.897 -4.361 30.360 1.00 10.00 C ATOM 812 NE2 HIS A 53 -5.599 -3.128 30.804 1.00 10.00 N ATOM 0 H HIS A 53 -7.178 -2.711 28.019 1.00 10.00 H new ATOM 0 HA HIS A 53 -6.031 -2.223 25.519 1.00 10.00 H new ATOM 0 HB2 HIS A 53 -3.998 -3.326 26.848 1.00 10.00 H new ATOM 0 HB3 HIS A 53 -4.598 -1.725 27.233 1.00 10.00 H new ATOM 0 HD2 HIS A 53 -4.771 -1.363 29.779 1.00 10.00 H new ATOM 0 HE1 HIS A 53 -6.297 -5.159 30.968 1.00 10.00 H new ATOM 0 HE2 HIS A 53 -5.721 -2.793 31.760 1.00 10.00 H new ATOM 820 N ALA A 54 -6.642 -5.388 25.968 1.00 10.00 N ATOM 821 CA ALA A 54 -6.789 -6.627 25.208 1.00 10.00 C ATOM 822 C ALA A 54 -7.426 -6.386 23.830 1.00 10.00 C ATOM 823 O ALA A 54 -6.979 -6.959 22.842 1.00 10.00 O ATOM 824 CB ALA A 54 -7.621 -7.623 26.021 1.00 10.00 C ATOM 0 H ALA A 54 -7.116 -5.403 26.871 1.00 10.00 H new ATOM 0 HA ALA A 54 -5.795 -7.038 25.029 1.00 10.00 H new ATOM 0 HB1 ALA A 54 -7.733 -8.549 25.457 1.00 10.00 H new ATOM 0 HB2 ALA A 54 -7.118 -7.832 26.965 1.00 10.00 H new ATOM 0 HB3 ALA A 54 -8.605 -7.198 26.220 1.00 10.00 H new ATOM 830 N ASP A 55 -8.432 -5.507 23.757 1.00 10.00 N ATOM 831 CA ASP A 55 -9.147 -5.213 22.509 1.00 10.00 C ATOM 832 C ASP A 55 -8.248 -4.408 21.563 1.00 10.00 C ATOM 833 O ASP A 55 -8.295 -4.568 20.342 1.00 10.00 O ATOM 834 CB ASP A 55 -10.434 -4.422 22.814 1.00 10.00 C ATOM 835 CG ASP A 55 -11.409 -4.366 21.629 1.00 10.00 C ATOM 836 OD1 ASP A 55 -11.392 -5.304 20.801 1.00 10.00 O ATOM 837 OD2 ASP A 55 -12.108 -3.343 21.507 1.00 10.00 O ATOM 0 H ASP A 55 -8.773 -4.980 24.561 1.00 10.00 H new ATOM 0 HA ASP A 55 -9.414 -6.153 22.026 1.00 10.00 H new ATOM 0 HB2 ASP A 55 -10.937 -4.876 23.668 1.00 10.00 H new ATOM 0 HB3 ASP A 55 -10.167 -3.406 23.104 1.00 10.00 H new ATOM 842 N ILE A 56 -7.386 -3.553 22.137 1.00 10.00 N ATOM 843 CA ILE A 56 -6.371 -2.831 21.381 1.00 10.00 C ATOM 844 C ILE A 56 -5.395 -3.850 20.790 1.00 10.00 C ATOM 845 O ILE A 56 -5.200 -3.851 19.578 1.00 10.00 O ATOM 846 CB ILE A 56 -5.641 -1.771 22.247 1.00 10.00 C ATOM 847 CG1 ILE A 56 -6.635 -0.757 22.849 1.00 10.00 C ATOM 848 CG2 ILE A 56 -4.566 -1.068 21.397 1.00 10.00 C ATOM 849 CD1 ILE A 56 -6.013 0.306 23.765 1.00 10.00 C ATOM 0 H ILE A 56 -7.380 -3.349 23.136 1.00 10.00 H new ATOM 0 HA ILE A 56 -6.851 -2.274 20.576 1.00 10.00 H new ATOM 0 HB ILE A 56 -5.156 -2.272 23.085 1.00 10.00 H new ATOM 0 HG12 ILE A 56 -7.153 -0.252 22.033 1.00 10.00 H new ATOM 0 HG13 ILE A 56 -7.389 -1.304 23.415 1.00 10.00 H new ATOM 0 HG21 ILE A 56 -4.052 -0.323 22.004 1.00 10.00 H new ATOM 0 HG22 ILE A 56 -3.846 -1.804 21.040 1.00 10.00 H new ATOM 0 HG23 ILE A 56 -5.038 -0.579 20.545 1.00 10.00 H new ATOM 0 HD11 ILE A 56 -6.795 0.969 24.136 1.00 10.00 H new ATOM 0 HD12 ILE A 56 -5.521 -0.182 24.607 1.00 10.00 H new ATOM 0 HD13 ILE A 56 -5.281 0.887 23.204 1.00 10.00 H new ATOM 861 N TYR A 57 -4.786 -4.701 21.622 1.00 10.00 N ATOM 862 CA TYR A 57 -3.786 -5.670 21.179 1.00 10.00 C ATOM 863 C TYR A 57 -4.329 -6.555 20.057 1.00 10.00 C ATOM 864 O TYR A 57 -3.629 -6.756 19.065 1.00 10.00 O ATOM 865 CB TYR A 57 -3.327 -6.516 22.371 1.00 10.00 C ATOM 866 CG TYR A 57 -2.409 -7.684 22.038 1.00 10.00 C ATOM 867 CD1 TYR A 57 -1.271 -7.502 21.226 1.00 10.00 C ATOM 868 CD2 TYR A 57 -2.685 -8.961 22.565 1.00 10.00 C ATOM 869 CE1 TYR A 57 -0.411 -8.579 20.954 1.00 10.00 C ATOM 870 CE2 TYR A 57 -1.832 -10.045 22.294 1.00 10.00 C ATOM 871 CZ TYR A 57 -0.683 -9.855 21.490 1.00 10.00 C ATOM 872 OH TYR A 57 0.136 -10.898 21.188 1.00 10.00 O ATOM 0 H TYR A 57 -4.975 -4.735 22.624 1.00 10.00 H new ATOM 0 HA TYR A 57 -2.930 -5.128 20.777 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -2.814 -5.865 23.079 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -4.210 -6.905 22.878 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -1.059 -6.528 20.810 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -3.559 -9.108 23.182 1.00 10.00 H new ATOM 0 HE1 TYR A 57 0.460 -8.430 20.333 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -2.053 -11.022 22.699 1.00 10.00 H new ATOM 0 HH TYR A 57 -0.187 -11.708 21.636 1.00 10.00 H new ATOM 882 N ASP A 58 -5.578 -7.006 20.176 1.00 10.00 N ATOM 883 CA ASP A 58 -6.255 -7.795 19.142 1.00 10.00 C ATOM 884 C ASP A 58 -6.329 -7.028 17.817 1.00 10.00 C ATOM 885 O ASP A 58 -5.910 -7.531 16.775 1.00 10.00 O ATOM 886 CB ASP A 58 -7.666 -8.167 19.616 1.00 10.00 C ATOM 887 CG ASP A 58 -8.521 -8.706 18.463 1.00 10.00 C ATOM 888 OD1 ASP A 58 -8.359 -9.892 18.123 1.00 10.00 O ATOM 889 OD2 ASP A 58 -9.295 -7.877 17.915 1.00 10.00 O ATOM 0 H ASP A 58 -6.155 -6.833 20.999 1.00 10.00 H new ATOM 0 HA ASP A 58 -5.677 -8.703 18.971 1.00 10.00 H new ATOM 0 HB2 ASP A 58 -7.600 -8.917 20.404 1.00 10.00 H new ATOM 0 HB3 ASP A 58 -8.148 -7.291 20.050 1.00 10.00 H new ATOM 894 N LYS A 59 -6.768 -5.764 17.856 1.00 10.00 N ATOM 895 CA LYS A 59 -6.956 -4.982 16.634 1.00 10.00 C ATOM 896 C LYS A 59 -5.607 -4.665 15.996 1.00 10.00 C ATOM 897 O LYS A 59 -5.460 -4.775 14.782 1.00 10.00 O ATOM 898 CB LYS A 59 -7.750 -3.695 16.938 1.00 10.00 C ATOM 899 CG LYS A 59 -8.922 -3.459 15.973 1.00 10.00 C ATOM 900 CD LYS A 59 -10.061 -4.497 16.020 1.00 10.00 C ATOM 901 CE LYS A 59 -10.851 -4.543 17.341 1.00 10.00 C ATOM 902 NZ LYS A 59 -10.212 -5.363 18.392 1.00 10.00 N ATOM 0 H LYS A 59 -6.998 -5.266 18.716 1.00 10.00 H new ATOM 0 HA LYS A 59 -7.534 -5.571 15.922 1.00 10.00 H new ATOM 0 HB2 LYS A 59 -8.133 -3.745 17.957 1.00 10.00 H new ATOM 0 HB3 LYS A 59 -7.074 -2.841 16.893 1.00 10.00 H new ATOM 0 HG2 LYS A 59 -9.345 -2.476 16.181 1.00 10.00 H new ATOM 0 HG3 LYS A 59 -8.528 -3.428 14.957 1.00 10.00 H new ATOM 0 HD2 LYS A 59 -10.756 -4.288 15.207 1.00 10.00 H new ATOM 0 HD3 LYS A 59 -9.639 -5.484 15.833 1.00 10.00 H new ATOM 0 HE2 LYS A 59 -10.977 -3.526 17.713 1.00 10.00 H new ATOM 0 HE3 LYS A 59 -11.848 -4.936 17.143 1.00 10.00 H new ATOM 0 HZ1 LYS A 59 -10.918 -5.615 19.113 1.00 10.00 H new ATOM 0 HZ2 LYS A 59 -9.825 -6.230 17.968 1.00 10.00 H new ATOM 0 HZ3 LYS A 59 -9.443 -4.821 18.835 1.00 10.00 H new ATOM 916 N VAL A 60 -4.641 -4.247 16.811 1.00 10.00 N ATOM 917 CA VAL A 60 -3.317 -3.851 16.362 1.00 10.00 C ATOM 918 C VAL A 60 -2.612 -5.064 15.740 1.00 10.00 C ATOM 919 O VAL A 60 -2.092 -4.953 14.641 1.00 10.00 O ATOM 920 CB VAL A 60 -2.571 -3.212 17.553 1.00 10.00 C ATOM 921 CG1 VAL A 60 -1.104 -2.875 17.262 1.00 10.00 C ATOM 922 CG2 VAL A 60 -3.251 -1.888 17.951 1.00 10.00 C ATOM 0 H VAL A 60 -4.764 -4.174 17.821 1.00 10.00 H new ATOM 0 HA VAL A 60 -3.354 -3.096 15.577 1.00 10.00 H new ATOM 0 HB VAL A 60 -2.607 -3.961 18.344 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -0.650 -2.430 18.148 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -0.567 -3.786 16.998 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -1.050 -2.169 16.433 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -2.718 -1.444 18.792 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -3.232 -1.201 17.105 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -4.285 -2.082 18.238 1.00 10.00 H new ATOM 932 N SER A 61 -2.650 -6.236 16.380 1.00 10.00 N ATOM 933 CA SER A 61 -2.042 -7.432 15.797 1.00 10.00 C ATOM 934 C SER A 61 -2.652 -7.754 14.427 1.00 10.00 C ATOM 935 O SER A 61 -1.916 -8.067 13.495 1.00 10.00 O ATOM 936 CB SER A 61 -2.188 -8.620 16.747 1.00 10.00 C ATOM 937 OG SER A 61 -1.642 -8.284 18.006 1.00 10.00 O ATOM 0 H SER A 61 -3.089 -6.380 17.289 1.00 10.00 H new ATOM 0 HA SER A 61 -0.981 -7.234 15.649 1.00 10.00 H new ATOM 0 HB2 SER A 61 -3.239 -8.887 16.854 1.00 10.00 H new ATOM 0 HB3 SER A 61 -1.677 -9.492 16.338 1.00 10.00 H new ATOM 0 HG SER A 61 -2.247 -7.669 18.471 1.00 10.00 H new ATOM 943 N GLY A 62 -3.974 -7.604 14.286 1.00 10.00 N ATOM 944 CA GLY A 62 -4.645 -7.773 13.010 1.00 10.00 C ATOM 945 C GLY A 62 -4.112 -6.783 11.976 1.00 10.00 C ATOM 946 O GLY A 62 -3.762 -7.186 10.865 1.00 10.00 O ATOM 0 H GLY A 