USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 927 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 54 ASN : amide:sc= -0.225! K(o=0.12!,f=1.2) USER MOD Set 1.2: B 59 SER OG : rot -149:sc= 0.345 USER MOD Set 2.1: A 20 TYR OH : rot -110:sc= 1.65 USER MOD Set 2.2: B 97 LYS NZ :NH3+ -139:sc= 1.2 (180deg=-0.418) USER MOD Single : A 1 GLY N :NH3+ -110:sc= 0.114 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.0193 X(o=-0.019,f=-0.0032) USER MOD Single : A 4 MET CE :methyl 164:sc=-0.00286 (180deg=-0.235) USER MOD Single : A 5 SER OG : rot 28:sc= 0.0953 USER MOD Single : A 7 GLN : amide:sc= -1.38! C(o=-1.4!,f=-1.6!) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : B 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 27 GLN : amide:sc= -0.627 X(o=-0.63,f=-0.76) USER MOD Single : B 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 34 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 LYS NZ :NH3+ 134:sc= 1.31 (180deg=0.578) USER MOD Single : B 38 MET CE :methyl -131:sc= -0.0926 (180deg=-2.59!) USER MOD Single : B 39 LYS NZ :NH3+ 164:sc= 1.04 (180deg=0.842) USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 TYR OH : rot -15:sc= 0 USER MOD Single : B 47 LYS NZ :NH3+ -174:sc= 1.89 (180deg=1.51) USER MOD Single : B 55 LYS NZ :NH3+ -146:sc= 1.26 (180deg=0.604) USER MOD Single : B 58 ASN : amide:sc= -0.42 X(o=-0.42,f=-0.13) USER MOD Single : B 60 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0615) USER MOD Single : B 65 SER OG : rot 180:sc= 0 USER MOD Single : B 67 SER OG : rot -55:sc= 1.11 USER MOD Single : B 68 TYR OH : rot 140:sc= 0.0456 USER MOD Single : B 69 ASN : amide:sc= -1.98 K(o=-2,f=-0.45) USER MOD Single : B 73 ASN : amide:sc= -2.01 X(o=-2,f=-1.6) USER MOD Single : B 76 TYR OH : rot 65:sc= 0.761 USER MOD Single : B 78 ASN : amide:sc= 0.127 K(o=0.13,f=-2.6!) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 82 SER OG : rot 180:sc= 0 USER MOD Single : B 92 ASN : amide:sc= -2.7! C(o=-2.7!,f=-1.4!) USER MOD Single : B 100 HIS : no HD1:sc= -2.04! K(o=-2!,f=-1.3) USER MOD Single : B 103 LYS NZ :NH3+ -179:sc= 1.17 (180deg=1.15) USER MOD Single : B 106 THR OG1 : rot 40:sc= 0.624 USER MOD Single : B 108 TYR OH : rot 37:sc= 1.24 USER MOD Single : B 110 TYR OH : rot 180:sc= 0.834 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.234 24.210 -0.965 1.00 0.00 N ATOM 2 CA GLY A 1 12.919 22.956 -1.355 1.00 0.00 C ATOM 3 C GLY A 1 12.348 22.377 -2.629 1.00 0.00 C ATOM 4 O GLY A 1 11.353 22.890 -3.148 1.00 0.00 O ATOM 0 H1 GLY A 1 12.880 25.014 -1.098 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.389 24.343 -1.557 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.951 24.155 0.034 1.00 0.00 H new ATOM 0 HA2 GLY A 1 13.983 23.150 -1.489 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.827 22.226 -0.551 1.00 0.00 H new ATOM 10 N PRO A 2 12.956 21.308 -3.163 1.00 0.00 N ATOM 11 CA PRO A 2 12.481 20.651 -4.383 1.00 0.00 C ATOM 12 C PRO A 2 11.096 20.033 -4.204 1.00 0.00 C ATOM 13 O PRO A 2 10.617 19.867 -3.080 1.00 0.00 O ATOM 14 CB PRO A 2 13.526 19.560 -4.642 1.00 0.00 C ATOM 15 CG PRO A 2 14.184 19.334 -3.327 1.00 0.00 C ATOM 16 CD PRO A 2 14.164 20.661 -2.626 1.00 0.00 C ATOM 0 HA PRO A 2 12.376 21.356 -5.208 1.00 0.00 H new ATOM 0 HB2 PRO A 2 13.059 18.647 -5.011 1.00 0.00 H new ATOM 0 HB3 PRO A 2 14.248 19.876 -5.395 1.00 0.00 H new ATOM 0 HG2 PRO A 2 13.653 18.578 -2.749 1.00 0.00 H new ATOM 0 HG3 PRO A 2 15.205 18.976 -3.457 1.00 0.00 H new ATOM 0 HD2 PRO A 2 14.110 20.544 -1.544 1.00 0.00 H new ATOM 0 HD3 PRO A 2 15.061 21.243 -2.840 1.00 0.00 H new ATOM 24 N HIS A 3 10.455 19.705 -5.312 1.00 0.00 N ATOM 25 CA HIS A 3 9.134 19.102 -5.276 1.00 0.00 C ATOM 26 C HIS A 3 9.153 17.785 -6.043 1.00 0.00 C ATOM 27 O HIS A 3 8.483 17.629 -7.063 1.00 0.00 O ATOM 28 CB HIS A 3 8.103 20.067 -5.875 1.00 0.00 C ATOM 29 CG HIS A 3 6.684 19.718 -5.554 1.00 0.00 C ATOM 30 ND1 HIS A 3 5.691 19.647 -6.503 1.00 0.00 N ATOM 31 CD2 HIS A 3 6.086 19.448 -4.370 1.00 0.00 C ATOM 32 CE1 HIS A 3 4.546 19.352 -5.919 1.00 0.00 C ATOM 33 NE2 HIS A 3 4.757 19.225 -4.622 1.00 0.00 N ATOM 0 H HIS A 3 10.829 19.847 -6.250 1.00 0.00 H new ATOM 0 HA HIS A 3 8.853 18.899 -4.243 1.00 0.00 H new ATOM 0 HB2 HIS A 3 8.310 21.074 -5.512 1.00 0.00 H new ATOM 0 HB3 HIS A 3 8.225 20.087 -6.958 1.00 0.00 H new ATOM 0 HD2 HIS A 3 6.568 19.414 -3.404 1.00 0.00 H new ATOM 0 HE1 HIS A 3 3.595 19.234 -6.418 1.00 0.00 H new ATOM 0 HE2 HIS A 3 4.049 18.999 -3.924 1.00 0.00 H new ATOM 42 N MET A 4 9.942 16.843 -5.546 1.00 0.00 N ATOM 43 CA MET A 4 10.123 15.565 -6.216 1.00 0.00 C ATOM 44 C MET A 4 8.994 14.602 -5.906 1.00 0.00 C ATOM 45 O MET A 4 8.547 14.481 -4.761 1.00 0.00 O ATOM 46 CB MET A 4 11.460 14.935 -5.832 1.00 0.00 C ATOM 47 CG MET A 4 12.641 15.560 -6.543 1.00 0.00 C ATOM 48 SD MET A 4 14.229 15.026 -5.871 1.00 0.00 S ATOM 49 CE MET A 4 14.187 13.272 -6.235 1.00 0.00 C ATOM 0 H MET A 4 10.468 16.941 -4.678 1.00 0.00 H new ATOM 0 HA MET A 4 10.116 15.763 -7.288 1.00 0.00 H new ATOM 0 HB2 MET A 4 11.602 15.028 -4.755 1.00 0.00 H new ATOM 0 HB3 MET A 4 11.430 13.869 -6.059 1.00 0.00 H new ATOM 0 HG2 MET A 4 12.597 15.306 -7.602 1.00 0.00 H new ATOM 0 HG3 MET A 4 12.569 16.645 -6.472 1.00 0.00 H new ATOM 0 HE1 MET A 4 15.191 12.858 -6.145 1.00 0.00 H new ATOM 0 HE2 MET A 4 13.523 12.770 -5.531 1.00 0.00 H new ATOM 0 HE3 MET A 4 13.821 13.120 -7.250 1.00 0.00 H new ATOM 59 N SER A 5 8.552 13.919 -6.942 1.00 0.00 N ATOM 60 CA SER A 5 7.499 12.925 -6.831 1.00 0.00 C ATOM 61 C SER A 5 7.564 11.965 -8.007 1.00 0.00 C ATOM 62 O SER A 5 7.583 12.389 -9.162 1.00 0.00 O ATOM 63 CB SER A 5 6.127 13.601 -6.770 1.00 0.00 C ATOM 64 OG SER A 5 5.961 14.515 -7.844 1.00 0.00 O ATOM 0 H SER A 5 8.913 14.037 -7.889 1.00 0.00 H new ATOM 0 HA SER A 5 7.645 12.363 -5.909 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.343 12.845 -6.807 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.018 14.126 -5.821 1.00 0.00 H new ATOM 0 HG SER A 5 6.506 14.227 -8.606 1.00 0.00 H new ATOM 70 N VAL A 6 7.607 10.680 -7.712 1.00 0.00 N ATOM 71 CA VAL A 6 7.711 9.659 -8.741 1.00 0.00 C ATOM 72 C VAL A 6 6.571 8.660 -8.622 1.00 0.00 C ATOM 73 O VAL A 6 6.171 8.282 -7.523 1.00 0.00 O ATOM 74 CB VAL A 6 9.058 8.911 -8.669 1.00 0.00 C ATOM 75 CG1 VAL A 6 10.200 9.823 -9.082 1.00 0.00 C ATOM 76 CG2 VAL A 6 9.292 8.359 -7.271 1.00 0.00 C ATOM 0 H VAL A 6 7.571 10.315 -6.760 1.00 0.00 H new ATOM 0 HA VAL A 6 7.651 10.167 -9.704 1.00 0.00 H new ATOM 0 HB VAL A 6 9.020 8.073 -9.365 1.00 0.00 H new ATOM 0 HG11 VAL A 6 11.141 9.276 -9.024 1.00 0.00 H new ATOM 0 HG12 VAL A 6 10.041 10.165 -10.105 1.00 0.00 H new ATOM 0 HG13 VAL A 6 10.239 10.683 -8.414 1.00 0.00 H new ATOM 0 HG21 VAL A 6 10.247 7.835 -7.242 1.00 0.00 H new ATOM 0 HG22 VAL A 6 9.306 9.179 -6.554 1.00 0.00 H new ATOM 0 HG23 VAL A 6 8.490 7.666 -7.014 1.00 0.00 H new ATOM 86 N GLN A 7 6.047 8.237 -9.756 1.00 0.00 N ATOM 87 CA GLN A 7 4.934 7.302 -9.774 1.00 0.00 C ATOM 88 C GLN A 7 5.445 5.874 -9.620 1.00 0.00 C ATOM 89 O GLN A 7 6.437 5.488 -10.241 1.00 0.00 O ATOM 90 CB GLN A 7 4.115 7.445 -11.068 1.00 0.00 C ATOM 91 CG GLN A 7 4.801 6.918 -12.327 1.00 0.00 C ATOM 92 CD GLN A 7 6.027 7.719 -12.738 1.00 0.00 C ATOM 93 OE1 GLN A 7 5.924 8.702 -13.465 1.00 0.00 O ATOM 94 NE2 GLN A 7 7.196 7.293 -12.285 1.00 0.00 N ATOM 0 H GLN A 7 6.373 8.525 -10.679 1.00 0.00 H new ATOM 0 HA GLN A 7 4.278 7.533 -8.934 1.00 0.00 H new ATOM 0 HB2 GLN A 7 3.168 6.920 -10.941 1.00 0.00 H new ATOM 0 HB3 GLN A 7 3.878 8.499 -11.216 1.00 0.00 H new ATOM 0 HG2 GLN A 7 5.094 5.881 -12.163 1.00 0.00 H new ATOM 0 HG3 GLN A 7 4.084 6.921 -13.148 1.00 0.00 H new ATOM 0 HE21 GLN A 7 7.241 6.471 -11.682 1.00 0.00 H new ATOM 0 HE22 GLN A 7 8.052 7.787 -12.539 1.00 0.00 H new ATOM 103 N ILE A 8 4.790 5.097 -8.773 1.00 0.00 N ATOM 104 CA ILE A 8 5.187 3.721 -8.558 1.00 0.00 C ATOM 105 C ILE A 8 4.117 2.792 -9.108 1.00 0.00 C ATOM 106 O ILE A 8 2.989 2.785 -8.617 1.00 0.00 O ATOM 107 CB ILE A 8 5.387 3.393 -7.062 1.00 0.00 C ATOM 108 CG1 ILE A 8 5.957 4.590 -6.294 1.00 0.00 C ATOM 109 CG2 ILE A 8 6.311 2.191 -6.918 1.00 0.00 C ATOM 110 CD1 ILE A 8 7.337 5.009 -6.740 1.00 0.00 C ATOM 0 H ILE A 8 3.983 5.397 -8.226 1.00 0.00 H new ATOM 0 HA ILE A 8 6.138 3.579 -9.072 1.00 0.00 H new ATOM 0 HB ILE A 8 4.412 3.158 -6.634 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.279 5.436 -6.406 1.00 0.00 H new ATOM 0 HG13 ILE A 8 5.989 4.345 -5.232 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.449 1.963 -5.861 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.869 1.330 -7.420 1.00 0.00 H new ATOM 0 HG23 ILE A 8 7.277 2.418 -7.370 1.00 0.00 H new ATOM 0 HD11 ILE A 8 7.668 5.862 -6.147 1.00 0.00 H new ATOM 0 HD12 ILE A 8 8.031 4.180 -6.602 1.00 0.00 H new ATOM 0 HD13 ILE A 8 7.310 5.288 -7.793 1.00 0.00 H new ATOM 122 N PRO A 9 4.433 2.021 -10.151 1.00 0.00 N ATOM 123 CA PRO A 9 3.504 1.039 -10.690 1.00 0.00 C ATOM 124 C PRO A 9 3.347 -0.143 -9.744 1.00 0.00 C ATOM 125 O PRO A 9 4.330 -0.655 -9.198 1.00 0.00 O ATOM 126 CB PRO A 9 4.139 0.593 -12.011 1.00 0.00 C ATOM 127 CG PRO A 9 5.309 1.499 -12.235 1.00 0.00 C ATOM 128 CD PRO A 9 5.701 2.036 -10.888 1.00 0.00 C ATOM 0 HA PRO A 9 2.505 1.452 -10.826 1.00 0.00 H new ATOM 0 HB2 PRO A 9 4.457 -0.448 -11.959 1.00 0.00 H new ATOM 0 HB3 PRO A 9 3.425 0.668 -12.831 1.00 0.00 H new ATOM 0 HG2 PRO A 9 6.137 0.957 -12.692 1.00 0.00 H new ATOM 0 HG3 PRO A 9 5.046 2.310 -12.914 1.00 0.00 H new ATOM 0 HD2 PRO A 9 6.455 1.413 -10.408 1.00 0.00 H new ATOM 0 HD3 PRO A 9 6.116 3.041 -10.958 1.00 0.00 H new ATOM 136 N VAL A 10 2.117 -0.567 -9.548 1.00 0.00 N ATOM 137 CA VAL A 10 1.816 -1.648 -8.628 1.00 0.00 C ATOM 138 C VAL A 10 1.608 -2.955 -9.381 1.00 0.00 C ATOM 139 O VAL A 10 0.836 -3.016 -10.340 1.00 0.00 O ATOM 140 CB VAL A 10 0.572 -1.324 -7.758 1.00 0.00 C ATOM 141 CG1 VAL A 10 -0.528 -0.685 -8.590 1.00 0.00 C ATOM 142 CG2 VAL A 10 0.048 -2.572 -7.059 1.00 0.00 C ATOM 0 H VAL A 10 1.300 -0.176 -10.018 1.00 0.00 H new ATOM 0 HA VAL A 10 2.672 -1.760 -7.962 1.00 0.00 H new ATOM 0 HB VAL A 10 0.885 -0.610 -6.996 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.387 -0.469 -7.954 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -0.160 0.242 -9.029 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -0.828 -1.369 -9.384 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -0.823 -2.313 -6.457 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.234 -3.315 -7.805 1.00 0.00 H new ATOM 0 HG23 VAL A 10 0.826 -2.981 -6.414 1.00 0.00 H new ATOM 152 N VAL A 11 2.310 -3.991 -8.950 1.00 0.00 N ATOM 153 CA VAL A 11 2.192 -5.295 -9.569 1.00 0.00 C ATOM 154 C VAL A 11 1.051 -6.069 -8.925 1.00 0.00 C ATOM 155 O VAL A 11 1.113 -6.410 -7.743 1.00 0.00 O ATOM 156 CB VAL A 11 3.501 -6.103 -9.432 1.00 0.00 C ATOM 157 CG1 VAL A 11 3.387 -7.437 -10.149 1.00 0.00 C ATOM 158 CG2 VAL A 11 4.684 -5.310 -9.962 1.00 0.00 C ATOM 0 H VAL A 11 2.968 -3.950 -8.172 1.00 0.00 H new ATOM 0 HA VAL A 11 1.990 -5.147 -10.630 1.00 0.00 H new ATOM 0 HB VAL A 11 3.669 -6.297 -8.373 1.00 0.00 H new ATOM 0 HG11 VAL A 11 4.320 -7.990 -10.040 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.570 -8.014 -9.716 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.189 -7.266 -11.207 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.595 -5.900 -9.855 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.524 -5.078 -11.015 1.00 0.00 H new ATOM 0 HG23 VAL A 11 4.783 -4.383 -9.397 1.00 0.00 H new ATOM 168 N GLU A 12 -0.002 -6.311 -9.685 1.00 0.00 N ATOM 169 CA GLU A 12 -1.138 -7.056 -9.176 1.00 0.00 C ATOM 170 C GLU A 12 -0.975 -8.536 -9.481 1.00 0.00 C ATOM 171 O GLU A 12 -1.102 -8.974 -10.625 1.00 0.00 O ATOM 172 CB GLU A 12 -2.447 -6.513 -9.745 1.00 0.00 C ATOM 173 CG GLU A 12 -2.721 -5.079 -9.326 1.00 0.00 C ATOM 174 CD GLU A 12 -4.122 -4.621 -9.666 1.00 0.00 C ATOM 175 OE1 GLU A 12 -5.044 -4.887 -8.868 1.00 0.00 O ATOM 176 OE2 GLU A 12 -4.315 -3.990 -10.724 1.00 0.00 O ATOM 0 H GLU A 12 -0.094 -6.004 -10.653 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.177 -6.933 -8.094 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -2.416 -6.569 -10.833 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -3.271 -7.146 -9.417 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -2.564 -4.984 -8.251 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -2.001 -4.420 -9.812 1.00 0.00 H new ATOM 183 N VAL A 13 -0.674 -9.290 -8.441 1.00 0.00 N ATOM 184 CA VAL A 13 -0.387 -10.712 -8.565 1.00 0.00 C ATOM 185 C VAL A 13 -1.215 -11.525 -7.582 1.00 0.00 C ATOM 186 O VAL A 13 -2.097 -10.987 -6.908 1.00 0.00 O ATOM 187 CB VAL A 13 1.109 -11.010 -8.330 1.00 0.00 C ATOM 188 CG1 VAL A 13 1.918 -10.719 -9.581 1.00 0.00 C ATOM 189 CG2 VAL A 13 1.634 -10.200 -7.152 1.00 0.00 C ATOM 0 H VAL A 13 -0.621 -8.937 -7.485 1.00 0.00 H new ATOM 0 HA VAL A 13 -0.649 -10.999 -9.583 1.00 0.00 H new ATOM 0 HB VAL A 13 1.215 -12.069 -8.096 1.00 0.00 H new ATOM 0 HG11 VAL A 13 2.970 -10.936 -9.393 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.559 -11.343 -10.400 1.00 0.00 H new ATOM 0 HG13 VAL A 13 1.807 -9.669 -9.850 1.00 0.00 H new ATOM 0 HG21 VAL A 13 2.690 -10.422 -7.000 1.00 0.00 H new ATOM 