USER MOD reduce.3.24.130724 H: found=0, std=0, add=1084, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1084 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 11 SER OG : rot -48:sc= 0.0683 USER MOD Set 1.2: A 76 CYS SG : rot -10:sc= -0.75! USER MOD Set 2.1: A 23 LYS NZ :NH3+ -148:sc= -0.199 (180deg=-0.907) USER MOD Set 2.2: A 41 THR OG1 : rot -24:sc= 1.5 USER MOD Single : A 1 MET CE :methyl -127:sc= -1.27 (180deg=-2.91!) USER MOD Single : A 1 MET N :NH3+ 138:sc=-0.000226 (180deg=-0.361) USER MOD Single : A 4 TYR OH : rot 180:sc= -0.075 USER MOD Single : A 5 TYR OH : rot -35:sc= -0.964 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 72:sc= -2.08! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= -0.874 K(o=-0.87,f=-4!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0.00718 USER MOD Single : A 38 GLN : amide:sc= -0.0911 X(o=-0.091,f=0) USER MOD Single : A 40 MET CE :methyl 154:sc= -13.4! (180deg=-16.1!) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 67:sc= -4.62! USER MOD Single : A 57 GLN : amide:sc=-0.00778 K(o=-0.0078,f=-0.86) USER MOD Single : A 58 SER OG : rot 49:sc= 0.133 USER MOD Single : A 63 ASN : amide:sc=-0.00975 X(o=-0.0097,f=0) USER MOD Single : A 64 TYR OH : rot -118:sc= 0.817 USER MOD Single : A 67 HIS : no HD1:sc= -3.66! C(o=-3.7!,f=-7.9!) USER MOD Single : A 69 TYR OH : rot -90:sc= 1.46 USER MOD Single : A 72 SER OG : rot -65:sc= 1.21 USER MOD Single : A 81 THR OG1 : rot 170:sc= -0.204! USER MOD Single : A 83 LYS NZ :NH3+ 159:sc= 0.154 (180deg=0.0432) USER MOD Single : A 84 GLN : amide:sc= -0.132 X(o=-0.13,f=0) USER MOD Single : A 85 TYR OH : rot -174:sc= -2.61 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0.0049 USER MOD Single : A 95 ASN : amide:sc= -0.559 K(o=-0.56,f=-3.2!) USER MOD Single : A 96 LYS NZ :NH3+ -110:sc= -0.602 (180deg=-1.36) USER MOD Single : A 101 TYR OH : rot 127:sc= -2.52! USER MOD Single : A 105 HIS : no HD1:sc= -5.12! K(o=-5.1!,f=-3.8) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot -29:sc= 1.14 USER MOD Single : A 116 THR OG1 : rot -156:sc= -1.67! USER MOD Single : A 117 ASN : amide:sc= -0.0306 X(o=-0.031,f=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 MET CE :methyl 173:sc= -11.7! (180deg=-12.1!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 127 THR OG1 : rot 77:sc= 0.508 USER MOD Single : A 128 TYR OH : rot 180:sc= -0.514 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ -179:sc= 0.325 (180deg=0.325) USER MOD Single : A 132 TYR OH : rot -169:sc= -0.892 USER MOD Single : A 133 GLN : amide:sc= -3.35 K(o=-3.4,f=-2.7!) USER MOD Single : A 136 SER OG : rot 48:sc= 1.14 USER MOD Single : A 137 GLN : amide:sc= -4.88 K(o=-4.9,f=-7.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.853 14.165 3.545 1.00 0.00 N ATOM 2 CA MET A 1 -9.282 12.938 2.927 1.00 0.00 C ATOM 3 C MET A 1 -9.315 11.766 3.901 1.00 0.00 C ATOM 4 O MET A 1 -9.397 11.957 5.114 1.00 0.00 O ATOM 5 CB MET A 1 -7.844 13.235 2.500 1.00 0.00 C ATOM 6 CG MET A 1 -6.895 13.464 3.665 1.00 0.00 C ATOM 7 SD MET A 1 -5.319 14.171 3.147 1.00 0.00 S ATOM 8 CE MET A 1 -5.762 15.898 2.982 1.00 0.00 C ATOM 0 H1 MET A 1 -9.266 14.986 3.293 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.821 14.311 3.195 1.00 0.00 H new ATOM 0 H3 MET A 1 -9.871 14.057 4.579 1.00 0.00 H new ATOM 0 HA MET A 1 -9.880 12.658 2.060 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.474 12.404 1.899 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.839 14.118 1.860 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.367 14.129 4.388 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.715 12.517 4.173 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.474 16.255 1.993 1.00 0.00 H new ATOM 0 HE2 MET A 1 -6.839 16.011 3.109 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.244 16.481 3.743 1.00 0.00 H new ATOM 20 N ARG A 2 -9.251 10.551 3.363 1.00 0.00 N ATOM 21 CA ARG A 2 -9.275 9.352 4.192 1.00 0.00 C ATOM 22 C ARG A 2 -8.848 8.121 3.397 1.00 0.00 C ATOM 23 O ARG A 2 -9.630 7.570 2.622 1.00 0.00 O ATOM 24 CB ARG A 2 -10.677 9.136 4.768 1.00 0.00 C ATOM 25 CG ARG A 2 -10.894 9.807 6.116 1.00 0.00 C ATOM 26 CD ARG A 2 -12.039 9.161 6.879 1.00 0.00 C ATOM 27 NE ARG A 2 -13.277 9.150 6.104 1.00 0.00 N ATOM 28 CZ ARG A 2 -14.073 10.209 5.963 1.00 0.00 C ATOM 29 NH1 ARG A 2 -13.764 11.363 6.542 1.00 0.00 N ATOM 30 NH2 ARG A 2 -15.181 10.115 5.241 1.00 0.00 N ATOM 0 H ARG A 2 -9.182 10.372 2.361 1.00 0.00 H new ATOM 0 HA ARG A 2 -8.566 9.495 5.008 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -11.414 9.516 4.060 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -10.857 8.066 4.872 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -9.980 9.744 6.707 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -11.105 10.866 5.967 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -11.768 8.139 7.143 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -12.201 9.699 7.813 1.00 0.00 H new ATOM 0 HE ARG A 2 -13.548 8.281 5.644 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -12.913 11.443 7.099 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -14.378 12.170 6.430 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -15.424 9.232 4.793 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -15.790 10.926 5.133 1.00 0.00 H new ATOM 44 N ILE A 3 -7.608 7.687 3.603 1.00 0.00 N ATOM 45 CA ILE A 3 -7.085 6.513 2.914 1.00 0.00 C ATOM 46 C ILE A 3 -7.851 5.267 3.341 1.00 0.00 C ATOM 47 O ILE A 3 -8.511 5.265 4.380 1.00 0.00 O ATOM 48 CB ILE A 3 -5.580 6.323 3.202 1.00 0.00 C ATOM 49 CG1 ILE A 3 -5.017 5.130 2.441 1.00 0.00 C ATOM 50 CG2 ILE A 3 -5.345 6.141 4.693 1.00 0.00 C ATOM 51 CD1 ILE A 3 -3.526 5.234 2.220 1.00 0.00 C ATOM 0 H ILE A 3 -6.947 8.131 4.241 1.00 0.00 H new ATOM 0 HA ILE A 3 -7.214 6.668 1.843 1.00 0.00 H new ATOM 0 HB ILE A 3 -5.062 7.220 2.863 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -5.236 4.216 2.992 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -5.519 5.049 1.477 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -4.279 6.008 4.880 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -5.700 7.022 5.228 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -5.887 5.262 5.042 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.177 4.358 1.673 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -3.305 6.133 1.644 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -3.018 5.286 3.183 1.00 0.00 H new ATOM 63 N TYR A 4 -7.777 4.212 2.539 1.00 0.00 N ATOM 64 CA TYR A 4 -8.485 2.979 2.853 1.00 0.00 C ATOM 65 C TYR A 4 -7.529 1.803 3.006 1.00 0.00 C ATOM 66 O TYR A 4 -7.389 1.251 4.096 1.00 0.00 O ATOM 67 CB TYR A 4 -9.526 2.677 1.776 1.00 0.00 C ATOM 68 CG TYR A 4 -10.814 3.448 1.960 1.00 0.00 C ATOM 69 CD1 TYR A 4 -11.424 3.529 3.206 1.00 0.00 C ATOM 70 CD2 TYR A 4 -11.417 4.099 0.891 1.00 0.00 C ATOM 71 CE1 TYR A 4 -12.598 4.236 3.380 1.00 0.00 C ATOM 72 CE2 TYR A 4 -12.591 4.808 1.058 1.00 0.00 C ATOM 73 CZ TYR A 4 -13.178 4.873 2.303 1.00 0.00 C ATOM 74 OH TYR A 4 -14.347 5.578 2.473 1.00 0.00 O ATOM 0 H TYR A 4 -7.238 4.185 1.673 1.00 0.00 H new ATOM 0 HA TYR A 4 -8.989 3.122 3.809 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -9.106 2.912 0.798 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -9.745 1.609 1.781 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -10.973 3.031 4.052 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -10.961 4.050 -0.087 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -13.060 4.290 4.355 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -13.047 5.309 0.217 1.00 0.00 H new ATOM 0 HH TYR A 4 -14.622 5.967 1.617 1.00 0.00 H new ATOM 84 N TYR A 5 -6.881 1.408 1.914 1.00 0.00 N ATOM 85 CA TYR A 5 -5.958 0.280 1.960 1.00 0.00 C ATOM 86 C TYR A 5 -4.522 0.708 1.704 1.00 0.00 C ATOM 87 O TYR A 5 -4.258 1.725 1.063 1.00 0.00 O ATOM 88 CB TYR A 5 -6.377 -0.795 0.952 1.00 0.00 C ATOM 89 CG TYR A 5 -5.446 -1.993 0.872 1.00 0.00 C ATOM 90 CD1 TYR A 5 -4.182 -1.893 0.297 1.00 0.00 C ATOM 91 CD2 TYR A 5 -5.841 -3.232 1.363 1.00 0.00 C ATOM 92 CE1 TYR A 5 -3.342 -2.987 0.216 1.00 0.00 C ATOM 93 CE2 TYR A 5 -5.006 -4.331 1.283 1.00 0.00 C ATOM 94 CZ TYR A 5 -3.760 -4.204 0.710 1.00 0.00 C ATOM 95 OH TYR A 5 -2.928 -5.297 0.628 1.00 0.00 O ATOM 0 H TYR A 5 -6.976 1.846 0.998 1.00 0.00 H new ATOM 0 HA TYR A 5 -6.003 -0.135 2.967 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -7.376 -1.146 1.211 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -6.445 -0.339 -0.036 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -3.852 -0.942 -0.093 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -6.816 -3.338 1.814 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -2.364 -2.889 -0.232 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -5.330 -5.286 1.669 1.00 0.00 H new ATOM 0 HH TYR A 5 -2.411 -5.253 -0.203 1.00 0.00 H new ATOM 105 N ILE A 6 -3.601 -0.093 2.219 