62 -4.599 -7.363 15.055 1.00 10.00 H new ATOM 0 HA2 GLY A 62 -4.501 -8.792 12.651 1.00 10.00 H new ATOM 0 HA3 GLY A 62 -5.718 -7.629 13.137 1.00 10.00 H new ATOM 950 N ASP A 63 -4.058 -5.491 12.312 1.00 10.00 N ATOM 951 CA ASP A 63 -3.592 -4.453 11.386 1.00 10.00 C ATOM 952 C ASP A 63 -2.150 -4.705 10.961 1.00 10.00 C ATOM 953 O ASP A 63 -1.866 -4.736 9.767 1.00 10.00 O ATOM 954 CB ASP A 63 -3.710 -3.047 11.986 1.00 10.00 C ATOM 955 CG ASP A 63 -3.153 -1.981 11.023 1.00 10.00 C ATOM 956 OD1 ASP A 63 -3.510 -2.028 9.820 1.00 10.00 O ATOM 957 OD2 ASP A 63 -2.353 -1.148 11.495 1.00 10.00 O ATOM 0 H ASP A 63 -4.334 -5.136 13.227 1.00 10.00 H new ATOM 0 HA ASP A 63 -4.240 -4.505 10.511 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -4.755 -2.830 12.208 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -3.168 -3.006 12.931 1.00 10.00 H new ATOM 962 N MET A 64 -1.248 -4.982 11.904 1.00 10.00 N ATOM 963 CA MET A 64 0.151 -5.214 11.580 1.00 10.00 C ATOM 964 C MET A 64 0.289 -6.401 10.636 1.00 10.00 C ATOM 965 O MET A 64 1.079 -6.329 9.692 1.00 10.00 O ATOM 966 CB MET A 64 0.990 -5.424 12.846 1.00 10.00 C ATOM 967 CG MET A 64 1.512 -4.089 13.381 1.00 10.00 C ATOM 968 SD MET A 64 0.279 -3.046 14.188 1.00 10.00 S ATOM 969 CE MET A 64 0.466 -1.498 13.292 1.00 10.00 C ATOM 0 H MET A 64 -1.467 -5.050 12.898 1.00 10.00 H new ATOM 0 HA MET A 64 0.531 -4.325 11.077 1.00 10.00 H new ATOM 0 HB2 MET A 64 0.387 -5.916 13.609 1.00 10.00 H new ATOM 0 HB3 MET A 64 1.828 -6.085 12.626 1.00 10.00 H new ATOM 0 HG2 MET A 64 2.315 -4.290 14.091 1.00 10.00 H new ATOM 0 HG3 MET A 64 1.950 -3.531 12.553 1.00 10.00 H new ATOM 0 HE1 MET A 64 -0.042 -0.700 13.834 1.00 10.00 H new ATOM 0 HE2 MET A 64 1.525 -1.257 13.200 1.00 10.00 H new ATOM 0 HE3 MET A 64 0.029 -1.598 12.298 1.00 10.00 H new ATOM 979 N GLN A 65 -0.490 -7.467 10.825 1.00 10.00 N ATOM 980 CA GLN A 65 -0.439 -8.630 9.949 1.00 10.00 C ATOM 981 C GLN A 65 -0.974 -8.283 8.552 1.00 10.00 C ATOM 982 O GLN A 65 -0.472 -8.809 7.546 1.00 10.00 O ATOM 983 CB GLN A 65 -1.209 -9.780 10.617 1.00 10.00 C ATOM 984 CG GLN A 65 -0.413 -10.341 11.815 1.00 10.00 C ATOM 985 CD GLN A 65 -1.224 -11.283 12.707 1.00 10.00 C ATOM 986 OE1 GLN A 65 -2.264 -11.805 12.315 1.00 10.00 O ATOM 987 NE2 GLN A 65 -0.770 -11.539 13.924 1.00 10.00 N ATOM 0 H GLN A 65 -1.167 -7.545 11.584 1.00 10.00 H new ATOM 0 HA GLN A 65 0.592 -8.952 9.802 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.183 -9.426 10.954 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.392 -10.573 9.891 1.00 10.00 H new ATOM 0 HG2 GLN A 65 0.462 -10.873 11.441 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -0.047 -9.510 12.418 1.00 10.00 H new ATOM 0 HE21 GLN A 65 0.094 -11.104 14.248 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -1.284 -12.171 14.538 1.00 10.00 H new ATOM 996 N LYS A 66 -1.962 -7.381 8.447 1.00 10.00 N ATOM 997 CA LYS A 66 -2.369 -6.836 7.152 1.00 10.00 C ATOM 998 C LYS A 66 -1.235 -6.036 6.513 1.00 10.00 C ATOM 999 O LYS A 66 -1.060 -6.197 5.304 1.00 10.00 O ATOM 1000 CB LYS A 66 -3.638 -5.971 7.259 1.00 10.00 C ATOM 1001 CG LYS A 66 -4.876 -6.799 7.624 1.00 10.00 C ATOM 1002 CD LYS A 66 -6.104 -5.896 7.798 1.00 10.00 C ATOM 1003 CE LYS A 66 -7.316 -6.752 8.181 1.00 10.00 C ATOM 1004 NZ LYS A 66 -8.543 -5.940 8.354 1.00 10.00 N ATOM 0 H LYS A 66 -2.489 -7.018 9.241 1.00 10.00 H new ATOM 0 HA LYS A 66 -2.603 -7.687 6.512 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -3.486 -5.198 8.012 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -3.810 -5.463 6.310 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -5.069 -7.536 6.845 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -4.691 -7.351 8.546 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -5.914 -5.150 8.569 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -6.305 -5.355 6.873 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -7.486 -7.504 7.410 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -7.103 -7.287 9.107 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -9.336 -6.561 8.612 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -8.392 -5.239 9.107 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -8.763 -5.449 7.464 1.00 10.00 H new ATOM 1018 N GLN A 67 -0.472 -5.254 7.283 1.00 10.00 N ATOM 1019 CA GLN A 67 0.618 -4.439 6.747 1.00 10.00 C ATOM 1020 C GLN A 67 1.727 -5.366 6.249 1.00 10.00 C ATOM 1021 O GLN A 67 2.032 -5.394 5.063 1.00 10.00 O ATOM 1022 CB GLN A 67 1.184 -3.441 7.788 1.00 10.00 C ATOM 1023 CG GLN A 67 0.199 -2.406 8.364 1.00 10.00 C ATOM 1024 CD GLN A 67 -0.632 -1.678 7.307 1.00 10.00 C ATOM 1025 OE1 GLN A 67 -0.120 -1.277 6.268 1.00 10.00 O ATOM 1026 NE2 GLN A 67 -1.927 -1.517 7.528 1.00 10.00 N ATOM 0 H GLN A 67 -0.594 -5.170 8.292 1.00 10.00 H new ATOM 0 HA GLN A 67 0.220 -3.841 5.927 1.00 10.00 H new ATOM 0 HB2 GLN A 67 1.599 -4.014 8.617 1.00 10.00 H new ATOM 0 HB3 GLN A 67 2.012 -2.902 7.327 1.00 10.00 H new ATOM 0 HG2 GLN A 67 -0.475 -2.909 9.057 1.00 10.00 H new ATOM 0 HG3 GLN A 67 0.759 -1.670 8.941 1.00 10.00 H new ATOM 0 HE21 GLN A 67 -2.342 -1.855 8.396 1.00 10.00 H new ATOM 0 HE22 GLN A 67 -2.510 -1.055 6.830 1.00 10.00 H new ATOM 1035 N GLY A 68 2.281 -6.175 7.153 1.00 10.00 N ATOM 1036 CA GLY A 68 3.479 -6.976 6.943 1.00 10.00 C ATOM 1037 C GLY A 68 4.380 -6.923 8.177 1.00 10.00 C ATOM 1038 O GLY A 68 5.580 -6.674 8.053 1.00 10.00 O ATOM 0 H GLY A 68 1.889 -6.292 8.087 1.00 10.00 H new ATOM 0 HA2 GLY A 68 3.201 -8.009 6.732 1.00 10.00 H new ATOM 0 HA3 GLY A 68 4.022 -6.608 6.073 1.00 10.00 H new ATOM 1042 N CYS A 69 3.796 -7.054 9.371 1.00 10.00 N ATOM 1043 CA CYS A 69 4.443 -7.002 10.675 1.00 10.00 C ATOM 1044 C CYS A 69 3.666 -7.922 11.629 1.00 10.00 C ATOM 1045 O CYS A 69 2.629 -8.455 11.245 1.00 10.00 O ATOM 1046 CB CYS A 69 4.426 -5.551 11.187 1.00 10.00 C ATOM 1047 SG CYS A 69 5.621 -4.523 10.290 1.00 10.00 S ATOM 0 H CYS A 69 2.791 -7.209 9.452 1.00 10.00 H new ATOM 0 HA CYS A 69 5.479 -7.335 10.612 1.00 10.00 H new ATOM 0 HB2 CYS A 69 3.426 -5.134 11.072 1.00 10.00 H new ATOM 0 HB3 CYS A 69 4.657 -5.536 12.252 1.00 10.00 H new ATOM 0 HG CYS A 69 5.929 -5.097 9.165 1.00 10.00 H new ATOM 1053 N ASP A 70 4.112 -8.068 12.874 1.00 10.00 N ATOM 1054 CA ASP A 70 3.388 -8.777 13.941 1.00 10.00 C ATOM 1055 C ASP A 70 3.716 -8.122 15.287 1.00 10.00 C ATOM 1056 O ASP A 70 4.639 -7.304 15.332 1.00 10.00 O ATOM 1057 CB ASP A 70 3.752 -10.268 13.944 1.00 10.00 C ATOM 1058 CG ASP A 70 2.869 -11.070 14.909 1.00 10.00 C ATOM 1059 OD1 ASP A 70 1.664 -10.717 15.013 1.00 10.00 O ATOM 1060 OD2 ASP A 70 3.383 -12.045 15.485 1.00 10.00 O ATOM 0 H ASP A 70 5.008 -7.690 13.183 1.00 10.00 H new ATOM 0 HA ASP A 70 2.315 -8.706 13.764 1.00 10.00 H new ATOM 0 HB2 ASP A 70 3.646 -10.670 12.936 1.00 10.00 H new ATOM 0 HB3 ASP A 70 4.798 -10.386 14.226 1.00 10.00 H new ATOM 1065 N CYS A 71 2.973 -8.402 16.361 1.00 10.00 N ATOM 1066 CA CYS A 71 3.049 -7.667 17.625 1.00 10.00 C ATOM 1067 C CYS A 71 3.092 -8.577 18.855 1.00 10.00 C ATOM 1068 O CYS A 71 2.598 -9.694 18.819 1.00 10.00 O ATOM 1069 CB CYS A 71 1.815 -6.766 17.739 1.00 10.00 C ATOM 1070 SG CYS A 71 1.977 -5.332 16.649 1.00 10.00 S ATOM 0 H CYS A 71 2.290 -9.159 16.376 1.00 10.00 H new ATOM 0 HA CYS A 71 3.978 -7.097 17.609 1.00 10.00 H new ATOM 0 HB2 CYS A 71 0.920 -7.330 17.477 1.00 10.00 H new ATOM 0 HB3 CYS A 71 1.693 -6.435 18.770 1.00 10.00 H new ATOM 0 HG CYS A 71 1.523 -4.274 17.253 1.00 10.00 H new ATOM 1076 N GLU A 72 3.568 -8.017 19.970 1.00 10.00 N ATOM 1077 CA GLU A 72 3.517 -8.581 21.315 1.00 10.00 C ATOM 1078 C GLU A 72 3.506 -7.396 22.297 1.00 10.00 C ATOM 1079 O GLU A 72 4.199 -6.396 22.062 1.00 10.00 O ATOM 1080 CB GLU A 72 4.751 -9.479 21.506 1.00 10.00 C ATOM 1081 CG GLU A 72 4.916 -9.997 22.940 1.00 10.00 C ATOM 1082 CD GLU A 72 3.743 -10.886 23.405 1.00 10.00 C ATOM 1083 OE1 GLU A 72 2.699 -10.305 23.802 1.00 10.00 O ATOM 1084 OE2 GLU A 72 3.904 -12.125 23.385 1.00 10.00 O ATOM 0 H GLU A 72 4.025 -7.105 19.954 1.00 10.00 H new ATOM 0 HA GLU A 72 2.631 -9.192 21.485 1.00 10.00 H new ATOM 0 HB2 GLU A 72 4.680 -10.329 20.827 1.00 10.00 H new ATOM 0 HB3 GLU A 72 5.644 -8.920 21.225 1.00 10.00 H new ATOM 0 HG2 GLU A 72 5.844 -10.565 23.010 1.00 10.00 H new ATOM 0 HG3 GLU A 72 5.011 -9.148 23.617 1.00 10.00 H new ATOM 1091 N CYS A 73 2.712 -7.453 23.363 1.00 10.00 N ATOM 1092 CA CYS A 73 2.643 -6.389 24.358 1.00 10.00 C ATOM 1093 C CYS A 73 3.875 -6.425 25.264 1.00 10.00 C ATOM 1094 O CYS A 73 4.303 -7.482 25.713 1.00 10.00 O ATOM 1095 CB CYS A 73 1.381 -6.547 25.209 1.00 10.00 C ATOM 1096 SG CYS A 73 -0.079 -6.348 24.157 1.00 10.00 S ATOM 0 H CYS A 73 2.096 -8.242 23.561 1.00 10.00 H new ATOM 0 HA CYS A 73 2.612 -5.432 23.837 1.00 10.00 H new ATOM 0 HB2 CYS A 73 1.370 -7.528 25.685 1.00 10.00 H new ATOM 0 HB3 CYS A 73 1.372 -5.805 26.008 1.00 10.00 H new ATOM 0 HG CYS A 73 -1.151 -6.577 24.855 1.00 10.00 H new ATOM 1102 N LEU A 74 4.396 -5.242 25.618 1.00 10.00 N ATOM 1103 CA LEU A 74 5.408 -5.111 26.669 1.00 10.00 C ATOM 1104 C LEU A 74 4.757 -4.745 28.010 1.00 10.00 C ATOM 1105 O LEU A 74 5.348 -4.953 29.063 1.00 10.00 O ATOM 1106 CB LEU A 74 6.469 -4.059 26.285 1.00 10.00 C ATOM 1107 CG LEU A 74 7.231 -4.336 24.972 1.00 10.00 C ATOM 1108 CD1 LEU A 74 8.392 -3.339 24.841 1.00 10.00 C ATOM 1109 CD2 LEU A 74 7.811 -5.756 24.891 1.00 10.00 C ATOM 0 H LEU A 74 4.129 -4.357 25.186 1.00 10.00 H new ATOM 0 HA LEU A 74 5.904 -6.076 26.777 1.00 10.00 H new ATOM 0 HB2 LEU A 74 5.980 -3.088 26.204 1.00 10.00 H new ATOM 0 HB3 LEU A 74 7.193 -3.985 27.097 1.00 10.00 H new ATOM 0 HG LEU A 74 6.507 -4.227 24.165 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.934 -3.531 23.915 1.00 10.00 H new ATOM 0 HD12 LEU A 74 7.999 -2.322 24.828 1.00 10.00 H new ATOM 0 HD13 LEU A 74 9.069 -3.455 25.688 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.333 -5.882 23.943 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.509 -5.911 25.713 1.00 10.00 H new ATOM 0 HD23 LEU A 74 7.002 -6.484 24.959 1.00 10.00 H new ATOM 1121 N GLY A 75 3.558 -4.153 27.983 1.00 10.00 N ATOM 1122 CA GLY A 75 2.792 -3.782 29.166 1.00 10.00 C ATOM 1123 C GLY A 75 1.705 -2.780 28.790 1.00 10.00 C ATOM 1124 O GLY A 75 1.534 -2.478 27.613 1.00 10.00 O ATOM 0 H GLY A 75 3.085 -3.914 27.111 1.00 10.00 H new ATOM 0 HA2 GLY A 75 2.342 -4.669 29.611 1.00 10.00 H new ATOM 0 HA3 GLY A 75 3.453 -3.349 29.917 1.00 10.00 H new ATOM 1128 N GLY A 76 0.982 -2.223 29.759 1.00 10.00 N ATOM 1129 CA GLY A 76 0.029 -1.144 29.504 1.00 10.00 C ATOM 1130 C GLY A 76 -0.205 -0.287 30.743 1.00 10.00 C ATOM 1131 O GLY A 76 0.450 -0.478 31.769 1.00 10.00 O ATOM 0 H GLY A 76 1.039 -2.504 30.738 1.00 10.00 H new ATOM 0 HA2 GLY A 76 0.400 -0.517 28.693 1.00 10.00 H new ATOM 0 HA3 GLY A 76 -0.919 -1.568 29.171 1.00 10.00 H new ATOM 1135 N GLY A 77 -1.176 0.621 30.659 1.00 10.00 N ATOM 1136 CA GLY A 77 -1.465 1.630 31.663 1.00 10.00 C ATOM 1137 C GLY A 77 -2.643 2.485 31.198 1.00 10.00 C ATOM 1138 O GLY A 77 -3.519 2.014 30.469 1.00 10.00 O ATOM 0 H GLY A 77 -1.804 0.671 29.857 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -1.700 1.155 32.615 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -0.589 2.257 31.827 1.00 10.00 H new ATOM 1142 N ARG A 78 -2.696 3.746 31.614 1.00 10.00 N ATOM 1143 CA ARG A 78 -3.726 4.714 31.230 1.00 10.00 C ATOM 1144 C ARG A 78 -3.066 6.053 30.934 1.00 10.00 C ATOM 1145 O ARG A 78 -1.973 6.295 31.432 1.00 10.00 O ATOM 1146 CB ARG A 78 -4.749 4.898 32.362 1.00 10.00 C ATOM 1147 CG ARG A 78 -5.492 3.614 32.768 1.00 10.00 C ATOM 1148 CD ARG A 78 -6.596 3.899 33.797 1.00 10.00 C ATOM 1149 NE ARG A 78 -6.067 4.578 34.991 1.00 10.00 N ATOM 1150 CZ ARG A 78 -5.569 3.987 36.090 1.00 10.00 C ATOM 1151 NH1 ARG A 78 -5.622 2.676 36.281 1.00 10.00 N ATOM 1152 NH2 ARG A 78 -4.977 4.711 37.022 1.00 10.00 N ATOM 0 H ARG A 78 -2.001 4.139 32.249 1.00 10.00 H new ATOM 0 HA ARG A 78 -4.244 4.342 30.346 1.00 10.00 H new ATOM 0 HB2 ARG A 78 -4.236 5.297 33.237 1.00 10.00 H new ATOM 0 HB3 ARG A 78 -5.482 5.644 32.054 1.00 10.00 H new ATOM 0 HG2 ARG A 78 -5.929 3.151 31.883 1.00 10.00 H new ATOM 0 HG3 ARG A 78 -4.782 2.899 33.184 1.00 10.00 H new ATOM 0 HD2 ARG A 78 -7.369 4.517 33.340 1.00 10.00 H new ATOM 0 HD3 ARG A 78 -7.070 2.962 34.091 1.00 10.00 H new ATOM 0 HE ARG A 78 -6.080 5.598 34.983 1.00 10.00 H new ATOM 0 HH11 ARG A 78 -6.053 2.075 35.578 1.00 10.00 H new ATOM 0 HH12 ARG A 78 -5.231 2.268 37.130 1.00 10.00 H new ATOM 0 HH21 ARG A 78 -4.897 5.722 36.909 1.00 10.00 H new ATOM 0 HH22 ARG A 78 -4.600 4.260 37.855 1.00 10.00 H new ATOM 1166 N ILE A 79 -3.738 6.938 30.212 1.00 10.00 N ATOM 1167 CA ILE A 79 -3.243 8.256 29.819 1.00 10.00 C ATOM 1168 C ILE A 79 -4.367 9.244 30.135 1.00 10.00 C ATOM 1169 O ILE A 79 -5.542 8.869 30.145 1.00 10.00 O ATOM 1170 CB ILE A 79 -2.842 8.265 28.317 1.00 10.00 C ATOM 1171 CG1 ILE A 79 -1.813 7.153 28.000 1.00 10.00 C ATOM 1172 CG2 ILE A 79 -2.278 9.641 27.914 1.00 10.00 C ATOM 1173 CD1 ILE A 79 -1.369 7.061 26.536 1.00 10.00 C ATOM 0 H ILE A 79 -4.681 6.753 29.869 1.00 10.00 H new ATOM 0 HA ILE A 79 -2.340 8.533 30.362 1.00 10.00 H new ATOM 0 HB ILE A 79 -3.742 8.068 27.735 1.00 10.00 H new ATOM 0 HG12 ILE A 79 -0.930 7.312 28.620 1.00 10.00 H new ATOM 0 HG13 ILE A 79 -2.240 6.194 28.293 1.00 10.00 H new ATOM 0 HG21 ILE A 79 -2.003 9.627 26.859 1.00 10.00 H new ATOM 0 HG22 ILE A 79 -3.035 10.408 28.082 1.00 10.00 H new ATOM 0 HG23 ILE A 79 -1.397 9.863 28.516 1.00 10.00 H new ATOM 0 HD11 ILE A 79 -0.649 6.250 26.424 1.00 10.00 H new ATOM 0 HD12 ILE A 79 -2.236 6.866 25.905 1.00 10.00 H new ATOM 0 HD13 ILE A 79 -0.906 8.001 26.236 1.00 10.00 H new ATOM 1185 N SER A 80 -4.033 10.495 30.455 1.00 10.00 N ATOM 1186 CA SER A 80 -4.983 11.593 30.611 1.00 10.00 C ATOM 1187 C SER A 80 -4.268 12.925 30.363 1.00 10.00 C ATOM 1188 O SER A 80 -3.102 13.076 30.722 1.00 10.00 O ATOM 1189 CB SER A 80 -5.576 11.586 32.030 1.00 10.00 C ATOM 1190 OG SER A 80 -6.071 10.303 32.375 1.00 10.00 O ATOM 0 H SER A 80 -3.067 10.778 30.617 1.00 10.00 H new ATOM 0 HA SER A 80 -5.790 11.468 29.889 1.00 10.00 H new ATOM 0 HB2 SER A 80 -4.813 11.889 32.747 1.00 10.00 H new ATOM 0 HB3 SER A 80 -6.381 12.318 32.094 1.00 10.00 H new ATOM 0 HG SER A 80 -6.142 10.231 33.350 1.00 10.00 H new ATOM 1196 N HIS A 81 -4.947 13.893 29.764 1.00 10.00 N ATOM 1197 CA HIS A 81 -4.504 15.281 29.674 1.00 10.00 C ATOM 1198 C HIS A 81 -4.785 15.951 31.024 1.00 10.00 C ATOM 1199 O HIS A 81 -5.817 15.682 31.646 1.00 10.00 O ATOM 1200 CB HIS A 81 -5.289 15.932 28.529 1.00 10.00 C ATOM 1201 CG HIS A 81 -5.058 17.399 28.282 1.00 10.00 C ATOM 1202 ND1 HIS A 81 -3.899 18.126 28.457 1.00 10.00 N ATOM 1203 CD2 HIS A 81 -5.992 18.252 27.756 1.00 10.00 C ATOM 1204 CE1 HIS A 81 -4.149 19.379 28.047 1.00 10.00 C ATOM 1205 NE2 HIS A 81 -5.406 19.506 27.594 1.00 10.00 N ATOM 0 H HIS A 81 -5.848 13.732 29.313 1.00 10.00 H new ATOM 0 HA HIS A 81 -3.438 15.376 29.465 1.00 10.00 H new ATOM 0 HB2 HIS A 81 -5.055 15.394 27.610 1.00 10.00 H new ATOM 0 HB3 HIS A 81 -6.352 15.785 28.722 1.00 10.00 H new ATOM 0 HD1 HIS A 81 -3.016 17.776 28.829 1.00 10.00 H new ATOM 0 HD2 HIS A 81 -7.011 17.996 27.508 1.00 10.00 H new ATOM 0 HE1 HIS A 81 -3.429 20.184 28.078 1.00 10.00 H new ATOM 1213 N GLN A 82 -3.852 16.769 31.532 1.00 10.00 N ATOM 1214 CA GLN A 82 -4.092 17.496 32.775 1.00 10.00 C ATOM 1215 C GLN A 82 -5.238 18.504 32.580 1.00 10.00 C ATOM 1216 O GLN A 82 -5.396 19.078 31.515 1.00 10.00 O ATOM 1217 CB GLN A 82 -2.785 18.134 33.275 1.00 10.00 C ATOM 1218 CG GLN A 82 -2.919 18.701 34.700 1.00 10.00 C ATOM 1219 CD GLN A 82 -1.570 18.829 35.406 1.00 10.00 C ATOM 1220 OE1 GLN A 82 -0.895 19.832 35.331 1.00 10.00 O ATOM 1221 NE2 GLN A 82 -1.132 17.795 