0 HG22 VAL A 13 1.513 -9.137 -7.359 1.00 0.00 H new ATOM 0 HG23 VAL A 13 1.075 -10.461 -6.253 1.00 0.00 H new ATOM 199 N ASP A 14 -0.926 -12.815 -7.500 1.00 0.00 N ATOM 200 CA ASP A 14 -1.636 -13.704 -6.597 1.00 0.00 C ATOM 201 C ASP A 14 -0.838 -13.871 -5.309 1.00 0.00 C ATOM 202 O ASP A 14 -1.402 -14.062 -4.230 1.00 0.00 O ATOM 203 CB ASP A 14 -1.853 -15.061 -7.274 1.00 0.00 C ATOM 204 CG ASP A 14 -2.794 -15.964 -6.506 1.00 0.00 C ATOM 205 OD1 ASP A 14 -4.016 -15.905 -6.756 1.00 0.00 O ATOM 206 OD2 ASP A 14 -2.322 -16.750 -5.661 1.00 0.00 O ATOM 0 H ASP A 14 -0.200 -13.270 -8.052 1.00 0.00 H new ATOM 0 HA ASP A 14 -2.608 -13.276 -6.353 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -2.250 -14.901 -8.276 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -0.891 -15.561 -7.388 1.00 0.00 H new ATOM 211 N GLU A 15 0.483 -13.773 -5.442 1.00 0.00 N ATOM 212 CA GLU A 15 1.404 -13.917 -4.324 1.00 0.00 C ATOM 213 C GLU A 15 2.641 -13.078 -4.554 1.00 0.00 C ATOM 214 O GLU A 15 2.898 -12.618 -5.668 1.00 0.00 O ATOM 215 CB GLU A 15 1.848 -15.365 -4.168 1.00 0.00 C ATOM 216 CG GLU A 15 0.731 -16.307 -3.809 1.00 0.00 C ATOM 217 CD GLU A 15 1.205 -17.735 -3.679 1.00 0.00 C ATOM 218 OE1 GLU A 15 1.659 -18.119 -2.578 1.00 0.00 O ATOM 219 OE2 GLU A 15 1.131 -18.482 -4.675 1.00 0.00 O ATOM 0 H GLU A 15 0.944 -13.591 -6.334 1.00 0.00 H new ATOM 0 HA GLU A 15 0.880 -13.590 -3.426 1.00 0.00 H new ATOM 0 HB2 GLU A 15 2.306 -15.697 -5.100 1.00 0.00 H new ATOM 0 HB3 GLU A 15 2.618 -15.418 -3.398 1.00 0.00 H new ATOM 0 HG2 GLU A 15 0.279 -15.990 -2.869 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.046 -16.252 -4.571 1.00 0.00 H new ATOM 226 N LEU A 16 3.413 -12.896 -3.504 1.00 0.00 N ATOM 227 CA LEU A 16 4.688 -12.226 -3.611 1.00 0.00 C ATOM 228 C LEU A 16 5.742 -13.185 -4.139 1.00 0.00 C ATOM 229 O LEU A 16 5.738 -14.371 -3.805 1.00 0.00 O ATOM 230 CB LEU A 16 5.140 -11.677 -2.258 1.00 0.00 C ATOM 231 CG LEU A 16 4.289 -10.553 -1.669 1.00 0.00 C ATOM 232 CD1 LEU A 16 3.982 -9.505 -2.716 1.00 0.00 C ATOM 233 CD2 LEU A 16 3.011 -11.090 -1.069 1.00 0.00 C ATOM 0 H LEU A 16 3.176 -13.206 -2.561 1.00 0.00 H new ATOM 0 HA LEU A 16 4.567 -11.393 -4.304 1.00 0.00 H new ATOM 0 HB2 LEU A 16 5.162 -12.500 -1.544 1.00 0.00 H new ATOM 0 HB3 LEU A 16 6.163 -11.315 -2.359 1.00 0.00 H new ATOM 0 HG LEU A 16 4.866 -10.086 -0.871 1.00 0.00 H new ATOM 0 HD11 LEU A 16 3.375 -8.715 -2.273 1.00 0.00 H new ATOM 0 HD12 LEU A 16 4.914 -9.080 -3.090 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.436 -9.963 -3.540 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.428 -10.266 -0.658 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.431 -11.596 -1.841 1.00 0.00 H new ATOM 0 HD23 LEU A 16 3.251 -11.796 -0.274 1.00 0.00 H new ATOM 245 N PRO A 17 6.632 -12.676 -4.999 1.00 0.00 N ATOM 246 CA PRO A 17 7.801 -13.417 -5.488 1.00 0.00 C ATOM 247 C PRO A 17 8.610 -14.063 -4.367 1.00 0.00 C ATOM 248 O PRO A 17 8.448 -13.739 -3.186 1.00 0.00 O ATOM 249 CB PRO A 17 8.641 -12.330 -6.148 1.00 0.00 C ATOM 250 CG PRO A 17 7.654 -11.322 -6.613 1.00 0.00 C ATOM 251 CD PRO A 17 6.547 -11.331 -5.593 1.00 0.00 C ATOM 0 HA PRO A 17 7.507 -14.237 -6.143 1.00 0.00 H new ATOM 0 HB2 PRO A 17 9.350 -11.895 -5.444 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.222 -12.729 -6.980 1.00 0.00 H new ATOM 0 HG2 PRO A 17 8.109 -10.334 -6.687 1.00 0.00 H new ATOM 0 HG3 PRO A 17 7.275 -11.574 -7.604 1.00 0.00 H new ATOM 0 HD2 PRO A 17 6.687 -10.552 -4.843 1.00 0.00 H new ATOM 0 HD3 PRO A 17 5.575 -11.158 -6.055 1.00 0.00 H new ATOM 259 N GLU A 18 9.500 -14.963 -4.746 1.00 0.00 N ATOM 260 CA GLU A 18 10.356 -15.622 -3.779 1.00 0.00 C ATOM 261 C GLU A 18 11.343 -14.616 -3.202 1.00 0.00 C ATOM 262 O GLU A 18 11.971 -13.849 -3.935 1.00 0.00 O ATOM 263 CB GLU A 18 11.094 -16.801 -4.415 1.00 0.00 C ATOM 264 CG GLU A 18 11.977 -16.409 -5.583 1.00 0.00 C ATOM 265 CD GLU A 18 12.728 -17.586 -6.160 1.00 0.00 C ATOM 266 OE1 GLU A 18 12.120 -18.377 -6.911 1.00 0.00 O ATOM 267 OE2 GLU A 18 13.930 -17.730 -5.865 1.00 0.00 O ATOM 0 H GLU A 18 9.648 -15.253 -5.713 1.00 0.00 H new ATOM 0 HA GLU A 18 9.737 -16.016 -2.973 1.00 0.00 H new ATOM 0 HB2 GLU A 18 11.706 -17.287 -3.655 1.00 0.00 H new ATOM 0 HB3 GLU A 18 10.363 -17.535 -4.754 1.00 0.00 H new ATOM 0 HG2 GLU A 18 11.364 -15.956 -6.362 1.00 0.00 H new ATOM 0 HG3 GLU A 18 12.690 -15.651 -5.257 1.00 0.00 H new ATOM 274 N GLY A 19 11.462 -14.615 -1.890 1.00 0.00 N ATOM 275 CA GLY A 19 12.286 -13.631 -1.224 1.00 0.00 C ATOM 276 C GLY A 19 11.451 -12.639 -0.446 1.00 0.00 C ATOM 277 O GLY A 19 11.984 -11.740 0.210 1.00 0.00 O ATOM 0 H GLY A 19 11.002 -15.280 -1.269 1.00 0.00 H new ATOM 0 HA2 GLY A 19 12.979 -14.133 -0.548 1.00 0.00 H new ATOM 0 HA3 GLY A 19 12.888 -13.101 -1.962 1.00 0.00 H new ATOM 281 N TYR A 20 10.136 -12.794 -0.531 1.00 0.00 N ATOM 282 CA TYR A 20 9.216 -11.946 0.208 1.00 0.00 C ATOM 283 C TYR A 20 8.667 -12.667 1.432 1.00 0.00 C ATOM 284 O TYR A 20 8.948 -13.847 1.653 1.00 0.00 O ATOM 285 CB TYR A 20 8.064 -11.506 -0.688 1.00 0.00 C ATOM 286 CG TYR A 20 8.431 -10.415 -1.662 1.00 0.00 C ATOM 287 CD1 TYR A 20 8.336 -9.085 -1.291 1.00 0.00 C ATOM 288 CD2 TYR A 20 8.863 -10.708 -2.949 1.00 0.00 C ATOM 289 CE1 TYR A 20 8.662 -8.074 -2.168 1.00 0.00 C ATOM 290 CE2 TYR A 20 9.191 -9.701 -3.832 1.00 0.00 C ATOM 291 CZ TYR A 20 9.088 -8.388 -3.438 1.00 0.00 C ATOM 292 OH TYR A 20 9.420 -7.385 -4.317 1.00 0.00 O ATOM 0 H TYR A 20 9.683 -13.503 -1.108 1.00 0.00 H new ATOM 0 HA TYR A 20 9.768 -11.068 0.543 1.00 0.00 H new ATOM 0 HB2 TYR A 20 7.699 -12.369 -1.245 1.00 0.00 H new ATOM 0 HB3 TYR A 20 7.242 -11.160 -0.062 1.00 0.00 H new ATOM 0 HD1 TYR A 20 8.000 -8.835 -0.295 1.00 0.00 H new ATOM 0 HD2 TYR A 20 8.943 -11.738 -3.262 1.00 0.00 H new ATOM 0 HE1 TYR A 20 8.584 -7.042 -1.861 1.00 0.00 H new ATOM 0 HE2 TYR A 20 9.528 -9.943 -4.829 1.00 0.00 H new ATOM 0 HH TYR A 20 8.746 -7.336 -5.027 1.00 0.00 H new ATOM 302 N ASP A 21 7.893 -11.944 2.231 1.00 0.00 N ATOM 303 CA ASP A 21 7.275 -12.515 3.419 1.00 0.00 C ATOM 304 C ASP A 21 5.795 -12.168 3.475 1.00 0.00 C ATOM 305 O ASP A 21 5.428 -11.000 3.644 1.00 0.00 O ATOM 306 CB ASP A 21 7.970 -12.010 4.684 1.00 0.00 C ATOM 307 CG ASP A 21 7.436 -12.685 5.935 1.00 0.00 C ATOM 308 OD1 ASP A 21 7.677 -13.899 6.105 1.00 0.00 O ATOM 309 OD2 ASP A 21 6.775 -12.012 6.751 1.00 0.00 O ATOM 0 H ASP A 21 7.678 -10.959 2.077 1.00 0.00 H new ATOM 0 HA ASP A 21 7.382 -13.598 3.364 1.00 0.00 H new ATOM 0 HB2 ASP A 21 9.042 -12.190 4.605 1.00 0.00 H new ATOM 0 HB3 ASP A 21 7.833 -10.932 4.767 1.00 0.00 H new ATOM 314 N ARG A 22 4.950 -13.177 3.322 1.00 0.00 N ATOM 315 CA ARG A 22 3.509 -12.985 3.382 1.00 0.00 C ATOM 316 C ARG A 22 2.909 -13.793 4.528 1.00 0.00 C ATOM 317 O ARG A 22 3.411 -14.862 4.879 1.00 0.00 O ATOM 318 CB ARG A 22 2.853 -13.382 2.055 1.00 0.00 C ATOM 319 CG ARG A 22 1.349 -13.151 2.034 1.00 0.00 C ATOM 320 CD ARG A 22 0.760 -13.265 0.637 1.00 0.00 C ATOM 321 NE ARG A 22 0.896 -14.607 0.079 1.00 0.00 N ATOM 322 CZ ARG A 22 -0.128 -15.440 -0.120 1.00 0.00 C ATOM 323 NH1 ARG A 22 -1.371 -15.056 0.144 1.00 0.00 N ATOM 324 NH2 ARG A 22 0.086 -16.655 -0.604 1.00 0.00 N ATOM 0 H ARG A 22 5.239 -14.141 3.155 1.00 0.00 H new ATOM 0 HA ARG A 22 3.315 -11.927 3.561 1.00 0.00 H new ATOM 0 HB2 ARG A 22 3.312 -12.813 1.246 1.00 0.00 H new ATOM 0 HB3 ARG A 22 3.055 -14.435 1.859 1.00 0.00 H new ATOM 0 HG2 ARG A 22 0.865 -13.875 2.689 1.00 0.00 H new ATOM 0 HG3 ARG A 22 1.131 -12.162 2.437 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -0.295 -12.994 0.668 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.254 -12.550 -0.021 1.00 0.00 H new ATOM 0 HE ARG A 22 1.830 -14.928 -0.174 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -1.550 -14.118 0.502 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -2.147 -15.699 -0.011 1.00 0.00 H new ATOM 0 HH21 ARG A 22 1.035 -16.956 -0.825 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -0.698 -17.289 -0.755 1.00 0.00 H new ATOM 338 N SER A 23 1.848 -13.268 5.117 1.00 0.00 N ATOM 339 CA SER A 23 1.169 -13.930 6.211 1.00 0.00 C ATOM 340 C SER A 23 -0.340 -13.745 6.073 1.00 0.00 C ATOM 341 O SER A 23 -0.848 -12.686 6.483 1.00 0.00 O ATOM 342 CB SER A 23 1.660 -13.367 7.545 1.00 0.00 C ATOM 343 OG SER A 23 3.070 -13.500 7.665 1.00 0.00 O ATOM 344 OXT SER A 23 -1.009 -14.650 5.535 1.00 0.00 O ATOM 0 H SER A 23 1.436 -12.374 4.849 1.00 0.00 H new ATOM 0 HA SER A 23 1.392 -14.996 6.181 1.00 0.00 H new ATOM 0 HB2 SER A 23 1.382 -12.316 7.625 1.00 0.00 H new ATOM 0 HB3 SER A 23 1.170 -13.890 8.367 1.00 0.00 H new ATOM 0 HG SER A 23 3.361 -13.132 8.525 1.00 0.00 H new TER 350 SER A 23 ATOM 351 N PRO B 24 -25.233 15.203 4.181 1.00 0.00 N ATOM 352 CA PRO B 24 -25.191 13.816 3.687 1.00 0.00 C ATOM 353 C PRO B 24 -25.554 12.845 4.800 1.00 0.00 C ATOM 354 O PRO B 24 -25.374 13.149 5.977 1.00 0.00 O ATOM 355 CB PRO B 24 -23.792 13.530 3.164 1.00 0.00 C ATOM 356 CG PRO B 24 -23.086 14.840 3.280 1.00 0.00 C ATOM 357 CD PRO B 24 -24.154 15.899 3.467 1.00 0.00 C ATOM 0 HA PRO B 24 -25.916 13.688 2.883 1.00 0.00 H new ATOM 0 HB2 PRO B 24 -23.297 12.757 3.752 1.00 0.00 H new ATOM 0 HB3 PRO B 24 -23.816 13.180 2.132 1.00 0.00 H new ATOM 0 HG2 PRO B 24 -22.396 14.834 4.124 1.00 0.00 H new ATOM 0 HG3 PRO B 24 -22.495 15.041 2.386 1.00 0.00 H new ATOM 0 HD2 PRO B 24 -23.778 16.746 4.041 1.00 0.00 H new ATOM 0 HD3 PRO B 24 -24.498 16.291 2.510 1.00 0.00 H new ATOM 367 N HIS B 25 -26.073 11.686 4.425 1.00 0.00 N ATOM 368 CA HIS B 25 -26.457 10.669 5.396 1.00 0.00 C ATOM 369 C HIS B 25 -25.287 9.743 5.684 1.00 0.00 C ATOM 370 O HIS B 25 -25.201 8.650 5.121 1.00 0.00 O ATOM 371 CB HIS B 25 -27.654 9.856 4.890 1.00 0.00 C ATOM 372 CG HIS B 25 -28.956 10.596 4.937 1.00 0.00 C ATOM 373 ND1 HIS B 25 -30.031 10.176 5.690 1.00 0.00 N ATOM 374 CD2 HIS B 25 -29.356 11.731 4.318 1.00 0.00 C ATOM 375 CE1 HIS B 25 -31.032 11.020 5.534 1.00 0.00 C ATOM 376 NE2 HIS B 25 -30.649 11.974 4.707 1.00 0.00 N ATOM 0 H HIS B 25 -26.239 11.424 3.453 1.00 0.00 H new ATOM 0 HA HIS B 25 -26.746 11.174 6.318 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -27.461 9.545 3.863 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -27.742 8.948 5.487 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -28.767 12.334 3.643 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -32.001 10.943 6.004 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -31.221 12.763 4.406 1.00 0.00 H new ATOM 385 N GLU B 26 -24.383 10.204 6.549 1.00 0.00 N ATOM 386 CA GLU B 26 -23.202 9.435 6.937 1.00 0.00 C ATOM 387 C GLU B 26 -22.333 9.130 5.717 1.00 0.00 C ATOM 388 O GLU B 26 -22.440 9.804 4.689 1.00 0.00 O ATOM 389 CB GLU B 26 -23.600 8.134 7.655 1.00 0.00 C ATOM 390 CG GLU B 26 -24.177 8.338 9.051 1.00 0.00 C ATOM 391 CD GLU B 26 -25.515 9.046 9.047 1.00 0.00 C ATOM 392 OE1 GLU B 26 -26.520 8.424 8.641 1.00 0.00 O ATOM 393 OE2 GLU B 26 -25.567 10.230 9.443 1.00 0.00 O ATOM 0 H GLU B 26 -24.449 11.117 6.998 1.00 0.00 H new ATOM 0 HA GLU B 26 -22.621 10.040 7.633 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -24.333 7.606 7.045 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -22.723 7.490 7.728 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -24.288 7.368 9.536 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -23.470 8.914 9.648 1.00 0.00 H new ATOM 400 N GLN B 27 -21.465 8.135 5.831 1.00 0.00 N ATOM 401 CA GLN B 27 -20.613 7.741 4.718 1.00 0.00 C ATOM 402 C GLN B 27 -21.410 7.016 3.644 1.00 0.00 C ATOM 403 O GLN B 27 -22.613 6.779 3.785 1.00 0.00 O ATOM 404 CB GLN B 27 -19.465 6.855 5.201 1.00 0.00 C ATOM 405 CG GLN B 27 -18.403 7.613 5.975 1.00 0.00 C ATOM 406 CD GLN B 27 -17.801 8.747 5.167 1.00 0.00 C ATOM 407 OE1 GLN B 27 -18.295 9.874 5.196 1.00 0.00 O ATOM 408 NE2 GLN B 27 -16.731 8.456 4.446 1.00 0.00 N ATOM 0 H GLN B 27 -21.332 7.587 6.681 1.00 0.00 H new ATOM 0 HA GLN B 27 -20.198 8.651 4.284 1.00 0.00 H new ATOM 0 HB2 GLN B 27 -19.868 6.063 5.832 1.00 0.00 H new ATOM 0 HB3 GLN B 27 -19.002 6.372 4.341 1.00 0.00 H new ATOM 0 HG2 GLN B 27 -18.840 8.014 6.890 1.00 0.00 H new ATOM 0 HG3 GLN B 27 -17.613 6.924 6.274 1.00 0.00 H new ATOM 0 HE21 GLN B 27 -16.355 7.508 4.451 1.00 0.00 H new ATOM 0 HE22 GLN B 27 -16.282 9.180 3.885 1.00 0.00 H new ATOM 417 N GLN B 28 -20.728 6.676 2.567 1.00 0.00 N ATOM 418 CA GLN B 28 -21.355 6.009 1.439 1.00 0.00 C ATOM 419 C GLN B 28 -20.879 4.573 1.331 1.00 0.00 C ATOM 420 O GLN B 28 -19.818 4.213 1.838 1.00 0.00 O ATOM 421 CB GLN B 28 -21.052 6.755 0.146 1.00 0.00 C ATOM 422 CG GLN B 28 -21.749 8.092 0.049 1.00 0.00 C ATOM 423 CD GLN B 28 -21.507 8.775 -1.277 1.00 0.00 C ATOM 424 OE1 GLN B 28 -20.546 9.528 -1.438 1.00 0.00 O ATOM 425 NE2 GLN B 28 -22.381 8.517 -2.235 1.00 0.00 N ATOM 0 H GLN B 28 -19.730 6.852 2.448 1.00 0.00 H new ATOM 0 HA GLN B 28 -22.433 6.007 1.603 1.00 0.00 H new ATOM 0 HB2 GLN B 28 -19.976 6.908 0.067 1.00 0.00 H new ATOM 0 HB3 GLN B 28 -21.349 6.136 -0.700 1.00 0.00 H new ATOM 0 HG2 GLN B 28 -22.820 7.951 0.191 1.00 0.00 H new ATOM 0 HG3 GLN B 28 -21.403 8.738 0.856 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -23.162 7.886 -2.056 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -22.274 