1.00 0.00 N ATOM 106 CA ILE A 6 -2.183 0.160 2.069 1.00 0.00 C ATOM 107 C ILE A 6 -1.414 -1.152 2.193 1.00 0.00 C ATOM 108 O ILE A 6 -1.966 -2.163 2.627 1.00 0.00 O ATOM 109 CB ILE A 6 -1.706 1.193 3.122 1.00 0.00 C ATOM 110 CG1 ILE A 6 -1.844 2.604 2.541 1.00 0.00 C ATOM 111 CG2 ILE A 6 -0.281 0.935 3.594 1.00 0.00 C ATOM 112 CD1 ILE A 6 -1.121 3.685 3.322 1.00 0.00 C ATOM 0 H ILE A 6 -3.819 -0.935 2.752 1.00 0.00 H new ATOM 0 HA ILE A 6 -1.992 0.581 1.082 1.00 0.00 H new ATOM 0 HB ILE A 6 -2.339 1.093 4.003 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -1.467 2.600 1.518 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -2.903 2.859 2.489 1.00 0.00 H new ATOM 0 HG21 ILE A 6 0.000 1.688 4.330 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -0.221 -0.055 4.046 1.00 0.00 H new ATOM 0 HG23 ILE A 6 0.399 0.987 2.744 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -1.275 4.649 2.837 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -1.513 3.724 4.338 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -0.055 3.460 3.353 1.00 0.00 H new ATOM 124 N GLY A 7 -0.151 -1.138 1.802 1.00 0.00 N ATOM 125 CA GLY A 7 0.649 -2.340 1.883 1.00 0.00 C ATOM 126 C GLY A 7 1.752 -2.375 0.853 1.00 0.00 C ATOM 127 O GLY A 7 2.103 -1.351 0.269 1.00 0.00 O ATOM 0 H GLY A 7 0.333 -0.320 1.432 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.085 -2.415 2.879 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.005 -3.210 1.750 1.00 0.00 H new ATOM 131 N VAL A 8 2.300 -3.561 0.634 1.00 0.00 N ATOM 132 CA VAL A 8 3.374 -3.735 -0.330 1.00 0.00 C ATOM 133 C VAL A 8 3.067 -4.893 -1.268 1.00 0.00 C ATOM 134 O VAL A 8 2.199 -5.718 -0.981 1.00 0.00 O ATOM 135 CB VAL A 8 4.728 -3.992 0.352 1.00 0.00 C ATOM 136 CG1 VAL A 8 5.846 -3.358 -0.446 1.00 0.00 C ATOM 137 CG2 VAL A 8 4.747 -3.479 1.789 1.00 0.00 C ATOM 0 H VAL A 8 2.018 -4.417 1.112 1.00 0.00 H new ATOM 0 HA VAL A 8 3.443 -2.805 -0.894 1.00 0.00 H new ATOM 0 HB VAL A 8 4.879 -5.071 0.386 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.799 -3.548 0.048 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.866 -3.786 -1.448 1.00 0.00 H new ATOM 0 HG13 VAL A 8 5.680 -2.283 -0.514 1.00 0.00 H new ATOM 0 HG21 VAL A 8 5.721 -3.680 2.234 1.00 0.00 H new ATOM 0 HG22 VAL A 8 4.560 -2.405 1.794 1.00 0.00 H new ATOM 0 HG23 VAL A 8 3.973 -3.985 2.366 1.00 0.00 H new ATOM 147 N PHE A 9 3.760 -4.945 -2.403 1.00 0.00 N ATOM 148 CA PHE A 9 3.525 -5.999 -3.380 1.00 0.00 C ATOM 149 C PHE A 9 4.764 -6.286 -4.221 1.00 0.00 C ATOM 150 O PHE A 9 5.269 -5.408 -4.921 1.00 0.00 O ATOM 151 CB PHE A 9 2.390 -5.593 -4.309 1.00 0.00 C ATOM 152 CG PHE A 9 1.104 -5.275 -3.609 1.00 0.00 C ATOM 153 CD1 PHE A 9 0.956 -4.103 -2.884 1.00 0.00 C ATOM 154 CD2 PHE A 9 0.032 -6.142 -3.700 1.00 0.00 C ATOM 155 CE1 PHE A 9 -0.239 -3.808 -2.263 1.00 0.00 C ATOM 156 CE2 PHE A 9 -1.165 -5.852 -3.080 1.00 0.00 C ATOM 157 CZ PHE A 9 -1.300 -4.682 -2.364 1.00 0.00 C ATOM 0 H PHE A 9 4.483 -4.275 -2.665 1.00 0.00 H new ATOM 0 HA PHE A 9 3.268 -6.902 -2.827 1.00 0.00 H new ATOM 0 HB2 PHE A 9 2.702 -4.722 -4.885 1.00 0.00 H new ATOM 0 HB3 PHE A 9 2.213 -6.399 -5.021 1.00 0.00 H new ATOM 0 HD1 PHE A 9 1.784 -3.415 -2.805 1.00 0.00 H new ATOM 0 HD2 PHE A 9 0.133 -7.058 -4.264 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -0.344 -2.893 -1.698 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -1.994 -6.540 -3.155 1.00 0.00 H new ATOM 0 HZ PHE A 9 -2.238 -4.450 -1.882 1.00 0.00 H new ATOM 167 N ARG A 10 5.233 -7.526 -4.179 1.00 0.00 N ATOM 168 CA ARG A 10 6.394 -7.919 -4.965 1.00 0.00 C ATOM 169 C ARG A 10 5.987 -8.169 -6.411 1.00 0.00 C ATOM 170 O ARG A 10 5.074 -8.948 -6.683 1.00 0.00 O ATOM 171 CB ARG A 10 7.039 -9.176 -4.381 1.00 0.00 C ATOM 172 CG ARG A 10 8.374 -9.532 -5.019 1.00 0.00 C ATOM 173 CD ARG A 10 8.204 -10.262 -6.346 1.00 0.00 C ATOM 174 NE ARG A 10 7.338 -11.435 -6.235 1.00 0.00 N ATOM 175 CZ ARG A 10 7.350 -12.447 -7.101 1.00 0.00 C ATOM 176 NH1 ARG A 10 8.188 -12.441 -8.130 1.00 0.00 N ATOM 177 NH2 ARG A 10 6.523 -13.470 -6.933 1.00 0.00 N ATOM 0 H ARG A 10 4.830 -8.273 -3.613 1.00 0.00 H new ATOM 0 HA ARG A 10 7.122 -7.108 -4.934 1.00 0.00 H new ATOM 0 HB2 ARG A 10 7.184 -9.035 -3.310 1.00 0.00 H new ATOM 0 HB3 ARG A 10 6.354 -10.015 -4.502 1.00 0.00 H new ATOM 0 HG2 ARG A 10 8.952 -8.622 -5.179 1.00 0.00 H new ATOM 0 HG3 ARG A 10 8.947 -10.157 -4.334 1.00 0.00 H new ATOM 0 HD2 ARG A 10 7.787 -9.576 -7.083 1.00 0.00 H new ATOM 0 HD3 ARG A 10 9.182 -10.571 -6.715 1.00 0.00 H new ATOM 0 HE ARG A 10 6.688 -11.481 -5.450 1.00 0.00 H new ATOM 0 HH11 ARG A 10 8.828 -11.658 -8.262 1.00 0.00 H new ATOM 0 HH12 ARG A 10 8.192 -13.219 -8.789 1.00 0.00 H new ATOM 0 HH21 ARG A 10 5.879 -13.481 -6.142 1.00 0.00 H new ATOM 0 HH22 ARG A 10 6.531 -14.246 -7.595 1.00 0.00 H new ATOM 191 N SER A 11 6.668 -7.504 -7.337 1.00 0.00 N ATOM 192 CA SER A 11 6.371 -7.655 -8.754 1.00 0.00 C ATOM 193 C SER A 11 6.519 -9.107 -9.192 1.00 0.00 C ATOM 194 O SER A 11 7.623 -9.577 -9.466 1.00 0.00 O ATOM 195 CB SER A 11 7.290 -6.770 -9.589 1.00 0.00 C ATOM 196 OG SER A 11 7.698 -5.623 -8.862 1.00 0.00 O ATOM 0 H SER A 11 7.428 -6.856 -7.131 1.00 0.00 H new ATOM 0 HA SER A 11 5.337 -7.348 -8.912 1.00 0.00 H new ATOM 0 HB2 SER A 11 8.167 -7.340 -9.896 1.00 0.00 H new ATOM 0 HB3 SER A 11 6.775 -6.463 -10.499 1.00 0.00 H new ATOM 0 HG SER A 11 6.916 -5.203 -8.447 1.00 0.00 H new ATOM 202 N GLY A 12 5.397 -9.810 -9.262 1.00 0.00 N ATOM 203 CA GLY A 12 5.417 -11.201 -9.672 1.00 0.00 C ATOM 204 C GLY A 12 5.432 -11.356 -11.180 1.00 0.00 C ATOM 205 O GLY A 12 6.200 -10.688 -11.872 1.00 0.00 O ATOM 0 H GLY A 12 4.472 -9.442 -9.042 1.00 0.00 H new ATOM 0 HA2 GLY A 12 6.295 -11.689 -9.250 1.00 0.00 H new ATOM 0 HA3 GLY A 12 4.543 -11.710 -9.265 1.00 0.00 H new ATOM 209 N GLY A 13 4.581 -12.239 -11.692 1.00 0.00 N ATOM 210 CA GLY A 13 4.514 -12.460 -13.124 1.00 0.00 C ATOM 211 C GLY A 13 3.396 -11.672 -13.778 1.00 0.00 C ATOM 212 O GLY A 13 3.495 -10.455 -13.933 1.00 0.00 O ATOM 0 H GLY A 13 3.937 -12.805 -11.140 1.00 0.00 H new ATOM 0 HA2 GLY A 13 5.465 -12.181 -13.577 1.00 0.00 H new ATOM 0 HA3 GLY A 13 4.368 -13.523 -13.319 1.00 0.00 H new ATOM 216 N GLU A 14 2.329 -12.366 -14.156 1.00 0.00 N ATOM 217 CA GLU A 14 1.186 -11.722 -14.793 1.00 0.00 C ATOM 218 C GLU A 14 0.563 -10.680 -13.869 1.00 0.00 C ATOM 219 O GLU A 14 -0.051 -9.717 -14.326 1.00 0.00 O ATOM 220 CB GLU A 14 0.138 -12.767 -15.181 1.00 0.00 C ATOM 221 CG GLU A 14 -0.274 -13.671 -14.031 1.00 0.00 C ATOM 222 CD GLU A 14 -0.440 -15.116 -14.456 1.00 0.00 C ATOM 223 OE1 GLU A 14 0.555 -15.719 -14.912 1.00 0.00 O ATOM 224 OE2 GLU A 14 -1.564 -15.646 -14.333 1.00 0.00 O ATOM 0 H GLU A 14 2.231 -13.374 -14.033 1.00 0.00 H new ATOM 0 HA GLU A 14 1.539 -11.218 -15.693 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -0.745 -12.258 -15.566 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.531 -13.380 -15.992 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.475 -13.612 -13.241 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.212 -13.310 -13.608 1.00 0.00 H new ATOM 231 N LYS A 15 0.728 -10.882 -12.565 1.00 0.00 N ATOM 232 CA LYS A 15 0.185 -9.965 -11.573 1.00 0.00 C ATOM 233 C LYS A 15 1.208 -9.690 -10.479 1.00 0.00 C ATOM 234 O LYS A 15 2.369 -10.085 -10.586 1.00 0.00 O ATOM 235 CB LYS A 15 -1.096 -10.539 -10.965 1.00 0.00 C ATOM 236 CG LYS A 15 -0.880 -11.843 -10.214 1.00 0.00 C ATOM 237 CD LYS A 15 -1.331 -13.043 -11.035 1.00 0.00 C ATOM 238 CE LYS A 15 -2.174 -14.000 -10.208 1.00 0.00 C ATOM 239 NZ LYS A 15 -3.157 -14.741 -11.045 1.00 0.00 N ATOM 0 H LYS A 15 1.235 -11.675 -12.172 1.00 0.00 H new ATOM 0 HA LYS A 15 -0.052 -9.024 -12.069 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -1.527 -9.804 -10.285 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -1.824 -10.703 -11.760 1.00 0.00 H new ATOM 0 HG2 LYS A 15 0.175 -11.949 -9.963 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -1.430 -11.817 -9.273 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -1.906 -12.701 -11.895 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.458 -13.568 -11.423 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -1.522 -14.710 -9.699 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -2.703 -13.442 -9.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -3.712 -15.383 -10.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -3.795 -14.065 -11.