36.121 1.00 10.00 N ATOM 0 H GLN A 82 -2.941 16.939 31.106 1.00 10.00 H new ATOM 0 HA GLN A 82 -4.415 16.810 33.558 1.00 10.00 H new ATOM 0 HB2 GLN A 82 -1.989 17.389 33.256 1.00 10.00 H new ATOM 0 HB3 GLN A 82 -2.490 18.933 32.595 1.00 10.00 H new ATOM 0 HG2 GLN A 82 -3.397 19.680 34.655 1.00 10.00 H new ATOM 0 HG3 GLN A 82 -3.572 18.054 35.285 1.00 10.00 H new ATOM 0 HE21 GLN A 82 -1.695 16.947 36.189 1.00 10.00 H new ATOM 0 HE22 GLN A 82 -0.234 17.851 36.601 1.00 10.00 H new ATOM 1230 N SER A 83 -6.033 18.717 33.630 1.00 10.00 N ATOM 1231 CA SER A 83 -7.272 19.481 33.569 1.00 10.00 C ATOM 1232 C SER A 83 -7.062 20.984 33.353 1.00 10.00 C ATOM 1233 O SER A 83 -7.998 21.661 32.939 1.00 10.00 O ATOM 1234 CB SER A 83 -8.059 19.207 34.861 1.00 10.00 C ATOM 1235 OG SER A 83 -7.203 19.122 35.997 1.00 10.00 O ATOM 0 H SER A 83 -5.827 18.355 34.561 1.00 10.00 H new ATOM 0 HA SER A 83 -7.833 19.153 32.694 1.00 10.00 H new ATOM 0 HB2 SER A 83 -8.790 20.001 35.016 1.00 10.00 H new ATOM 0 HB3 SER A 83 -8.616 18.276 34.756 1.00 10.00 H new ATOM 0 HG SER A 83 -6.968 18.185 36.160 1.00 10.00 H new ATOM 1241 N GLN A 84 -5.880 21.520 33.683 1.00 10.00 N ATOM 1242 CA GLN A 84 -5.620 22.959 33.721 1.00 10.00 C ATOM 1243 C GLN A 84 -4.189 23.282 33.245 1.00 10.00 C ATOM 1244 O GLN A 84 -3.647 24.323 33.606 1.00 10.00 O ATOM 1245 CB GLN A 84 -5.923 23.455 35.156 1.00 10.00 C ATOM 1246 CG GLN A 84 -6.290 24.945 35.265 1.00 10.00 C ATOM 1247 CD GLN A 84 -7.588 25.288 34.533 1.00 10.00 C ATOM 1248 OE1 GLN A 84 -7.581 25.804 33.431 1.00 10.00 O ATOM 1249 NE2 GLN A 84 -8.737 25.015 35.145 1.00 10.00 N ATOM 0 H GLN A 84 -5.068 20.956 33.934 1.00 10.00 H new ATOM 0 HA GLN A 84 -6.270 23.491 33.027 1.00 10.00 H new ATOM 0 HB2 GLN A 84 -6.743 22.864 35.563 1.00 10.00 H new ATOM 0 HB3 GLN A 84 -5.051 23.264 35.782 1.00 10.00 H new ATOM 0 HG2 GLN A 84 -6.388 25.215 36.316 1.00 10.00 H new ATOM 0 HG3 GLN A 84 -5.478 25.546 34.856 1.00 10.00 H new ATOM 0 HE21 GLN A 84 -8.733 24.582 36.069 1.00 10.00 H new ATOM 0 HE22 GLN A 84 -9.622 25.238 34.691 1.00 10.00 H new ATOM 1258 N ASP A 85 -3.558 22.394 32.469 1.00 10.00 N ATOM 1259 CA ASP A 85 -2.217 22.609 31.911 1.00 10.00 C ATOM 1260 C ASP A 85 -2.120 21.853 30.585 1.00 10.00 C ATOM 1261 O ASP A 85 -2.826 20.867 30.395 1.00 10.00 O ATOM 1262 CB ASP A 85 -1.143 22.109 32.889 1.00 10.00 C ATOM 1263 CG ASP A 85 0.269 22.491 32.428 1.00 10.00 C ATOM 1264 OD1 ASP A 85 0.799 21.779 31.543 1.00 10.00 O ATOM 1265 OD2 ASP A 85 0.732 23.571 32.834 1.00 10.00 O ATOM 0 H ASP A 85 -3.967 21.497 32.208 1.00 10.00 H new ATOM 0 HA ASP A 85 -2.051 23.674 31.746 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -1.328 22.528 33.878 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -1.214 21.025 32.984 1.00 10.00 H new ATOM 1270 N LYS A 86 -1.286 22.324 29.653 1.00 10.00 N ATOM 1271 CA LYS A 86 -1.061 21.677 28.362 1.00 10.00 C ATOM 1272 C LYS A 86 -0.594 20.215 28.489 1.00 10.00 C ATOM 1273 O LYS A 86 -0.829 19.454 27.552 1.00 10.00 O ATOM 1274 CB LYS A 86 -0.025 22.470 27.547 1.00 10.00 C ATOM 1275 CG LYS A 86 -0.467 23.908 27.219 1.00 10.00 C ATOM 1276 CD LYS A 86 0.495 24.640 26.263 1.00 10.00 C ATOM 1277 CE LYS A 86 1.698 25.336 26.928 1.00 10.00 C ATOM 1278 NZ LYS A 86 2.677 24.404 27.543 1.00 10.00 N ATOM 0 H LYS A 86 -0.742 23.178 29.778 1.00 10.00 H new ATOM 0 HA LYS A 86 -2.024 21.667 27.852 1.00 10.00 H new ATOM 0 HB2 LYS A 86 0.912 22.505 28.103 1.00 10.00 H new ATOM 0 HB3 LYS A 86 0.176 21.939 26.616 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -1.461 23.882 26.773 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -0.548 24.476 28.146 1.00 10.00 H new ATOM 0 HD2 LYS A 86 0.872 23.921 25.535 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -0.072 25.387 25.708 1.00 10.00 H new ATOM 0 HE2 LYS A 86 2.210 25.943 26.182 1.00 10.00 H new ATOM 0 HE3 LYS A 86 1.331 26.017 27.695 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 3.599 24.877 27.630 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 2.342 24.121 28.486 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 2.777 23.560 26.944 1.00 10.00 H new ATOM 1292 N LYS A 87 0.102 19.849 29.569 1.00 10.00 N ATOM 1293 CA LYS A 87 0.791 18.567 29.671 1.00 10.00 C ATOM 1294 C LYS A 87 -0.147 17.364 29.589 1.00 10.00 C ATOM 1295 O LYS A 87 -1.354 17.439 29.862 1.00 10.00 O ATOM 1296 CB LYS A 87 1.695 18.570 30.919 1.00 10.00 C ATOM 1297 CG LYS A 87 0.987 18.482 32.286 1.00 10.00 C ATOM 1298 CD LYS A 87 0.874 17.064 32.872 1.00 10.00 C ATOM 1299 CE LYS A 87 2.225 16.371 33.098 1.00 10.00 C ATOM 1300 NZ LYS A 87 3.082 17.063 34.089 1.00 10.00 N ATOM 0 H LYS A 87 0.202 20.437 30.397 1.00 10.00 H new ATOM 0 HA LYS A 87 1.429 18.448 28.795 1.00 10.00 H new ATOM 0 HB2 LYS A 87 2.388 17.732 30.840 1.00 10.00 H new ATOM 0 HB3 LYS A 87 2.294 19.481 30.904 1.00 10.00 H new ATOM 0 HG2 LYS A 87 1.524 19.110 32.997 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -0.015 18.898 32.186 1.00 10.00 H new ATOM 0 HD2 LYS A 87 0.341 17.116 33.821 1.00 10.00 H new ATOM 0 HD3 LYS A 87 0.271 16.452 32.201 1.00 10.00 H new ATOM 0 HE2 LYS A 87 2.049 15.348 33.432 1.00 10.00 H new ATOM 0 HE3 LYS A 87 2.757 16.309 32.149 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 3.637 16.361 34.618 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 3.726 17.714 33.596 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 2.485 17.601 34.749 1.00 10.00 H new ATOM 1314 N ILE A 88 0.458 16.200 29.352 1.00 10.00 N ATOM 1315 CA ILE A 88 -0.182 14.889 29.364 1.00 10.00 C ATOM 1316 C ILE A 88 0.455 14.097 30.515 1.00 10.00 C ATOM 1317 O ILE A 88 1.594 14.354 30.927 1.00 10.00 O ATOM 1318 CB ILE A 88 -0.008 14.213 27.974 1.00 10.00 C ATOM 1319 CG1 ILE A 88 -0.527 15.063 26.789 1.00 10.00 C ATOM 1320 CG2 ILE A 88 -0.647 12.812 27.916 1.00 10.00 C ATOM 1321 CD1 ILE A 88 -2.018 15.412 26.844 1.00 10.00 C ATOM 0 H ILE A 88 1.454 16.145 29.137 1.00 10.00 H new ATOM 0 HA ILE A 88 -1.257 14.947 29.534 1.00 10.00 H new ATOM 0 HB ILE A 88 1.072 14.120 27.861 1.00 10.00 H new ATOM 0 HG12 ILE A 88 0.046 15.989 26.748 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -0.330 14.525 25.862 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -0.497 12.385 26.925 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -0.182 12.169 28.663 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.715 12.890 28.120 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -2.285 16.008 25.971 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -2.606 14.495 26.850 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -2.225 15.982 27.750 1.00 10.00 H new ATOM 1333 N HIS A 89 -0.248 13.112 31.066 1.00 10.00 N ATOM 1334 CA HIS A 89 0.251 12.258 32.132 1.00 10.00 C ATOM 1335 C HIS A 89 -0.140 10.813 31.843 1.00 10.00 C ATOM 1336 O HIS A 89 -1.117 10.574 31.136 1.00 10.00 O ATOM 1337 CB HIS A 89 -0.302 12.741 33.480 1.00 10.00 C ATOM 1338 CG HIS A 89 0.368 12.086 34.662 1.00 10.00 C ATOM 1339 ND1 HIS A 89 1.666 12.290 35.068 1.00 10.00 N ATOM 1340 CD2 HIS A 89 -0.185 11.179 35.527 1.00 10.00 C ATOM 1341 CE1 HIS A 89 1.889 11.531 36.154 1.00 10.00 C ATOM 1342 NE2 HIS A 89 0.789 10.842 36.477 1.00 10.00 N ATOM 0 H HIS A 89 -1.199 12.883 30.776 1.00 10.00 H new ATOM 0 HA HIS A 89 1.339 12.310 32.182 1.00 10.00 H new ATOM 0 HB2 HIS A 89 -0.177 13.821 33.551 1.00 10.00 H new ATOM 0 HB3 HIS A 89 -1.373 12.541 33.520 1.00 10.00 H new ATOM 0 HD2 HIS A 89 -1.192 10.792 35.485 1.00 10.00 H new ATOM 0 HE1 HIS A 89 2.825 11.484 36.691 1.00 10.00 H new ATOM 0 HE2 HIS A 89 0.680 10.198 37.261 1.00 10.00 H new ATOM 1350 N VAL A 90 0.601 9.857 32.399 1.00 10.00 N ATOM 1351 CA VAL A 90 0.452 8.427 32.146 1.00 10.00 C ATOM 1352 C VAL A 90 0.570 7.715 33.501 1.00 10.00 C ATOM 1353 O VAL A 90 1.467 8.028 34.280 1.00 10.00 O ATOM 1354 CB VAL A 90 1.531 7.971 31.135 1.00 10.00 C ATOM 