8.949 -3.153 1.00 0.00 H new ATOM 434 N GLU B 29 -21.672 3.767 0.644 1.00 0.00 N ATOM 435 CA GLU B 29 -21.412 2.336 0.527 1.00 0.00 C ATOM 436 C GLU B 29 -20.279 2.057 -0.454 1.00 0.00 C ATOM 437 O GLU B 29 -19.731 0.957 -0.486 1.00 0.00 O ATOM 438 CB GLU B 29 -22.677 1.598 0.080 1.00 0.00 C ATOM 439 CG GLU B 29 -23.167 2.004 -1.302 1.00 0.00 C ATOM 440 CD GLU B 29 -24.331 1.164 -1.777 1.00 0.00 C ATOM 441 OE1 GLU B 29 -24.095 0.079 -2.339 1.00 0.00 O ATOM 442 OE2 GLU B 29 -25.493 1.587 -1.594 1.00 0.00 O ATOM 0 H GLU B 29 -22.510 4.081 0.154 1.00 0.00 H new ATOM 0 HA GLU B 29 -21.112 1.973 1.510 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -22.482 0.526 0.086 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -23.470 1.782 0.805 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -23.464 3.053 -1.284 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -22.347 1.917 -2.014 1.00 0.00 H new ATOM 449 N ASP B 30 -19.936 3.056 -1.253 1.00 0.00 N ATOM 450 CA ASP B 30 -18.864 2.922 -2.230 1.00 0.00 C ATOM 451 C ASP B 30 -17.526 3.287 -1.607 1.00 0.00 C ATOM 452 O ASP B 30 -16.479 3.160 -2.242 1.00 0.00 O ATOM 453 CB ASP B 30 -19.128 3.806 -3.451 1.00 0.00 C ATOM 454 CG ASP B 30 -19.218 5.275 -3.101 1.00 0.00 C ATOM 455 OD1 ASP B 30 -20.282 5.698 -2.611 1.00 0.00 O ATOM 456 OD2 ASP B 30 -18.234 6.011 -3.327 1.00 0.00 O ATOM 0 H ASP B 30 -20.386 3.972 -1.244 1.00 0.00 H new ATOM 0 HA ASP B 30 -18.831 1.882 -2.553 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -18.331 3.659 -4.180 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -20.057 3.493 -3.927 1.00 0.00 H new ATOM 461 N VAL B 31 -17.568 3.730 -0.358 1.00 0.00 N ATOM 462 CA VAL B 31 -16.368 4.139 0.355 1.00 0.00 C ATOM 463 C VAL B 31 -15.613 2.923 0.883 1.00 0.00 C ATOM 464 O VAL B 31 -16.111 2.191 1.741 1.00 0.00 O ATOM 465 CB VAL B 31 -16.705 5.080 1.532 1.00 0.00 C ATOM 466 CG1 VAL B 31 -15.440 5.553 2.234 1.00 0.00 C ATOM 467 CG2 VAL B 31 -17.526 6.262 1.045 1.00 0.00 C ATOM 0 H VAL B 31 -18.427 3.815 0.185 1.00 0.00 H new ATOM 0 HA VAL B 31 -15.739 4.677 -0.354 1.00 0.00 H new ATOM 0 HB VAL B 31 -17.298 4.521 2.256 1.00 0.00 H new ATOM 0 HG11 VAL B 31 -15.707 6.214 3.059 1.00 0.00 H new ATOM 0 HG12 VAL B 31 -14.895 4.692 2.621 1.00 0.00 H new ATOM 0 HG13 VAL B 31 -14.811 6.092 1.526 1.00 0.00 H new ATOM 0 HG21 VAL B 31 -17.756 6.916 1.886 1.00 0.00 H new ATOM 0 HG22 VAL B 31 -16.958 6.817 0.298 1.00 0.00 H new ATOM 0 HG23 VAL B 31 -18.454 5.902 0.601 1.00 0.00 H new ATOM 477 N PRO B 32 -14.406 2.685 0.355 1.00 0.00 N ATOM 478 CA PRO B 32 -13.557 1.584 0.797 1.00 0.00 C ATOM 479 C PRO B 32 -12.959 1.834 2.176 1.00 0.00 C ATOM 480 O PRO B 32 -12.462 2.924 2.464 1.00 0.00 O ATOM 481 CB PRO B 32 -12.457 1.534 -0.265 1.00 0.00 C ATOM 482 CG PRO B 32 -12.386 2.918 -0.805 1.00 0.00 C ATOM 483 CD PRO B 32 -13.783 3.471 -0.724 1.00 0.00 C ATOM 0 HA PRO B 32 -14.114 0.652 0.894 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -11.504 1.229 0.167 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -12.696 0.815 -1.049 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -11.692 3.527 -0.226 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -12.027 2.917 -1.834 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -13.780 4.536 -0.493 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -14.317 3.351 -1.667 1.00 0.00 H new ATOM 491 N GLU B 33 -13.020 0.826 3.031 1.00 0.00 N ATOM 492 CA GLU B 33 -12.444 0.917 4.351 1.00 0.00 C ATOM 493 C GLU B 33 -11.197 0.050 4.417 1.00 0.00 C ATOM 494 O GLU B 33 -11.275 -1.172 4.519 1.00 0.00 O ATOM 495 CB GLU B 33 -13.469 0.491 5.400 1.00 0.00 C ATOM 496 CG GLU B 33 -12.990 0.680 6.823 1.00 0.00 C ATOM 497 CD GLU B 33 -14.117 0.566 7.828 1.00 0.00 C ATOM 498 OE1 GLU B 33 -14.986 1.464 7.856 1.00 0.00 O ATOM 499 OE2 GLU B 33 -14.146 -0.420 8.593 1.00 0.00 O ATOM 0 H GLU B 33 -13.467 -0.068 2.827 1.00 0.00 H new ATOM 0 HA GLU B 33 -12.161 1.949 4.560 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -14.385 1.063 5.254 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -13.720 -0.558 5.246 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -12.227 -0.065 7.049 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -12.518 1.658 6.919 1.00 0.00 H new ATOM 506 N TYR B 34 -10.052 0.686 4.294 1.00 0.00 N ATOM 507 CA TYR B 34 -8.785 -0.022 4.301 1.00 0.00 C ATOM 508 C TYR B 34 -8.223 -0.139 5.710 1.00 0.00 C ATOM 509 O TYR B 34 -8.528 0.671 6.590 1.00 0.00 O ATOM 510 CB TYR B 34 -7.766 0.688 3.415 1.00 0.00 C ATOM 511 CG TYR B 34 -8.140 0.755 1.953 1.00 0.00 C ATOM 512 CD1 TYR B 34 -7.992 -0.351 1.127 1.00 0.00 C ATOM 513 CD2 TYR B 34 -8.621 1.931 1.396 1.00 0.00 C ATOM 514 CE1 TYR B 34 -8.316 -0.287 -0.214 1.00 0.00 C ATOM 515 CE2 TYR B 34 -8.949 2.004 0.057 1.00 0.00 C ATOM 516 CZ TYR B 34 -8.795 0.893 -0.745 1.00 0.00 C ATOM 517 OH TYR B 34 -9.121 0.965 -2.081 1.00 0.00 O ATOM 0 H TYR B 34 -9.970 1.697 4.187 1.00 0.00 H new ATOM 0 HA TYR B 34 -8.973 -1.023 3.912 1.00 0.00 H new ATOM 0 HB2 TYR B 34 -7.626 1.703 3.787 1.00 0.00 H new ATOM 0 HB3 TYR B 34 -6.807 0.179 3.508 1.00 0.00 H new ATOM 0 HD1 TYR B 34 -7.618 -1.276 1.540 1.00 0.00 H new ATOM 0 HD2 TYR B 34 -8.741 2.804 2.020 1.00 0.00 H new ATOM 0 HE1 TYR B 34 -8.195 -1.156 -0.844 1.00 0.00 H new ATOM 0 HE2 TYR B 34 -9.324 2.927 -0.360 1.00 0.00 H new ATOM 0 HH TYR B 34 -9.443 1.866 -2.291 1.00 0.00 H new ATOM 527 N GLU B 35 -7.403 -1.153 5.910 1.00 0.00 N ATOM 528 CA GLU B 35 -6.707 -1.348 7.167 1.00 0.00 C ATOM 529 C GLU B 35 -5.207 -1.321 6.914 1.00 0.00 C ATOM 530 O GLU B 35 -4.663 -2.232 6.287 1.00 0.00 O ATOM 531 CB GLU B 35 -7.113 -2.681 7.801 1.00 0.00 C ATOM 532 CG GLU B 35 -6.598 -2.868 9.219 1.00 0.00 C ATOM 533 CD GLU B 35 -6.818 -4.273 9.736 1.00 0.00 C ATOM 534 OE1 GLU B 35 -7.927 -4.571 10.222 1.00 0.00 O ATOM 535 OE2 GLU B 35 -5.882 -5.092 9.656 1.00 0.00 O ATOM 0 H GLU B 35 -7.201 -1.864 5.207 1.00 0.00 H new ATOM 0 HA GLU B 35 -6.975 -0.548 7.857 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -8.201 -2.754 7.807 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -6.743 -3.496 7.179 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -5.533 -2.636 9.249 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -7.097 -2.159 9.880 1.00 0.00 H new ATOM 542 N VAL B 36 -4.556 -0.255 7.360 1.00 0.00 N ATOM 543 CA VAL B 36 -3.118 -0.099 7.189 1.00 0.00 C ATOM 544 C VAL B 36 -2.360 -0.671 8.383 1.00 0.00 C ATOM 545 O VAL B 36 -2.675 -0.365 9.533 1.00 0.00 O ATOM 546 CB VAL B 36 -2.731 1.386 7.010 1.00 0.00 C ATOM 547 CG1 VAL B 36 -1.222 1.543 6.881 1.00 0.00 C ATOM 548 CG2 VAL B 36 -3.436 1.980 5.801 1.00 0.00 C ATOM 0 H VAL B 36 -5.006 0.520 7.847 1.00 0.00 H new ATOM 0 HA VAL B 36 -2.843 -0.649 6.289 1.00 0.00 H new ATOM 0 HB VAL B 36 -3.053 1.929 7.898 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -0.975 2.597 6.756 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -0.738 1.161 7.780 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -0.871 0.983 6.014 1.00 0.00 H new ATOM 0 HG21 VAL B 36 -3.151 3.026 5.691 1.00 0.00 H new ATOM 0 HG22 VAL B 36 -3.148 1.430 4.905 1.00 0.00 H new ATOM 0 HG23 VAL B 36 -4.515 1.910 5.939 1.00 0.00 H new ATOM 558 N LYS B 37 -1.376 -1.514 8.102 1.00 0.00 N ATOM 559 CA LYS B 37 -0.524 -2.084 9.133 1.00 0.00 C ATOM 560 C LYS B 37 0.925 -1.830 8.763 1.00 0.00 C ATOM 561 O LYS B 37 1.280 -1.878 7.588 1.00 0.00 O ATOM 562 CB LYS B 37 -0.768 -3.593 9.301 1.00 0.00 C ATOM 563 CG LYS B 37 -2.220 -3.960 9.578 1.00 0.00 C ATOM 564 CD LYS B 37 -3.039 -4.023 8.298 1.00 0.00 C ATOM 565 CE LYS B 37 -3.106 -5.430 7.728 1.00 0.00 C ATOM 566 NZ LYS B 37 -3.792 -6.374 8.649 1.00 0.00 N ATOM 0 H LYS B 37 -1.147 -1.820 7.156 1.00 0.00 H new ATOM 0 HA LYS B 37 -0.761 -1.608 10.085 1.00 0.00 H new ATOM 0 HB2 LYS B 37 -0.441 -4.106 8.397 1.00 0.00 H new ATOM 0 HB3 LYS B 37 -0.149 -3.962 10.119 1.00 0.00 H new ATOM 0 HG2 LYS B 37 -2.261 -4.925 10.084 1.00 0.00 H new ATOM 0 HG3 LYS B 37 -2.658 -3.226 10.254 1.00 0.00 H new ATOM 0 HD2 LYS B 37 -4.049 -3.665 8.497 1.00 0.00 H new ATOM 0 HD3 LYS B 37 -2.604 -3.353 7.557 1.00 0.00 H new ATOM 0 HE2 LYS B 37 -3.631 -5.409 6.773 1.00 0.00 H new ATOM 0 HE3 LYS B 37 -2.096 -5.788 7.528 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 -4.475 -6.947 8.113 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 -3.089 -6.999 9.093 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 -4.293 -5.838 9.386 1.00 0.00 H new ATOM 580 N MET B 38 1.755 -1.554 9.750 1.00 0.00 N ATOM 581 CA MET B 38 3.142 -1.206 9.486 1.00 0.00 C ATOM 582 C MET B 38 4.082 -2.139 10.238 1.00 0.00 C ATOM 583 O MET B 38 3.808 -2.515 11.377 1.00 0.00 O ATOM 584 CB MET B 38 3.393 0.242 9.885 1.00 0.00 C ATOM 585 CG MET B 38 4.294 0.968 8.913 1.00 0.00 C ATOM 586 SD MET B 38 4.069 2.751 8.943 1.00 0.00 S ATOM 587 CE MET B 38 4.637 3.146 7.295 1.00 0.00 C ATOM 0 H MET B 38 1.498 -1.563 10.737 1.00 0.00 H new ATOM 0 HA MET B 38 3.337 -1.319 8.420 1.00 0.00 H new ATOM 0 HB2 MET B 38 2.440 0.767 9.951 1.00 0.00 H new ATOM 0 HB3 MET B 38 3.841 0.268 10.878 1.00 0.00 H new ATOM 0 HG2 MET B 38 5.333 0.735 9.146 1.00 0.00 H new ATOM 0 HG3 MET B 38 4.103 0.600 7.905 1.00 0.00 H new ATOM 0 HE1 MET B 38 5.353 3.966 7.344 1.00 0.00 H new ATOM 0 HE2 MET B 38 5.116 2.271 6.856 1.00 0.00 H new ATOM 0 HE3 MET B 38 3.788 3.442 6.679 1.00 0.00 H new ATOM 597 N LYS B 39 5.184 -2.519 9.602 1.00 0.00 N ATOM 598 CA LYS B 39 6.110 -3.472 10.204 1.00 0.00 C ATOM 599 C LYS B 39 7.555 -3.076 9.908 1.00 0.00 C ATOM 600 O LYS B 39 7.894 -2.747 8.772 1.00 0.00 O ATOM 601 CB LYS B 39 5.812 -4.882 9.672 1.00 0.00 C ATOM 602 CG LYS B 39 6.181 -6.010 10.630 1.00 0.00 C ATOM 603 CD LYS B 39 7.675 -6.281 10.651 1.00 0.00 C ATOM 604 CE LYS B 39 8.042 -7.293 11.722 1.00 0.00 C ATOM 605 NZ LYS B 39 9.488 -7.630 11.694 1.00 0.00 N ATOM 0 H LYS B 39 5.457 -2.186 8.678 1.00 0.00 H new ATOM 0 HA LYS B 39 5.977 -3.466 11.286 1.00 0.00 H new ATOM 0 HB2 LYS B 39 4.749 -4.952 9.440 1.00 0.00 H new ATOM 0 HB3 LYS B 39 6.352 -5.025 8.736 1.00 0.00 H new ATOM 0 HG2 LYS B 39 5.846 -5.754 11.635 1.00 0.00 H new ATOM 0 HG3 LYS B 39 5.653 -6.918 10.339 1.00 0.00 H new ATOM 0 HD2 LYS B 39 7.993 -6.650 9.676 1.00 0.00 H new ATOM 0 HD3 LYS B 39 8.212 -5.350 10.830 1.00 0.00 H new ATOM 0 HE2 LYS B 39 7.781 -6.895 12.702 1.00 0.00 H new ATOM 0 HE3 LYS B 39 7.455 -8.200 11.580 1.00 0.00 H new ATOM 0 HZ1 LYS B 39 9.753 -8.098 12.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 39 9.680 -8.269 10.896 1.00 0.00 H new ATOM 0 HZ3 LYS B 39 10.045 -6.759 11.582 1.00 0.00 H new ATOM 619 N ARG B 40 8.393 -3.101 10.936 1.00 0.00 N ATOM 620 CA ARG B 40 9.802 -2.743 10.797 1.00 0.00 C ATOM 621 C ARG B 40 10.675 -3.988 10.683 1.00 0.00 C ATOM 622 O ARG B 40 10.459 -4.980 11.380 1.00 0.00 O ATOM 623 CB ARG B 40 10.274 -1.897 11.988 1.00 0.00 C ATOM 624 CG ARG B 40 9.898 -0.423 11.903 1.00 0.00 C ATOM 625 CD ARG B 40 8.398 -0.205 11.995 1.00 0.00 C ATOM 626 NE ARG B 40 8.042 1.201 11.808 1.00 0.00 N ATOM 627 CZ ARG B 40 6.809 1.694 11.949 1.00 0.00 C ATOM 628 NH1 ARG B 40 5.806 0.901 12.311 1.00 0.00 N ATOM 629 NH2 ARG B 40 6.586 2.985 11.742 1.00 0.00 N ATOM 0 H ARG B 40 8.121 -3.367 11.882 1.00 0.00 H new ATOM 0 HA ARG B 40 9.899 -2.157 9.883 1.00 0.00 H new ATOM 0 HB2 ARG B 40 9.854 -2.314 12.903 1.00 0.00 H new ATOM 0 HB3 ARG B 40 11.358 -1.979 12.069 1.00 0.00 H new ATOM 0 HG2 ARG B 40 10.392 0.123 12.707 1.00 0.00 H new ATOM 0 HG3 ARG B 40 10.266 -0.010 10.964 1.00 0.00 H new ATOM 0 HD2 ARG B 40 7.896 -0.811 11.241 1.00 0.00 H new ATOM 0 HD3 ARG B 40 8.040 -0.545 12.967 1.00 0.00 H new ATOM 0 HE ARG B 40 8.787 1.850 11.552 1.00 0.00 H new ATOM 0 HH11 ARG B 40 5.976 -0.090 12.483 1.00 0.00 H new ATOM 0 HH12 ARG B 40 4.866 1.283 12.417 1.00 0.00 H new ATOM 0 HH21 ARG B 40 7.356 3.599 11.476 1.00 0.00 H new ATOM 0 HH22 ARG B 40 5.645 3.364 11.849 1.00 0.00 H new ATOM 643 N PHE B 41 11.653 -3.928 9.793 1.00 0.00 N ATOM 644 CA PHE B 41 12.604 -5.019 9.616 1.00 0.00 C ATOM 645 C PHE B 41 14.020 -4.545 9.918 1.00 0.00 C ATOM 646 O PHE B 41 14.271 -3.343 10.030 1.00 0.00 O ATOM 647 CB PHE B 41 12.543 -5.571 8.190 1.00 0.00 C ATOM 648 CG PHE B 41 11.308 -6.371 7.891 1.00 0.00 C ATOM 649 CD1 PHE B 41 10.098 -5.743 7.647 1.00 0.00 C ATOM 650 CD2 PHE B 41 11.363 -7.754 7.844 1.00 0.00 C ATOM 651 CE1 PHE B 41 8.966 -6.481 7.365 1.00 0.00 C ATOM 652 CE2 PHE B 41 10.233 -8.497 7.564 1.00 0.00 C ATOM 653 CZ PHE B 41 9.033 -7.860 7.322 1.00 0.00 C ATOM 0 H PHE B 41 11.811 -3.130 9.177 1.00 0.00 H new ATOM 0 HA PHE B 41 12.334 -5.813 10.312 1.00 0.00 H new ATOM 0 HB2 PHE B 41 12.602 -4.739 7.488 1.00 0.00 H new ATOM 0 HB3 PHE B 41 13.418 -6.197 8.017 1.00 0.00 H new ATOM 0 HD1 PHE B 41 10.039 -4.665 7.678 1.00 0.00 H new ATOM 0 HD2 PHE B 41 12.301 -8.257 8.028 1.00 0.00 H new ATOM 0 HE1 PHE B 41 8.028 -5.980 7.178 1.00 0.00 H new ATOM 0 HE2 PHE B 41 10.288 -9.575 7.534 1.00 0.00 H new ATOM 0 HZ PHE B 41 8.148 -8.438 7.100 1.00 0.00 H new ATOM 663 N LYS B 42 14.937 -5.489 10.048 1.00 0.00 N ATOM 664 CA LYS B 42 16.331 -5.180 10.328 1.00 0.00 C ATOM 665 C LYS B 42 17.239 -6.181 9.623 1.00 0.00 C ATOM 666 O LYS B 42 17.342 -7.334 10.040 1.00 0.00 O