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -2.652 -15.294 -11.767 1.00 0.00 H new ATOM 253 N ALA A 16 0.772 -9.007 -9.428 1.00 0.00 N ATOM 254 CA ALA A 16 1.651 -8.672 -8.317 1.00 0.00 C ATOM 255 C ALA A 16 1.457 -9.627 -7.148 1.00 0.00 C ATOM 256 O ALA A 16 0.380 -10.193 -6.966 1.00 0.00 O ATOM 257 CB ALA A 16 1.398 -7.244 -7.869 1.00 0.00 C ATOM 0 H ALA A 16 -0.186 -8.674 -9.322 1.00 0.00 H new ATOM 0 HA ALA A 16 2.681 -8.767 -8.661 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.059 -7.001 -7.037 1.00 0.00 H new ATOM 0 HB2 ALA A 16 1.592 -6.563 -8.698 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.361 -7.141 -7.550 1.00 0.00 H new ATOM 263 N LEU A 17 2.507 -9.795 -6.350 1.00 0.00 N ATOM 264 CA LEU A 17 2.446 -10.672 -5.191 1.00 0.00 C ATOM 265 C LEU A 17 2.023 -9.887 -3.953 1.00 0.00 C ATOM 266 O LEU A 17 2.476 -8.764 -3.736 1.00 0.00 O ATOM 267 CB LEU A 17 3.798 -11.343 -4.949 1.00 0.00 C ATOM 268 CG LEU A 17 3.859 -12.245 -3.713 1.00 0.00 C ATOM 269 CD1 LEU A 17 4.627 -13.522 -4.017 1.00 0.00 C ATOM 270 CD2 LEU A 17 4.495 -11.506 -2.546 1.00 0.00 C ATOM 0 H LEU A 17 3.407 -9.335 -6.486 1.00 0.00 H new ATOM 0 HA LEU A 17 1.705 -11.447 -5.389 1.00 0.00 H new ATOM 0 HB2 LEU A 17 4.055 -11.936 -5.827 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.559 -10.569 -4.854 1.00 0.00 H new ATOM 0 HG LEU A 17 2.840 -12.516 -3.437 1.00 0.00 H new ATOM 0 HD11 LEU A 17 4.659 -14.149 -3.126 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.130 -14.062 -4.823 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.643 -13.272 -4.321 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.530 -12.162 -1.676 1.00 0.00 H new ATOM 0 HD22 LEU A 17 5.507 -11.205 -2.815 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.904 -10.621 -2.310 1.00 0.00 H new ATOM 282 N GLU A 18 1.146 -10.478 -3.150 1.00 0.00 N ATOM 283 CA GLU A 18 0.657 -9.825 -1.943 1.00 0.00 C ATOM 284 C GLU A 18 1.728 -9.782 -0.856 1.00 0.00 C ATOM 285 O GLU A 18 1.840 -10.703 -0.047 1.00 0.00 O ATOM 286 CB GLU A 18 -0.585 -10.546 -1.418 1.00 0.00 C ATOM 287 CG GLU A 18 -1.636 -10.805 -2.487 1.00 0.00 C ATOM 288 CD GLU A 18 -2.282 -12.169 -2.352 1.00 0.00 C ATOM 289 OE1 GLU A 18 -2.845 -12.456 -1.275 1.00 0.00 O ATOM 290 OE2 GLU A 18 -2.225 -12.952 -3.324 1.00 0.00 O ATOM 0 H GLU A 18 0.759 -11.408 -3.313 1.00 0.00 H new ATOM 0 HA GLU A 18 0.398 -8.799 -2.204 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -0.284 -11.497 -0.978 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.030 -9.952 -0.620 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.406 -10.035 -2.428 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.176 -10.721 -3.471 1.00 0.00 H new ATOM 297 N LEU A 19 2.502 -8.700 -0.831 1.00 0.00 N ATOM 298 CA LEU A 19 3.548 -8.535 0.172 1.00 0.00 C ATOM 299 C LEU A 19 2.927 -8.175 1.519 1.00 0.00 C ATOM 300 O LEU A 19 2.658 -9.054 2.338 1.00 0.00 O ATOM 301 CB LEU A 19 4.556 -7.474 -0.273 1.00 0.00 C ATOM 302 CG LEU A 19 5.989 -7.979 -0.467 1.00 0.00 C ATOM 303 CD1 LEU A 19 6.010 -9.314 -1.197 1.00 0.00 C ATOM 304 CD2 LEU A 19 6.816 -6.950 -1.222 1.00 0.00 C ATOM 0 H LEU A 19 2.424 -7.927 -1.492 1.00 0.00 H new ATOM 0 HA LEU A 19 4.085 -9.477 0.283 1.00 0.00 H new ATOM 0 HB2 LEU A 19 4.211 -7.038 -1.211 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.567 -6.673 0.466 1.00 0.00 H new ATOM 0 HG LEU A 19 6.428 -8.129 0.519 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.041 -9.646 -1.319 1.00 0.00 H new ATOM 0 HD12 LEU A 19 5.457 -10.054 -0.618 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.547 -9.200 -2.177 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.832 -7.324 -1.352 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.368 -6.769 -2.199 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.842 -6.018 -0.657 1.00 0.00 H new ATOM 316 N SER A 20 2.662 -6.890 1.734 1.00 0.00 N ATOM 317 CA SER A 20 2.031 -6.449 2.970 1.00 0.00 C ATOM 318 C SER A 20 0.599 -6.031 2.673 1.00 0.00 C ATOM 319 O SER A 20 0.341 -5.389 1.655 1.00 0.00 O ATOM 320 CB SER A 20 2.787 -5.282 3.602 1.00 0.00 C ATOM 321 OG SER A 20 2.231 -4.942 4.860 1.00 0.00 O ATOM 0 H SER A 20 2.873 -6.142 1.073 1.00 0.00 H new ATOM 0 HA SER A 20 2.046 -7.277 3.679 1.00 0.00 H new ATOM 0 HB2 SER A 20 3.837 -5.547 3.724 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.751 -4.418 2.938 1.00 0.00 H new ATOM 0 HG SER A 20 2.458 -5.634 5.516 1.00 0.00 H new ATOM 327 N GLU A 21 -0.338 -6.395 3.539 1.00 0.00 N ATOM 328 CA GLU A 21 -1.731 -6.037 3.307 1.00 0.00 C ATOM 329 C GLU A 21 -2.386 -5.429 4.540 1.00 0.00 C ATOM 330 O GLU A 21 -2.621 -6.109 5.541 1.00 0.00 O ATOM 331 CB GLU A 21 -2.521 -7.264 2.848 1.00 0.00 C ATOM 332 CG GLU A 21 -1.785 -8.120 1.830 1.00 0.00 C ATOM 333 CD GLU A 21 -2.644 -9.243 1.283 1.00 0.00 C ATOM 334 OE1 GLU A 21 -2.947 -10.184 2.047 1.00 0.00 O ATOM 335 OE2 GLU A 21 -3.015 -9.181 0.092 1.00 0.00 O ATOM 0 H GLU A 21 -0.165 -6.927 4.392 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.742 -5.278 2.524 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -2.762 -7.876 3.717 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -3.467 -6.936 2.417 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -1.449 -7.490 1.006 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -0.893 -8.542 2.293 1.00 0.00 H new ATOM 342 N VAL A 22 -2.699 -4.142 4.440 1.00 0.00 N ATOM 343 CA VAL A 22 -3.353 -3.411 5.508 1.00 0.00 C ATOM 344 C VAL A 22 -4.579 -2.687 4.961 1.00 0.00 C ATOM 345 O VAL A 22 -4.518 -2.074 3.896 1.00 0.00 O ATOM 346 CB VAL A 22 -2.387 -2.406 6.159 1.00 0.00 C ATOM 347 CG1 VAL A 22 -1.933 -1.348 5.167 1.00 0.00 C ATOM 348 CG2 VAL A 22 -3.022 -1.762 7.380 1.00 0.00 C ATOM 0 H VAL A 22 -2.504 -3.579 3.612 1.00 0.00 H new ATOM 0 HA VAL A 22 -3.666 -4.121 6.273 1.00 0.00 H new ATOM 0 HB VAL A 22 -1.504 -2.958 6.481 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -1.252 -0.655 5.661 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -1.421 -1.827 4.333 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.800 -0.802 4.795 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -2.321 -1.055 7.824 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -3.929 -1.236 7.083 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -3.272 -2.533 8.109 1.00 0.00 H new ATOM 358 N LYS A 23 -5.699 -2.782 5.667 1.00 0.00 N ATOM 359 CA LYS A 23 -6.929 -2.148 5.204 1.00 0.00 C ATOM 360 C LYS A 23 -7.518 -1.205 6.236 1.00 0.00 C ATOM 361 O LYS A 23 -7.178 -1.249 7.419 1.00 0.00 O ATOM 362 CB LYS A 23 -7.980 -3.203 4.865 1.00 0.00 C ATOM 363 CG LYS A 23 -7.455 -4.334 3.995 1.00 0.00 C ATOM 364 CD LYS A 23 -7.611 -5.685 4.676 1.00 0.00 C ATOM 365 CE LYS A 23 -7.286 -6.829 3.729 1.00 0.00 C ATOM 366 NZ LYS A 23 -7.914 -6.639 2.392 1.00 0.00 N ATOM 0 H LYS A 23 -5.782 -3.285 6.551 1.00 0.00 H new ATOM 0 HA LYS A 23 -6.662 -1.572 4.318 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -8.373 -3.622 5.791 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -8.814 -2.721 4.354 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -7.990 -4.341 3.045 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -6.403 -4.160 3.767 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -6.955 -5.733 5.545 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -8.632 -5.793 5.042 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -6.205 -6.909 3.614 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -7.631 -7.768 4.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -8.151 -7.566 1.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -8.781 -6.074 2.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -7.249 -6.144 1.763 1.00 0.00 H new ATOM 380 N ASP A 24 -8.444 -0.381 5.769 1.00 0.00 N ATOM 381 CA ASP A 24 -9.147 0.554 6.623 1.00 0.00 C ATOM 382 C ASP A 24 -10.625 0.537 6.257 1.00 0.00 C ATOM 383 O ASP A 24 -11.022 1.039 5.205 1.00 0.00 O ATOM 384 CB ASP A 24 -8.577 1.964 6.466 1.00 0.00 C ATOM 385 CG ASP A 24 -8.738 2.795 7.724 1.00 0.00 C ATOM 386 OD1 ASP A 24 -9.877 3.213 8.017 1.00 0.00 O ATOM 387 OD2 ASP A 24 -7.724 3.028 8.415 1.00 0.00 O ATOM 0 H ASP A 24 -8.726 -0.344 4.789 1.00 0.00 H new ATOM 0 HA ASP A 24 -9.021 0.258 7.664 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -7.520 1.899 6.209 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -9.076 2.465 5.636 1.00 0.00 H new ATOM 392 N LEU A 25 -11.428 -0.058 7.124 1.00 0.00 N ATOM 393 CA LEU A 25 -12.863 -0.167 6.894 1.00 0.00 C ATOM 394 C LEU A 25 -13.637 0.619 7.945 1.00 0.00 C ATOM 395 O LEU A 25 -14.221 0.046 8.864 1.00 0.00 O ATOM 396 CB LEU A 25 -13.294 -1.638 6.911 1.00 0.00 C ATOM 397 CG LEU A 25 -12.214 -2.654 6.510 1.00 0.00 C ATOM 398 CD1 LEU A 25 -12.843 -4.014 6.244 1.00 0.00 C ATOM 399 CD2 LEU A 25 -11.442 -2.178 5.283 1.00 0.00 C ATOM 0 H LEU A 25 -11.110 -0.476 7.999 1.00 0.00 H new ATOM 0 HA LEU A 25 -13.086 0.254 5.914 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -13.643 -1.884 7.914 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -14.145 -1.756 6.240 1.00 0.00 H new ATOM 0 HG LEU A 25 -11.510 -2.746 7.337 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -12.067 -4.725 5.961 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -13.345 -4.365 7.145 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -13.568 -3.927 5.435 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -10.684 -2.916 