1355 CG1 VAL A 90 1.355 6.500 30.751 1.00 10.00 C ATOM 1356 CG2 VAL A 90 1.534 8.809 29.841 1.00 10.00 C ATOM 0 H VAL A 90 1.348 10.065 33.062 1.00 10.00 H new ATOM 0 HA VAL A 90 -0.513 8.183 31.702 1.00 10.00 H new ATOM 0 HB VAL A 90 2.482 8.115 31.648 1.00 10.00 H new ATOM 0 HG11 VAL A 90 2.130 6.214 30.040 1.00 10.00 H new ATOM 0 HG12 VAL A 90 1.435 5.879 31.643 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.375 6.357 30.296 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.312 8.442 29.172 1.00 10.00 H new ATOM 0 HG22 VAL A 90 0.564 8.725 29.351 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.728 9.854 30.084 1.00 10.00 H new ATOM 1366 N TYR A 91 -0.341 6.798 33.830 1.00 10.00 N ATOM 1367 CA TYR A 91 -0.451 6.236 35.173 1.00 10.00 C ATOM 1368 C TYR A 91 -1.151 4.874 35.173 1.00 10.00 C ATOM 1369 O TYR A 91 -1.613 4.409 34.131 1.00 10.00 O ATOM 1370 CB TYR A 91 -1.125 7.246 36.130 1.00 10.00 C ATOM 1371 CG TYR A 91 -2.630 7.487 36.010 1.00 10.00 C ATOM 1372 CD1 TYR A 91 -3.244 7.779 34.773 1.00 10.00 C ATOM 1373 CD2 TYR A 91 -3.416 7.510 37.181 1.00 10.00 C ATOM 1374 CE1 TYR A 91 -4.614 8.082 34.705 1.00 10.00 C ATOM 1375 CE2 TYR A 91 -4.785 7.826 37.125 1.00 10.00 C ATOM 1376 CZ TYR A 91 -5.388 8.129 35.886 1.00 10.00 C ATOM 1377 OH TYR A 91 -6.718 8.405 35.830 1.00 10.00 O ATOM 0 H TYR A 91 -1.024 6.425 33.170 1.00 10.00 H new ATOM 0 HA TYR A 91 0.557 6.053 35.544 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -0.924 6.918 37.150 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -0.626 8.206 36.000 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -2.654 7.769 33.869 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -2.960 7.282 38.133 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -5.076 8.279 33.749 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -5.375 7.837 38.030 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.093 8.395 36.736 1.00 10.00 H new ATOM 1387 N GLY A 92 -1.244 4.240 36.343 1.00 10.00 N ATOM 1388 CA GLY A 92 -1.819 2.911 36.490 1.00 10.00 C ATOM 1389 C GLY A 92 -0.876 1.838 35.950 1.00 10.00 C ATOM 1390 O GLY A 92 0.335 2.050 35.834 1.00 10.00 O ATOM 0 H GLY A 92 -0.918 4.643 37.221 1.00 10.00 H new ATOM 0 HA2 GLY A 92 -2.030 2.718 37.542 1.00 10.00 H new ATOM 0 HA3 GLY A 92 -2.770 2.863 35.960 1.00 10.00 H new ATOM 1394 N TYR A 93 -1.439 0.669 35.640 1.00 10.00 N ATOM 1395 CA TYR A 93 -0.778 -0.418 34.923 1.00 10.00 C ATOM 1396 C TYR A 93 -1.846 -1.306 34.278 1.00 10.00 C ATOM 1397 O TYR A 93 -2.996 -1.330 34.723 1.00 10.00 O ATOM 1398 CB TYR A 93 0.124 -1.245 35.856 1.00 10.00 C ATOM 1399 CG TYR A 93 -0.501 -1.811 37.121 1.00 10.00 C ATOM 1400 CD1 TYR A 93 -1.131 -3.072 37.098 1.00 10.00 C ATOM 1401 CD2 TYR A 93 -0.376 -1.122 38.343 1.00 10.00 C ATOM 1402 CE1 TYR A 93 -1.641 -3.640 38.278 1.00 10.00 C ATOM 1403 CE2 TYR A 93 -0.863 -1.695 39.530 1.00 10.00 C ATOM 1404 CZ TYR A 93 -1.504 -2.952 39.505 1.00 10.00 C ATOM 1405 OH TYR A 93 -1.975 -3.502 40.662 1.00 10.00 O ATOM 0 H TYR A 93 -2.402 0.447 35.891 1.00 10.00 H new ATOM 0 HA TYR A 93 -0.135 0.007 34.152 1.00 10.00 H new ATOM 0 HB2 TYR A 93 0.529 -2.077 35.280 1.00 10.00 H new ATOM 0 HB3 TYR A 93 0.967 -0.620 36.149 1.00 10.00 H new ATOM 0 HD1 TYR A 93 -1.223 -3.607 36.164 1.00 10.00 H new ATOM 0 HD2 TYR A 93 0.095 -0.151 38.368 1.00 10.00 H new ATOM 0 HE1 TYR A 93 -2.136 -4.599 38.247 1.00 10.00 H new ATOM 0 HE2 TYR A 93 -0.746 -1.170 40.467 1.00 10.00 H new ATOM 0 HH TYR A 93 -1.796 -2.894 41.410 1.00 10.00 H new ATOM 1415 N SER A 94 -1.500 -2.052 33.228 1.00 10.00 N ATOM 1416 CA SER A 94 -2.386 -3.068 32.680 1.00 10.00 C ATOM 1417 C SER A 94 -2.398 -4.257 33.636 1.00 10.00 C ATOM 1418 O SER A 94 -1.347 -4.787 33.974 1.00 10.00 O ATOM 1419 CB SER A 94 -1.910 -3.497 31.291 1.00 10.00 C ATOM 1420 OG SER A 94 -2.631 -4.629 30.845 1.00 10.00 O ATOM 0 H SER A 94 -0.608 -1.967 32.741 1.00 10.00 H new ATOM 0 HA SER A 94 -3.395 -2.668 32.575 1.00 10.00 H new ATOM 0 HB2 SER A 94 -2.040 -2.676 30.586 1.00 10.00 H new ATOM 0 HB3 SER A 94 -0.845 -3.726 31.320 1.00 10.00 H new ATOM 0 HG SER A 94 -2.210 -4.987 30.035 1.00 10.00 H new ATOM 1426 N MET A 95 -3.591 -4.697 34.035 1.00 10.00 N ATOM 1427 CA MET A 95 -3.751 -5.953 34.761 1.00 10.00 C ATOM 1428 C MET A 95 -3.609 -7.162 33.820 1.00 10.00 C ATOM 1429 O MET A 95 -3.410 -8.265 34.306 1.00 10.00 O ATOM 1430 CB MET A 95 -5.111 -5.975 35.483 1.00 10.00 C ATOM 1431 CG MET A 95 -5.206 -4.887 36.565 1.00 10.00 C ATOM 1432 SD MET A 95 -6.798 -4.791 37.428 1.00 10.00 S ATOM 1433 CE MET A 95 -6.758 -6.323 38.400 1.00 10.00 C ATOM 0 H MET A 95 -4.464 -4.198 33.866 1.00 10.00 H new ATOM 0 HA MET A 95 -2.958 -6.023 35.506 1.00 10.00 H new ATOM 0 HB2 MET A 95 -5.910 -5.833 34.755 1.00 10.00 H new ATOM 0 HB3 MET A 95 -5.264 -6.953 35.938 1.00 10.00 H new ATOM 0 HG2 MET A 95 -4.422 -5.061 37.302 1.00 10.00 H new ATOM 0 HG3 MET A 95 -5.002 -3.920 36.104 1.00 10.00 H new ATOM 0 HE1 MET A 95 -7.640 -6.372 39.039 1.00 10.00 H new ATOM 0 HE2 MET A 95 -6.750 -7.181 37.727 1.00 10.00 H new ATOM 0 HE3 MET A 95 -5.860 -6.338 39.018 1.00 10.00 H new ATOM 1443 N ALA A 96 -3.741 -6.962 32.495 1.00 10.00 N ATOM 1444 CA ALA A 96 -3.632 -8.043 31.520 1.00 10.00 C ATOM 1445 C ALA A 96 -2.170 -8.433 31.267 1.00 10.00 C ATOM 1446 O ALA A 96 -1.904 -9.593 30.978 1.00 10.00 O ATOM 1447 CB ALA A 96 -4.296 -7.625 30.200 1.00 10.00 C ATOM 0 H ALA A 96 -3.925 -6.048 32.081 1.00 10.00 H new ATOM 0 HA ALA A 96 -4.144 -8.914 31.929 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -4.211 -8.436 29.477 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -5.349 -7.405 30.376 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -3.800 -6.737 29.809 1.00 10.00 H new ATOM 1453 N TYR A 97 -1.238 -7.474 31.355 1.00 10.00 N ATOM 1454 CA TYR A 97 0.155 -7.686 30.956 1.00 10.00 C ATOM 1455 C TYR A 97 1.118 -7.290 32.074 1.00 10.00 C ATOM 1456 O TYR A 97 2.015 -8.051 32.414 1.00 10.00 O ATOM 1457 CB TYR A 97 0.458 -6.868 29.689 1.00 10.00 C ATOM 1458 CG TYR A 97 -0.541 -7.024 28.558 1.00 10.00 C ATOM 1459 CD1 TYR A 97 -0.778 -8.288 27.987 1.00 10.00 C ATOM 1460 CD2 TYR A 97 -1.252 -5.898 28.097 1.00 10.00 C ATOM 1461 CE1 TYR A 97 -1.738 -8.435 26.973 1.00 10.00 C ATOM 1462 CE2 TYR A 97 -2.207 -6.033 27.079 1.00 10.00 C ATOM 1463 CZ TYR A 97 -2.459 -7.308 26.527 1.00 10.00 C ATOM 1464 OH TYR A 97 -3.375 -7.441 25.538 1.00 10.00 O ATOM 0 H TYR A 97 -1.430 -6.535 31.703 1.00 10.00 H new ATOM 0 HA TYR A 97 0.296 -8.747 30.751 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.510 -5.814 29.962 1.00 10.00 H new ATOM 0 HB3 TYR A 97 1.444 -7.152 29.321 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -0.220 -9.147 28.329 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -1.061 -4.927 28.529 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -1.923 -9.406 26.537 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -2.746 -5.168 26.720 1.00 10.00 H new ATOM 0 HH TYR A 97 -2.960 -7.876 24.764 1.00 10.00 H new ATOM 1474 N GLY A 98 0.936 -6.097 32.640 1.00 10.00 N ATOM 1475 CA GLY A 98 1.798 -5.508 33.654 1.00 10.00 C ATOM 1476 C GLY A 98 1.975 -4.017 33.366 1.00 10.00 C ATOM 1477 O GLY A 98 1.424 -3.515 32.377 1.00 10.00 O ATOM 0 H GLY A 98 0.152 -5.494 32.392 1.00 10.00 H new ATOM 0 HA2 GLY A 98 1.363 -5.649 34.643 1.00 10.00 H new ATOM 0 HA3 GLY A 98 2.767 -6.007 33.657 1.00 10.00 H new ATOM 1481 N PRO A 99 2.701 -3.278 34.220 1.00 10.00 N ATOM 1482 CA PRO A 99 3.109 -1.909 33.934 1.00 10.00 C ATOM 1483 C PRO A 99 3.828 -1.833 32.587 1.00 10.00 C ATOM 1484 O PRO A 99 4.748 -2.606 32.329 1.00 10.00 O ATOM 1485 CB PRO A 99 4.039 -1.496 35.082 1.00 10.00 C ATOM 1486 CG PRO A 99 3.685 -2.455 36.219 1.00 10.00 C ATOM 1487 CD PRO A 99 3.252 -3.725 35.489 1.00 10.00 C ATOM 0 HA PRO A 99 2.251 -1.240 33.866 1.00 10.00 H new ATOM 0 HB2 PRO A 99 5.087 -1.587 34.797 