ATOM 667 CB LYS B 42 16.581 -5.206 11.841 1.00 0.00 C ATOM 668 CG LYS B 42 18.005 -4.853 12.241 1.00 0.00 C ATOM 669 CD LYS B 42 18.188 -4.910 13.750 1.00 0.00 C ATOM 670 CE LYS B 42 19.610 -4.559 14.149 1.00 0.00 C ATOM 671 NZ LYS B 42 19.806 -4.591 15.624 1.00 0.00 N ATOM 0 H LYS B 42 14.739 -6.486 9.963 1.00 0.00 H new ATOM 0 HA LYS B 42 16.556 -4.181 9.954 1.00 0.00 H new ATOM 0 HB2 LYS B 42 15.896 -4.509 12.324 1.00 0.00 H new ATOM 0 HB3 LYS B 42 16.344 -6.200 12.221 1.00 0.00 H new ATOM 0 HG2 LYS B 42 18.700 -5.542 11.762 1.00 0.00 H new ATOM 0 HG3 LYS B 42 18.248 -3.853 11.881 1.00 0.00 H new ATOM 0 HD2 LYS B 42 17.493 -4.220 14.229 1.00 0.00 H new ATOM 0 HD3 LYS B 42 17.944 -5.909 14.110 1.00 0.00 H new ATOM 0 HE2 LYS B 42 20.301 -5.258 13.678 1.00 0.00 H new ATOM 0 HE3 LYS B 42 19.856 -3.566 13.773 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 20.791 -4.345 15.849 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 19.167 -3.905 16.074 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 19.597 -5.545 15.981 1.00 0.00 H new ATOM 685 N GLY B 43 17.876 -5.747 8.546 1.00 0.00 N ATOM 686 CA GLY B 43 18.764 -6.624 7.809 1.00 0.00 C ATOM 687 C GLY B 43 18.004 -7.540 6.873 1.00 0.00 C ATOM 688 O GLY B 43 18.244 -8.748 6.835 1.00 0.00 O ATOM 0 H GLY B 43 17.794 -4.803 8.168 1.00 0.00 H new ATOM 0 HA2 GLY B 43 19.472 -6.025 7.236 1.00 0.00 H new ATOM 0 HA3 GLY B 43 19.347 -7.223 8.509 1.00 0.00 H new ATOM 692 N ALA B 44 17.077 -6.967 6.127 1.00 0.00 N ATOM 693 CA ALA B 44 16.269 -7.727 5.196 1.00 0.00 C ATOM 694 C ALA B 44 16.218 -7.022 3.855 1.00 0.00 C ATOM 695 O ALA B 44 16.705 -5.898 3.728 1.00 0.00 O ATOM 696 CB ALA B 44 14.868 -7.940 5.750 1.00 0.00 C ATOM 0 H ALA B 44 16.865 -5.969 6.150 1.00 0.00 H new ATOM 0 HA ALA B 44 16.726 -8.706 5.055 1.00 0.00 H new ATOM 0 HB1 ALA B 44 14.277 -8.513 5.035 1.00 0.00 H new ATOM 0 HB2 ALA B 44 14.928 -8.486 6.691 1.00 0.00 H new ATOM 0 HB3 ALA B 44 14.393 -6.974 5.921 1.00 0.00 H new ATOM 702 N ALA B 45 15.648 -7.677 2.857 1.00 0.00 N ATOM 703 CA ALA B 45 15.500 -7.077 1.537 1.00 0.00 C ATOM 704 C ALA B 45 14.671 -5.800 1.621 1.00 0.00 C ATOM 705 O ALA B 45 14.810 -4.887 0.807 1.00 0.00 O ATOM 706 CB ALA B 45 14.855 -8.071 0.591 1.00 0.00 C ATOM 0 H ALA B 45 15.279 -8.625 2.934 1.00 0.00 H new ATOM 0 HA ALA B 45 16.486 -6.816 1.154 1.00 0.00 H new ATOM 0 HB1 ALA B 45 14.746 -7.618 -0.394 1.00 0.00 H new ATOM 0 HB2 ALA B 45 15.481 -8.960 0.515 1.00 0.00 H new ATOM 0 HB3 ALA B 45 13.873 -8.351 0.972 1.00 0.00 H new ATOM 712 N TYR B 46 13.841 -5.746 2.646 1.00 0.00 N ATOM 713 CA TYR B 46 12.972 -4.620 2.901 1.00 0.00 C ATOM 714 C TYR B 46 13.102 -4.226 4.363 1.00 0.00 C ATOM 715 O TYR B 46 13.250 -5.086 5.228 1.00 0.00 O ATOM 716 CB TYR B 46 11.522 -4.977 2.551 1.00 0.00 C ATOM 717 CG TYR B 46 11.209 -6.449 2.706 1.00 0.00 C ATOM 718 CD1 TYR B 46 11.112 -7.031 3.962 1.00 0.00 C ATOM 719 CD2 TYR B 46 11.023 -7.257 1.592 1.00 0.00 C ATOM 720 CE1 TYR B 46 10.842 -8.377 4.105 1.00 0.00 C ATOM 721 CE2 TYR B 46 10.748 -8.603 1.727 1.00 0.00 C ATOM 722 CZ TYR B 46 10.661 -9.157 2.986 1.00 0.00 C ATOM 723 OH TYR B 46 10.398 -10.499 3.127 1.00 0.00 O ATOM 0 H TYR B 46 13.753 -6.495 3.332 1.00 0.00 H new ATOM 0 HA TYR B 46 13.262 -3.776 2.276 1.00 0.00 H new ATOM 0 HB2 TYR B 46 10.850 -4.402 3.188 1.00 0.00 H new ATOM 0 HB3 TYR B 46 11.320 -4.677 1.523 1.00 0.00 H new ATOM 0 HD1 TYR B 46 11.250 -6.421 4.842 1.00 0.00 H new ATOM 0 HD2 TYR B 46 11.095 -6.826 0.605 1.00 0.00 H new ATOM 0 HE1 TYR B 46 10.773 -8.815 5.090 1.00 0.00 H new ATOM 0 HE2 TYR B 46 10.602 -9.218 0.851 1.00 0.00 H new ATOM 0 HH TYR B 46 10.609 -10.779 4.042 1.00 0.00 H new ATOM 733 N LYS B 47 13.076 -2.936 4.629 1.00 0.00 N ATOM 734 CA LYS B 47 13.276 -2.421 5.977 1.00 0.00 C ATOM 735 C LYS B 47 11.935 -2.084 6.599 1.00 0.00 C ATOM 736 O LYS B 47 11.800 -1.999 7.821 1.00 0.00 O ATOM 737 CB LYS B 47 14.163 -1.166 5.970 1.00 0.00 C ATOM 738 CG LYS B 47 15.606 -1.395 5.526 1.00 0.00 C ATOM 739 CD LYS B 47 15.711 -1.760 4.049 1.00 0.00 C ATOM 740 CE LYS B 47 15.237 -0.629 3.151 1.00 0.00 C ATOM 741 NZ LYS B 47 15.097 -1.073 1.742 1.00 0.00 N ATOM 0 H LYS B 47 12.917 -2.215 3.925 1.00 0.00 H new ATOM 0 HA LYS B 47 13.777 -3.193 6.562 1.00 0.00 H new ATOM 0 HB2 LYS B 47 13.710 -0.424 5.312 1.00 0.00 H new ATOM 0 HB3 LYS B 47 14.171 -0.740 6.973 1.00 0.00 H new ATOM 0 HG2 LYS B 47 16.189 -0.494 5.717 1.00 0.00 H new ATOM 0 HG3 LYS B 47 16.045 -2.192 6.126 1.00 0.00 H new ATOM 0 HD2 LYS B 47 16.745 -2.006 3.808 1.00 0.00 H new ATOM 0 HD3 LYS B 47 15.117 -2.653 3.852 1.00 0.00 H new ATOM 0 HE2 LYS B 47 14.279 -0.254 3.512 1.00 0.00 H new ATOM 0 HE3 LYS B 47 15.944 0.199 3.204 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 14.871 -0.255 1.141 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 15.989 -1.501 1.423 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 14.332 -1.775 1.673 1.00 0.00 H new ATOM 755 N LEU B 48 10.953 -1.883 5.742 1.00 0.00 N ATOM 756 CA LEU B 48 9.621 -1.521 6.175 1.00 0.00 C ATOM 757 C LEU B 48 8.585 -2.266 5.337 1.00 0.00 C ATOM 758 O LEU B 48 8.717 -2.366 4.118 1.00 0.00 O ATOM 759 CB LEU B 48 9.438 -0.004 6.032 1.00 0.00 C ATOM 760 CG LEU B 48 8.643 0.690 7.143 1.00 0.00 C ATOM 761 CD1 LEU B 48 7.216 0.191 7.192 1.00 0.00 C ATOM 762 CD2 LEU B 48 9.310 0.483 8.489 1.00 0.00 C ATOM 0 H LEU B 48 11.057 -1.966 4.731 1.00 0.00 H new ATOM 0 HA LEU B 48 9.485 -1.799 7.220 1.00 0.00 H new ATOM 0 HB2 LEU B 48 10.425 0.456 5.978 1.00 0.00 H new ATOM 0 HB3 LEU B 48 8.942 0.193 5.082 1.00 0.00 H new ATOM 0 HG LEU B 48 8.625 1.756 6.917 1.00 0.00 H new ATOM 0 HD11 LEU B 48 6.679 0.703 7.991 1.00 0.00 H new ATOM 0 HD12 LEU B 48 6.727 0.392 6.239 1.00 0.00 H new ATOM 0 HD13 LEU B 48 7.212 -0.882 7.382 1.00 0.00 H new ATOM 0 HD21 LEU B 48 8.729 0.984 9.264 1.00 0.00 H new ATOM 0 HD22 LEU B 48 9.364 -0.583 8.708 1.00 0.00 H new ATOM 0 HD23 LEU B 48 10.317 0.900 8.464 1.00 0.00 H new ATOM 774 N ARG B 49 7.574 -2.810 5.994 1.00 0.00 N ATOM 775 CA ARG B 49 6.472 -3.452 5.296 1.00 0.00 C ATOM 776 C ARG B 49 5.156 -2.824 5.723 1.00 0.00 C ATOM 777 O ARG B 49 4.921 -2.606 6.908 1.00 0.00 O ATOM 778 CB ARG B 49 6.444 -4.957 5.567 1.00 0.00 C ATOM 779 CG ARG B 49 5.362 -5.684 4.785 1.00 0.00 C ATOM 780 CD ARG B 49 5.374 -7.178 5.054 1.00 0.00 C ATOM 781 NE ARG B 49 4.980 -7.507 6.423 1.00 0.00 N ATOM 782 CZ ARG B 49 5.181 -8.699 6.980 1.00 0.00 C ATOM 783 NH1 ARG B 49 5.779 -9.659 6.287 1.00 0.00 N ATOM 784 NH2 ARG B 49 4.772 -8.931 8.219 1.00 0.00 N ATOM 0 H ARG B 49 7.493 -2.820 7.011 1.00 0.00 H new ATOM 0 HA ARG B 49 6.616 -3.305 4.226 1.00 0.00 H new ATOM 0 HB2 ARG B 49 7.415 -5.384 5.315 1.00 0.00 H new ATOM 0 HB3 ARG B 49 6.289 -5.125 6.633 1.00 0.00 H new ATOM 0 HG2 ARG B 49 4.387 -5.276 5.050 1.00 0.00 H new ATOM 0 HG3 ARG B 49 5.503 -5.506 3.719 1.00 0.00 H new ATOM 0 HD2 ARG B 49 4.699 -7.674 4.357 1.00 0.00 H new ATOM 0 HD3 ARG B 49 6.373 -7.569 4.864 1.00 0.00 H new ATOM 0 HE ARG B 49 4.527 -6.784 6.981 1.00 0.00 H new ATOM 0 HH11 ARG B 49 6.084 -9.483 5.330 1.00 0.00 H new ATOM 0 HH12 ARG B 49 5.934 -10.573 6.712 1.00 0.00 H new ATOM 0 HH21 ARG B 49 4.302 -8.196 8.747 1.00 0.00 H new ATOM 0 HH22 ARG B 49 4.927 -9.845 8.644 1.00 0.00 H new ATOM 798 N ILE B 50 4.314 -2.514 4.753 1.00 0.00 N ATOM 799 CA ILE B 50 3.023 -1.908 5.029 1.00 0.00 C ATOM 800 C ILE B 50 1.928 -2.750 4.385 1.00 0.00 C ATOM 801 O ILE B 50 2.045 -3.147 3.226 1.00 0.00 O ATOM 802 CB ILE B 50 2.913 -0.445 4.504 1.00 0.00 C ATOM 803 CG1 ILE B 50 4.087 0.438 4.962 1.00 0.00 C ATOM 804 CG2 ILE B 50 1.615 0.184 4.983 1.00 0.00 C ATOM 805 CD1 ILE B 50 5.406 0.156 4.275 1.00 0.00 C ATOM 0 H ILE B 50 4.502 -2.673 3.763 1.00 0.00 H new ATOM 0 HA ILE B 50 2.909 -1.873 6.112 1.00 0.00 H new ATOM 0 HB ILE B 50 2.936 -0.501 3.416 1.00 0.00 H new ATOM 0 HG12 ILE B 50 3.823 1.482 4.795 1.00 0.00 H new ATOM 0 HG13 ILE B 50 4.220 0.311 6.036 1.00 0.00 H new ATOM 0 HG21 ILE B 50 1.547 1.206 4.611 1.00 0.00 H new ATOM 0 HG22 ILE B 50 0.770 -0.395 4.609 1.00 0.00 H new ATOM 0 HG23 ILE B 50 1.595 0.192 6.073 1.00 0.00 H new ATOM 0 HD11 ILE B 50 6.170 0.828 4.665 1.00 0.00 H new ATOM 0 HD12 ILE B 50 5.701 -0.876 4.463 1.00 0.00 H new ATOM 0 HD13 ILE B 50 5.298 0.313 3.202 1.00 0.00 H new ATOM 817 N LEU B 51 0.887 -3.045 5.144 1.00 0.00 N ATOM 818 CA LEU B 51 -0.214 -3.849 4.651 1.00 0.00 C ATOM 819 C LEU B 51 -1.466 -3.006 4.571 1.00 0.00 C ATOM 820 O LEU B 51 -1.887 -2.422 5.565 1.00 0.00 O ATOM 821 CB LEU B 51 -0.456 -5.056 5.565 1.00 0.00 C ATOM 822 CG LEU B 51 0.322 -6.328 5.223 1.00 0.00 C ATOM 823 CD1 LEU B 51 -0.099 -6.851 3.865 1.00 0.00 C ATOM 824 CD2 LEU B 51 1.820 -6.080 5.254 1.00 0.00 C ATOM 0 H LEU B 51 0.783 -2.737 6.111 1.00 0.00 H new ATOM 0 HA LEU B 51 0.041 -4.215 3.657 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -0.209 -4.767 6.587 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -1.520 -5.290 5.549 1.00 0.00 H new ATOM 0 HG LEU B 51 0.091 -7.080 5.978 1.00 0.00 H new ATOM 0 HD11 LEU B 51 0.462 -7.756 3.634 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -1.165 -7.078 3.877 1.00 0.00 H new ATOM 0 HD13 LEU B 51 0.102 -6.095 3.106 1.00 0.00 H new ATOM 0 HD21 LEU B 51 2.347 -7.002 5.007 1.00 0.00 H new ATOM 0 HD22 LEU B 51 2.076 -5.310 4.527 1.00 0.00 H new ATOM 0 HD23 LEU B 51 2.114 -5.750 6.251 1.00 0.00 H new ATOM 836 N ILE B 52 -2.038 -2.915 3.388 1.00 0.00 N ATOM 837 CA ILE B 52 -3.272 -2.172 3.204 1.00 0.00 C ATOM 838 C ILE B 52 -4.313 -3.052 2.536 1.00 0.00 C ATOM 839 O ILE B 52 -4.259 -3.288 1.330 1.00 0.00 O ATOM 840 CB ILE B 52 -3.079 -0.899 2.346 1.00 0.00 C ATOM 841 CG1 ILE B 52 -1.918 -0.044 2.861 1.00 0.00 C ATOM 842 CG2 ILE B 52 -4.361 -0.082 2.330 1.00 0.00 C ATOM 843 CD1 ILE B 52 -0.571 -0.439 2.297 1.00 0.00 C ATOM 0 H ILE B 52 -1.670 -3.345 2.539 1.00 0.00 H new ATOM 0 HA ILE B 52 -3.602 -1.865 4.196 1.00 0.00 H new ATOM 0 HB ILE B 52 -2.837 -1.214 1.331 1.00 0.00 H new ATOM 0 HG12 ILE B 52 -2.112 1.000 2.616 1.00 0.00 H new ATOM 0 HG13 ILE B 52 -1.881 -0.115 3.948 1.00 0.00 H new ATOM 0 HG21 ILE B 52 -4.215 0.812 1.724 1.00 0.00 H new ATOM 0 HG22 ILE B 52 -5.168 -0.680 1.907 1.00 0.00 H new ATOM 0 HG23 ILE B 52 -4.620 0.209 3.348 1.00 0.00 H new ATOM 0 HD11 ILE B 52 0.201 0.212 2.708 1.00 0.00 H new ATOM 0 HD12 ILE B 52 -0.354 -1.473 2.564 1.00 0.00 H new ATOM 0 HD13 ILE B 52 -0.588 -0.341 1.212 1.00 0.00 H new ATOM 855 N GLU B 53 -5.257 -3.542 3.313 1.00 0.00 N ATOM 856 CA GLU B 53 -6.304 -4.387 2.768 1.00 0.00 C ATOM 857 C GLU B 53 -7.651 -3.703 2.894 1.00 0.00 C ATOM 858 O GLU B 53 -7.859 -2.865 3.771 1.00 0.00 O ATOM 859 CB GLU B 53 -6.328 -5.747 3.464 1.00 0.00 C ATOM 860 CG GLU B 53 -6.801 -5.694 4.902 1.00 0.00 C ATOM 861 CD GLU B 53 -6.648 -7.026 5.602 1.00 0.00 C ATOM 862 OE1 GLU B 53 -7.427 -7.952 5.299 1.00 0.00 O ATOM 863 OE2 GLU B 53 -5.748 -7.155 6.454 1.00 0.00 O ATOM 0 H GLU B 53 -5.323 -3.373 4.317 1.00 0.00 H new ATOM 0 HA GLU B 53 -6.093 -4.553 1.712 1.00 0.00 H new ATOM 0 HB2 GLU B 53 -6.977 -6.419 2.903 1.00 0.00 H new ATOM 0 HB3 GLU B 53 -5.326 -6.175 3.437 1.00 0.00 H new ATOM 0 HG2 GLU B 53 -6.235 -4.935 5.441 1.00 0.00 H new ATOM 0 HG3 GLU B 53 -7.847 -5.390 4.928 1.00 0.00 H new ATOM 870 N ASN B 54 -8.555 -4.059 2.007 1.00 0.00 N ATOM 871 CA ASN B 54 -9.878 -3.455 1.977 1.00 0.00 C ATOM 872 C ASN B 54 -10.869 -4.315 2.734 1.00 0.00 C ATOM 873 O ASN B 54 -11.233 -5.400 2.283 1.00 0.00 O ATOM 874 CB ASN B 54 -10.359 -3.290 0.541 1.00 0.00 C ATOM 875 CG ASN B 54 -11.608 -2.434 0.422 1.00 0.00 C ATOM 876 OD1 ASN B 54 -12.424 -2.634 -0.475 1.00 0.00 O ATOM 877 ND2 ASN B 54 -11.766 -1.468 1.314 1.00 0.00 N ATOM 0 H ASN B 54 -8.400 -4.768 1.291 1.00 0.00 H new ATOM 0 HA ASN B 54 -9.810 -2.475 2.450 1.00 0.00 H new ATOM 0 HB2 ASN B 54 -9.562 -2.843 -0.053 1.00 0.00 H new ATOM 0 HB3 ASN B 54 -10.559 -4.274 0.117 1.00 0.00 H new ATOM 0 HD21 ASN B 54 -12.585 -0.862 1.270 1.00 0.00 H new ATOM 0 HD22 ASN B 54 -11.069 -1.330 2.045 1.00 0.00 H new ATOM 884 N LYS B 55 -11.314 -3.826 3.870 1.00 0.00 N ATOM 885 CA LYS B 55 -12.287 -4.541 4.674 1.00 0.00 C ATOM 886 C LYS B 55 -13.439 -3.627 5.054 1.00 0.00 C ATOM 887 O LYS B 55 -13.388 -2.893 6.041 1.00 0.00 O ATOM 888 CB LYS B 55 -11.631 -5.135 5.918 1.00 0.00 C ATOM 889 CG LYS B 55 -10.786 -4.149 6.710 1.00 0.00 C ATOM 890 CD LYS B 55 -10.293 -4.774 8.001 1.00 0.00 C ATOM 891 CE LYS B 55 -9.575 -6.082 7.734 1.00 0.00 C ATOM 892 NZ LYS B 55 -9.030 -6.681 8.979 1.00 0.00 N ATOM 0 H LYS B 55 -11.017 -2.932 4.262 1.00 0.00 H new ATOM 0 HA LYS B 55 -12.685 -5.363 4.079 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -12.409 -5.534 6.569 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -11.004 -5.975 5.618 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -9.935 -3.828 6.109 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -11.373 -3.258 6.933 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -9.620 -4.083 8.509 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -11.136 -4.948 8.670 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -10.264 -6.785 7.265 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -8.763 -5.912 7.027 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -8.138 -7.172 8.767 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -8.854 -5.931 9.677 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -9.715 -7.361 9.366 1.00 0.00 H new ATOM 906 N ALA B 56 -14.475 -3.676 4.252 1.00 0.00 N ATOM 907 CA ALA B 56 -15.664 -2.875 4.479 1.00 0.00 C ATOM 908 C ALA B 56 -16.918 -3.724 4.319 1.00 0.00 C ATOM 909 O ALA B 56 -16.885 -4.764 3.663 1.00 0.00 O ATOM 910 CB ALA B 56 -15.691 -1.712 3.501 1.00 0.00 C ATOM 0 H ALA B 56 -14.522 -4.270 3.424 1.00 0.00 H new ATOM 0 HA ALA B 56 -15.639 -2.488 5.498 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -16.585 -1.112 3.674 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -14.805 -1.094 3.647 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -15.702 -2.095 2.481 1.00 0.00 H new ATOM 916 N PRO B 57 -18.042 -3.290 4.922 1.00 0.00 N ATOM 917 CA PRO B 57 -19.343 -3.953 4.761 1.00 0.00 C ATOM 918 C PRO B 57 -19.795 -3.949 3.311 1.00 0.00 C ATOM 919 O PRO B 57 -20.601 -4.779 2.892 1.00 0.00 O ATOM 920 CB PRO B 57 -20.296 -3.116 5.625 1.00 0.00 C ATOM 921 CG PRO B 57 -19.599 -1.814 5.827 1.00 0.00 C ATOM 922 CD PRO B 57 -18.133 -2.130 5.823 1.00 0.00 C ATOM 0 HA PRO B 57 -19.308 -5.001 5.057 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -21.256 -2.976 5.129 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -20.498 -3.607 6.577 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -19.849 -1.109 5.034 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -19.897 -1.353 6.769 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -17.541 -1.290 5.459 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -17.769 -2.367 6.823 1.00 0.00 H new ATOM 930 N ASN B 58 -19.261 -3.004 2.551 1.00 0.00 N ATOM 931 CA ASN B 58 -19.601 -2.868 1.143 1.00 0.00 C ATOM 932 C ASN B 58 -18.359 -2.539 0.329 1.00 0.00 C ATOM 933 O ASN B 58 -17.645 -3.440 -0.116 1.00 0.00 O ATOM 934 CB ASN B 58 -20.677 -1.791 0.955 1.00 0.00 C ATOM 935 CG ASN B 58 -21.975 -2.154 1.649 1.00 0.00 C ATOM 936 OD1 ASN B 58 -22.880 -2.723 1.043 1.00 0.00 O ATOM 937 ND2 ASN B 58 -22.067 -1.834 2.932 1.00 0.00 N ATOM 0 H ASN B 58 -18.587 -2.317 2.889 1.00 0.00 H new ATOM 0 HA ASN B 58 -20.002 -3.817 0.786 1.00 0.00 H new ATOM 0 HB2 ASN B 58 -20.311 -0.841 1.346 1.00 0.00 H new ATOM 0 HB3 ASN B 58 -20.863 -1.647 -0.109 1.00 0.00 H new ATOM 0 HD21 ASN B 58 -22.913 -2.060 3.455 1.00 0.00 H new ATOM 0 HD22 ASN B 58 -21.291 -1.362 3.397 1.00 0.00 H new ATOM 944 N SER B 59 -18.104 -1.247 0.165 1.00 0.00 N ATOM 945 CA SER B 59 -16.938 -0.741 -0.558 1.00 0.00 C ATOM 946 C SER B 59 -17.038 -1.002 -2.052 1.00 0.00 C ATOM 947 O SER B 59 -17.466 -2.068 -2.503 1.00 0.00 O ATOM 948 CB SER B 59 -15.637 -1.334 -0.012 1.00 0.00 C ATOM 949 OG SER B 59 -14.507 -0.877 -0.732 1.00 0.00 O ATOM 0 H SER B 59 -18.706 -0.511 0.533 1.00 0.00 H new ATOM 0 HA SER B 59 -16.922 0.338 -0.401 1.00 0.00 H new ATOM 0 HB2 SER B 59 -15.530 -1.068 1.040 1.00 0.00 H new ATOM 0 HB3 SER B 59 -15.684 -2.422 -0.062 1.00 0.00 H new ATOM 0 HG SER B 59 -13.817 -1.573 -0.734 1.00 0.00 H new ATOM 955 N LYS B 60 -16.636 -0.008 -2.810 1.00 0.00 N ATOM 956 CA LYS B 60 -16.589 -0.102 -4.254 1.00 0.00 C ATOM 957 C LYS B 60 -15.297 0.536 -4.745 1.00 0.00 C ATOM 958 O LYS B 60 -15.284 1.690 -5.177 1.00 0.00 O ATOM 959 CB LYS B 60 -17.811 0.581 -4.873 1.00 0.00 C ATOM 960 CG LYS B 60 -19.126 -0.090 -4.501 1.00 0.00 C ATOM 961 CD LYS B 60 -20.321 0.648 -5.074 1.00 0.00 C ATOM 962 CE LYS B 60 -21.628 0.060 -4.565 1.00 0.00 C ATOM 963 NZ LYS B 60 -21.823 -1.348 -5.004 1.00 0.00 N ATOM 0 H LYS B 60 -16.331 0.893 -2.442 1.00 0.00 H new ATOM 0 HA LYS B 60 -16.609 -1.148 -4.558 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -17.838 1.622 -4.552 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -17.707 0.584 -5.958 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -19.125 -1.117 -4.866 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -19.215 -0.137 -3.416 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -20.264 1.702 -4.804 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -20.296 0.596 -6.162 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -21.644 0.104 -3.476 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -22.460 0.668 -4.921 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -22.756 -1.683 -4.691 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -21.767 -1.399 -6.041 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -21.082 -1.947 -4.587 1.00 0.00 H new ATOM 977 N PRO B 61 -14.180 -0.207 -4.639 1.00 0.00 N ATOM 978 CA PRO B 61 -12.850 0.294 -4.993 1.00 0.00 C ATOM 979 C PRO B 61 -12.747 0.699 -6.457 1.00 0.00 C ATOM 980 O PRO B 61 -13.229 0.007 -7.354 1.00 0.00 O ATOM 981 CB PRO B 61 -11.918 -0.883 -4.699 1.00 0.00 C ATOM 982 CG PRO B 61 -12.801 -2.079 -4.686 1.00 0.00 C ATOM 983 CD PRO B 61 -14.128 -1.603 -4.171 1.00 0.00 C ATOM 0 HA PRO B 61 -12.604 1.195 -4.431 1.00 0.00 H new ATOM 0 HB2 PRO B 61 -11.143 -0.973 -5.460 1.00 0.00 H new ATOM 0 HB3 PRO B 61 -11.411 -0.756 -3.742 1.00 0.00 H new ATOM 0 HG2 PRO B 61 -12.899 -2.503 -5.685 1.00 0.00 H new ATOM 0 HG3 PRO B 61 -12.391 -2.861 -4.046 1.00 0.00 H new ATOM 0 HD2 PRO B 61 -14.952 -2.194 -4.570 1.00 0.00 H new ATOM 0 HD3 PRO B 61 -14.187 -1.668 -3.084 1.00 0.00 H new ATOM 991 N ASP B 62 -12.105 1.833 -6.668 1.00 0.00 N ATOM 992 CA ASP B 62 -11.936 2.408 -7.995 1.00 0.00 C ATOM 993 C ASP B 62 -10.766 1.750 -8.722 1.00 0.00 C ATOM 994 O ASP B 62 -10.964 0.946 -9.631 1.00 0.00 O ATOM 995 CB ASP B 62 -11.724 3.921 -7.866 1.00 0.00 C ATOM 996 CG ASP B 62 -11.369 4.597 -9.171 1.00 0.00 C ATOM 997 OD1 ASP B 62 -12.262 4.764 -10.028 1.00 0.00 O ATOM 998 OD2 ASP B 62 -10.195 4.984 -9.333 1.00 0.00 O ATOM 0 H ASP B 62 -11.683 2.386 -5.922 1.00 0.00 H new ATOM 0 HA ASP B 62 -12.833 2.225 -8.586 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -12.632 4.374 -7.467 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -10.931 4.108 -7.142 1.00 0.00 H new ATOM 1003 N ARG B 63 -9.552 2.091 -8.315 1.00 0.00 N ATOM 1004 CA ARG B 63 -8.347 1.473 -8.852 1.00 0.00 C ATOM 1005 C ARG B 63 -7.166 1.834 -7.970 1.00 0.00 C ATOM 1006 O ARG B 63 -7.313 2.611 -7.030 1.00 0.00 O ATOM 1007 CB ARG B 63 -8.095 1.946 -10.282 1.00 0.00 C ATOM 1008 CG ARG B 63 -7.809 3.432 -10.386 1.00 0.00 C ATOM 1009 CD ARG B 63 -8.095 3.941 -11.780 1.00 0.00 C ATOM 1010 NE ARG B 63 -7.904 5.385 -11.887 1.00 0.00 N ATOM 1011 CZ ARG B 63 -8.545 6.154 -12.764 1.00 0.00 C ATOM 1012 NH1 ARG B 63 -9.394 5.614 -13.631 1.00 0.00 N ATOM 1013 NH2 ARG B 63 -8.326 7.461 -12.780 1.00 0.00 N ATOM 0 H ARG B 63 -9.374 2.802 -7.605 1.00 0.00 H new ATOM 0 HA ARG B 63 -8.476 0.391 -8.867 1.00 0.00 H new ATOM 0 HB2 ARG B 63 -7.253 1.392 -10.696 1.00 0.00 H new ATOM 0 HB3 ARG B 63 -8.965 1.708 -10.894 1.00 0.00 H new ATOM 0 HG2 ARG B 63 -8.419 3.975 -9.664 1.00 0.00 H new ATOM 0 HG3 ARG B 63 -6.767 3.624 -10.131 1.00 0.00 H new ATOM 0 HD2 ARG B 63 -7.442 3.436 -12.491 1.00 0.00 H new ATOM 0 HD3 ARG B 63 -9.120 3.690 -12.054 1.00 0.00 H new ATOM 0 HE ARG B 63 -7.241 5.830 -11.253 1.00 0.00 H new ATOM 0 HH11 ARG B 63 -9.556 4.607 -13.626 1.00 0.00 H new ATOM 0 HH12 ARG B 63 -9.884 6.206 -14.302 1.00 0.00 H new ATOM 0 HH21 ARG B 63 -7.667 7.876 -12.121 1.00 0.00 H new ATOM 0 HH22 ARG B 63 -8.816 8.052 -13.451 1.00 0.00 H new ATOM 1027 N PHE B 64 -6.007 1.274 -8.263 1.00 0.00 N ATOM 1028 CA PHE B 64 -4.809 1.578 -7.499 1.00 0.00 C ATOM 1029 C PHE B 64 -3.778 2.284 -8.363 1.00 0.00 C ATOM 1030 O PHE B 64 -3.283 1.722 -9.338 1.00 0.00 O ATOM 1031 CB PHE B 64 -4.211 0.302 -6.906 1.00 0.00 C ATOM 1032 CG PHE B 64 -5.040 -0.286 -5.803 1.00 0.00 C ATOM 1033 CD1 PHE B 64 -4.892 0.166 -4.505 1.00 0.00 C ATOM 1034 CD2 PHE B 64 -5.964 -1.282 -6.063 1.00 0.00 C ATOM 1035 CE1 PHE B 64 -5.651 -0.366 -3.480 1.00 0.00 C ATOM 1036 CE2 PHE B 64 -6.728 -1.817 -5.044 1.00 0.00 C ATOM 1037 CZ PHE B 64 -6.571 -1.359 -3.751 1.00 0.00 C ATOM 0 H PHE B 64 -5.869 0.607 -9.023 1.00 0.00 H new ATOM 0 HA PHE B 64 -5.092 2.245 -6.685 1.00 0.00 H new ATOM 0 HB2 PHE B 64 -4.095 -0.438 -7.698 1.00 0.00 H new ATOM 0 HB3 PHE B 64 -3.213 0.520 -6.524 1.00 0.00 H new ATOM 0 HD1 PHE B 64 -4.175 0.944 -4.289 1.00 0.00 H new ATOM 0 HD2 PHE B 64 -6.089 -1.645 -7.072 1.00 0.00 H new ATOM 0 HE1 PHE B 64 -5.525 -0.006 -2.470 1.00 0.00 H new ATOM 0 HE2 PHE B 64 -7.448 -2.593 -5.259 1.00 0.00 H new ATOM 0 HZ PHE B 64 -7.167 -1.777 -2.953 1.00 0.00 H new ATOM 1047 N SER B 65 -3.472 3.521 -8.015 1.00 0.00 N ATOM 1048 CA SER B 65 -2.437 4.270 -8.708 1.00 0.00 C ATOM 1049 C SER B 65 -1.572 5.014 -7.695 1.00 0.00 C ATOM 1050 O SER B 65 -1.739 6.214 -7.476 1.00 0.00 O ATOM 1051 CB SER B 65 -3.070 5.253 -9.700 1.00 0.00 C ATOM 1052 OG SER B 65 -3.950 4.579 -10.588 1.00 0.00 O ATOM 0 H SER B 65 -3.926 4.029 -7.256 1.00 0.00 H new ATOM 0 HA SER B 65 -1.807 3.577 -9.266 1.00 0.00 H new ATOM 0 HB2 SER B 65 -3.616 6.024 -9.156 1.00 0.00 H new ATOM 0 HB3 SER B 65 -2.288 5.757 -10.269 1.00 0.00 H new ATOM 0 HG SER B 65 -4.344 5.225 -11.211 1.00 0.00 H new ATOM 1058 N PRO B 66 -0.631 4.295 -7.067 1.00 0.00 N ATOM 1059 CA PRO B 66 0.249 4.857 -6.042 1.00 0.00 C ATOM 1060 C PRO B 66 1.421 5.652 -6.615 1.00 0.00 C ATOM 1061 O PRO B 66 1.811 5.475 -7.774 1.00 0.00 O ATOM 1062 CB PRO B 66 0.756 3.615 -5.309 1.00 0.00 C ATOM 1063 CG PRO B 66 0.727 2.525 -6.326 1.00 0.00 C ATOM 1064 CD PRO B 66 -0.380 2.857 -7.287 1.00 0.00 C ATOM 0 HA PRO B 66 -0.278 5.573 -5.411 1.00 0.00 H new ATOM 0 HB2 PRO B 66 1.764 3.768 -4.924 1.00 0.00 H new ATOM 0 HB3 PRO B 66 0.122 3.375 -4.455 1.00 0.00 H new ATOM 0 HG2 PRO B 66 1.683 2.456 -6.846 1.00 0.00 H new ATOM 0 HG3 PRO B 66 0.551 1.559 -5.853 1.00 0.00 H new ATOM 0 HD2 PRO B 66 -0.086 2.657 -8.317 1.00 0.00 H new ATOM 0 HD3 PRO B 66 -1.272 2.262 -7.089 1.00 0.00 H new ATOM 1072 N SER B 67 1.978 6.532 -5.795 1.00 0.00 N ATOM 1073 CA SER B 67 3.149 7.314 -6.180 1.00 0.00 C ATOM 1074 C SER B 67 3.874 7.817 -4.937 1.00 0.00 C ATOM 1075 O SER B 67 3.250 8.080 -3.905 1.00 0.00 O ATOM 1076 CB SER B 67 2.764 8.493 -7.086 1.00 0.00 C ATOM 1077 OG SER B 67 1.958 9.437 -6.406 1.00 0.00 O ATOM 0 H SER B 67 1.637 6.724 -4.853 1.00 0.00 H new ATOM 0 HA SER B 67 3.817 6.664 -6.746 1.00 0.00 H new ATOM 0 HB2 SER B 67 3.668 8.982 -7.450 1.00 0.00 H new ATOM 0 HB3 SER B 67 2.229 8.121 -7.960 1.00 0.00 H new ATOM 0 HG SER B 67 1.170 8.988 -6.035 1.00 0.00 H new ATOM 1083 N TYR B 68 5.188 7.938 -5.037 1.00 0.00 N ATOM 1084 CA TYR B 68 6.002 8.352 -3.912 1.00 0.00 C ATOM 1085 C TYR B 68 6.497 9.775 -4.098 1.00 0.00 C ATOM 1086 O TYR B 68 7.227 10.078 -5.042 1.00 0.00 O ATOM 1087 CB TYR B 68 7.192 7.411 -3.733 1.00 0.00 C ATOM 1088 CG TYR B 68 8.148 7.849 -2.648 1.00 0.00 C ATOM 1089 CD1 TYR B 68 7.742 7.917 -1.322 1.00 0.00 C ATOM 1090 CD2 TYR B 68 9.452 8.206 -2.954 1.00 0.00 C ATOM 1091 CE1 TYR B 68 8.609 8.327 -0.332 1.00 0.00 C ATOM 1092 CE2 TYR B 68 10.325 8.619 -1.967 1.00 0.00 C ATOM 1093 CZ TYR B 68 9.899 8.676 -0.658 1.00 0.00 C ATOM 1094 OH TYR B 68 10.763 9.087 0.330 1.00 0.00 O ATOM 0 H TYR B 68 5.713 7.754 -5.892 1.00 0.00 H new ATOM 0 HA TYR B 68 5.380 8.311 -3.018 1.00 0.00 H new ATOM 0 HB2 TYR B 68 6.823 6.412 -3.500 1.00 0.00 H new ATOM 0 HB3 TYR B 68 7.733 7.339 -4.676 1.00 0.00 H new ATOM 0 HD1 TYR B 68 6.730 7.644 -1.062 1.00 0.00 H new ATOM 0 HD2 TYR B 68 9.790 8.160 -3.979 1.00 0.00 H new ATOM 0 HE1 TYR B 68 8.277 8.374 0.695 1.00 0.00 H new ATOM 0 HE2 TYR B 68 11.338 8.896 -2.220 1.00 0.00 H new ATOM 0 HH TYR B 68 11.650 8.704 0.169 1.00 0.00 H new ATOM 1104 N ASN B 69 6.094 10.642 -3.195 1.00 0.00 N ATOM 1105 CA ASN B 69 6.552 12.018 -3.211 1.00 0.00 C ATOM 1106 C ASN B 69 7.666 12.221 -2.196 1.00 0.00 C ATOM 1107 O ASN B 69 7.435 12.186 -0.989 1.00 0.00 O ATOM 1108 CB ASN B 69 5.387 12.987 -2.960 1.00 0.00 C ATOM 1109 CG ASN B 69 4.413 12.508 -1.896 1.00 0.00 C ATOM 1110 OD1 ASN B 69 3.501 11.735 -2.180 1.00 0.00 O ATOM 1111 ND2 ASN B 69 4.577 12.989 -0.676 1.00 0.00 N ATOM 0 H ASN B 69 5.448 10.420 -2.437 1.00 0.00 H new ATOM 0 HA ASN B 69 6.954 12.235 -4.201 1.00 0.00 H new ATOM 0 HB2 ASN B 69 5.789 13.955 -2.662 1.00 0.00 H new ATOM 0 HB3 ASN B 69 4.845 13.140 -3.894 1.00 0.00 H new ATOM 0 HD21 ASN B 69 3.934 12.720 0.069 1.00 0.00 H new ATOM 0 HD22 ASN B 69 5.347 13.629 -0.479 1.00 0.00 H new ATOM 1118 N PHE B 70 8.881 12.434 -2.706 1.00 0.00 N ATOM 1119 CA PHE B 70 10.071 12.603 -1.869 1.00 0.00 C ATOM 1120 C PHE B 70 9.916 13.802 -0.955 1.00 0.00 C ATOM 1121 O PHE B 70 10.400 13.804 0.177 1.00 0.00 O ATOM 1122 CB PHE B 70 11.320 12.809 -2.732 1.00 0.00 C ATOM 1123 CG PHE B 70 11.741 11.610 -3.527 1.00 0.00 C ATOM 1124 CD1 PHE B 70 11.131 11.314 -4.732 1.00 0.00 C ATOM 1125 CD2 PHE B 70 12.759 10.787 -3.074 1.00 0.00 C ATOM 1126 CE1 PHE B 70 11.527 10.220 -5.471 1.00 0.00 C ATOM 1127 CE2 PHE B 70 13.159 9.689 -3.808 1.00 0.00 C ATOM 1128 CZ PHE B 70 12.542 9.404 -5.009 1.00 0.00 C ATOM 0 H PHE B 70 9.067 12.494 -3.707 1.00 0.00 H new ATOM 0 HA PHE B 70 10.182 11.696 -1.274 1.00 0.00 H new ATOM 0 HB2 PHE B 70 11.138 13.636 -3.418 1.00 0.00 H new ATOM 0 HB3 PHE B 70 12.146 13.107 -2.086 1.00 0.00 H new ATOM 0 HD1 PHE B 70 10.336 11.947 -5.098 1.00 0.00 H new ATOM 0 HD2 PHE B 70 13.245 11.007 -2.135 1.00 0.00 H new ATOM 0 HE1 PHE B 70 11.044 10.000 -6.412 1.00 0.00 H new ATOM 0 HE2 PHE B 70 13.953 9.054 -3.443 1.00 0.00 H new ATOM 0 HZ PHE B 70 12.852 8.545 -5.586 1.00 0.00 H new ATOM 1138 N ALA B 71 9.222 14.811 -1.466 1.00 0.00 N ATOM 1139 CA ALA B 71 9.016 16.061 -0.754 1.00 0.00 C ATOM 1140 C ALA B 71 8.470 15.827 0.651 1.00 0.00 C ATOM 1141 O ALA B 71 8.934 16.435 1.613 1.00 0.00 O ATOM 1142 CB ALA B 71 8.079 16.949 -1.554 1.00 0.00 C ATOM 0 H ALA B 71 8.786 14.783 -2.388 1.00 0.00 H new ATOM 0 HA ALA B 71 9.980 16.557 -0.643 1.00 0.00 H new ATOM 0 HB1 ALA B 71 7.923 17.887 -1.021 1.00 0.00 H new ATOM 0 HB2 ALA B 71 8.518 17.155 -2.530 1.00 0.00 H new ATOM 0 HB3 ALA B 71 7.122 16.443 -1.685 1.00 0.00 H new ATOM 1148 N GLU B 72 7.494 14.935 0.768 1.00 0.00 N ATOM 1149 CA GLU B 72 6.898 14.633 2.064 1.00 0.00 C ATOM 1150 C GLU B 72 7.262 13.220 2.490 1.00 0.00 C ATOM 1151 O GLU B 72 6.787 12.729 3.511 1.00 0.00 O ATOM 1152 CB GLU B 72 5.377 14.753 2.003 1.00 0.00 C ATOM 1153 CG GLU B 72 4.876 15.897 1.139 1.00 0.00 C ATOM 1154 CD GLU B 72 5.242 17.260 1.688 1.00 0.00 C ATOM 1155 OE1 GLU B 72 4.571 17.729 2.631 1.00 0.00 O ATOM 1156 OE2 GLU B 72 6.192 17.878 1.174 1.00 0.00 O ATOM 0 H GLU B 72 7.100 14.411 -0.013 1.00 0.00 H new ATOM 0 HA GLU B 72 7.286 15.351 2.787 1.00 0.00 H new ATOM 0 HB2 GLU B 72 4.965 13.818 1.623 1.00 0.00 H new ATOM 0 HB3 GLU B 72 4.993 14.882 3.015 1.00 0.00 H new ATOM 0 HG2 GLU B 72 5.288 15.794 0.135 1.00 0.00 H new ATOM 0 HG3 GLU B 72 3.792 15.828 1.048 1.00 0.00 H new ATOM 1163 N ASN B 73 8.101 12.580 1.663 1.00 0.00 N ATOM 1164 CA ASN B 73 8.538 11.182 1.841 1.00 0.00 C ATOM 1165 C ASN B 73 7.357 10.262 2.132 1.00 0.00 C ATOM 1166 O ASN B 73 7.414 9.393 3.006 1.00 0.00 O ATOM 1167 CB ASN B 73 9.639 11.039 2.918 1.00 0.00 C ATOM 1168 CG ASN B 73 9.264 11.628 4.264 1.00 0.00 C ATOM 1169 OD1 ASN B 73 9.580 12.781 4.561 1.00 0.00 O ATOM 1170 ND2 ASN B 73 8.584 10.849 5.084 1.00 0.00 N ATOM 0 H ASN B 73 8.503 13.024 0.837 1.00 0.00 H new ATOM 0 HA ASN B 73 8.981 10.871 0.895 1.00 0.00 H new ATOM 0 HB2 ASN B 73 9.871 9.982 3.047 1.00 0.00 H new ATOM 0 HB3 ASN B 73 10.548 11.524 2.561 1.00 0.00 H new ATOM 0 HD21 ASN B 73 8.301 11.196 6.000 1.00 0.00 H new ATOM 0 HD22 ASN B 73 8.341 9.900 4.801 1.00 0.00 H new ATOM 1177 N ILE B 74 6.291 10.447 1.364 1.00 0.00 N ATOM 1178 CA ILE B 74 5.073 9.674 1.542 1.00 0.00 C ATOM 1179 C ILE B 74 4.708 8.921 0.268 1.00 0.00 C ATOM 1180 O ILE B 74 4.783 9.465 -0.834 1.00 0.00 O ATOM 1181 CB ILE B 74 3.914 10.598 1.974 1.00 0.00 C ATOM 1182 CG1 ILE B 74 4.176 11.101 3.395 1.00 0.00 C ATOM 1183 CG2 ILE B 74 2.568 9.883 1.886 1.00 0.00 C ATOM 1184 CD1 ILE B 74 3.427 12.359 3.749 1.00 0.00 C ATOM 0 H ILE B 74 6.248 11.130 0.608 1.00 0.00 H new ATOM 0 HA ILE B 74 5.249 8.938 2.327 1.00 0.00 H new ATOM 0 HB ILE B 74 3.868 11.448 1.293 1.00 0.00 H new ATOM 0 HG12 ILE B 74 3.904 10.318 4.102 1.00 0.00 H new ATOM 0 HG13 ILE B 74 5.244 11.281 3.514 1.00 0.00 H new ATOM 0 HG21 ILE B 74 1.774 10.562 2.197 1.00 0.00 H new ATOM 0 HG22 ILE B 74 2.391 9.565 0.858 1.00 0.00 H new ATOM 0 HG23 ILE B 74 2.576 9.011 2.539 1.00 0.00 H new ATOM 0 HD11 ILE B 74 3.667 12.650 4.772 1.00 0.00 H new ATOM 0 HD12 ILE B 74 3.716 13.159 3.067 1.00 0.00 H new ATOM 0 HD13 ILE B 74 2.355 12.180 3.665 1.00 0.00 H new ATOM 1196 N LEU B 75 4.347 7.658 0.436 1.00 0.00 N ATOM 1197 CA LEU B 75 3.887 6.823 -0.660 1.00 0.00 C ATOM 1198 C LEU B 75 2.366 6.753 -0.606 1.00 0.00 C ATOM 1199 O LEU B 75 1.796 6.030 0.205 1.00 0.00 O ATOM 1200 CB LEU B 75 4.527 5.423 -0.539 1.00 0.00 C ATOM 1201 CG LEU B 75 4.215 4.400 -1.650 1.00 0.00 C ATOM 1202 CD1 LEU B 75 2.890 3.696 -1.401 1.00 0.00 C ATOM 1203 CD2 LEU B 75 4.208 5.067 -3.014 1.00 0.00 C ATOM 0 H LEU B 75 4.365 7.183 1.339 1.00 0.00 H new ATOM 0 HA LEU B 75 4.183 7.242 -1.622 1.00 0.00 H new ATOM 0 HB2 LEU B 75 5.609 5.550 -0.493 1.00 0.00 H new ATOM 0 HB3 LEU B 75 4.216 4.992 0.413 1.00 0.00 H new ATOM 0 HG LEU B 75 5.005 3.649 -1.633 1.00 0.00 H new ATOM 0 HD11 LEU B 75 2.701 2.982 -2.203 1.00 0.00 H new ATOM 0 HD12 LEU B 75 2.932 3.169 -0.448 1.00 0.00 H new ATOM 0 HD13 LEU B 75 2.086 4.432 -1.374 1.00 0.00 H new ATOM 0 HD21 LEU B 75 3.986 4.325 -3.781 1.00 0.00 H new ATOM 0 HD22 LEU B 75 3.448 5.848 -3.033 1.00 0.00 H new ATOM 0 HD23 LEU B 75 5.186 5.508 -3.208 1.00 0.00 H new ATOM 1215 N TYR B 76 1.704 7.527 -1.446 1.00 0.00 N ATOM 1216 CA TYR B 76 0.256 7.561 -1.431 1.00 0.00 C ATOM 1217 C TYR B 76 -0.284 6.422 -2.283 1.00 0.00 C ATOM 1218 O TYR B 76 0.317 6.054 -3.293 1.00 0.00 O ATOM 1219 CB TYR B 76 -0.259 8.923 -1.922 1.00 0.00 C ATOM 1220 CG TYR B 76 -0.965 8.880 -3.259 1.00 0.00 C ATOM 1221 CD1 TYR B 76 -0.246 8.908 -4.439 1.00 0.00 C ATOM 1222 CD2 TYR B 76 -2.347 8.803 -3.336 1.00 0.00 C ATOM 1223 CE1 TYR B 76 -0.882 8.861 -5.661 1.00 0.00 C ATOM 1224 CE2 TYR B 76 -2.992 8.759 -4.555 1.00 0.00 C ATOM 1225 CZ TYR B 76 -2.255 8.787 -5.714 1.00 0.00 C ATOM 1226 OH TYR B 76 -2.893 8.734 -6.933 1.00 0.00 O ATOM 0 H TYR B 76 2.141 8.134 -2.140 1.00 0.00 H new ATOM 0 HA TYR B 76 -0.100 7.430 -0.409 1.00 0.00 H new ATOM 0 HB2 TYR B 76 -0.943 9.329 -1.177 1.00 0.00 H new ATOM 0 HB3 TYR B 76 0.583 9.612 -1.991 1.00 0.00 H new ATOM 0 HD1 TYR B 76 0.832 8.968 -4.403 1.00 0.00 H new ATOM 0 HD2 TYR B 76 -2.929 8.777 -2.426 1.00 0.00 H new ATOM 0 HE1 TYR B 76 -0.305 8.882 -6.574 1.00 0.00 H new ATOM 0 HE2 TYR B 76 -4.070 8.703 -4.598 1.00 0.00 H new ATOM 0 HH TYR B 76 -2.660 7.898 -7.388 1.00 0.00 H new ATOM 1236 N ILE B 77 -1.400 5.854 -1.857 1.00 0.00 N ATOM 1237 CA ILE B 77 -2.021 4.759 -2.582 1.00 0.00 C ATOM 1238 C ILE B 77 -3.157 5.279 -3.453 1.00 0.00 C ATOM 1239 O ILE B 77 -3.136 5.136 -4.674 1.00 0.00 O ATOM 1240 CB ILE B 77 -2.567 3.685 -1.613 1.00 0.00 C ATOM 1241 CG1 ILE B 77 -1.425 3.036 -0.820 1.00 0.00 C ATOM 1242 CG2 ILE B 77 -3.361 2.633 -2.373 1.00 0.00 C ATOM 1243 CD1 ILE B 77 -0.416 2.304 -1.681 1.00 0.00 C ATOM 0 H ILE B 77 -1.895 6.134 -1.010 1.00 0.00 H new ATOM 0 HA ILE B 77 -1.257 4.303 -3.212 1.00 0.00 H new ATOM 0 HB ILE B 77 -3.236 4.173 -0.904 1.00 0.00 H new ATOM 0 HG12 ILE B 77 -0.908 3.808 -0.249 1.00 0.00 H new ATOM 0 HG13 ILE B 77 -1.848 2.336 -0.100 1.00 0.00 H new ATOM 0 HG21 ILE B 77 -3.737 1.886 -1.674 1.00 0.00 H new ATOM 0 HG22 ILE B 77 -4.199 3.108 -2.883 1.00 0.00 H new ATOM 0 HG23 ILE B 77 -2.716 2.151 -3.108 1.00 0.00 H new ATOM 0 HD11 ILE B 77 0.359 1.873 -1.047 1.00 0.00 H new ATOM 0 HD12 ILE B 77 -0.917 1.509 -2.232 1.00 0.00 H new ATOM 0 HD13 ILE B 77 0.037 3.003 -2.384 1.00 0.00 H new ATOM 1255 N ASN B 78 -4.136 5.897 -2.809 1.00 0.00 N ATOM 1256 CA ASN B 78 -5.294 6.454 -3.495 1.00 0.00 C ATOM 1257 C ASN B 78 -5.732 7.725 -2.794 1.00 0.00 C ATOM 1258 O ASN B 78 -5.116 8.134 -1.810 1.00 0.00 O ATOM 1259 CB ASN B 78 -6.456 5.453 -3.515 1.00 0.00 C ATOM 1260 CG ASN B 78 -6.306 4.383 -4.578 1.00 0.00 C ATOM 1261 OD1 ASN B 78 -5.731 4.618 -5.642 1.00 0.00 O ATOM 1262 ND2 ASN B 78 -6.826 3.199 -4.301 1.00 0.00 N ATOM 0 H ASN B 78 -4.151 6.027 -1.797 1.00 0.00 H new ATOM 0 HA ASN B 78 -5.013 6.674 -4.525 1.00 0.00 H new ATOM 0 HB2 ASN B 78 -6.533 4.976 -2.538 1.00 0.00 H new ATOM 0 HB3 ASN B 78 -7.389 5.992 -3.681 1.00 0.00 H new ATOM 0 HD21 ASN B 78 -6.759 2.441 -4.980 1.00 0.00 H new ATOM 0 HD22 ASN B 78 -7.294 3.044 -3.408 1.00 0.00 H new ATOM 1269 N GLY B 79 -6.804 8.334 -3.276 1.00 0.00 N ATOM 1270 CA GLY B 79 -7.345 9.509 -2.619 1.00 0.00 C ATOM 1271 C GLY B 79 -8.045 9.155 -1.322 1.00 0.00 C ATOM 1272 O GLY B 79 -8.623 10.012 -0.656 1.00 0.00 O ATOM 0 H GLY B 79 -7.310 8.037 -4.110 1.00 0.00 H new ATOM 0 HA2 GLY B 79 -6.540 10.216 -2.417 1.00 0.00 H new ATOM 0 HA3 GLY B 79 -8.047 10.008 -3.287 1.00 0.00 H new ATOM 1276 N LYS B 80 -7.987 7.880 -0.967 1.00 0.00 N ATOM 1277 CA LYS B 80 -8.602 7.384 0.247 1.00 0.00 C ATOM 1278 C LYS B 80 -7.606 7.460 1.388 1.00 0.00 C ATOM 1279 O LYS B 80 -7.954 7.821 2.513 1.00 0.00 O ATOM 1280 CB LYS B 80 -9.053 5.936 0.052 1.00 0.00 C ATOM 1281 CG LYS B 80 -9.826 5.709 -1.235 1.00 0.00 C ATOM 1282 CD LYS B 80 -11.112 6.518 -1.264 1.00 0.00 C ATOM 1283 CE LYS B 80 -11.913 6.259 -2.530 1.00 0.00 C ATOM 1284 NZ LYS B 80 -13.160 7.067 -2.574 1.00 0.00 N ATOM 0 H LYS B 80 -7.511 7.163 -1.515 1.00 0.00 H new ATOM 0 HA LYS B 80 -9.472 7.997 0.483 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -8.177 5.287 0.059 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -9.675 5.641 0.897 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -9.204 5.983 -2.087 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -10.059 4.649 -1.338 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -11.718 6.269 -0.393 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -10.875 7.580 -1.194 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -11.300 6.491 -3.401 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -12.165 5.200 -2.590 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -13.676 6.861 -3.453 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -13.758 6.828 -1.757 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -12.920 8.078 -2.543 1.00 0.00 H new ATOM 1298 N LEU B 81 -6.360 7.117 1.086 1.00 0.00 N ATOM 1299 CA LEU B 81 -5.306 7.129 2.087 1.00 0.00 C ATOM 1300 C LEU B 81 -3.919 7.179 1.462 1.00 0.00 C ATOM 1301 O LEU B 81 -3.711 6.752 0.320 1.00 0.00 O ATOM 1302 CB LEU B 81 -5.424 5.929 3.040 1.00 0.00 C ATOM 1303 CG LEU B 81 -5.674 4.557 2.401 1.00 0.00 C ATOM 1304 CD1 LEU B 81 -4.495 4.108 1.555 1.00 0.00 C ATOM 1305 CD2 LEU B 81 -5.951 3.538 3.483 1.00 0.00 C ATOM 0 H LEU B 81 -6.057 6.828 0.156 1.00 0.00 H new ATOM 0 HA LEU B 81 -5.438 8.043 2.666 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -4.506 5.869 3.625 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -6.235 6.130 3.740 1.00 0.00 H new ATOM 0 HG LEU B 81 -6.539 4.643 1.743 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -4.710 3.132 1.120 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -4.323 4.831 0.758 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -3.605 4.038 2.180 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -6.129 2.563 3.028 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -5.093 3.475 4.152 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -6.832 3.840 4.050 1.00 0.00 H new ATOM 1317 N SER B 82 -2.986 7.729 2.214 1.00 0.00 N ATOM 1318 CA SER B 82 -1.593 7.754 1.820 1.00 0.00 C ATOM 1319 C SER B 82 -0.750 7.043 2.872 1.00 0.00 C ATOM 1320 O SER B 82 -1.090 7.061 4.056 1.00 0.00 O ATOM 1321 CB SER B 82 -1.125 9.199 1.637 1.00 0.00 C ATOM 1322 OG SER B 82 -1.449 9.986 2.770 1.00 0.00 O ATOM 0 H SER B 82 -3.173 8.170 3.114 1.00 0.00 H new ATOM 0 HA SER B 82 -1.477 7.234 0.869 1.00 0.00 H new ATOM 0 HB2 SER B 82 -0.048 9.218 1.473 1.00 0.00 H new ATOM 0 HB3 SER B 82 -1.590 9.626 0.748 1.00 0.00 H new ATOM 0 HG SER B 82 -1.138 10.905 2.630 1.00 0.00 H new ATOM 1328 N ILE B 83 0.325 6.400 2.445 1.00 0.00 N ATOM 1329 CA ILE B 83 1.193 5.681 3.364 1.00 0.00 C ATOM 1330 C ILE B 83 2.456 6.488 3.641 1.00 0.00 C ATOM 1331 O ILE B 83 3.350 6.570 2.799 1.00 0.00 O ATOM 1332 CB ILE B 83 1.575 4.291 2.809 1.00 0.00 C ATOM 1333 CG1 ILE B 83 0.314 3.464 2.532 1.00 0.00 C ATOM 1334 CG2 ILE B 83 2.498 3.560 3.774 1.00 0.00 C ATOM 1335 CD1 ILE B 83 -0.590 3.302 3.737 1.00 0.00 C ATOM 0 H ILE B 83 0.617 6.361 1.469 1.00 0.00 H new ATOM 0 HA ILE B 83 0.643 5.539 4.294 1.00 0.00 H new ATOM 0 HB ILE B 83 2.111 4.429 1.870 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -0.250 3.937 1.728 1.00 0.00 H new ATOM 0 HG13 ILE B 83 0.609 2.477 2.176 1.00 0.00 H new ATOM 0 HG21 ILE B 83 2.754 2.583 3.363 1.00 0.00 H new ATOM 0 HG22 ILE B 83 3.408 4.143 3.919 1.00 0.00 H new ATOM 0 HG23 ILE B 83 1.994 3.430 4.732 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -1.460 2.706 3.462 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -0.044 2.800 4.536 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -0.917 4.283 4.081 1.00 0.00 H new ATOM 1347 N PRO B 84 2.536 7.114 4.817 1.00 0.00 N ATOM 1348 CA PRO B 84 3.687 7.920 5.191 1.00 0.00 C ATOM 1349 C PRO B 84 4.838 7.083 5.722 1.00 0.00 C ATOM 1350 O PRO B 84 4.663 6.239 6.603 1.00 0.00 O ATOM 1351 CB PRO B 84 3.135 8.831 6.278 1.00 0.00 C ATOM 1352 CG PRO B 84 2.040 8.044 6.919 1.00 0.00 C ATOM 1353 CD PRO B 84 1.509 7.094 5.873 1.00 0.00 C ATOM 0 HA PRO B 84 4.106 8.455 4.339 1.00 0.00 H new ATOM 0 HB2 PRO B 84 3.907 9.096 7.001 1.00 0.00 H new ATOM 0 HB3 PRO B 84 2.758 9.764 5.858 1.00 0.00 H new ATOM 0 HG2 PRO B 84 2.414 7.496 7.784 1.00 0.00 H new ATOM 0 HG3 PRO B 84 1.250 8.704 7.278 1.00 0.00 H new ATOM 0 HD2 PRO B 84 1.372 6.091 6.278 1.00 0.00 H new ATOM 0 HD3 PRO B 84 0.540 7.419 5.494 1.00 0.00 H new ATOM 1361 N LEU B 85 6.015 7.329 5.183 1.00 0.00 N ATOM 1362 CA LEU B 85 7.201 6.598 5.586 1.00 0.00 C ATOM 1363 C LEU B 85 7.975 7.396 6.622 1.00 0.00 C ATOM 1364 O LEU B 85 7.958 8.628 6.605 1.00 0.00 O ATOM 1365 CB LEU B 85 8.105 6.297 4.379 1.00 0.00 C ATOM 1366 CG LEU B 85 7.543 5.315 3.342 1.00 0.00 C ATOM 1367 CD1 LEU B 85 6.929 4.099 4.021 1.00 0.00 C ATOM 1368 CD2 LEU B 85 6.532 5.995 2.434 1.00 0.00 C ATOM 0 H LEU B 85 6.177 8.032 4.462 1.00 0.00 H new ATOM 0 HA LEU B 85 