5.021 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -12.130 -2.052 4.447 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -10.960 -1.225 5.503 1.00 0.00 H new ATOM 411 N SER A 26 -13.624 1.938 7.806 1.00 0.00 N ATOM 412 CA SER A 26 -14.314 2.814 8.749 1.00 0.00 C ATOM 413 C SER A 26 -15.548 3.465 8.124 1.00 0.00 C ATOM 414 O SER A 26 -16.494 3.817 8.829 1.00 0.00 O ATOM 415 CB SER A 26 -13.360 3.896 9.257 1.00 0.00 C ATOM 416 OG SER A 26 -13.679 4.279 10.583 1.00 0.00 O ATOM 0 H SER A 26 -13.144 2.427 7.050 1.00 0.00 H new ATOM 0 HA SER A 26 -14.648 2.198 9.584 1.00 0.00 H new ATOM 0 HB2 SER A 26 -12.335 3.528 9.219 1.00 0.00 H new ATOM 0 HB3 SER A 26 -13.411 4.766 8.602 1.00 0.00 H new ATOM 0 HG SER A 26 -13.053 4.970 10.883 1.00 0.00 H new ATOM 422 N GLN A 27 -15.532 3.634 6.805 1.00 0.00 N ATOM 423 CA GLN A 27 -16.654 4.256 6.106 1.00 0.00 C ATOM 424 C GLN A 27 -17.629 3.212 5.564 1.00 0.00 C ATOM 425 O GLN A 27 -18.800 3.507 5.330 1.00 0.00 O ATOM 426 CB GLN A 27 -16.142 5.137 4.963 1.00 0.00 C ATOM 427 CG GLN A 27 -16.141 6.621 5.292 1.00 0.00 C ATOM 428 CD GLN A 27 -17.539 7.178 5.477 1.00 0.00 C ATOM 429 OE1 GLN A 27 -18.254 6.799 6.405 1.00 0.00 O ATOM 430 NE2 GLN A 27 -17.937 8.084 4.591 1.00 0.00 N ATOM 0 H GLN A 27 -14.760 3.351 6.201 1.00 0.00 H new ATOM 0 HA GLN A 27 -17.191 4.873 6.826 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -15.129 4.830 4.705 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -16.760 4.969 4.081 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -15.564 6.787 6.202 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -15.639 7.166 4.493 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -17.312 8.369 3.837 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -18.868 8.494 4.664 1.00 0.00 H new ATOM 439 N PHE A 28 -17.138 1.996 5.359 1.00 0.00 N ATOM 440 CA PHE A 28 -17.964 0.911 4.836 1.00 0.00 C ATOM 441 C PHE A 28 -18.932 0.399 5.904 1.00 0.00 C ATOM 442 O PHE A 28 -19.185 1.082 6.895 1.00 0.00 O ATOM 443 CB PHE A 28 -17.067 -0.215 4.315 1.00 0.00 C ATOM 444 CG PHE A 28 -15.806 0.296 3.676 1.00 0.00 C ATOM 445 CD1 PHE A 28 -15.833 1.434 2.884 1.00 0.00 C ATOM 446 CD2 PHE A 28 -14.597 -0.342 3.886 1.00 0.00 C ATOM 447 CE1 PHE A 28 -14.675 1.924 2.314 1.00 0.00 C ATOM 448 CE2 PHE A 28 -13.437 0.143 3.315 1.00 0.00 C ATOM 449 CZ PHE A 28 -13.477 1.278 2.531 1.00 0.00 C ATOM 0 H PHE A 28 -16.170 1.735 5.547 1.00 0.00 H new ATOM 0 HA PHE A 28 -18.564 1.289 4.008 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -16.808 -0.879 5.140 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -17.622 -0.810 3.589 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -16.770 1.942 2.711 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -14.560 -1.228 4.502 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -14.708 2.812 1.699 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -12.499 -0.366 3.482 1.00 0.00 H new ATOM 0 HZ PHE A 28 -12.569 1.660 2.087 1.00 0.00 H new ATOM 459 N GLY A 29 -19.483 -0.796 5.695 1.00 0.00 N ATOM 460 CA GLY A 29 -20.428 -1.348 6.655 1.00 0.00 C ATOM 461 C GLY A 29 -20.105 -2.772 7.072 1.00 0.00 C ATOM 462 O GLY A 29 -19.289 -3.444 6.443 1.00 0.00 O ATOM 0 H GLY A 29 -19.295 -1.388 4.886 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -20.446 -0.714 7.541 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -21.429 -1.322 6.224 1.00 0.00 H new ATOM 466 N PHE A 30 -20.757 -3.233 8.137 1.00 0.00 N ATOM 467 CA PHE A 30 -20.550 -4.587 8.657 1.00 0.00 C ATOM 468 C PHE A 30 -21.108 -5.658 7.715 1.00 0.00 C ATOM 469 O PHE A 30 -21.653 -6.666 8.164 1.00 0.00 O ATOM 470 CB PHE A 30 -21.199 -4.724 10.037 1.00 0.00 C ATOM 471 CG PHE A 30 -22.615 -4.220 10.089 1.00 0.00 C ATOM 472 CD1 PHE A 30 -23.665 -5.022 9.670 1.00 0.00 C ATOM 473 CD2 PHE A 30 -22.894 -2.947 10.559 1.00 0.00 C ATOM 474 CE1 PHE A 30 -24.967 -4.562 9.718 1.00 0.00 C ATOM 475 CE2 PHE A 30 -24.194 -2.482 10.609 1.00 0.00 C ATOM 476 CZ PHE A 30 -25.232 -3.290 10.188 1.00 0.00 C ATOM 0 H PHE A 30 -21.439 -2.685 8.662 1.00 0.00 H new ATOM 0 HA PHE A 30 -19.474 -4.744 8.736 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -21.184 -5.773 10.334 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -20.601 -4.178 10.766 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -23.463 -6.017 9.302 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -22.086 -2.311 10.890 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -25.777 -5.196 9.388 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -24.398 -1.487 10.977 1.00 0.00 H new ATOM 0 HZ PHE A 30 -26.249 -2.928 10.226 1.00 0.00 H new ATOM 486 N PHE A 31 -20.965 -5.439 6.413 1.00 0.00 N ATOM 487 CA PHE A 31 -21.447 -6.382 5.414 1.00 0.00 C ATOM 488 C PHE A 31 -20.670 -6.207 4.116 1.00 0.00 C ATOM 489 O PHE A 31 -20.247 -7.181 3.493 1.00 0.00 O ATOM 490 CB PHE A 31 -22.943 -6.180 5.163 1.00 0.00 C ATOM 491 CG PHE A 31 -23.292 -4.798 4.689 1.00 0.00 C ATOM 492 CD1 PHE A 31 -23.142 -3.705 5.527 1.00 0.00 C ATOM 493 CD2 PHE A 31 -23.770 -4.593 3.405 1.00 0.00 C ATOM 494 CE1 PHE A 31 -23.463 -2.433 5.094 1.00 0.00 C ATOM 495 CE2 PHE A 31 -24.093 -3.323 2.965 1.00 0.00 C ATOM 496 CZ PHE A 31 -23.939 -2.241 3.811 1.00 0.00 C ATOM 0 H PHE A 31 -20.516 -4.610 6.024 1.00 0.00 H new ATOM 0 HA PHE A 31 -21.293 -7.394 5.788 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -23.280 -6.905 4.422 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -23.489 -6.388 6.083 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -22.770 -3.849 6.531 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -23.892 -5.435 2.740 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -23.342 -1.590 5.758 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -24.465 -3.177 1.962 1.00 0.00 H new ATOM 0 HZ PHE A 31 -24.190 -1.247 3.470 1.00 0.00 H new ATOM 506 N GLU A 32 -20.475 -4.953 3.724 1.00 0.00 N ATOM 507 CA GLU A 32 -19.736 -4.634 2.511 1.00 0.00 C ATOM 508 C GLU A 32 -18.250 -4.451 2.819 1.00 0.00 C ATOM 509 O GLU A 32 -17.411 -4.527 1.923 1.00 0.00 O ATOM 510 CB GLU A 32 -20.298 -3.370 1.860 1.00 0.00 C ATOM 511 CG GLU A 32 -20.146 -2.124 2.717 1.00 0.00 C ATOM 512 CD GLU A 32 -20.941 -0.948 2.183 1.00 0.00 C ATOM 513 OE1 GLU A 32 -22.071 -1.167 1.697 1.00 0.00 O ATOM 514 OE2 GLU A 32 -20.434 0.192 2.252 1.00 0.00 O ATOM 0 H GLU A 32 -20.820 -4.139 4.232 1.00 0.00 H new ATOM 0 HA GLU A 32 -19.847 -5.465 1.815 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -19.795 -3.208 0.907 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -21.355 -3.523 1.641 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -20.470 -2.345 3.734 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -19.092 -1.851 2.771 1.00 0.00 H new ATOM 521 N ARG A 33 -17.930 -4.216 4.094 1.00 0.00 N ATOM 522 CA ARG A 33 -16.542 -4.029 4.519 1.00 0.00 C ATOM 523 C ARG A 33 -15.648 -5.118 3.936 1.00 0.00 C ATOM 524 O ARG A 33 -14.603 -4.834 3.351 1.00 0.00 O ATOM 525 CB ARG A 33 -16.444 -4.055 6.047 1.00 0.00 C ATOM 526 CG ARG A 33 -16.718 -2.714 6.709 1.00 0.00 C ATOM 527 CD ARG A 33 -17.041 -2.879 8.186 1.00 0.00 C ATOM 528 NE ARG A 33 -16.033 -3.677 8.880 1.00 0.00 N ATOM 529 CZ ARG A 33 -16.144 -4.076 10.145 1.00 0.00 C ATOM 530 NH1 ARG A 33 -17.215 -3.755 10.859 1.00 0.00 N ATOM 531 NH2 ARG A 33 -15.180 -4.799 10.697 1.00 0.00 N ATOM 0 H ARG A 33 -18.613 -4.151 4.849 1.00 0.00 H new ATOM 0 HA ARG A 33 -16.206 -3.059 4.152 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -17.150 -4.790 6.433 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -15.447 -4.391 6.331 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -15.849 -2.066 6.595 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -17.550 -2.222 6.206 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -17.111 -1.897 8.654 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -18.016 -3.354 8.293 1.00 0.00 H new ATOM 0 HE ARG A 33 -15.194 -3.944 8.365 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -17.960 -3.199 10.439 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -17.293 -4.064 11.828 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -14.354 -5.049 10.153 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -15.264 -5.105 11.666 1.00 0.00 H new ATOM 545 N SER A 34 -16.075 -6.364 4.098 1.00 0.00 N ATOM 546 CA SER A 34 -15.326 -7.505 3.590 1.00 0.00 C ATOM 547 C SER A 34 -15.162 -7.407 2.076 1.00 0.00 C ATOM 548 O SER A 34 -14.055 -7.542 1.548 1.00 0.00 O ATOM 549 CB SER A 34 -16.042 -8.805 3.958 1.00 0.00 C ATOM 550 OG SER A 34 -15.267 -9.935 3.599 1.00 0.00 O ATOM 0 H SER A 34 -16.940 -6.610 4.579 1.00 0.00 H new ATOM 0 HA SER A 34 -14.336 -7.502 4.046 1.00 0.00 H new ATOM 0 HB2 SER A 34 -16.241 -8.823 5.029 1.00 0.00 H new ATOM 0 HB3 SER A 34 -17.007 -8.847 3.453 1.00 0.00 H new ATOM 0 HG SER A 34 -15.747 -10.753 3.847 1.00 0.00 H new ATOM 556 N SER A 35 -16.270 -7.164 1.385 