1.00 10.00 H new ATOM 0 HB3 PRO A 99 3.876 -0.458 35.372 1.00 10.00 H new ATOM 0 HG2 PRO A 99 4.539 -2.638 36.871 1.00 10.00 H new ATOM 0 HG3 PRO A 99 2.885 -2.059 36.845 1.00 10.00 H new ATOM 0 HD2 PRO A 99 4.097 -4.396 35.335 1.00 10.00 H new ATOM 0 HD3 PRO A 99 2.509 -4.275 36.067 1.00 10.00 H new ATOM 1495 N ALA A 100 3.430 -0.886 31.735 1.00 10.00 N ATOM 1496 CA ALA A 100 4.216 -0.530 30.571 1.00 10.00 C ATOM 1497 C ALA A 100 5.541 0.079 31.029 1.00 10.00 C ATOM 1498 O ALA A 100 5.672 0.586 32.145 1.00 10.00 O ATOM 1499 CB ALA A 100 3.432 0.458 29.702 1.00 10.00 C ATOM 0 H ALA A 100 2.565 -0.356 31.837 1.00 10.00 H new ATOM 0 HA ALA A 100 4.425 -1.418 29.975 1.00 10.00 H new ATOM 0 HB1 ALA A 100 4.026 0.724 28.827 1.00 10.00 H new ATOM 0 HB2 ALA A 100 2.498 -0.002 29.380 1.00 10.00 H new ATOM 0 HB3 ALA A 100 3.214 1.357 30.279 1.00 10.00 H new ATOM 1505 N GLN A 101 6.514 0.127 30.116 1.00 10.00 N ATOM 1506 CA GLN A 101 7.733 0.896 30.298 1.00 10.00 C ATOM 1507 C GLN A 101 7.381 2.353 29.989 1.00 10.00 C ATOM 1508 O GLN A 101 7.783 2.894 28.957 1.00 10.00 O ATOM 1509 CB GLN A 101 8.872 0.332 29.430 1.00 10.00 C ATOM 1510 CG GLN A 101 9.255 -1.095 29.855 1.00 10.00 C ATOM 1511 CD GLN A 101 10.497 -1.596 29.116 1.00 10.00 C ATOM 1512 OE1 GLN A 101 11.590 -1.661 29.651 1.00 10.00 O ATOM 1513 NE2 GLN A 101 10.364 -1.945 27.844 1.00 10.00 N ATOM 0 H GLN A 101 6.472 -0.372 29.227 1.00 10.00 H new ATOM 0 HA GLN A 101 8.110 0.832 31.319 1.00 10.00 H new ATOM 0 HB2 GLN A 101 8.566 0.331 28.384 1.00 10.00 H new ATOM 0 HB3 GLN A 101 9.744 0.981 29.507 1.00 10.00 H new ATOM 0 HG2 GLN A 101 9.438 -1.117 30.929 1.00 10.00 H new ATOM 0 HG3 GLN A 101 8.420 -1.768 29.660 1.00 10.00 H new ATOM 0 HE21 GLN A 101 9.450 -1.892 27.393 1.00 10.00 H new ATOM 0 HE22 GLN A 101 11.175 -2.267 27.316 1.00 10.00 H new ATOM 1522 N HIS A 102 6.561 2.957 30.855 1.00 10.00 N ATOM 1523 CA HIS A 102 5.915 4.251 30.645 1.00 10.00 C ATOM 1524 C HIS A 102 6.886 5.348 30.197 1.00 10.00 C ATOM 1525 O HIS A 102 6.491 6.178 29.392 1.00 10.00 O ATOM 1526 CB HIS A 102 5.188 4.697 31.921 1.00 10.00 C ATOM 1527 CG HIS A 102 4.126 3.752 32.432 1.00 10.00 C ATOM 1528 ND1 HIS A 102 4.186 2.986 33.575 1.00 10.00 N ATOM 1529 CD2 HIS A 102 2.884 3.552 31.896 1.00 10.00 C ATOM 1530 CE1 HIS A 102 3.012 2.348 33.713 1.00 10.00 C ATOM 1531 NE2 HIS A 102 2.183 2.652 32.703 1.00 10.00 N ATOM 0 H HIS A 102 6.322 2.540 31.755 1.00 10.00 H new ATOM 0 HA HIS A 102 5.200 4.107 29.835 1.00 10.00 H new ATOM 0 HB2 HIS A 102 5.929 4.842 32.708 1.00 10.00 H new ATOM 0 HB3 HIS A 102 4.727 5.667 31.735 1.00 10.00 H new ATOM 0 HD1 HIS A 102 4.983 2.915 34.207 1.00 10.00 H new ATOM 0 HD2 HIS A 102 2.506 4.014 30.996 1.00 10.00 H new ATOM 0 HE1 HIS A 102 2.769 1.681 34.527 1.00 10.00 H new ATOM 1539 N ALA A 103 8.153 5.323 30.631 1.00 10.00 N ATOM 1540 CA ALA A 103 9.158 6.298 30.211 1.00 10.00 C ATOM 1541 C ALA A 103 9.365 6.313 28.687 1.00 10.00 C ATOM 1542 O ALA A 103 9.560 7.375 28.103 1.00 10.00 O ATOM 1543 CB ALA A 103 10.485 6.001 30.919 1.00 10.00 C ATOM 0 H ALA A 103 8.507 4.624 31.284 1.00 10.00 H new ATOM 0 HA ALA A 103 8.795 7.287 30.492 1.00 10.00 H new ATOM 0 HB1 ALA A 103 11.235 6.728 30.606 1.00 10.00 H new ATOM 0 HB2 ALA A 103 10.344 6.066 31.998 1.00 10.00 H new ATOM 0 HB3 ALA A 103 10.821 4.998 30.657 1.00 10.00 H new ATOM 1549 N ILE A 104 9.303 5.142 28.039 1.00 10.00 N ATOM 1550 CA ILE A 104 9.413 5.042 26.586 1.00 10.00 C ATOM 1551 C ILE A 104 8.176 5.718 25.987 1.00 10.00 C ATOM 1552 O ILE A 104 8.278 6.545 25.084 1.00 10.00 O ATOM 1553 CB ILE A 104 9.541 3.559 26.143 1.00 10.00 C ATOM 1554 CG1 ILE A 104 10.724 2.857 26.855 1.00 10.00 C ATOM 1555 CG2 ILE A 104 9.682 3.468 24.610 1.00 10.00 C ATOM 1556 CD1 ILE A 104 10.933 1.392 26.449 1.00 10.00 C ATOM 0 H ILE A 104 9.176 4.245 28.508 1.00 10.00 H new ATOM 0 HA ILE A 104 10.313 5.542 26.228 1.00 10.00 H new ATOM 0 HB ILE A 104 8.630 3.037 26.437 1.00 10.00 H new ATOM 0 HG12 ILE A 104 11.638 3.413 26.646 1.00 10.00 H new ATOM 0 HG13 ILE A 104 10.562 2.903 27.932 1.00 10.00 H new ATOM 0 HG21 ILE A 104 9.771 2.423 24.314 1.00 10.00 H new ATOM 0 HG22 ILE A 104 8.803 3.906 24.137 1.00 10.00 H new ATOM 0 HG23 ILE A 104 10.572 4.011 24.294 1.00 10.00 H new ATOM 0 HD11 ILE A 104 11.781 0.980 26.996 1.00 10.00 H new ATOM 0 HD12 ILE A 104 10.037 0.818 26.684 1.00 10.00 H new ATOM 0 HD13 ILE A 104 11.130 1.336 25.378 1.00 10.00 H new ATOM 1568 N SER A 105 6.989 5.358 26.490 1.00 10.00 N ATOM 1569 CA SER A 105 5.740 5.928 26.030 1.00 10.00 C ATOM 1570 C SER A 105 5.710 7.451 26.193 1.00 10.00 C ATOM 1571 O SER A 105 5.300 8.120 25.251 1.00 10.00 O ATOM 1572 CB SER A 105 4.562 5.262 26.749 1.00 10.00 C ATOM 1573 OG SER A 105 4.741 3.851 26.810 1.00 10.00 O ATOM 0 H SER A 105 6.879 4.662 27.228 1.00 10.00 H new ATOM 0 HA SER A 105 5.651 5.730 24.962 1.00 10.00 H new ATOM 0 HB2 SER A 105 4.470 5.666 27.757 1.00 10.00 H new ATOM 0 HB3 SER A 105 3.633 5.493 26.227 1.00 10.00 H new ATOM 0 HG SER A 105 4.113 3.469 27.458 1.00 10.00 H new ATOM 1579 N THR A 106 6.149 8.015 27.320 1.00 10.00 N ATOM 1580 CA THR A 106 6.087 9.455 27.518 1.00 10.00 C ATOM 1581 C THR A 106 6.986 10.189 26.528 1.00 10.00 C ATOM 1582 O THR A 106 6.569 11.227 26.027 1.00 10.00 O ATOM 1583 CB THR A 106 6.384 9.836 28.977 1.00 10.00 C ATOM 1584 OG1 THR A 106 7.563 9.235 29.482 1.00 10.00 O ATOM 1585 CG2 THR A 106 5.234 9.393 29.885 1.00 10.00 C ATOM 0 H THR A 106 6.548 7.496 28.102 1.00 10.00 H new ATOM 0 HA THR A 106 5.066 9.778 27.315 1.00 10.00 H new ATOM 0 HB THR A 106 6.510 10.919 28.977 1.00 10.00 H new ATOM 0 HG1 THR A 106 8.054 8.810 28.748 1.00 10.00 H new ATOM 0 HG21 THR A 106 5.457 9.669 30.916 1.00 10.00 H new ATOM 0 HG22 THR A 106 4.312 9.882 29.570 1.00 10.00 H new ATOM 0 HG23 THR A 106 5.112 8.312 29.817 1.00 10.00 H new ATOM 1593 N GLU A 107 8.172 9.665 26.199 1.00 10.00 N ATOM 1594 CA GLU A 107 9.044 10.299 25.212 1.00 10.00 C ATOM 1595 C GLU A 107 8.409 10.248 23.816 1.00 10.00 C ATOM 1596 O GLU A 107 8.436 11.232 23.077 1.00 10.00 O ATOM 1597 CB GLU A 107 10.415 9.609 25.200 1.00 10.00 C ATOM 1598 CG GLU A 107 11.272 9.945 26.434 1.00 10.00 C ATOM 1599 CD GLU A 107 11.765 11.405 26.439 1.00 10.00 C ATOM 1600 OE1 GLU A 107 12.843 11.667 25.876 1.00 10.00 O ATOM 1601 OE2 GLU A 107 11.042 12.279 27.005 1.00 10.00 O ATOM 0 H GLU A 107 8.547 8.806 26.602 1.00 10.00 H new ATOM 0 HA GLU A 107 9.178 11.345 25.489 1.00 10.00 H new ATOM 0 HB2 GLU A 107 10.271 8.530 25.148 1.00 10.00 H new ATOM 0 HB3 GLU A 107 10.955 9.902 24.300 1.00 10.00 H new ATOM 0 HG2 GLU A 107 10.690 9.760 27.337 1.00 10.00 H new ATOM 0 HG3 GLU A 107 12.132 9.276 26.467 1.00 10.00 H new ATOM 1608 N LYS A 108 7.778 9.122 23.467 1.00 10.00 N ATOM 1609 CA LYS A 108 7.092 8.985 22.185 1.00 10.00 C ATOM 1610 C LYS A 108 5.896 9.941 22.116 1.00 10.00 C ATOM 1611 O LYS A 108 5.720 10.634 21.118 1.00 10.00 O ATOM 1612 CB LYS A 108 6.698 7.514 21.984 1.00 10.00 C ATOM 1613 CG LYS A 108 7.916 6.662 21.595 1.00 10.00 C ATOM 1614 CD LYS A 108 7.553 5.176 21.468 1.00 10.00 C ATOM 1615 CE LYS A 108 8.751 4.384 20.929 1.00 10.00 C ATOM 1616 NZ LYS A 108 8.780 4.346 19.449 1.00 10.00 N ATOM 0 H LYS A 108 7.730 8.292 24.058 1.00 10.00 H new ATOM 0 HA LYS A 108 7.754 9.265 21.366 1.00 10.00 H new ATOM 0 HB2 LYS A 108 6.256 7.124 22.901 1.00 10.00 H new ATOM 0 HB3 LYS A 108 5.937 7.441 21.207 1.00 10.00 H new ATOM 0 HG2 LYS A 108 8.323 7.019 20.649 1.00 10.00 H new ATOM 0 HG3 LYS A 108 8.699 6.783 22.344 1.00 10.00 H new ATOM 0 HD2 LYS A 108 7.255 4.782 22.440 1.00 10.00 H new ATOM 0 HD3 LYS A 108 6.699 5.058 20.801 1.00 10.00 H new ATOM 0 HE2 LYS A 108 9.674 4.831 21.297 1.00 10.00 H new ATOM 0 HE3 LYS A 108 8.714 3.366 21.316 1.00 10.00 H new ATOM 0 HZ1 LYS A 108 9.750 4.520 19.116 1.00 10.00 H new ATOM 0 HZ2 LYS A 108 8.464 3.412 19.119 1.00 10.00 H new