6.883 5.650 6.020 1.00 0.00 H new ATOM 0 HB2 LEU B 85 8.329 7.237 3.875 1.00 0.00 H new ATOM 0 HB3 LEU B 85 9.051 5.901 4.749 1.00 0.00 H new ATOM 0 HG LEU B 85 8.373 4.974 2.723 1.00 0.00 H new ATOM 0 HD11 LEU B 85 6.538 3.419 3.265 1.00 0.00 H new ATOM 0 HD12 LEU B 85 7.691 3.588 4.610 1.00 0.00 H new ATOM 0 HD13 LEU B 85 6.118 4.419 4.676 1.00 0.00 H new ATOM 0 HD21 LEU B 85 6.151 5.275 1.710 1.00 0.00 H new ATOM 0 HD22 LEU B 85 5.706 6.379 3.033 1.00 0.00 H new ATOM 0 HD23 LEU B 85 7.013 6.819 1.907 1.00 0.00 H new ATOM 1380 N PRO B 86 8.637 6.705 7.559 1.00 0.00 N ATOM 1381 CA PRO B 86 9.484 7.356 8.551 1.00 0.00 C ATOM 1382 C PRO B 86 10.689 8.024 7.899 1.00 0.00 C ATOM 1383 O PRO B 86 11.297 7.476 6.979 1.00 0.00 O ATOM 1384 CB PRO B 86 9.925 6.213 9.470 1.00 0.00 C ATOM 1385 CG PRO B 86 9.754 4.978 8.659 1.00 0.00 C ATOM 1386 CD PRO B 86 8.608 5.241 7.726 1.00 0.00 C ATOM 0 HA PRO B 86 8.961 8.149 9.085 1.00 0.00 H new ATOM 0 HB2 PRO B 86 10.961 6.338 9.785 1.00 0.00 H new ATOM 0 HB3 PRO B 86 9.318 6.178 10.375 1.00 0.00 H new ATOM 0 HG2 PRO B 86 10.663 4.749 8.103 1.00 0.00 H new ATOM 0 HG3 PRO B 86 9.546 4.119 9.298 1.00 0.00 H new ATOM 0 HD2 PRO B 86 8.737 4.725 6.775 1.00 0.00 H new ATOM 0 HD3 PRO B 86 7.661 4.903 8.146 1.00 0.00 H new ATOM 1394 N ARG B 87 11.038 9.199 8.400 1.00 0.00 N ATOM 1395 CA ARG B 87 12.113 10.005 7.829 1.00 0.00 C ATOM 1396 C ARG B 87 13.466 9.392 8.154 1.00 0.00 C ATOM 1397 O ARG B 87 14.503 9.849 7.678 1.00 0.00 O ATOM 1398 CB ARG B 87 12.063 11.442 8.366 1.00 0.00 C ATOM 1399 CG ARG B 87 10.951 12.307 7.782 1.00 0.00 C ATOM 1400 CD ARG B 87 9.568 11.745 8.071 1.00 0.00 C ATOM 1401 NE ARG B 87 9.326 11.564 9.500 1.00 0.00 N ATOM 1402 CZ ARG B 87 8.409 10.739 10.001 1.00 0.00 C ATOM 1403 NH1 ARG B 87 7.622 10.040 9.191 1.00 0.00 N ATOM 1404 NH2 ARG B 87 8.274 10.618 11.310 1.00 0.00 N ATOM 0 H ARG B 87 10.587 9.622 9.211 1.00 0.00 H new ATOM 0 HA ARG B 87 11.976 10.027 6.748 1.00 0.00 H new ATOM 0 HB2 ARG B 87 11.945 11.406 9.449 1.00 0.00 H new ATOM 0 HB3 ARG B 87 13.021 11.923 8.166 1.00 0.00 H new ATOM 0 HG2 ARG B 87 11.024 13.314 8.192 1.00 0.00 H new ATOM 0 HG3 ARG B 87 11.088 12.391 6.704 1.00 0.00 H new ATOM 0 HD2 ARG B 87 8.813 12.416 7.660 1.00 0.00 H new ATOM 0 HD3 ARG B 87 9.455 10.788 7.562 1.00 0.00 H new ATOM 0 HE ARG B 87 9.894 12.102 10.154 1.00 0.00 H new ATOM 0 HH11 ARG B 87 7.719 10.134 8.180 1.00 0.00 H new ATOM 0 HH12 ARG B 87 6.921 9.409 9.580 1.00 0.00 H new ATOM 0 HH21 ARG B 87 8.872 11.157 11.936 1.00 0.00 H new ATOM 0 HH22 ARG B 87 7.571 9.986 11.694 1.00 0.00 H new ATOM 1418 N ASP B 88 13.438 8.348 8.967 1.00 0.00 N ATOM 1419 CA ASP B 88 14.647 7.658 9.385 1.00 0.00 C ATOM 1420 C ASP B 88 15.096 6.674 8.306 1.00 0.00 C ATOM 1421 O ASP B 88 16.212 6.155 8.338 1.00 0.00 O ATOM 1422 CB ASP B 88 14.383 6.929 10.707 1.00 0.00 C ATOM 1423 CG ASP B 88 15.599 6.207 11.250 1.00 0.00 C ATOM 1424 OD1 ASP B 88 16.637 6.867 11.479 1.00 0.00 O ATOM 1425 OD2 ASP B 88 15.516 4.978 11.467 1.00 0.00 O ATOM 0 H ASP B 88 12.579 7.956 9.354 1.00 0.00 H new ATOM 0 HA ASP B 88 15.446 8.384 9.533 1.00 0.00 H new ATOM 0 HB2 ASP B 88 14.037 7.650 11.448 1.00 0.00 H new ATOM 0 HB3 ASP B 88 13.577 6.209 10.562 1.00 0.00 H new ATOM 1430 N ILE B 89 14.224 6.443 7.335 1.00 0.00 N ATOM 1431 CA ILE B 89 14.485 5.476 6.282 1.00 0.00 C ATOM 1432 C ILE B 89 14.602 6.165 4.928 1.00 0.00 C ATOM 1433 O ILE B 89 13.822 7.063 4.609 1.00 0.00 O ATOM 1434 CB ILE B 89 13.366 4.416 6.219 1.00 0.00 C ATOM 1435 CG1 ILE B 89 13.235 3.718 7.573 1.00 0.00 C ATOM 1436 CG2 ILE B 89 13.639 3.400 5.116 1.00 0.00 C ATOM 1437 CD1 ILE B 89 12.157 2.662 7.613 1.00 0.00 C ATOM 0 H ILE B 89 13.324 6.916 7.256 1.00 0.00 H new ATOM 0 HA ILE B 89 15.430 4.985 6.516 1.00 0.00 H new ATOM 0 HB ILE B 89 12.426 4.916 5.986 1.00 0.00 H new ATOM 0 HG12 ILE B 89 14.190 3.259 7.828 1.00 0.00 H new ATOM 0 HG13 ILE B 89 13.026 4.466 8.338 1.00 0.00 H new ATOM 0 HG21 ILE B 89 12.836 2.664 5.093 1.00 0.00 H new ATOM 0 HG22 ILE B 89 13.691 3.911 4.155 1.00 0.00 H new ATOM 0 HG23 ILE B 89 14.586 2.897 5.311 1.00 0.00 H new ATOM 0 HD11 ILE B 89 12.125 2.212 8.605 1.00 0.00 H new ATOM 0 HD12 ILE B 89 11.192 3.118 7.390 1.00 0.00 H new ATOM 0 HD13 ILE B 89 12.374 1.892 6.872 1.00 0.00 H new ATOM 1449 N VAL B 90 15.591 5.755 4.147 1.00 0.00 N ATOM 1450 CA VAL B 90 15.757 6.262 2.796 1.00 0.00 C ATOM 1451 C VAL B 90 14.876 5.470 1.829 1.00 0.00 C ATOM 1452 O VAL B 90 15.074 4.272 1.620 1.00 0.00 O ATOM 1453 CB VAL B 90 17.239 6.221 2.343 1.00 0.00 C ATOM 1454 CG1 VAL B 90 17.839 4.833 2.520 1.00 0.00 C ATOM 1455 CG2 VAL B 90 17.374 6.683 0.900 1.00 0.00 C ATOM 0 H VAL B 90 16.292 5.070 4.429 1.00 0.00 H new ATOM 0 HA VAL B 90 15.446 7.307 2.790 1.00 0.00 H new ATOM 0 HB VAL B 90 17.797 6.907 2.980 1.00 0.00 H new ATOM 0 HG11 VAL B 90 18.879 4.842 2.192 1.00 0.00 H new ATOM 0 HG12 VAL B 90 17.792 4.548 3.571 1.00 0.00 H new ATOM 0 HG13 VAL B 90 17.277 4.115 1.924 1.00 0.00 H new ATOM 0 HG21 VAL B 90 18.422 6.646 0.603 1.00 0.00 H new ATOM 0 HG22 VAL B 90 16.790 6.029 0.252 1.00 0.00 H new ATOM 0 HG23 VAL B 90 17.007 7.705 0.809 1.00 0.00 H new ATOM 1465 N VAL B 91 13.883 6.136 1.267 1.00 0.00 N ATOM 1466 CA VAL B 91 12.917 5.470 0.409 1.00 0.00 C ATOM 1467 C VAL B 91 12.915 6.075 -0.988 1.00 0.00 C ATOM 1468 O VAL B 91 12.869 7.291 -1.153 1.00 0.00 O ATOM 1469 CB VAL B 91 11.494 5.548 1.007 1.00 0.00 C ATOM 1470 CG1 VAL B 91 10.497 4.821 0.127 1.00 0.00 C ATOM 1471 CG2 VAL B 91 11.473 4.988 2.422 1.00 0.00 C ATOM 0 H VAL B 91 13.724 7.136 1.389 1.00 0.00 H new ATOM 0 HA VAL B 91 13.214 4.424 0.340 1.00 0.00 H new ATOM 0 HB VAL B 91 11.203 6.597 1.051 1.00 0.00 H new ATOM 0 HG11 VAL B 91 9.503 4.890 0.569 1.00 0.00 H new ATOM 0 HG12 VAL B 91 10.486 5.276 -0.863 1.00 0.00 H new ATOM 0 HG13 VAL B 91 10.784 3.773 0.041 1.00 0.00 H new ATOM 0 HG21 VAL B 91 10.462 5.053 2.824 1.00 0.00 H new ATOM 0 HG22 VAL B 91 11.791 3.946 2.405 1.00 0.00 H new ATOM 0 HG23 VAL B 91 12.151 5.564 3.051 1.00 0.00 H new ATOM 1481 N ASN B 92 12.995 5.212 -1.987 1.00 0.00 N ATOM 1482 CA ASN B 92 12.961 5.628 -3.384 1.00 0.00 C ATOM 1483 C ASN B 92 12.159 4.631 -4.201 1.00 0.00 C ATOM 1484 O ASN B 92 11.925 3.508 -3.760 1.00 0.00 O ATOM 1485 CB ASN B 92 14.374 5.748 -3.965 1.00 0.00 C ATOM 1486 CG ASN B 92 15.424 5.049 -3.130 1.00 0.00 C ATOM 1487 OD1 ASN B 92 16.159 5.684 -2.372 1.00 0.00 O ATOM 1488 ND2 ASN B 92 15.468 3.733 -3.225 1.00 0.00 N ATOM 0 H ASN B 92 13.085 4.205 -1.856 1.00 0.00 H new ATOM 0 HA ASN B 92 12.487 6.609 -3.430 1.00 0.00 H new ATOM 0 HB2 ASN B 92 14.382 5.330 -4.972 1.00 0.00 H new ATOM 0 HB3 ASN B 92 14.634 6.803 -4.055 1.00 0.00 H new ATOM 0 HD21 ASN B 92 16.129 3.203 -2.657 1.00 0.00 H new ATOM 0 HD22 ASN B 92 14.841 3.247 -3.866 1.00 0.00 H new ATOM 1495 N ALA B 93 11.775 5.037 -5.406 1.00 0.00 N ATOM 1496 CA ALA B 93 10.934 4.223 -6.283 1.00 0.00 C ATOM 1497 C ALA B 93 11.624 2.925 -6.687 1.00 0.00 C ATOM 1498 O ALA B 93 10.979 1.974 -7.134 1.00 0.00 O ATOM 1499 CB ALA B 93 10.563 5.020 -7.520 1.00 0.00 C ATOM 0 H ALA B 93 12.036 5.939 -5.804 1.00 0.00 H new ATOM 0 HA ALA B 93 10.033 3.958 -5.730 1.00 0.00 H new ATOM 0 HB1 ALA B 93 9.936 4.410 -8.171 1.00 0.00 H new ATOM 0 HB2 ALA B 93 10.016 5.916 -7.225 1.00 0.00 H new ATOM 0 HB3 ALA B 93 11.469 5.307 -8.053 1.00 0.00 H new ATOM 1505 N ALA B 94 12.934 2.897 -6.522 1.00 0.00 N ATOM 1506 CA ALA B 94 13.729 1.723 -6.860 1.00 0.00 C ATOM 1507 C ALA B 94 13.733 0.723 -5.712 1.00 0.00 C ATOM 1508 O ALA B 94 14.095 -0.441 -5.880 1.00 0.00 O ATOM 1509 CB ALA B 94 15.150 2.138 -7.200 1.00 0.00 C ATOM 0 H ALA B 94 13.476 3.678 -6.153 1.00 0.00 H new ATOM 0 HA ALA B 94 13.281 1.242 -7.729 1.00 0.00 H new ATOM 0 HB1 ALA B 94 15.737 1.254 -7.451 1.00 0.00 H new ATOM 0 HB2 ALA B 94 15.136 2.819 -8.051 1.00 0.00 H new ATOM 0 HB3 ALA B 94 15.598 2.639 -6.342 1.00 0.00 H new ATOM 1515 N ASP B 95 13.310 1.189 -4.547 1.00 0.00 N ATOM 1516 CA ASP B 95 13.342 0.387 -3.331 1.00 0.00 C ATOM 1517 C ASP B 95 11.926 -0.006 -2.934 1.00 0.00 C ATOM 1518 O ASP B 95 11.702 -1.004 -2.254 1.00 0.00 O ATOM 1519 CB ASP B 95 14.005 1.200 -2.220 1.00 0.00 C ATOM 1520 CG ASP B 95 14.486 0.363 -1.058 1.00 0.00 C ATOM 1521 OD1 ASP B 95 15.187 -0.646 -1.291 1.00 0.00 O ATOM 1522 OD2 ASP B 95 14.203 0.733 0.097 1.00 0.00 O ATOM 0 H ASP B 95 12.936 2.129 -4.417 1.00 0.00 H new ATOM 0 HA ASP B 95 13.915 -0.525 -3.501 1.00 0.00 H new ATOM 0 HB2 ASP B 95 14.851 1.746 -2.637 1.00 0.00 H new ATOM 0 HB3 ASP B 95 13.296 1.942 -1.853 1.00 0.00 H new ATOM 1527 N ILE B 96 10.978 0.798 -3.392 1.00 0.00 N ATOM 1528 CA ILE B 96 9.562 0.584 -3.140 1.00 0.00 C ATOM 1529 C ILE B 96 9.025 -0.581 -3.966 1.00 0.00 C ATOM 1530 O ILE B 96 9.006 -0.530 -5.199 1.00 0.00 O ATOM 1531 CB ILE B 96 8.784 1.870 -3.486 1.00 0.00 C ATOM 1532 CG1 ILE B 96 9.128 2.973 -2.494 1.00 0.00 C ATOM 1533 CG2 ILE B 96 7.283 1.627 -3.511 1.00 0.00 C ATOM 1534 CD1 ILE B 96 8.711 4.343 -2.967 1.00 0.00 C ATOM 0 H ILE B 96 11.173 1.626 -3.955 1.00 0.00 H new ATOM 0 HA ILE B 96 9.430 0.340 -2.086 1.00 0.00 H new ATOM 0 HB ILE B 96 9.083 2.183 -4.486 1.00 0.00 H new ATOM 0 HG12 ILE B 96 8.643 2.761 -1.541 1.00 0.00 H new ATOM 0 HG13 ILE B 96 10.203 2.969 -2.313 1.00 0.00 H new ATOM 0 HG21 ILE B 96 6.768 2.555 -3.758 1.00 0.00 H new ATOM 0 HG22 ILE B 96 7.049 0.872 -4.261 1.00 0.00 H new ATOM 0 HG23 ILE B 96 6.954 1.280 -2.532 1.00 0.00 H new ATOM 0 HD11 ILE B 96 8.983 5.085 -2.217 1.00 0.00 H new ATOM 0 HD12 ILE B 96 9.216 4.573 -3.905 1.00 0.00 H new ATOM 0 HD13 ILE B 96 7.632 4.362 -3.121 1.00 0.00 H new ATOM 1546 N LYS B 97 8.604 -1.630 -3.280 1.00 0.00 N ATOM 1547 CA LYS B 97 8.039 -2.798 -3.935 1.00 0.00 C ATOM 1548 C LYS B 97 6.543 -2.875 -3.642 1.00 0.00 C ATOM 1549 O LYS B 97 6.137 -3.319 -2.568 1.00 0.00 O ATOM 1550 CB LYS B 97 8.737 -4.072 -3.440 1.00 0.00 C ATOM 1551 CG LYS B 97 10.248 -3.935 -3.301 1.00 0.00 C ATOM 1552 CD LYS B 97 10.920 -3.561 -4.615 1.00 0.00 C ATOM 1553 CE LYS B 97 10.873 -4.701 -5.622 1.00 0.00 C ATOM 1554 NZ LYS B 97 11.568 -5.917 -5.121 1.00 0.00 N ATOM 0 H LYS B 97 8.643 -1.697 -2.263 1.00 0.00 H new ATOM 0 HA LYS B 97 8.191 -2.712 -5.011 1.00 0.00 H new ATOM 0 HB2 LYS B 97 8.317 -4.352 -2.474 1.00 0.00 H new ATOM 0 HB3 LYS B 97 8.518 -4.886 -4.131 1.00 0.00 H new ATOM 0 HG2 LYS B 97 10.474 -3.176 -2.552 1.00 0.00 H new ATOM 0 HG3 LYS B 97 10.664 -4.875 -2.938 1.00 0.00 H new ATOM 0 HD2 LYS B 97 10.429 -2.684 -5.037 1.00 0.00 H new ATOM 0 HD3 LYS B 97 11.958 -3.286 -4.426 1.00 0.00 H new ATOM 0 HE2 LYS B 97 9.834 -4.944 -5.846 1.00 0.00 H new ATOM 0 HE3 LYS B 97 11.334 -4.379 -6.556 1.00 0.00 H new ATOM 0 HZ1 LYS B 97 12.116 -6.347 -5.893 1.00 0.00 H new ATOM 0 HZ2 LYS B 97 12.209 -5.655 -4.345 1.00 0.00 H new ATOM 0 HZ3 LYS B 97 10.865 -6.600 -4.774 1.00 0.00 H new ATOM 1568 N ILE B 98 5.729 -2.414 -4.584 1.00 0.00 N ATOM 1569 CA ILE B 98 4.283 -2.418 -4.405 1.00 0.00 C ATOM 1570 C ILE B 98 3.651 -3.604 -5.130 1.00 0.00 C ATOM 1571 O ILE B 98 3.727 -3.713 -6.358 1.00 0.00 O ATOM 1572 CB ILE B 98 3.634 -1.108 -4.912 1.00 0.00 C ATOM 1573 CG1 ILE B 98 4.285 0.105 -4.249 1.00 0.00 C ATOM 1574 CG2 ILE B 98 2.138 -1.113 -4.635 1.00 0.00 C ATOM 1575 CD1 ILE B 98 3.663 1.429 -4.645 1.00 0.00 C ATOM 0 H ILE B 98 6.044 -2.034 -5.476 1.00 0.00 H new ATOM 0 HA ILE B 98 4.099 -2.502 -3.334 1.00 0.00 H new ATOM 0 HB ILE B 98 3.791 -1.044 -5.989 1.00 0.00 H new ATOM 0 HG12 ILE B 98 4.220 -0.006 -3.167 1.00 0.00 H new ATOM 0 HG13 ILE B 98 5.344 0.122 -4.505 1.00 0.00 H new ATOM 0 HG21 ILE B 98 1.698 -0.184 -4.998 1.00 0.00 H new ATOM 0 HG22 ILE B 98 1.676 -1.958 -5.146 1.00 0.00 H new ATOM 0 HG23 ILE B 98 1.967 -1.201 -3.562 1.00 0.00 H new ATOM 0 HD11 ILE B 98 4.179 2.241 -4.133 1.00 0.00 H new ATOM 0 HD12 ILE B 98 3.752 1.565 -5.723 1.00 0.00 H new ATOM 0 HD13 ILE B 98 2.610 1.435 -4.364 1.00 0.00 H new ATOM 1587 N PHE B 99 3.038 -4.490 -4.362 1.00 0.00 N ATOM 1588 CA PHE B 99 2.373 -5.661 -4.907 1.00 0.00 C ATOM 1589 C PHE B 99 0.973 -5.782 -4.330 1.00 0.00 C ATOM 1590 O PHE B 99 0.792 -5.875 -3.117 1.00 0.00 O ATOM 1591 CB PHE B 99 3.161 -6.930 -4.592 1.00 0.00 C ATOM 1592 CG PHE B 99 4.429 -7.090 -5.379 1.00 0.00 C ATOM 1593 CD1 PHE B 99 5.603 -6.486 -4.965 1.00 0.00 C ATOM 1594 CD2 PHE B 99 4.447 -7.861 -6.528 1.00 0.00 C ATOM 1595 CE1 PHE B 99 6.770 -6.646 -5.686 1.00 0.00 C ATOM 1596 CE2 PHE B 99 5.610 -8.026 -7.252 1.00 0.00 C ATOM 1597 CZ PHE B 99 6.773 -7.416 -6.831 1.00 0.00 C ATOM 0 H PHE B 99 2.988 -4.418 -3.346 1.00 0.00 H new ATOM 0 HA PHE B 99 2.314 -5.543 -5.989 1.00 0.00 H new ATOM 0 HB2 PHE B 99 3.405 -6.936 -3.530 1.00 0.00 H new ATOM 0 HB3 PHE B 99 2.522 -7.794 -4.777 1.00 0.00 H new ATOM 0 HD1 PHE B 99 5.607 -5.883 -4.069 1.00 0.00 H new ATOM 0 HD2 PHE B 99 3.539 -8.340 -6.863 1.00 0.00 H new ATOM 0 HE1 PHE B 99 7.680 -6.169 -5.354 1.00 0.00 H new ATOM 0 HE2 PHE B 99 5.610 -8.631 -8.146 1.00 0.00 H new ATOM 0 HZ PHE B 99 7.685 -7.541 -7.397 1.00 0.00 H new ATOM 1607 N HIS B 100 -0.018 -5.780 -5.194 1.00 0.00 N ATOM 1608 CA HIS B 100 -1.398 -5.870 -4.752 1.00 0.00 C ATOM 1609 C HIS B 100 -1.996 -7.220 -5.114 1.00 0.00 C ATOM 1610 O HIS B 100 -1.976 -7.632 -6.271 1.00 0.00 O ATOM 1611 CB