1.00 0.00 N ATOM 557 CA SER A 35 -16.256 -7.041 -0.068 1.00 0.00 C ATOM 558 C SER A 35 -15.279 -5.956 -0.510 1.00 0.00 C ATOM 559 O SER A 35 -14.490 -6.156 -1.436 1.00 0.00 O ATOM 560 CB SER A 35 -17.659 -6.725 -0.589 1.00 0.00 C ATOM 561 OG SER A 35 -18.648 -7.071 0.366 1.00 0.00 O ATOM 0 H SER A 35 -17.191 -7.048 1.808 1.00 0.00 H new ATOM 0 HA SER A 35 -15.929 -7.993 -0.486 1.00 0.00 H new ATOM 0 HB2 SER A 35 -17.732 -5.663 -0.825 1.00 0.00 H new ATOM 0 HB3 SER A 35 -17.837 -7.270 -1.516 1.00 0.00 H new ATOM 0 HG SER A 35 -19.536 -6.858 0.010 1.00 0.00 H new ATOM 567 N VAL A 36 -15.330 -4.807 0.158 1.00 0.00 N ATOM 568 CA VAL A 36 -14.440 -3.704 -0.176 1.00 0.00 C ATOM 569 C VAL A 36 -12.990 -4.102 0.056 1.00 0.00 C ATOM 570 O VAL A 36 -12.115 -3.791 -0.752 1.00 0.00 O ATOM 571 CB VAL A 36 -14.743 -2.425 0.631 1.00 0.00 C ATOM 572 CG1 VAL A 36 -14.243 -1.208 -0.128 1.00 0.00 C ATOM 573 CG2 VAL A 36 -16.231 -2.295 0.931 1.00 0.00 C ATOM 0 H VAL A 36 -15.973 -4.618 0.927 1.00 0.00 H new ATOM 0 HA VAL A 36 -14.609 -3.483 -1.230 1.00 0.00 H new ATOM 0 HB VAL A 36 -14.222 -2.491 1.586 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.459 -0.307 0.446 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -13.167 -1.291 -0.281 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.743 -1.151 -1.095 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -16.409 -1.383 1.501 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -16.788 -2.253 -0.005 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -16.562 -3.156 1.512 1.00 0.00 H new ATOM 583 N GLY A 37 -12.738 -4.808 1.155 1.00 0.00 N ATOM 584 CA GLY A 37 -11.386 -5.248 1.452 1.00 0.00 C ATOM 585 C GLY A 37 -10.774 -5.979 0.277 1.00 0.00 C ATOM 586 O GLY A 37 -9.648 -5.686 -0.129 1.00 0.00 O ATOM 0 H GLY A 37 -13.441 -5.082 1.841 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -10.769 -4.387 1.708 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -11.398 -5.902 2.324 1.00 0.00 H new ATOM 590 N GLN A 38 -11.532 -6.914 -0.288 1.00 0.00 N ATOM 591 CA GLN A 38 -11.069 -7.666 -1.445 1.00 0.00 C ATOM 592 C GLN A 38 -10.842 -6.714 -2.612 1.00 0.00 C ATOM 593 O GLN A 38 -9.921 -6.892 -3.408 1.00 0.00 O ATOM 594 CB GLN A 38 -12.086 -8.742 -1.828 1.00 0.00 C ATOM 595 CG GLN A 38 -11.702 -9.534 -3.067 1.00 0.00 C ATOM 596 CD GLN A 38 -10.657 -10.595 -2.780 1.00 0.00 C ATOM 597 OE1 GLN A 38 -9.565 -10.577 -3.349 1.00 0.00 O ATOM 598 NE2 GLN A 38 -10.987 -11.527 -1.895 1.00 0.00 N ATOM 0 H GLN A 38 -12.465 -7.167 0.036 1.00 0.00 H new ATOM 0 HA GLN A 38 -10.130 -8.159 -1.195 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -12.206 -9.430 -0.991 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -13.055 -8.271 -1.995 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -12.592 -10.008 -3.481 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -11.322 -8.851 -3.827 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -11.903 -11.504 -1.447 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -10.324 -12.267 -1.662 1.00 0.00 H new ATOM 607 N PHE A 39 -11.689 -5.690 -2.693 1.00 0.00 N ATOM 608 CA PHE A 39 -11.585 -4.688 -3.746 1.00 0.00 C ATOM 609 C PHE A 39 -10.298 -3.885 -3.591 1.00 0.00 C ATOM 610 O PHE A 39 -9.629 -3.559 -4.573 1.00 0.00 O ATOM 611 CB PHE A 39 -12.795 -3.751 -3.709 1.00 0.00 C ATOM 612 CG PHE A 39 -12.782 -2.708 -4.790 1.00 0.00 C ATOM 613 CD1 PHE A 39 -12.004 -1.569 -4.663 1.00 0.00 C ATOM 614 CD2 PHE A 39 -13.549 -2.867 -5.932 1.00 0.00 C ATOM 615 CE1 PHE A 39 -11.992 -0.606 -5.654 1.00 0.00 C ATOM 616 CE2 PHE A 39 -13.541 -1.908 -6.928 1.00 0.00 C ATOM 617 CZ PHE A 39 -12.761 -0.777 -6.789 1.00 0.00 C ATOM 0 H PHE A 39 -12.456 -5.534 -2.039 1.00 0.00 H new ATOM 0 HA PHE A 39 -11.565 -5.200 -4.708 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -13.706 -4.343 -3.798 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -12.831 -3.256 -2.739 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -11.399 -1.432 -3.779 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -14.160 -3.750 -6.046 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -11.383 0.279 -5.541 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -14.144 -2.043 -7.814 1.00 0.00 H new ATOM 0 HZ PHE A 39 -12.752 -0.027 -7.566 1.00 0.00 H new ATOM 627 N MET A 40 -9.965 -3.569 -2.345 1.00 0.00 N ATOM 628 CA MET A 40 -8.768 -2.798 -2.037 1.00 0.00 C ATOM 629 C MET A 40 -7.500 -3.506 -2.512 1.00 0.00 C ATOM 630 O MET A 40 -6.740 -2.964 -3.314 1.00 0.00 O ATOM 631 CB MET A 40 -8.686 -2.546 -0.533 1.00 0.00 C ATOM 632 CG MET A 40 -9.379 -1.268 -0.092 1.00 0.00 C ATOM 633 SD MET A 40 -9.930 -1.335 1.622 1.00 0.00 S ATOM 634 CE MET A 40 -11.703 -1.375 1.396 1.00 0.00 C ATOM 0 H MET A 40 -10.512 -3.837 -1.527 1.00 0.00 H new ATOM 0 HA MET A 40 -8.839 -1.849 -2.568 1.00 0.00 H new ATOM 0 HB2 MET A 40 -9.131 -3.391 -0.007 1.00 0.00 H new ATOM 0 HB3 MET A 40 -7.638 -2.502 -0.237 1.00 0.00 H new ATOM 0 HG2 MET A 40 -8.697 -0.427 -0.218 1.00 0.00 H new ATOM 0 HG3 MET A 40 -10.237 -1.082 -0.739 1.00 0.00 H new ATOM 0 HE1 MET A 40 -12.168 -1.864 2.252 1.00 0.00 H new ATOM 0 HE2 MET A 40 -12.082 -0.357 1.310 1.00 0.00 H new ATOM 0 HE3 MET A 40 -11.942 -1.929 0.488 1.00 0.00 H new ATOM 644 N THR A 41 -7.272 -4.712 -2.003 1.00 0.00 N ATOM 645 CA THR A 41 -6.087 -5.484 -2.367 1.00 0.00 C ATOM 646 C THR A 41 -6.063 -5.789 -3.860 1.00 0.00 C ATOM 647 O THR A 41 -5.102 -5.455 -4.541 1.00 0.00 O ATOM 648 CB THR A 41 -6.034 -6.785 -1.570 1.00 0.00 C ATOM 649 OG1 THR A 41 -6.315 -6.548 -0.201 1.00 0.00 O ATOM 650 CG2 THR A 41 -4.694 -7.483 -1.650 1.00 0.00 C ATOM 0 H THR A 41 -7.890 -5.176 -1.338 1.00 0.00 H new ATOM 0 HA THR A 41 -5.211 -4.881 -2.127 1.00 0.00 H new ATOM 0 HB THR A 41 -6.788 -7.430 -2.022 1.00 0.00 H new ATOM 0 HG1 THR A 41 -6.108 -5.616 0.019 1.00 0.00 H new ATOM 0 HG21 THR A 41 -4.726 -8.400 -1.062 1.00 0.00 H new ATOM 0 HG22 THR A 41 -4.472 -7.726 -2.689 1.00 0.00 H new ATOM 0 HG23 THR A 41 -3.918 -6.826 -1.257 1.00 0.00 H new ATOM 658 N PHE A 42 -7.119 -6.427 -4.364 1.00 0.00 N ATOM 659 CA PHE A 42 -7.207 -6.771 -5.785 1.00 0.00 C ATOM 660 C PHE A 42 -6.724 -5.612 -6.655 1.00 0.00 C ATOM 661 O PHE A 42 -5.972 -5.801 -7.614 1.00 0.00 O ATOM 662 CB PHE A 42 -8.649 -7.132 -6.151 1.00 0.00 C ATOM 663 CG PHE A 42 -8.780 -7.818 -7.481 1.00 0.00 C ATOM 664 CD1 PHE A 42 -8.771 -7.085 -8.657 1.00 0.00 C ATOM 665 CD2 PHE A 42 -8.912 -9.195 -7.554 1.00 0.00 C ATOM 666 CE1 PHE A 42 -8.893 -7.714 -9.881 1.00 0.00 C ATOM 667 CE2 PHE A 42 -9.034 -9.829 -8.775 1.00 0.00 C ATOM 668 CZ PHE A 42 -9.025 -9.087 -9.941 1.00 0.00 C ATOM 0 H PHE A 42 -7.926 -6.716 -3.811 1.00 0.00 H new ATOM 0 HA PHE A 42 -6.564 -7.632 -5.969 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -9.060 -7.779 -5.376 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -9.251 -6.223 -6.160 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.668 -6.011 -8.616 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -8.920 -9.779 -6.646 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.885 -7.132 -10.791 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -9.136 -10.903 -8.819 1.00 0.00 H new ATOM 0 HZ PHE A 42 -9.121 -9.580 -10.897 1.00 0.00 H new ATOM 678 N PHE A 43 -7.149 -4.409 -6.297 1.00 0.00 N ATOM 679 CA PHE A 43 -6.754 -3.210 -7.023 1.00 0.00 C ATOM 680 C PHE A 43 -5.296 -2.873 -6.728 1.00 0.00 C ATOM 681 O PHE A 43 -4.574 -2.362 -7.584 1.00 0.00 O ATOM 682 CB PHE A 43 -7.657 -2.041 -6.628 1.00 0.00 C ATOM 683 CG PHE A 43 -8.082 -1.184 -7.784 1.00 0.00 C ATOM 684 CD1 PHE A 43 -8.438 -1.754 -8.996 1.00 0.00 C ATOM 685 CD2 PHE A 43 -8.122 0.193 -7.659 1.00 0.00 C ATOM 686 CE1 PHE A 43 -8.825 -0.966 -10.059 1.00 0.00 C ATOM 687 CE2 PHE A 43 -8.509 0.989 -8.718 1.00 0.00 C ATOM 688 CZ PHE A 43 -8.861 0.408 -9.922 1.00 0.00 C ATOM 0 H PHE A 43 -7.769 -4.237 -5.506 1.00 0.00 H new ATOM 0 HA PHE A 43 -6.860 -3.392 -8.092 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -8.545 -2.432 -6.132 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -7.134 -1.420 -5.901 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -8.412 -2.828 -9.109 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -7.847 0.651 -6.721 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -9.100 -1.423 -10.998 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -8.537 2.063 -8.606 1.00 0.00 H new ATOM 0 HZ PHE A 43 -9.163 1.027 -10.754 1.00 0.00 H new ATOM 698 N ALA A 44 -4.878 -3.169 -5.502 1.00 0.00 N ATOM 699 CA ALA A 44 -3.510 -2.914 -5.055 1.00 0.00 C ATOM 700 C ALA A 44 -2.517 -3.878 -5.705 1.00 0.00 C ATOM 701 O ALA A 44 -1.378 -3.510 -6.006 1.00 0.00 O ATOM 702 CB ALA A 44 -3.436 -3.024 -3.541 1.00 0.00 C ATOM 0 H ALA A 44 -5.475 -3.591 -4.791 1.00 0.00 H new ATOM 0 HA ALA A 44 -3.236 -1.904 -5.360 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -2.415 -2.833 -3.212 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -4.105 -2.292 -3.090 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.735 -4.026 -3.234 1.00 0.00 H new ATOM 708 N GLU A 45 -2.954 -5.109 -5.930 1.00 0.00 N ATOM 709 CA GLU A 45 -2.104 -6.112 -6.551 1.00 0.00 C ATOM 710 C GLU A 45 -1.911 -5.778 -8.023 1.00 0.00 C ATOM 711 O GLU A 45 -0.810 -5.898 -8.558 1.00 0.00 O ATOM 712 CB GLU A 45 -2.713 -7.505 -6.385 1.00 0.00 C ATOM 713 CG GLU A 45 -4.138 -7.604 -6.891 1.00 0.00 C ATOM 714 CD GLU A 45 -4.632 -9.036 -6.961 1.00 0.00 C ATOM 715 OE1 GLU A 45 -4.340 -9.716 -7.968 1.00 0.00 O ATOM 716 OE2 GLU A 45 -5.313 -9.477 -6.011 1.00 0.00 O ATOM 0 H GLU A 45 -3.890 -5.436 -5.692 1.00 0.00 H new ATOM 0 HA GLU A 45 -1.131 -6.110 -6.060 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.096 -8.229 -6.917 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -2.690 -7.780 -5.331 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.793 -7.029 -6.237 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -4.201 -7.153 -7.881 1.00 0.00 H new ATOM 723 N THR A 46 -2.984 -5.330 -8.670 1.00 0.00 N ATOM 724 CA THR A 46 -2.914 -4.952 -10.075 1.00 0.00 C ATOM 725 C THR A 46 -1.889 -3.834 -10.256 1.00 0.00 C ATOM 726 O THR A 46 -0.966 -3.948 -11.059 1.00 0.00 O ATOM 727 CB THR A 46 -4.296 -4.507 -10.573 1.00 0.00 C ATOM 728 OG1 THR A 46 -5.049 -5.623 -11.013 1.00 0.00 O ATOM 729 CG2 THR A 46 -4.248 -3.511 -11.715 1.00 0.00 C ATOM 0 H THR A 46 -3.905 -5.221 -8.246 1.00 0.00 H new ATOM 0 HA THR A 46 -2.600 -5.814 -10.665 1.00 0.00 H new ATOM 0 HB THR A 46 -4.760 -4.019 -9.716 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.928 -5.322 -11.326 1.00 0.00 H new ATOM 0 HG21 THR A 46 -5.263 -3.246 -12.010 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.718 -2.614 -11.394 1.00 0.00 H new ATOM 0 HG23 THR A 46 -3.728 -3.955 -12.564 1.00 0.00 H new ATOM 737 N VAL A 47 -2.057 -2.757 -9.493 1.00 0.00 N ATOM 738 CA VAL A 47 -1.138 -1.619 -9.561 1.00 0.00 C ATOM 739 C VAL A 47 0.306 -2.077 -9.521 1.00 0.00 C ATOM 740 O VAL A 47 1.057 -1.864 -10.471 1.00 0.00 O ATOM 741 CB VAL A 47 -1.332 -0.612 -8.411 1.00 0.00 C ATOM 742 CG1 VAL A 47 -2.112 0.593 -8.862 1.00 0.00 C ATOM 743 CG2 VAL A 47 -1.982 -1.233 -7.193 1.00 0.00 C ATOM 0 H VAL A 47 -2.817 -2.646 -8.822 1.00 0.00 H new ATOM 0 HA VAL A 47 -1.368 -1.128 -10.506 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.332 -0.292 -8.117 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -2.231 1.283 -8.027 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.577 1.091 -9.671 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -3.094 0.279 -9.216 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -2.094 -0.478 -6.415 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -2.963 -1.623 -7.463 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -1.358 -2.046 -6.822 1.00 0.00 H new ATOM 753 N ALA A 48 0.695 -2.713 -8.423 1.00 0.00 N ATOM 754 CA ALA A 48 2.058 -3.197 -8.298 1.00 0.00 C ATOM 755 C ALA A 48 2.405 -4.059 -9.507 1.00 0.00 C ATOM 756 O ALA A 48 3.553 -4.097 -9.950 1.00 0.00 O ATOM 757 CB ALA A 48 2.243 -3.948 -6.994 1.00 0.00 C ATOM 0 H ALA A 48 0.095 -2.902 -7.620 1.00 0.00 H new ATOM 0 HA ALA A 48 2.744 -2.350 -8.276 1.00 0.00 H new ATOM 0 HB1 ALA A 48 3.271 -4.302 -6.921 1.00 0.00 H new ATOM 0 HB2 ALA A 48 2.028 -3.283 -6.158 1.00 0.00 H new ATOM 0 HB3 ALA A 48 1.563 -4.800 -6.965 1.00 0.00 H new ATOM 763 N SER A 49 1.386 -4.717 -10.062 1.00 0.00 N ATOM 764 CA SER A 49 1.566 -5.537 -11.248 1.00 0.00 C ATOM 765 C SER A 49 1.813 -4.627 -12.447 1.00 0.00 C ATOM 766 O SER A 49 2.608 -4.942 -13.332 1.00 0.00 O ATOM 767 CB SER A 49 0.335 -6.422 -11.481 1.00 0.00 C ATOM 768 OG SER A 49 -0.046 -6.434 -12.848 1.00 0.00 O ATOM 0 H SER A 49 0.431 -4.694 -9.705 1.00 0.00 H new ATOM 0 HA SER A 49 2.425 -6.193 -11.111 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.550 -7.439 -11.153 1.00 0.00 H new ATOM 0 HB3 SER A 49 -0.495 -6.060 -10.874 1.00 0.00 H new ATOM 0 HG SER A 49 -0.832 -7.008 -12.963 1.00 0.00 H new ATOM 774 N ARG A 50 1.137 -3.476 -12.447 1.00 0.00 N ATOM 775 CA ARG A 50 1.293 -2.492 -13.510 1.00 0.00 C ATOM 776 C ARG A 50 2.611 -1.761 -13.347 1.00 0.00 C ATOM 777 O ARG A 50 3.219 -1.325 -14.324 1.00 0.00 O ATOM 778 CB ARG A 50 0.149 -1.474 -13.496 1.00 0.00 C ATOM 779 CG ARG A 50 -1.238 -2.092 -13.457 1.00 0.00 C ATOM 780 CD ARG A 50 -2.193 -1.250 -12.624 1.00 0.00 C ATOM 781 NE ARG A 50 -3.402 -0.895 -13.363 1.00 0.00 N ATOM 782 CZ ARG A 50 -3.465 0.095 -14.252 1.00 0.00 C ATOM 783 NH1 ARG A 50 -2.390 0.828 -14.516 1.00 0.00 N ATOM 784 NH2 ARG A 50 -4.604 0.352 -14.879 1.00 0.00 N ATOM 0 H ARG A 50 0.476 -3.206 -11.719 1.00 0.00 H new ATOM 0 HA ARG A 50 1.276 -3.022 -14.462 1.00 0.00 H new ATOM 0 HB2 ARG A 50 0.268 -0.823 -12.630 1.00 0.00 H new ATOM 0 HB3 ARG A 50 0.228 -0.844 -14.382 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -1.625 -2.188 -14.472 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -1.179 -3.098 -13.041 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -2.468 -1.799 -11.723 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -1.686 -0.341 -12.301 1.00 0.00 H new ATOM 0 HE ARG A 50 -4.248 -1.437 -13.188 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -1.510 0.634 -14.037 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -2.444 1.585 -15.198 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.433 -0.208 -14.681 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -4.652 1.110 -15.560 1.00 0.00 H new ATOM 798 N THR A 51 3.050 -1.631 -12.102 1.00 0.00 N ATOM 799 CA THR A 51 4.292 -0.957 -11.813 1.00 0.00 C ATOM 800 C THR A 51 5.462 -1.894 -12.062 1.00 0.00 C ATOM 801 O THR A 51 5.709 -2.822 -11.291 1.00 0.00 O ATOM 802 CB THR A 51 4.287 -0.470 -10.363 1.00 0.00 C ATOM 803 OG1 THR A 51 3.035 0.102 -10.046 1.00 0.00 O ATOM 804 CG2 THR A 51 5.356 0.560 -10.070 1.00 0.00 C ATOM 0 H THR A 51 2.559 -1.986 -11.282 1.00 0.00 H new ATOM 0 HA THR A 51 4.398 -0.094 -12.471 1.00 0.00 H new ATOM 0 HB THR A 51 4.490 -1.351 -9.754 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.347 -0.596 -10.047 1.00 0.00 H new ATOM 0 HG21 THR A 51 5.294 0.861 -9.024 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.338 0.131 -10.267 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.206 1.431 -10.708 1.00 0.00 H new ATOM 812 N GLY A 52 6.178 -1.644 -13.149 1.00 0.00 N ATOM 813 CA GLY A 52 7.319 -2.471 -13.495 1.00 0.00 C ATOM 814 C GLY A 52 8.595 -2.009 -12.821 1.00 0.00 C ATOM 815 O GLY A 52 9.667 -2.034 -13.424 1.00 0.00 O ATOM 0 H GLY A 52 5.989 -0.882 -13.800 1.00 0.00 H new ATOM 0 HA2 GLY A 52 7.115 -3.503 -13.211 1.00 0.00 H new ATOM 0 HA3 GLY A 52 7.458 -2.459 -14.576 1.00 0.00 H new ATOM 819 N ALA A 53 8.481 -1.587 -11.565 1.00 0.00 N ATOM 820 CA ALA A 53 9.636 -1.118 -10.810 1.00 0.00 C ATOM 821 C ALA A 53 10.245 0.124 -11.448 1.00 0.00 C ATOM 822 O ALA A 53 10.280 0.252 -12.671 1.00 0.00 O ATOM 823 CB ALA A 53 10.678 -2.219 -10.698 1.00 0.00 C ATOM 0 H ALA A 53 7.601 -1.561 -11.050 1.00 0.00 H new ATOM 0 HA ALA A 53 9.297 -0.850 -9.809 1.00 0.00 H new ATOM 0 HB1 ALA A 53 11.534 -1.853 -10.131 1.00 0.00 H new ATOM 0 HB2 ALA A 53 10.245 -3.079 -10.187 1.00 0.00 H new ATOM 0 HB3 ALA A 53 11.003 -2.516 -11.695 1.00 0.00 H new ATOM 829 N GLY A 54 10.723 1.037 -10.610 1.00 0.00 N ATOM 830 CA GLY A 54 11.321 2.259 -11.109 1.00 0.00 C ATOM 831 C GLY A 54 10.289 3.324 -11.431 1.00 0.00 C ATOM 832 O GLY A 54 10.639 4.438 -11.817 1.00 0.00 O ATOM 0 H GLY A 54 10.707 0.952 -9.594 1.00 0.00 H new ATOM 0 HA2 GLY A 54 12.019 2.647 -10.367 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.900 2.036 -12.005 1.00 0.00 H new ATOM 836 N GLU A 55 9.011 2.981 -11.273 1.00 0.00 N ATOM 837 CA GLU A 55 7.934 3.919 -11.553 1.00 0.00 C ATOM 838 C GLU A 55 6.877 3.891 -10.452 1.00 0.00 C ATOM 839 O GLU A 55 6.951 3.083 -9.526 1.00 0.00 O ATOM 840 CB GLU A 55 7.289 3.600 -12.902 1.00 0.00 C ATOM 841 CG GLU A 55 6.712 2.195 -12.983 1.00 0.00 C ATOM 842 CD GLU A 55 6.407 1.771 -14.407 1.00 0.00 C ATOM 843 OE1 GLU A 55 5.624 2.473 -15.080 1.00 0.00 O ATOM 844 OE2 GLU A 55 6.949 0.736 -14.847 1.00 0.00 O ATOM 0 H GLU A 55 8.701 2.063 -10.954 1.00 0.00 H new ATOM 0 HA GLU A 55 8.364 4.920 -11.589 1.00 0.00 H new ATOM 0 HB2 GLU A 55 6.495 4.322 -13.096 1.00 0.00 H new ATOM 0 HB3 GLU A 55 8.032 3.725 -13.689 1.00 0.00 H new ATOM 0 HG2 GLU A 55 7.417 1.491 -12.541 1.00 0.00 H new ATOM 0 HG3 GLU A 55 5.799 2.146 -12.390 1.00 0.00 H new ATOM 851 N ARG A 56 5.895 4.779 -10.565 1.00 0.00 N ATOM 852 CA ARG A 56 4.816 4.862 -9.584 1.00 0.00 C ATOM 853 C ARG A 56 3.463 4.953 -10.282 1.00 0.00 C ATOM 854 O ARG A 56 3.391 5.238 -11.478 1.00 0.00 O ATOM 855 CB ARG A 56 5.016 6.073 -8.670 1.00 0.00 C ATOM 856 CG ARG A 56 5.456 7.329 -9.407 1.00 0.00 C ATOM 857 CD ARG A 56 6.812 7.816 -8.920 1.00 0.00 C ATOM 858 NE ARG A 56 7.893 7.417 -9.819 1.00 0.00 N ATOM 859 CZ ARG A 56 9.184 