ATOM 0 HZ3 LYS A 108 8.147 5.079 19.070 1.00 10.00 H new ATOM 1630 N ILE A 109 5.081 10.012 23.170 1.00 10.00 N ATOM 1631 CA ILE A 109 3.964 10.948 23.260 1.00 10.00 C ATOM 1632 C ILE A 109 4.497 12.381 23.154 1.00 10.00 C ATOM 1633 O ILE A 109 3.901 13.163 22.428 1.00 10.00 O ATOM 1634 CB ILE A 109 3.149 10.699 24.555 1.00 10.00 C ATOM 1635 CG1 ILE A 109 2.476 9.304 24.508 1.00 10.00 C ATOM 1636 CG2 ILE A 109 2.055 11.767 24.773 1.00 10.00 C ATOM 1637 CD1 ILE A 109 2.006 8.809 25.883 1.00 10.00 C ATOM 0 H ILE A 109 5.180 9.415 23.991 1.00 10.00 H new ATOM 0 HA ILE A 109 3.273 10.791 22.431 1.00 10.00 H new ATOM 0 HB ILE A 109 3.855 10.754 25.384 1.00 10.00 H new ATOM 0 HG12 ILE A 109 1.622 9.343 23.832 1.00 10.00 H new ATOM 0 HG13 ILE A 109 3.179 8.583 24.091 1.00 10.00 H new ATOM 0 HG21 ILE A 109 1.512 11.549 25.693 1.00 10.00 H new ATOM 0 HG22 ILE A 109 2.517 12.751 24.849 1.00 10.00 H new ATOM 0 HG23 ILE A 109 1.363 11.756 23.931 1.00 10.00 H new ATOM 0 HD11 ILE A 109 1.544 7.827 25.778 1.00 10.00 H new ATOM 0 HD12 ILE A 109 2.861 8.738 26.556 1.00 10.00 H new ATOM 0 HD13 ILE A 109 1.279 9.510 26.293 1.00 10.00 H new ATOM 1649 N LYS A 110 5.604 12.713 23.827 1.00 10.00 N ATOM 1650 CA LYS A 110 6.214 14.040 23.771 1.00 10.00 C ATOM 1651 C LYS A 110 6.574 14.409 22.329 1.00 10.00 C ATOM 1652 O LYS A 110 6.375 15.547 21.938 1.00 10.00 O ATOM 1653 CB LYS A 110 7.439 14.060 24.702 1.00 10.00 C ATOM 1654 CG LYS A 110 8.134 15.425 24.792 1.00 10.00 C ATOM 1655 CD LYS A 110 9.400 15.365 25.663 1.00 10.00 C ATOM 1656 CE LYS A 110 9.091 15.115 27.147 1.00 10.00 C ATOM 1657 NZ LYS A 110 10.311 14.755 27.908 1.00 10.00 N ATOM 0 H LYS A 110 6.104 12.060 24.430 1.00 10.00 H new ATOM 0 HA LYS A 110 5.506 14.794 24.115 1.00 10.00 H new ATOM 0 HB2 LYS A 110 7.128 13.756 25.701 1.00 10.00 H new ATOM 0 HB3 LYS A 110 8.159 13.320 24.354 1.00 10.00 H new ATOM 0 HG2 LYS A 110 8.398 15.765 23.791 1.00 10.00 H new ATOM 0 HG3 LYS A 110 7.442 16.158 25.206 1.00 10.00 H new ATOM 0 HD2 LYS A 110 10.052 14.573 25.294 1.00 10.00 H new ATOM 0 HD3 LYS A 110 9.948 16.302 25.564 1.00 10.00 H new ATOM 0 HE2 LYS A 110 8.642 16.009 27.581 1.00 10.00 H new ATOM 0 HE3 LYS A 110 8.357 14.314 27.236 1.00 10.00 H new ATOM 0 HZ1 LYS A 110 10.066 14.610 28.908 1.00 10.00 H new ATOM 0 HZ2 LYS A 110 10.716 13.879 27.520 1.00 10.00 H new ATOM 0 HZ3 LYS A 110 11.008 15.523 27.830 1.00 10.00 H new ATOM 1671 N ALA A 111 7.118 13.469 21.549 1.00 10.00 N ATOM 1672 CA ALA A 111 7.415 13.704 20.146 1.00 10.00 C ATOM 1673 C ALA A 111 6.127 13.921 19.339 1.00 10.00 C ATOM 1674 O ALA A 111 6.090 14.778 18.466 1.00 10.00 O ATOM 1675 CB ALA A 111 8.227 12.527 19.583 1.00 10.00 C ATOM 0 H ALA A 111 7.360 12.534 21.876 1.00 10.00 H new ATOM 0 HA ALA A 111 8.010 14.613 20.061 1.00 10.00 H new ATOM 0 HB1 ALA A 111 8.447 12.707 18.531 1.00 10.00 H new ATOM 0 HB2 ALA A 111 9.160 12.430 20.138 1.00 10.00 H new ATOM 0 HB3 ALA A 111 7.650 11.607 19.680 1.00 10.00 H new ATOM 1681 N LYS A 112 5.091 13.105 19.567 1.00 10.00 N ATOM 1682 CA LYS A 112 3.856 13.146 18.786 1.00 10.00 C ATOM 1683 C LYS A 112 3.059 14.425 19.068 1.00 10.00 C ATOM 1684 O LYS A 112 2.554 15.044 18.131 1.00 10.00 O ATOM 1685 CB LYS A 112 3.029 11.881 19.108 1.00 10.00 C ATOM 1686 CG LYS A 112 1.749 11.722 18.263 1.00 10.00 C ATOM 1687 CD LYS A 112 2.047 11.372 16.795 1.00 10.00 C ATOM 1688 CE LYS A 112 0.783 10.970 16.014 1.00 10.00 C ATOM 1689 NZ LYS A 112 -0.164 12.096 15.811 1.00 10.00 N ATOM 0 H LYS A 112 5.089 12.397 20.301 1.00 10.00 H new ATOM 0 HA LYS A 112 4.097 13.160 17.723 1.00 10.00 H new ATOM 0 HB2 LYS A 112 3.658 11.003 18.960 1.00 10.00 H new ATOM 0 HB3 LYS A 112 2.753 11.901 20.162 1.00 10.00 H new ATOM 0 HG2 LYS A 112 1.125 10.942 18.699 1.00 10.00 H new ATOM 0 HG3 LYS A 112 1.175 12.648 18.302 1.00 10.00 H new ATOM 0 HD2 LYS A 112 2.513 12.229 16.308 1.00 10.00 H new ATOM 0 HD3 LYS A 112 2.767 10.555 16.759 1.00 10.00 H new ATOM 0 HE2 LYS A 112 1.076 10.571 15.043 1.00 10.00 H new ATOM 0 HE3 LYS A 112 0.274 10.168 16.548 1.00 10.00 H new ATOM 0 HZ1 LYS A 112 -0.993 11.761 15.280 1.00 10.00 H new ATOM 0 HZ2 LYS A 112 -0.470 12.463 16.735 1.00 10.00 H new ATOM 0 HZ3 LYS A 112 0.307 12.854 15.276 1.00 10.00 H new ATOM 1703 N TYR A 113 2.776 14.686 20.344 1.00 10.00 N ATOM 1704 CA TYR A 113 1.842 15.713 20.790 1.00 10.00 C ATOM 1705 C TYR A 113 2.411 17.123 20.522 1.00 10.00 C ATOM 1706 O TYR A 113 3.625 17.284 20.530 1.00 10.00 O ATOM 1707 CB TYR A 113 1.536 15.472 22.279 1.00 10.00 C ATOM 1708 CG TYR A 113 0.301 16.187 22.794 1.00 10.00 C ATOM 1709 CD1 TYR A 113 -0.971 15.841 22.299 1.00 10.00 C ATOM 1710 CD2 TYR A 113 0.419 17.193 23.769 1.00 10.00 C ATOM 1711 CE1 TYR A 113 -2.117 16.523 22.742 1.00 10.00 C ATOM 1712 CE2 TYR A 113 -0.723 17.879 24.223 1.00 10.00 C ATOM 1713 CZ TYR A 113 -1.994 17.555 23.702 1.00 10.00 C ATOM 1714 OH TYR A 113 -3.099 18.232 24.127 1.00 10.00 O ATOM 0 H TYR A 113 3.203 14.173 21.115 1.00 10.00 H new ATOM 0 HA TYR A 113 0.910 15.653 20.229 1.00 10.00 H new ATOM 0 HB2 TYR A 113 1.415 14.401 22.443 1.00 10.00 H new ATOM 0 HB3 TYR A 113 2.396 15.789 22.869 1.00 10.00 H new ATOM 0 HD1 TYR A 113 -1.066 15.046 21.574 1.00 10.00 H new ATOM 0 HD2 TYR A 113 1.390 17.440 24.171 1.00 10.00 H new ATOM 0 HE1 TYR A 113 -3.089 16.260 22.351 1.00 10.00 H new ATOM 0 HE2 TYR A 113 -0.627 18.653 24.970 1.00 10.00 H new ATOM 0 HH TYR A 113 -2.836 18.906 24.788 1.00 10.00 H new ATOM 1724 N PRO A 114 1.566 18.146 20.254 1.00 10.00 N ATOM 1725 CA PRO A 114 2.035 19.514 20.045 1.00 10.00 C ATOM 1726 C PRO A 114 2.798 20.099 21.245 1.00 10.00 C ATOM 1727 O PRO A 114 3.740 20.861 21.041 1.00 10.00 O ATOM 1728 CB PRO A 114 0.779 20.345 19.735 1.00 10.00 C ATOM 1729 CG PRO A 114 -0.205 19.315 19.186 1.00 10.00 C ATOM 1730 CD PRO A 114 0.137 18.067 19.994 1.00 10.00 C ATOM 0 HA PRO A 114 2.759 19.531 19.230 1.00 10.00 H new ATOM 0 HB2 PRO A 114 0.391 20.834 20.629 1.00 10.00 H new ATOM 0 HB3 PRO A 114 0.987 21.129 19.007 1.00 10.00 H new ATOM 0 HG2 PRO A 114 -1.240 19.623 19.334 1.00 10.00 H new ATOM 0 HG3 PRO A 114 -0.070 19.155 18.116 1.00 10.00 H new ATOM 0 HD2 PRO A 114 -0.429 18.036 20.925 1.00 10.00 H new ATOM 0 HD3 PRO A 114 -0.111 17.162 19.440 1.00 10.00 H new ATOM 1738 N ASP A 115 2.330 19.836 22.471 1.00 10.00 N ATOM 1739 CA ASP A 115 3.023 20.273 23.684 1.00 10.00 C ATOM 1740 C ASP A 115 4.098 19.256 24.072 1.00 10.00 C ATOM 1741 O ASP A 115 3.937 18.060 23.827 1.00 10.00 O ATOM 1742 CB ASP A 115 2.034 20.466 24.837 1.00 10.00 C ATOM 1743 CG ASP A 115 2.772 20.947 26.086 1.00 10.00 C ATOM 1744 OD1 ASP A 115 3.155 22.150 26.099 1.00 10.00 O ATOM 1745 OD2 ASP A 115 2.960 20.142 27.012 1.00 10.00 O ATOM 0 H ASP A 115 1.468 19.319 22.647 1.00 10.00 H new ATOM 0 HA ASP A 115 3.500 21.232 23.480 1.00 10.00 H new ATOM 0 HB2 ASP A 115 1.271 21.191 24.554 1.00 10.00 H new ATOM 0 HB3 ASP A 115 1.520 19.528 25.047 1.00 10.00 H new ATOM 1750 N TYR A 116 5.164 19.717 24.738 1.00 10.00 N ATOM 1751 CA TYR A 116 6.372 18.932 24.973 1.00 10.00 C ATOM 1752 C TYR A 116 6.568 18.556 26.450 1.00 10.00 C ATOM 1753 O TYR A 116 7.684 18.173 26.834 1.00 10.00 O ATOM 1754 CB TYR A 116 7.586 19.675 24.388 1.00 10.00 C ATOM 1755 CG TYR A 116 7.455 20.032 22.916 1.00 10.00 C ATOM 1756 CD1 TYR A 116 7.358 19.012 21.949 1.00 10.00 C ATOM 1757 CD2 TYR A 116 7.421 21.382 22.511 1.00 10.00 C ATOM 1758 CE1 TYR A 116 7.213 19.329 20.587 1.00 10.00 C ATOM 1759 CE2 TYR A 116 7.279 21.706 21.150 1.00 10.00 C ATOM 1760 CZ TYR A 116 7.162 20.683 20.184 1.00 10.00 C ATOM 1761 OH TYR A 116 7.046 21.009 18.866 1.00 10.00 O ATOM 0 H TYR A 116 5.208 20.657 25.131 1.00 10.00 H new ATOM 0 HA TYR A 116 6.263 17.978 24.457 1.00 10.00 H new ATOM 0 HB2 TYR A 116 7.746 20.590 24.958 1.00 10.00 H new ATOM 0 HB3 TYR A 116 8.474 19.057 24.522 1.00 10.00 H new ATOM 0 HD1 TYR A 116 7.395 17.977 