HIS B 100 -2.234 -4.734 -5.348 1.00 0.00 C ATOM 1612 CG HIS B 100 -3.694 -4.832 -5.035 1.00 0.00 C ATOM 1613 ND1 HIS B 100 -4.205 -4.757 -3.756 1.00 0.00 N ATOM 1614 CD2 HIS B 100 -4.754 -5.016 -5.848 1.00 0.00 C ATOM 1615 CE1 HIS B 100 -5.516 -4.897 -3.802 1.00 0.00 C ATOM 1616 NE2 HIS B 100 -5.873 -5.054 -5.060 1.00 0.00 N ATOM 0 H HIS B 100 0.102 -5.717 -6.205 1.00 0.00 H new ATOM 0 HA HIS B 100 -1.411 -5.772 -3.666 1.00 0.00 H new ATOM 0 HB2 HIS B 100 -1.855 -3.782 -4.976 1.00 0.00 H new ATOM 0 HB3 HIS B 100 -2.103 -4.728 -6.430 1.00 0.00 H new ATOM 0 HD2 HIS B 100 -4.726 -5.115 -6.923 1.00 0.00 H new ATOM 0 HE1 HIS B 100 -6.183 -4.885 -2.953 1.00 0.00 H new ATOM 0 HE2 HIS B 100 -6.828 -5.183 -5.393 1.00 0.00 H new ATOM 1625 N ILE B 101 -2.521 -7.900 -4.109 1.00 0.00 N ATOM 1626 CA ILE B 101 -3.183 -9.176 -4.304 1.00 0.00 C ATOM 1627 C ILE B 101 -4.693 -8.997 -4.219 1.00 0.00 C ATOM 1628 O ILE B 101 -5.225 -8.666 -3.161 1.00 0.00 O ATOM 1629 CB ILE B 101 -2.730 -10.197 -3.241 1.00 0.00 C ATOM 1630 CG1 ILE B 101 -1.229 -10.461 -3.359 1.00 0.00 C ATOM 1631 CG2 ILE B 101 -3.508 -11.496 -3.371 1.00 0.00 C ATOM 1632 CD1 ILE B 101 -0.702 -11.372 -2.275 1.00 0.00 C ATOM 0 H ILE B 101 -2.500 -7.584 -3.139 1.00 0.00 H new ATOM 0 HA ILE B 101 -2.912 -9.552 -5.291 1.00 0.00 H new ATOM 0 HB ILE B 101 -2.934 -9.775 -2.257 1.00 0.00 H new ATOM 0 HG12 ILE B 101 -1.019 -10.905 -4.332 1.00 0.00 H new ATOM 0 HG13 ILE B 101 -0.695 -9.512 -3.320 1.00 0.00 H new ATOM 0 HG21 ILE B 101 -3.170 -12.200 -2.610 1.00 0.00 H new ATOM 0 HG22 ILE B 101 -4.571 -11.298 -3.236 1.00 0.00 H new ATOM 0 HG23 ILE B 101 -3.341 -11.923 -4.360 1.00 0.00 H new ATOM 0 HD11 ILE B 101 0.369 -11.521 -2.414 1.00 0.00 H new ATOM 0 HD12 ILE B 101 -0.882 -10.919 -1.300 1.00 0.00 H new ATOM 0 HD13 ILE B 101 -1.212 -12.334 -2.328 1.00 0.00 H new ATOM 1644 N ARG B 102 -5.379 -9.197 -5.338 1.00 0.00 N ATOM 1645 CA ARG B 102 -6.835 -9.082 -5.373 1.00 0.00 C ATOM 1646 C ARG B 102 -7.484 -10.267 -4.662 1.00 0.00 C ATOM 1647 O ARG B 102 -8.613 -10.171 -4.184 1.00 0.00 O ATOM 1648 CB ARG B 102 -7.338 -9.004 -6.819 1.00 0.00 C ATOM 1649 CG ARG B 102 -6.836 -7.789 -7.584 1.00 0.00 C ATOM 1650 CD ARG B 102 -7.320 -7.801 -9.026 1.00 0.00 C ATOM 1651 NE ARG B 102 -6.703 -6.742 -9.825 1.00 0.00 N ATOM 1652 CZ ARG B 102 -6.904 -6.575 -11.132 1.00 0.00 C ATOM 1653 NH1 ARG B 102 -7.731 -7.376 -11.789 1.00 0.00 N ATOM 1654 NH2 ARG B 102 -6.275 -5.604 -11.781 1.00 0.00 N ATOM 0 H ARG B 102 -4.953 -9.439 -6.233 1.00 0.00 H new ATOM 0 HA ARG B 102 -7.113 -8.164 -4.855 1.00 0.00 H new ATOM 0 HB2 ARG B 102 -7.032 -9.906 -7.349 1.00 0.00 H new ATOM 0 HB3 ARG B 102 -8.428 -8.992 -6.814 1.00 0.00 H new ATOM 0 HG2 ARG B 102 -7.180 -6.880 -7.091 1.00 0.00 H new ATOM 0 HG3 ARG B 102 -5.746 -7.770 -7.565 1.00 0.00 H new ATOM 0 HD2 ARG B 102 -7.097 -8.769 -9.474 1.00 0.00 H new ATOM 0 HD3 ARG B 102 -8.403 -7.683 -9.045 1.00 0.00 H new ATOM 0 HE ARG B 102 -6.079 -6.089 -9.351 1.00 0.00 H new ATOM 0 HH11 ARG B 102 -8.217 -8.124 -11.294 1.00 0.00 H new ATOM 0 HH12 ARG B 102 -7.882 -7.244 -12.789 1.00 0.00 H new ATOM 0 HH21 ARG B 102 -5.638 -4.985 -11.280 1.00 0.00 H new ATOM 0 HH22 ARG B 102 -6.429 -5.476 -12.781 1.00 0.00 H new ATOM 1668 N LYS B 103 -6.749 -11.372 -4.579 1.00 0.00 N ATOM 1669 CA LYS B 103 -7.248 -12.591 -3.949 1.00 0.00 C ATOM 1670 C LYS B 103 -7.577 -12.354 -2.476 1.00 0.00 C ATOM 1671 O LYS B 103 -8.670 -12.685 -2.017 1.00 0.00 O ATOM 1672 CB LYS B 103 -6.208 -13.707 -4.090 1.00 0.00 C ATOM 1673 CG LYS B 103 -6.616 -15.024 -3.450 1.00 0.00 C ATOM 1674 CD LYS B 103 -5.554 -16.097 -3.652 1.00 0.00 C ATOM 1675 CE LYS B 103 -4.225 -15.698 -3.028 1.00 0.00 C ATOM 1676 NZ LYS B 103 -3.189 -16.746 -3.213 1.00 0.00 N ATOM 0 H LYS B 103 -5.799 -11.448 -4.943 1.00 0.00 H new ATOM 0 HA LYS B 103 -8.168 -12.890 -4.452 1.00 0.00 H new ATOM 0 HB2 LYS B 103 -6.014 -13.876 -5.149 1.00 0.00 H new ATOM 0 HB3 LYS B 103 -5.271 -13.374 -3.643 1.00 0.00 H new ATOM 0 HG2 LYS B 103 -6.785 -14.874 -2.384 1.00 0.00 H new ATOM 0 HG3 LYS B 103 -7.560 -15.360 -3.878 1.00 0.00 H new ATOM 0 HD2 LYS B 103 -5.895 -17.034 -3.213 1.00 0.00 H new ATOM 0 HD3 LYS B 103 -5.416 -16.276 -4.718 1.00 0.00 H new ATOM 0 HE2 LYS B 103 -3.881 -14.765 -3.473 1.00 0.00 H new ATOM 0 HE3 LYS B 103 -4.366 -15.510 -1.963 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 -2.304 -16.443 -2.759 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 -3.513 -17.635 -2.781 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 -3.024 -16.895 -4.229 1.00 0.00 H new ATOM 1690 N GLU B 104 -6.643 -11.748 -1.752 1.00 0.00 N ATOM 1691 CA GLU B 104 -6.859 -11.414 -0.349 1.00 0.00 C ATOM 1692 C GLU B 104 -7.342 -9.976 -0.225 1.00 0.00 C ATOM 1693 O GLU B 104 -7.565 -9.471 0.878 1.00 0.00 O ATOM 1694 CB GLU B 104 -5.568 -11.582 0.461 1.00 0.00 C ATOM 1695 CG GLU B 104 -4.978 -12.981 0.416 1.00 0.00 C ATOM 1696 CD GLU B 104 -3.741 -13.119 1.288 1.00 0.00 C ATOM 1697 OE1 GLU B 104 -2.630 -12.811 0.804 1.00 0.00 O ATOM 1698 OE2 GLU B 104 -3.875 -13.545 2.459 1.00 0.00 O ATOM 0 H GLU B 104 -5.728 -11.478 -2.114 1.00 0.00 H new ATOM 0 HA GLU B 104 -7.614 -12.094 0.046 1.00 0.00 H new ATOM 0 HB2 GLU B 104 -4.826 -10.875 0.090 1.00 0.00 H new ATOM 0 HB3 GLU B 104 -5.768 -11.318 1.500 1.00 0.00 H new ATOM 0 HG2 GLU B 104 -5.730 -13.700 0.741 1.00 0.00 H new ATOM 0 HG3 GLU B 104 -4.723 -13.231 -0.614 1.00 0.00 H new ATOM 1705 N ARG B 105 -7.484 -9.325 -1.382 1.00 0.00 N ATOM 1706 CA ARG B 105 -7.807 -7.901 -1.459 1.00 0.00 C ATOM 1707 C ARG B 105 -6.843 -7.095 -0.596 1.00 0.00 C ATOM 1708 O ARG B 105 -7.222 -6.100 0.025 1.00 0.00 O ATOM 1709 CB ARG B 105 -9.260 -7.644 -1.045 1.00 0.00 C ATOM 1710 CG ARG B 105 -10.273 -8.339 -1.942 1.00 0.00 C ATOM 1711 CD ARG B 105 -11.702 -7.984 -1.567 1.00 0.00 C ATOM 1712 NE ARG B 105 -12.670 -8.675 -2.419 1.00 0.00 N ATOM 1713 CZ ARG B 105 -13.939 -8.300 -2.571 1.00 0.00 C ATOM 1714 NH1 ARG B 105 -14.399 -7.223 -1.949 1.00 0.00 N ATOM 1715 NH2 ARG B 105 -14.747 -9.002 -3.353 1.00 0.00 N ATOM 0 H ARG B 105 -7.378 -9.772 -2.292 1.00 0.00 H new ATOM 0 HA ARG B 105 -7.697 -7.578 -2.494 1.00 0.00 H new ATOM 0 HB2 ARG B 105 -9.403 -7.981 -0.018 1.00 0.00 H new ATOM 0 HB3 ARG B 105 -9.450 -6.571 -1.058 1.00 0.00 H new ATOM 0 HG2 ARG B 105 -10.090 -8.060 -2.980 1.00 0.00 H new ATOM 0 HG3 ARG B 105 -10.138 -9.418 -1.874 1.00 0.00 H new ATOM 0 HD2 ARG B 105 -11.881 -8.247 -0.524 1.00 0.00 H new ATOM 0 HD3 ARG B 105 -11.844 -6.907 -1.653 1.00 0.00 H new ATOM 0 HE ARG B 105 -12.352 -9.498 -2.930 1.00 0.00 H new ATOM 0 HH11 ARG B 105 -13.780 -6.677 -1.350 1.00 0.00 H new ATOM 0 HH12 ARG B 105 -15.372 -6.941 -2.069 1.00 0.00 H new ATOM 0 HH21 ARG B 105 -14.397 -9.828 -3.838 1.00 0.00 H new ATOM 0 HH22 ARG B 105 -15.719 -8.716 -3.470 1.00 0.00 H new ATOM 1729 N THR B 106 -5.585 -7.521 -0.583 1.00 0.00 N ATOM 1730 CA THR B 106 -4.596 -6.946 0.302 1.00 0.00 C ATOM 1731 C THR B 106 -3.429 -6.379 -0.497 1.00 0.00 C ATOM 1732 O THR B 106 -2.942 -7.007 -1.438 1.00 0.00 O ATOM 1733 CB THR B 106 -4.087 -8.005 1.302 1.00 0.00 C ATOM 1734 OG1 THR B 106 -5.190 -8.562 2.032 1.00 0.00 O ATOM 1735 CG2 THR B 106 -3.089 -7.402 2.276 1.00 0.00 C ATOM 0 H THR B 106 -5.231 -8.267 -1.181 1.00 0.00 H new ATOM 0 HA THR B 106 -5.066 -6.135 0.858 1.00 0.00 H new ATOM 0 HB THR B 106 -3.588 -8.791 0.735 1.00 0.00 H new ATOM 0 HG1 THR B 106 -5.952 -8.686 1.429 1.00 0.00 H new ATOM 0 HG21 THR B 106 -2.747 -8.171 2.969 1.00 0.00 H new ATOM 0 HG22 THR B 106 -2.237 -7.005 1.725 1.00 0.00 H new ATOM 0 HG23 THR B 106 -3.566 -6.597 2.834 1.00 0.00 H new ATOM 1743 N LEU B 107 -3.014 -5.173 -0.149 1.00 0.00 N ATOM 1744 CA LEU B 107 -1.883 -4.540 -0.801 1.00 0.00 C ATOM 1745 C LEU B 107 -0.636 -4.680 0.067 1.00 0.00 C ATOM 1746 O LEU B 107 -0.604 -4.200 1.201 1.00 0.00 O ATOM 1747 CB LEU B 107 -2.181 -3.061 -1.058 1.00 0.00 C ATOM 1748 CG LEU B 107 -1.844 -2.556 -2.464 1.00 0.00 C ATOM 1749 CD1 LEU B 107 -2.182 -1.083 -2.598 1.00 0.00 C ATOM 1750 CD2 LEU B 107 -0.379 -2.791 -2.791 1.00 0.00 C ATOM 0 H LEU B 107 -3.446 -4.611 0.585 1.00 0.00 H new ATOM 0 HA LEU B 107 -1.707 -5.033 -1.757 1.00 0.00 H new ATOM 0 HB2 LEU B 107 -3.240 -2.884 -0.871 1.00 0.00 H new ATOM 0 HB3 LEU B 107 -1.626 -2.465 -0.334 1.00 0.00 H new ATOM 0 HG LEU B 107 -2.448 -3.119 -3.176 1.00 0.00 H new ATOM 0 HD11 LEU B 107 -1.935 -0.743 -3.604 1.00 0.00 H new ATOM 0 HD12 LEU B 107 -3.247 -0.936 -2.416 1.00 0.00 H new ATOM 0 HD13 LEU B 107 -1.607 -0.510 -1.870 1.00 0.00 H new ATOM 0 HD21 LEU B 107 -0.167 -2.423 -3.795 1.00 0.00 H new ATOM 0 HD22 LEU B 107 0.244 -2.261 -2.071 1.00 0.00 H new ATOM 0 HD23 LEU B 107 -0.162 -3.858 -2.742 1.00 0.00 H new ATOM 1762 N TYR B 108 0.370 -5.358 -0.462 1.00 0.00 N ATOM 1763 CA TYR B 108 1.625 -5.557 0.247 1.00 0.00 C ATOM 1764 C TYR B 108 2.671 -4.547 -0.206 1.00 0.00 C ATOM 1765 O TYR B 108 3.034 -4.495 -1.384 1.00 0.00 O ATOM 1766 CB TYR B 108 2.146 -6.978 0.019 1.00 0.00 C ATOM 1767 CG TYR B 108 1.247 -8.054 0.580 1.00 0.00 C ATOM 1768 CD1 TYR B 108 0.033 -8.355 -0.021 1.00 0.00 C ATOM 1769 CD2 TYR B 108 1.608 -8.758 1.718 1.00 0.00 C ATOM 1770 CE1 TYR B 108 -0.798 -9.324 0.499 1.00 0.00 C ATOM 1771 CE2 TYR B 108 0.785 -9.733 2.242 1.00 0.00 C ATOM 1772 CZ TYR B 108 -0.420 -10.012 1.631 1.00 0.00 C ATOM 1773 OH TYR B 108 -1.250 -10.973 2.167 1.00 0.00 O ATOM 0 H TYR B 108 0.341 -5.783 -1.389 1.00 0.00 H new ATOM 0 HA TYR B 108 1.437 -5.411 1.311 1.00 0.00 H new ATOM 0 HB2 TYR B 108 2.269 -7.142 -1.051 1.00 0.00 H new ATOM 0 HB3 TYR B 108 3.133 -7.070 0.472 1.00 0.00 H new ATOM 0 HD1 TYR B 108 -0.266 -7.821 -0.911 1.00 0.00 H new ATOM 0 HD2 TYR B 108 2.548 -8.540 2.202 1.00 0.00 H new ATOM 0 HE1 TYR B 108 -1.741 -9.543 0.021 1.00 0.00 H new ATOM 0 HE2 TYR B 108 1.083 -10.276 3.127 1.00 0.00 H new ATOM 0 HH TYR B 108 -1.693 -11.464 1.443 1.00 0.00 H new ATOM 1783 N ILE B 109 3.135 -3.737 0.730 1.00 0.00 N ATOM 1784 CA ILE B 109 4.187 -2.769 0.462 1.00 0.00 C ATOM 1785 C ILE B 109 5.478 -3.205 1.146 1.00 0.00 C ATOM 1786 O ILE B 109 5.502 -3.409 2.361 1.00 0.00 O ATOM 1787 CB ILE B 109 3.808 -1.363 0.978 1.00 0.00 C ATOM 1788 CG1 ILE B 109 2.440 -0.930 0.439 1.00 0.00 C ATOM 1789 CG2 ILE B 109 4.875 -0.343 0.602 1.00 0.00 C ATOM 1790 CD1 ILE B 109 2.384 -0.795 -1.066 1.00 0.00 C ATOM 0 H ILE B 109 2.796 -3.731 1.692 1.00 0.00 H new ATOM 0 HA ILE B 109 4.323 -2.723 -0.618 1.00 0.00 H new ATOM 0 HB ILE B 109 3.746 -1.412 2.065 1.00 0.00 H new ATOM 0 HG12 ILE B 109 1.690 -1.655 0.756 1.00 0.00 H new ATOM 0 HG13 ILE B 109 2.170 0.025 0.889 1.00 0.00 H new ATOM 0 HG21 ILE B 109 4.587 0.640 0.976 1.00 0.00 H new ATOM 0 HG22 ILE B 109 5.828 -0.634 1.044 1.00 0.00 H new ATOM 0 HG23 ILE B 109 4.975 -0.304 -0.483 1.00 0.00 H new ATOM 0 HD11 ILE B 109 1.383 -0.486 -1.367 1.00 0.00 H new ATOM 0 HD12 ILE B 109 3.108 -0.048 -1.391 1.00 0.00 H new ATOM 0 HD13 ILE B 109 2.621 -1.754 -1.526 1.00 0.00 H new ATOM 1802 N TYR B 110 6.539 -3.360 0.373 1.00 0.00 N ATOM 1803 CA TYR B 110 7.841 -3.707 0.926 1.00 0.00 C ATOM 1804 C TYR B 110 8.856 -2.643 0.529 1.00 0.00 C ATOM 1805 O TYR B 110 8.983 -2.314 -0.649 1.00 0.00 O ATOM 1806 CB TYR B 110 8.317 -5.079 0.427 1.00 0.00 C ATOM 1807 CG TYR B 110 7.374 -6.236 0.714 1.00 0.00 C ATOM 1808 CD1 TYR B 110 6.298 -6.497 -0.125 1.00 0.00 C ATOM 1809 CD2 TYR B 110 7.575 -7.086 1.801 1.00 0.00 C ATOM 1810 CE1 TYR B 110 5.451 -7.562 0.110 1.00 0.00 C ATOM 1811 CE2 TYR B 110 6.732 -8.155 2.037 1.00 0.00 C ATOM 1812 CZ TYR B 110 5.673 -8.388 1.190 1.00 0.00 C ATOM 1813 OH TYR B 110 4.833 -9.454 1.421 1.00 0.00 O ATOM 0 H TYR B 110 6.526 -3.251 -0.641 1.00 0.00 H new ATOM 0 HA TYR B 110 7.748 -3.756 2.011 1.00 0.00 H new ATOM 0 HB2 TYR B 110 8.477 -5.020 -0.650 1.00 0.00 H new ATOM 0 HB3 TYR B 110 9.283 -5.298 0.882 1.00 0.00 H new ATOM 0 HD1 TYR B 110 6.121 -5.856 -0.976 1.00 0.00 H new ATOM 0 HD2 TYR B 110 8.404 -6.906 2.470 1.00 0.00 H new ATOM 0 HE1 TYR B 110 4.617 -7.747 -0.551 1.00 0.00 H new ATOM 0 HE2 TYR B 110 6.904 -8.805 2.882 1.00 0.00 H new ATOM 0 HH TYR B 110 5.129 -9.936 2.221 1.00 0.00 H new ATOM 1823 N ILE B 111 9.551 -2.090 1.506 1.00 0.00 N ATOM 1824 CA ILE B 111 10.554 -1.070 1.245 1.00 0.00 C ATOM 1825 C ILE B 111 11.834 -1.402 1.998 1.00 0.00 C ATOM 1826 O ILE B 111 11.943 -1.039 3.184 1.00 0.00 O ATOM 1827 CB ILE B 111 10.058 0.340 1.651 1.00 0.00 C ATOM 1828 CG1 ILE B 111 8.742 0.664 0.939 1.00 0.00 C ATOM 1829 CG2 ILE B 111 11.112 1.393 1.325 1.00 0.00 C ATOM 1830 CD1 ILE B 111 8.135 1.990 1.346 1.00 0.00 C ATOM 1831 OXT ILE B 111 12.714 -2.064 1.413 1.00 0.00 O ATOM 0 H ILE B 111 9.440 -2.330 2.491 1.00 0.00 H new ATOM 0 HA ILE B 111 10.747 -1.059 0.172 1.00 0.00 H new ATOM 0 HB ILE B 111 9.884 0.349 2.727 1.00 0.00 H new ATOM 0 HG12 ILE B 111 8.914 0.669 -0.137 1.00 0.00 H new ATOM 0 HG13 ILE B 111 8.025 -0.131 1.143 1.00 0.00 H new ATOM 0 HG21 ILE B 111 10.746 2.377 1.617 1.00 0.00 H new ATOM 0 HG22 ILE B 111 12.029 1.171 1.870 1.00 0.00 H new ATOM 0 HG23 ILE B 111 11.315 1.385 0.254 1.00 0.00 H new ATOM 0 HD11 ILE B 111 7.206 2.148 0.799 1.00 0.00 H new ATOM 0 HD12 ILE B 111 7.929 1.983 2.416 1.00 0.00 H new ATOM 0 HD13 ILE B 111 8.833 2.795 1.116 1.00 0.00 H new TER 1843 ILE B 111