7.605 -9.556 1.00 0.00 C ATOM 860 NH1 ARG A 56 9.559 8.188 -8.424 1.00 0.00 N ATOM 861 NH2 ARG A 56 10.102 7.210 -10.427 1.00 0.00 N ATOM 0 H ARG A 56 5.823 5.453 -11.327 1.00 0.00 H new ATOM 0 HA ARG A 56 4.836 3.957 -8.977 1.00 0.00 H new ATOM 0 HB2 ARG A 56 4.083 6.279 -8.145 1.00 0.00 H new ATOM 0 HB3 ARG A 56 5.761 5.827 -7.913 1.00 0.00 H new ATOM 0 HG2 ARG A 56 5.504 7.126 -10.477 1.00 0.00 H new ATOM 0 HG3 ARG A 56 4.714 8.114 -9.265 1.00 0.00 H new ATOM 0 HD2 ARG A 56 6.797 8.902 -8.832 1.00 0.00 H new ATOM 0 HD3 ARG A 56 7.004 7.418 -7.924 1.00 0.00 H new ATOM 0 HE ARG A 56 7.643 6.968 -10.700 1.00 0.00 H new ATOM 0 HH11 ARG A 56 8.856 8.494 -7.751 1.00 0.00 H new ATOM 0 HH12 ARG A 56 10.550 8.330 -8.227 1.00 0.00 H new ATOM 0 HH21 ARG A 56 9.819 6.762 -11.299 1.00 0.00 H new ATOM 0 HH22 ARG A 56 11.091 7.354 -10.226 1.00 0.00 H new ATOM 875 N GLN A 57 2.390 4.708 -9.534 1.00 0.00 N ATOM 876 CA GLN A 57 1.044 4.767 -10.102 1.00 0.00 C ATOM 877 C GLN A 57 0.044 5.399 -9.140 1.00 0.00 C ATOM 878 O GLN A 57 0.295 5.525 -7.943 1.00 0.00 O ATOM 879 CB GLN A 57 0.551 3.366 -10.494 1.00 0.00 C ATOM 880 CG GLN A 57 1.440 2.670 -11.511 1.00 0.00 C ATOM 881 CD GLN A 57 1.168 3.126 -12.931 1.00 0.00 C ATOM 882 OE1 GLN A 57 1.363 4.294 -13.268 1.00 0.00 O ATOM 883 NE2 GLN A 57 0.713 2.205 -13.772 1.00 0.00 N ATOM 0 H GLN A 57 2.424 4.469 -8.543 1.00 0.00 H new ATOM 0 HA GLN A 57 1.109 5.393 -10.992 1.00 0.00 H new ATOM 0 HB2 GLN A 57 0.486 2.749 -9.598 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -0.458 3.445 -10.900 1.00 0.00 H new ATOM 0 HG2 GLN A 57 2.485 2.861 -11.266 1.00 0.00 H new ATOM 0 HG3 GLN A 57 1.288 1.593 -11.444 1.00 0.00 H new ATOM 0 HE21 GLN A 57 0.566 1.248 -13.450 1.00 0.00 H new ATOM 0 HE22 GLN A 57 0.511 2.454 -14.740 1.00 0.00 H new ATOM 892 N SER A 58 -1.104 5.764 -9.692 1.00 0.00 N ATOM 893 CA SER A 58 -2.193 6.351 -8.941 1.00 0.00 C ATOM 894 C SER A 58 -3.492 5.986 -9.645 1.00 0.00 C ATOM 895 O SER A 58 -3.835 6.560 -10.678 1.00 0.00 O ATOM 896 CB SER A 58 -2.038 7.871 -8.852 1.00 0.00 C ATOM 897 OG SER A 58 -1.650 8.418 -10.099 1.00 0.00 O ATOM 0 H SER A 58 -1.303 5.658 -10.687 1.00 0.00 H new ATOM 0 HA SER A 58 -2.193 5.967 -7.921 1.00 0.00 H new ATOM 0 HB2 SER A 58 -2.980 8.318 -8.533 1.00 0.00 H new ATOM 0 HB3 SER A 58 -1.294 8.120 -8.095 1.00 0.00 H new ATOM 0 HG SER A 58 -2.235 8.072 -10.805 1.00 0.00 H new ATOM 903 N ILE A 59 -4.187 5.006 -9.097 1.00 0.00 N ATOM 904 CA ILE A 59 -5.432 4.525 -9.689 1.00 0.00 C ATOM 905 C ILE A 59 -6.638 5.229 -9.092 1.00 0.00 C ATOM 906 O ILE A 59 -7.045 4.948 -7.965 1.00 0.00 O ATOM 907 CB ILE A 59 -5.596 2.995 -9.524 1.00 0.00 C ATOM 908 CG1 ILE A 59 -4.604 2.460 -8.497 1.00 0.00 C ATOM 909 CG2 ILE A 59 -5.399 2.291 -10.855 1.00 0.00 C ATOM 910 CD1 ILE A 59 -4.886 1.048 -8.051 1.00 0.00 C ATOM 0 H ILE A 59 -3.914 4.524 -8.241 1.00 0.00 H new ATOM 0 HA ILE A 59 -5.376 4.755 -10.753 1.00 0.00 H new ATOM 0 HB ILE A 59 -6.608 2.796 -9.171 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -3.600 2.503 -8.920 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -4.611 3.114 -7.625 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -5.518 1.216 -10.719 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.139 2.651 -11.570 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -4.398 2.500 -11.233 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -4.137 0.741 -7.321 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.876 1.001 -7.597 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -4.849 0.380 -8.912 1.00 0.00 H new ATOM 922 N GLU A 60 -7.205 6.140 -9.866 1.00 0.00 N ATOM 923 CA GLU A 60 -8.373 6.893 -9.432 1.00 0.00 C ATOM 924 C GLU A 60 -9.643 6.292 -10.015 1.00 0.00 C ATOM 925 O GLU A 60 -9.895 6.396 -11.216 1.00 0.00 O ATOM 926 CB GLU A 60 -8.248 8.358 -9.854 1.00 0.00 C ATOM 927 CG GLU A 60 -9.354 9.246 -9.307 1.00 0.00 C ATOM 928 CD GLU A 60 -10.388 9.601 -10.357 1.00 0.00 C ATOM 929 OE1 GLU A 60 -11.032 8.676 -10.892 1.00 0.00 O ATOM 930 OE2 GLU A 60 -10.553 10.806 -10.643 1.00 0.00 O ATOM 0 H GLU A 60 -6.875 6.377 -10.801 1.00 0.00 H new ATOM 0 HA GLU A 60 -8.429 6.841 -8.345 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -7.285 8.743 -9.518 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -8.252 8.415 -10.942 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -9.844 8.739 -8.476 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.917 10.161 -8.909 1.00 0.00 H new ATOM 937 N GLU A 61 -10.437 5.654 -9.163 1.00 0.00 N ATOM 938 CA GLU A 61 -11.680 5.031 -9.614 1.00 0.00 C ATOM 939 C GLU A 61 -12.845 5.356 -8.684 1.00 0.00 C ATOM 940 O GLU A 61 -12.978 4.771 -7.612 1.00 0.00 O ATOM 941 CB GLU A 61 -11.501 3.514 -9.713 1.00 0.00 C ATOM 942 CG GLU A 61 -12.743 2.784 -10.199 1.00 0.00 C ATOM 943 CD GLU A 61 -12.412 1.534 -10.989 1.00 0.00 C ATOM 944 OE1 GLU A 61 -12.160 0.484 -10.362 1.00 0.00 O ATOM 945 OE2 GLU A 61 -12.403 1.605 -12.237 1.00 0.00 O ATOM 0 H GLU A 61 -10.247 5.554 -8.166 1.00 0.00 H new ATOM 0 HA GLU A 61 -11.915 5.437 -10.598 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -10.675 3.298 -10.390 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -11.221 3.125 -8.734 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -13.361 2.515 -9.342 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -13.335 3.456 -10.820 1.00 0.00 H new ATOM 952 N GLY A 62 -13.700 6.277 -9.114 1.00 0.00 N ATOM 953 CA GLY A 62 -14.855 6.653 -8.319 1.00 0.00 C ATOM 954 C GLY A 62 -14.486 7.177 -6.943 1.00 0.00 C ATOM 955 O GLY A 62 -14.511 6.435 -5.962 1.00 0.00 O ATOM 0 H GLY A 62 -13.614 6.772 -10.002 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -15.422 7.416 -8.852 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -15.510 5.788 -8.208 1.00 0.00 H new ATOM 959 N ASN A 63 -14.156 8.464 -6.871 1.00 0.00 N ATOM 960 CA ASN A 63 -13.792 9.101 -5.606 1.00 0.00 C ATOM 961 C ASN A 63 -12.798 8.257 -4.812 1.00 0.00 C ATOM 962 O ASN A 63 -12.765 8.313 -3.583 1.00 0.00 O ATOM 963 CB ASN A 63 -15.043 9.357 -4.765 1.00 0.00 C ATOM 964 CG ASN A 63 -15.839 10.549 -5.260 1.00 0.00 C ATOM 965 OD1 ASN A 63 -16.953 10.400 -5.763 1.00 0.00 O ATOM 966 ND2 ASN A 63 -15.271 11.741 -5.119 1.00 0.00 N ATOM 0 H ASN A 63 -14.133 9.089 -7.677 1.00 0.00 H new ATOM 0 HA ASN A 63 -13.311 10.050 -5.843 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -15.676 8.470 -4.780 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -14.752 9.523 -3.728 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -15.760 12.579 -5.433 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -14.346 11.818 -4.696 1.00 0.00 H new ATOM 973 N TYR A 64 -11.986 7.479 -5.520 1.00 0.00 N ATOM 974 CA TYR A 64 -10.989 6.630 -4.877 1.00 0.00 C ATOM 975 C TYR A 64 -9.623 6.825 -5.525 1.00 0.00 C ATOM 976 O TYR A 64 -9.516 7.395 -6.610 1.00 0.00 O ATOM 977 CB TYR A 64 -11.395 5.158 -4.974 1.00 0.00 C ATOM 978 CG TYR A 64 -12.138 4.635 -3.765 1.00 0.00 C ATOM 979 CD1 TYR A 64 -13.326 5.221 -3.345 1.00 0.00 C ATOM 980 CD2 TYR A 64 -11.656 3.545 -3.051 1.00 0.00 C ATOM 981 CE1 TYR A 64 -14.009 4.736 -2.245 1.00 0.00 C ATOM 982 CE2 TYR A 64 -12.334 3.054 -1.952 1.00 0.00 C ATOM 983 CZ TYR A 64 -13.509 3.653 -1.553 1.00 0.00 C ATOM 984 OH TYR A 64 -14.189 3.167 -0.460 1.00 0.00 O ATOM 0 H TYR A 64 -11.998 7.419 -6.538 1.00 0.00 H new ATOM 0 HA TYR A 64 -10.929 6.915 -3.827 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -12.021 5.023 -5.856 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -10.499 4.555 -5.124 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -13.722 6.068 -3.886 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -10.735 3.073 -3.361 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -14.930 5.203 -1.929 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -11.945 2.205 -1.409 1.00 0.00 H new ATOM 0 HH TYR A 64 -13.625 3.245 0.337 1.00 0.00 H new ATOM 994 N ILE A 65 -8.585 6.336 -4.857 1.00 0.00 N ATOM 995 CA ILE A 65 -7.222 6.437 -5.364 1.00 0.00 C ATOM 996 C ILE A 65 -6.390 5.250 -4.906 1.00 0.00 C ATOM 997 O ILE A 65 -6.538 4.770 -3.784 1.00 0.00 O ATOM 998 CB ILE A 65 -6.517 7.733 -4.901 1.00 0.00 C ATOM 999 CG1 ILE A 65 -7.120 8.950 -5.592 1.00 0.00 C ATOM 1000 CG2 ILE A 65 -5.020 7.664 -5.185 1.00 0.00 C ATOM 1001 CD1 ILE A 65 -6.612 9.159 -7.000 1.00 0.00 C ATOM 0 H ILE A 65 -8.663 5.863 -3.957 1.00 0.00 H new ATOM 0 HA ILE A 65 -7.300 6.451 -6.451 1.00 0.00 H new ATOM 0 HB ILE A 65 -6.666 7.830 -3.826 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -8.204 8.843 -5.618 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.902 9.839 -5.000 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -4.544 8.586 -4.851 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -4.587 6.818 -4.651 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -4.858 7.539 -6.256 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.084 