22.257 1.00 10.00 H new ATOM 0 HD2 TYR A 116 7.504 22.168 23.247 1.00 10.00 H new ATOM 0 HE1 TYR A 116 7.141 18.541 19.852 1.00 10.00 H new ATOM 0 HE2 TYR A 116 7.259 22.741 20.843 1.00 10.00 H new ATOM 0 HH TYR A 116 7.025 21.984 18.771 1.00 10.00 H new ATOM 1771 N GLU A 117 5.527 18.623 27.287 1.00 10.00 N ATOM 1772 CA GLU A 117 5.578 18.113 28.654 1.00 10.00 C ATOM 1773 C GLU A 117 4.669 16.886 28.765 1.00 10.00 C ATOM 1774 O GLU A 117 3.461 16.921 28.547 1.00 10.00 O ATOM 1775 CB GLU A 117 5.226 19.202 29.682 1.00 10.00 C ATOM 1776 CG GLU A 117 5.509 18.701 31.110 1.00 10.00 C ATOM 1777 CD GLU A 117 5.106 19.694 32.208 1.00 10.00 C ATOM 1778 OE1 GLU A 117 5.623 20.826 32.198 1.00 10.00 O ATOM 1779 OE2 GLU A 117 4.369 19.212 33.114 1.00 10.00 O ATOM 0 H GLU A 117 4.628 19.033 27.033 1.00 10.00 H new ATOM 0 HA GLU A 117 6.598 17.809 28.887 1.00 10.00 H new ATOM 0 HB2 GLU A 117 5.809 20.101 29.483 1.00 10.00 H new ATOM 0 HB3 GLU A 117 4.175 19.475 29.587 1.00 10.00 H new ATOM 0 HG2 GLU A 117 4.976 17.763 31.268 1.00 10.00 H new ATOM 0 HG3 GLU A 117 6.573 18.483 31.204 1.00 10.00 H new ATOM 1786 N VAL A 118 5.268 15.756 29.156 1.00 10.00 N ATOM 1787 CA VAL A 118 4.570 14.534 29.514 1.00 10.00 C ATOM 1788 C VAL A 118 5.289 14.003 30.757 1.00 10.00 C ATOM 1789 O VAL A 118 6.519 14.072 30.820 1.00 10.00 O ATOM 1790 CB VAL A 118 4.594 13.511 28.351 1.00 10.00 C ATOM 1791 CG1 VAL A 118 3.615 12.357 28.624 1.00 10.00 C ATOM 1792 CG2 VAL A 118 4.251 14.126 26.985 1.00 10.00 C ATOM 0 H VAL A 118 6.282 15.673 29.232 1.00 10.00 H new ATOM 0 HA VAL A 118 3.514 14.715 29.717 1.00 10.00 H new ATOM 0 HB VAL A 118 5.620 13.147 28.305 1.00 10.00 H new ATOM 0 HG11 VAL A 118 3.647 11.649 27.796 1.00 10.00 H new ATOM 0 HG12 VAL A 118 3.899 11.849 29.546 1.00 10.00 H new ATOM 0 HG13 VAL A 118 2.604 12.753 28.724 1.00 10.00 H new ATOM 0 HG21 VAL A 118 4.287 13.352 26.218 1.00 10.00 H new ATOM 0 HG22 VAL A 118 3.250 14.555 27.020 1.00 10.00 H new ATOM 0 HG23 VAL A 118 4.973 14.907 26.746 1.00 10.00 H new ATOM 1802 N THR A 119 4.563 13.448 31.725 1.00 10.00 N ATOM 1803 CA THR A 119 5.151 12.749 32.867 1.00 10.00 C ATOM 1804 C THR A 119 4.429 11.423 33.083 1.00 10.00 C ATOM 1805 O THR A 119 3.408 11.169 32.444 1.00 10.00 O ATOM 1806 CB THR A 119 5.125 13.636 34.127 1.00 10.00 C ATOM 1807 OG1 THR A 119 3.831 14.138 34.433 1.00 10.00 O ATOM 1808 CG2 THR A 119 6.053 14.841 33.988 1.00 10.00 C ATOM 0 H THR A 119 3.543 13.470 31.740 1.00 10.00 H new ATOM 0 HA THR A 119 6.199 12.533 32.658 1.00 10.00 H new ATOM 0 HB THR A 119 5.457 12.979 34.931 1.00 10.00 H new ATOM 0 HG1 THR A 119 3.226 13.390 34.619 1.00 10.00 H new ATOM 0 HG21 THR A 119 6.007 15.442 34.896 1.00 10.00 H new ATOM 0 HG22 THR A 119 7.075 14.497 33.832 1.00 10.00 H new ATOM 0 HG23 THR A 119 5.740 15.445 33.137 1.00 10.00 H new ATOM 1816 N TRP A 120 4.925 10.596 34.001 1.00 10.00 N ATOM 1817 CA TRP A 120 4.263 9.358 34.376 1.00 10.00 C ATOM 1818 C TRP A 120 4.451 9.065 35.857 1.00 10.00 C ATOM 1819 O TRP A 120 5.315 9.654 36.507 1.00 10.00 O ATOM 1820 CB TRP A 120 4.751 8.191 33.502 1.00 10.00 C ATOM 1821 CG TRP A 120 6.193 7.805 33.637 1.00 10.00 C ATOM 1822 CD1 TRP A 120 7.228 8.364 32.968 1.00 10.00 C ATOM 1823 CD2 TRP A 120 6.783 6.766 34.479 1.00 10.00 C ATOM 1824 NE1 TRP A 120 8.410 7.768 33.356 1.00 10.00 N ATOM 1825 CE2 TRP A 120 8.196 6.769 34.282 1.00 10.00 C ATOM 1826 CE3 TRP A 120 6.265 5.802 35.372 1.00 10.00 C ATOM 1827 CZ2 TRP A 120 9.049 5.875 34.946 1.00 10.00 C ATOM 1828 CZ3 TRP A 120 7.112 4.901 36.047 1.00 10.00 C ATOM 1829 CH2 TRP A 120 8.502 4.937 35.838 1.00 10.00 C ATOM 0 H TRP A 120 5.796 10.769 34.503 1.00 10.00 H new ATOM 0 HA TRP A 120 3.194 9.477 34.201 1.00 10.00 H new ATOM 0 HB2 TRP A 120 4.142 7.317 33.731 1.00 10.00 H new ATOM 0 HB3 TRP A 120 4.563 8.446 32.459 1.00 10.00 H new ATOM 0 HD1 TRP A 120 7.142 9.157 32.240 1.00 10.00 H new ATOM 0 HE1 TRP A 120 9.329 8.034 33.002 1.00 10.00 H new ATOM 0 HE3 TRP A 120 5.199 5.755 35.541 1.00 10.00 H new ATOM 0 HZ2 TRP A 120 10.115 5.907 34.774 1.00 10.00 H new ATOM 0 HZ3 TRP A 120 6.691 4.178 36.730 1.00 10.00 H new ATOM 0 HH2 TRP A 120 9.147 4.246 36.361 1.00 10.00 H new ATOM 1840 N ALA A 121 3.649 8.134 36.377 1.00 10.00 N ATOM 1841 CA ALA A 121 3.746 7.564 37.713 1.00 10.00 C ATOM 1842 C ALA A 121 3.271 6.109 37.653 1.00 10.00 C ATOM 1843 O ALA A 121 2.617 5.708 36.694 1.00 10.00 O ATOM 1844 CB ALA A 121 2.879 8.375 38.685 1.00 10.00 C ATOM 0 H ALA A 121 2.874 7.739 35.845 1.00 10.00 H new ATOM 0 HA ALA A 121 4.776 7.597 38.067 1.00 10.00 H new ATOM 0 HB1 ALA A 121 2.954 7.946 39.684 1.00 10.00 H new ATOM 0 HB2 ALA A 121 3.226 9.408 38.707 1.00 10.00 H new ATOM 0 HB3 ALA A 121 1.840 8.348 38.355 1.00 10.00 H new ATOM 1850 N ASN A 122 3.592 5.307 38.667 1.00 10.00 N ATOM 1851 CA ASN A 122 3.178 3.904 38.767 1.00 10.00 C ATOM 1852 C ASN A 122 3.022 3.528 40.247 1.00 10.00 C ATOM 1853 O ASN A 122 3.383 2.437 40.656 1.00 10.00 O ATOM 1854 CB ASN A 122 4.177 3.008 38.007 1.00 10.00 C ATOM 1855 CG ASN A 122 3.760 1.538 37.968 1.00 10.00 C ATOM 1856 OD1 ASN A 122 4.491 0.659 38.391 1.00 10.00 O ATOM 1857 ND2 ASN A 122 2.604 1.212 37.409 1.00 10.00 N ATOM 0 H ASN A 122 4.157 5.617 39.457 1.00 10.00 H new ATOM 0 HA ASN A 122 2.208 3.751 38.295 1.00 10.00 H new ATOM 0 HB2 ASN A 122 4.282 3.376 36.986 1.00 10.00 H new ATOM 0 HB3 ASN A 122 5.157 3.088 38.477 1.00 10.00 H new ATOM 0 HD21 ASN A 122 2.332 0.232 37.335 1.00 10.00 H new ATOM 0 HD22 ASN A 122 1.986 1.941 37.052 1.00 10.00 H new ATOM 1864 N ASP A 123 2.568 4.484 41.068 1.00 10.00 N ATOM 1865 CA ASP A 123 2.439 4.326 42.531 1.00 10.00 C ATOM 1866 C ASP A 123 1.460 3.208 42.927 1.00 10.00 C ATOM 1867 O ASP A 123 1.618 2.564 43.957 1.00 10.00 O ATOM 1868 CB ASP A 123 1.983 5.654 43.146 1.00 10.00 C ATOM 1869 CG ASP A 123 1.793 5.542 44.668 1.00 10.00 C ATOM 1870 OD1 ASP A 123 2.838 5.504 45.355 1.00 10.00 O ATOM 1871 OD2 ASP A 123 0.620 5.593 45.097 1.00 10.00 O ATOM 0 H ASP A 123 2.275 5.402 40.735 1.00 10.00 H new ATOM 0 HA ASP A 123 3.419 4.041 42.915 1.00 10.00 H new ATOM 0 HB2 ASP A 123 2.719 6.428 42.927 1.00 10.00 H new ATOM 0 HB3 ASP A 123 1.046 5.966 42.684 1.00 10.00 H new ATOM 1876 N GLY A 124 0.482 2.929 42.060 1.00 10.00 N ATOM 1877 CA GLY A 124 -0.519 1.893 42.229 1.00 10.00 C ATOM 1878 C GLY A 124 -1.375 1.822 40.967 1.00 10.00 C ATOM 1879 O GLY A 124 -1.084 2.506 39.974 1.00 10.00 O ATOM 0 H GLY A 124 0.369 3.445 41.188 1.00 10.00 H new ATOM 0 HA2 GLY A 124 -0.039 0.932 42.414 1.00 10.00 H new ATOM 0 HA3 GLY A 124 -1.143 2.110 43.096 1.00 10.00 H new ATOM 1883 N TYR A 125 -2.384 0.943 40.976 1.00 10.00 N ATOM 1884 CA TYR A 125 -3.377 0.902 39.907 1.00 10.00 C ATOM 1885 C TYR A 125 -4.143 2.225 39.878 1.00 10.00 C ATOM 1886 O TYR A 125 -4.516 2.710 40.962 1.00 10.00 O ATOM 1887 CB TYR A 125 -4.323 -0.299 40.068 1.00 10.00 C ATOM 1888 CG TYR A 125 -5.298 -0.434 38.910 1.00 10.00 C ATOM 1889 CD1 TYR A 125 -4.865 -0.973 37.683 1.00 10.00 C ATOM 1890 CD2 TYR A 125 -6.620 0.034 39.038 1.00 10.00 C ATOM 1891 CE1 TYR A 125 -5.749 -1.046 36.590 1.00 10.00 C ATOM 1892 CE2 TYR A 125 -7.507 -0.035 37.947 1.00 10.00 C ATOM 1893 CZ TYR A 125 -7.076 -0.574 36.719 1.00 10.00 C ATOM 1894 OH TYR A 125 -7.925 -0.600 35.646 1.00 10.00 O ATOM 1895 OXT TYR A 125 -4.378 2.713 38.742 1.00 10.00 O ATOM 0 H TYR A 125 -2.531 0.253 41.713 1.00 10.00 H new ATOM 0 HA TYR A 125 -2.868 0.771 38.952 1.00 10.00 H new ATOM 0 HB2 TYR A 125 -3.734 -1.212 40.151 1.00 10.00 H new ATOM 0 HB3 TYR A 125 -4.882 -0.195 40.998 1.00 10.00 H new ATOM 0 HD1 TYR A 125 -3.851 -1.331 37.580 1.00 10.00 H new ATOM 0 HD2 TYR A 125 -6.955 0.448 39.978 1.00 10.00 H new ATOM 0 HE1 TYR A 125 -5.414 -1.463 35.652 1.00 10.00 H new ATOM 0 HE2 TYR A 125 -8.520 0.326 38.052 1.00 10.00 H new ATOM 0 HH TYR A 125 -8.797 -0.240 35.910 1.00 10.00 H new TER 1905 TYR A 125