10.043 -7.430 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -5.531 9.298 -6.980 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -6.854 8.287 -7.607 1.00 0.00 H new ATOM 1013 N GLY A 66 -5.499 4.797 -5.773 1.00 0.00 N ATOM 1014 CA GLY A 66 -4.638 3.687 -5.430 1.00 0.00 C ATOM 1015 C GLY A 66 -3.200 3.963 -5.790 1.00 0.00 C ATOM 1016 O GLY A 66 -2.685 3.459 -6.788 1.00 0.00 O ATOM 0 H GLY A 66 -5.357 5.178 -6.708 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.713 3.485 -4.361 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.977 2.790 -5.948 1.00 0.00 H new ATOM 1020 N HIS A 67 -2.555 4.784 -4.976 1.00 0.00 N ATOM 1021 CA HIS A 67 -1.171 5.153 -5.207 1.00 0.00 C ATOM 1022 C HIS A 67 -0.275 3.925 -5.310 1.00 0.00 C ATOM 1023 O HIS A 67 -0.631 2.835 -4.859 1.00 0.00 O ATOM 1024 CB HIS A 67 -0.675 6.078 -4.097 1.00 0.00 C ATOM 1025 CG HIS A 67 -1.412 7.379 -4.038 1.00 0.00 C ATOM 1026 ND1 HIS A 67 -1.519 8.232 -5.116 1.00 0.00 N ATOM 1027 CD2 HIS A 67 -2.086 7.970 -3.025 1.00 0.00 C ATOM 1028 CE1 HIS A 67 -2.226 9.291 -4.768 1.00 0.00 C ATOM 1029 NE2 HIS A 67 -2.582 9.158 -3.504 1.00 0.00 N ATOM 0 H HIS A 67 -2.972 5.208 -4.147 1.00 0.00 H new ATOM 0 HA HIS A 67 -1.123 5.682 -6.159 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -0.773 5.569 -3.138 1.00 0.00 H new ATOM 0 HB3 HIS A 67 0.387 6.276 -4.246 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -2.211 7.580 -2.026 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -2.472 10.125 -5.409 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -3.135 9.828 -2.970 1.00 0.00 H new ATOM 1038 N VAL A 68 0.888 4.117 -5.917 1.00 0.00 N ATOM 1039 CA VAL A 68 1.852 3.044 -6.105 1.00 0.00 C ATOM 1040 C VAL A 68 3.261 3.617 -6.167 1.00 0.00 C ATOM 1041 O VAL A 68 3.483 4.668 -6.768 1.00 0.00 O ATOM 1042 CB VAL A 68 1.535 2.253 -7.403 1.00 0.00 C ATOM 1043 CG1 VAL A 68 2.752 2.056 -8.295 1.00 0.00 C ATOM 1044 CG2 VAL A 68 0.933 0.903 -7.089 1.00 0.00 C ATOM 0 H VAL A 68 1.188 5.017 -6.291 1.00 0.00 H new ATOM 0 HA VAL A 68 1.786 2.360 -5.259 1.00 0.00 H new ATOM 0 HB VAL A 68 0.815 2.864 -7.947 1.00 0.00 H new ATOM 0 HG11 VAL A 68 2.464 1.497 -9.185 1.00 0.00 H new ATOM 0 HG12 VAL A 68 3.148 3.028 -8.590 1.00 0.00 H new ATOM 0 HG13 VAL A 68 3.517 1.502 -7.750 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.722 0.374 -8.018 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.635 0.322 -6.491 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.007 1.039 -6.531 1.00 0.00 H new ATOM 1054 N TYR A 69 4.211 2.924 -5.563 1.00 0.00 N ATOM 1055 CA TYR A 69 5.590 3.377 -5.580 1.00 0.00 C ATOM 1056 C TYR A 69 6.548 2.195 -5.566 1.00 0.00 C ATOM 1057 O TYR A 69 6.654 1.468 -4.574 1.00 0.00 O ATOM 1058 CB TYR A 69 5.867 4.313 -4.402 1.00 0.00 C ATOM 1059 CG TYR A 69 6.282 5.704 -4.826 1.00 0.00 C ATOM 1060 CD1 TYR A 69 7.583 5.967 -5.236 1.00 0.00 C ATOM 1061 CD2 TYR A 69 5.371 6.752 -4.817 1.00 0.00 C ATOM 1062 CE1 TYR A 69 7.962 7.237 -5.626 1.00 0.00 C ATOM 1063 CE2 TYR A 69 5.743 8.023 -5.206 1.00 0.00 C ATOM 1064 CZ TYR A 69 7.040 8.262 -5.609 1.00 0.00 C ATOM 1065 OH TYR A 69 7.415 9.527 -5.996 1.00 0.00 O ATOM 0 H TYR A 69 4.054 2.052 -5.058 1.00 0.00 H new ATOM 0 HA TYR A 69 5.753 3.934 -6.503 1.00 0.00 H new ATOM 0 HB2 TYR A 69 4.972 4.381 -3.783 1.00 0.00 H new ATOM 0 HB3 TYR A 69 6.652 3.881 -3.781 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.309 5.167 -5.250 1.00 0.00 H new ATOM 0 HD2 TYR A 69 4.355 6.570 -4.500 1.00 0.00 H new ATOM 0 HE1 TYR A 69 8.977 7.426 -5.943 1.00 0.00 H new ATOM 0 HE2 TYR A 69 5.022 8.827 -5.195 1.00 0.00 H new ATOM 0 HH TYR A 69 7.745 10.023 -5.218 1.00 0.00 H new ATOM 1075 N ALA A 70 7.238 2.010 -6.682 1.00 0.00 N ATOM 1076 CA ALA A 70 8.194 0.921 -6.822 1.00 0.00 C ATOM 1077 C ALA A 70 9.616 1.460 -6.902 1.00 0.00 C ATOM 1078 O ALA A 70 9.850 2.538 -7.449 1.00 0.00 O ATOM 1079 CB ALA A 70 7.868 0.090 -8.053 1.00 0.00 C ATOM 0 H ALA A 70 7.153 2.603 -7.508 1.00 0.00 H new ATOM 0 HA ALA A 70 8.122 0.282 -5.942 1.00 0.00 H new ATOM 0 HB1 ALA A 70 8.590 -0.721 -8.146 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.865 -0.326 -7.956 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.914 0.721 -8.941 1.00 0.00 H new ATOM 1085 N ARG A 71 10.564 0.709 -6.352 1.00 0.00 N ATOM 1086 CA ARG A 71 11.963 1.123 -6.364 1.00 0.00 C ATOM 1087 C ARG A 71 12.821 0.110 -7.110 1.00 0.00 C ATOM 1088 O ARG A 71 12.315 -0.888 -7.625 1.00 0.00 O ATOM 1089 CB ARG A 71 12.477 1.291 -4.932 1.00 0.00 C ATOM 1090 CG ARG A 71 13.509 2.400 -4.783 1.00 0.00 C ATOM 1091 CD ARG A 71 13.212 3.283 -3.581 1.00 0.00 C ATOM 1092 NE ARG A 71 14.428 3.862 -3.013 1.00 0.00 N ATOM 1093 CZ ARG A 71 14.441 4.934 -2.225 1.00 0.00 C ATOM 1094 NH1 ARG A 71 13.308 5.547 -1.904 1.00 0.00 N ATOM 1095 NH2 ARG A 71 15.591 5.395 -1.753 1.00 0.00 N ATOM 0 H ARG A 71 10.391 -0.186 -5.894 1.00 0.00 H new ATOM 0 HA ARG A 71 12.031 2.080 -6.881 1.00 0.00 H new ATOM 0 HB2 ARG A 71 11.634 1.500 -4.274 1.00 0.00 H new ATOM 0 HB3 ARG A 71 12.916 0.350 -4.599 1.00 0.00 H new ATOM 0 HG2 ARG A 71 14.502 1.962 -4.677 1.00 0.00 H new ATOM 0 HG3 ARG A 71 13.524 3.008 -5.687 1.00 0.00 H new ATOM 0 HD2 ARG A 71 12.534 4.083 -3.878 1.00 0.00 H new ATOM 0 HD3 ARG A 71 12.699 2.697 -2.818 1.00 0.00 H new ATOM 0 HE ARG A 71 15.319 3.418 -3.234 1.00 0.00 H new ATOM 0 HH11 ARG A 71 12.419 5.197 -2.262 1.00 0.00 H new ATOM 0 HH12 ARG A 71 13.326 6.368 -1.299 1.00 0.00 H new ATOM 0 HH21 ARG A 71 16.465 4.928 -1.994 1.00 0.00 H new ATOM 0 HH22 ARG A 71 15.602 6.217 -1.149 1.00 0.00 H new ATOM 1109 N SER A 72 14.124 0.370 -7.164 1.00 0.00 N ATOM 1110 CA SER A 72 15.053 -0.524 -7.845 1.00 0.00 C ATOM 1111 C SER A 72 15.629 -1.549 -6.872 1.00 0.00 C ATOM 1112 O SER A 72 16.804 -1.908 -6.955 1.00 0.00 O ATOM 1113 CB SER A 72 16.185 0.277 -8.491 1.00 0.00 C ATOM 1114 OG SER A 72 17.173 -0.583 -9.032 1.00 0.00 O ATOM 0 H SER A 72 14.559 1.192 -6.745 1.00 0.00 H new ATOM 0 HA SER A 72 14.505 -1.055 -8.624 1.00 0.00 H new ATOM 0 HB2 SER A 72 15.781 0.913 -9.279 1.00 0.00 H new ATOM 0 HB3 SER A 72 16.638 0.936 -7.750 1.00 0.00 H new ATOM 0 HG SER A 72 17.602 -1.085 -8.308 1.00 0.00 H new ATOM 1120 N GLU A 73 14.792 -2.015 -5.950 1.00 0.00 N ATOM 1121 CA GLU A 73 15.211 -2.999 -4.962 1.00 0.00 C ATOM 1122 C GLU A 73 14.821 -4.406 -5.406 1.00 0.00 C ATOM 1123 O GLU A 73 15.657 -5.307 -5.448 1.00 0.00 O ATOM 1124 CB GLU A 73 14.585 -2.679 -3.602 1.00 0.00 C ATOM 1125 CG GLU A 73 14.678 -1.212 -3.219 1.00 0.00 C ATOM 1126 CD GLU A 73 15.999 -0.863 -2.561 1.00 0.00 C ATOM 1127 OE1 GLU A 73 16.401 -1.579 -1.620 1.00 0.00 O ATOM 1128 OE2 GLU A 73 16.631 0.127 -2.987 1.00 0.00 O ATOM 0 H GLU A 73 13.818 -1.725 -5.868 1.00 0.00 H new ATOM 0 HA GLU A 73 16.296 -2.957 -4.869 1.00 0.00 H new ATOM 0 HB2 GLU A 73 13.536 -2.977 -3.615 1.00 0.00 H new ATOM 0 HB3 GLU A 73 15.077 -3.278 -2.835 1.00 0.00 H new ATOM 0 HG2 GLU A 73 14.547 -0.599 -4.111 1.00 0.00 H new ATOM 0 HG3 GLU A 73 13.862 -0.965 -2.540 1.00 0.00 H new ATOM 1135 N GLY A 74 13.546 -4.583 -5.742 1.00 0.00 N ATOM 1136 CA GLY A 74 13.071 -5.881 -6.185 1.00 0.00 C ATOM 1137 C GLY A 74 11.624 -6.140 -5.808 1.00 0.00 C ATOM 1138 O GLY A 74 10.969 -6.995 -6.403 1.00 0.00 O ATOM 0 H GLY A 74 12.835 -3.852 -5.715 1.00 0.00 H new ATOM 0 HA2 GLY A 74 13.177 -5.951 -7.268 1.00 0.00 H new ATOM 0 HA3 GLY A 74 13.699 -6.659 -5.752 1.00 0.00 H new ATOM 1142 N ILE A 75 11.119 -5.401 -4.823 1.00 0.00 N ATOM 1143 CA ILE A 75 9.737 -5.568 -4.386 1.00 0.00 C ATOM 1144 C ILE A 75 9.080 -4.203 -4.147 1.00 0.00 C ATOM 1145 O ILE A 75 9.469 -3.457 -3.249 1.00 0.00 O ATOM 1146 CB ILE A 75 9.637 -6.493 -3.132 1.00 0.00 C ATOM 1147 CG1 ILE A 75 9.560 -5.710 -1.814 1.00 0.00 C ATOM 1148 CG2 ILE A 75 10.818 -7.456 -3.085 1.00 0.00 C ATOM 1149 CD1 ILE A 75 10.841 -4.984 -1.458 1.00 0.00 C ATOM 0 H ILE A 75 11.642 -4.687 -4.316 1.00 0.00 H new ATOM 0 HA ILE A 75 9.187 -6.067 -5.184 1.00 0.00 H new ATOM 0 HB ILE A 75 8.705 -7.049 -3.234 1.00 0.00 H new ATOM 0 HG12 ILE A 75 8.749 -4.985 -1.880 1.00 0.00 H new ATOM 0 HG13 ILE A 75 9.307 -6.398 -1.008 1.00 0.00 H new ATOM 0 HG21 ILE A 75 10.733 -8.093 -2.205 1.00 0.00 H new ATOM 0 HG22 ILE A 75 10.819 -8.075 -3.982 1.00 0.00 H new ATOM 0 HG23 ILE A 75 11.748 -6.889 -3.034 1.00 0.00 H new ATOM 0 HD11 ILE A 75 10.709 -4.454 -0.515 1.00 0.00 H new ATOM 0 HD12 ILE A 75 11.652 -5.705 -1.358 1.00 0.00 H new ATOM 0 HD13 ILE A 75 11.085 -4.270 -2.244 1.00 0.00 H new ATOM 1161 N CYS A 76 8.099 -3.876 -4.989 1.00 0.00 N ATOM 1162 CA CYS A 76 7.397 -2.595 -4.904 1.00 0.00 C ATOM 1163 C CYS A 76 6.255 -2.642 -3.896 1.00 0.00 C ATOM 1164 O CYS A 76 5.853 -3.714 -3.452 1.00 0.00 O ATOM 1165 CB CYS A 76 6.857 -2.201 -6.281 1.00 0.00 C ATOM 1166 SG CYS A 76 5.569 -3.301 -6.914 1.00 0.00 S ATOM 0 H CYS A 76 7.772 -4.483 -5.740 1.00 0.00 H new ATOM 0 HA CYS A 76 8.114 -1.848 -4.563 1.00 0.00 H new ATOM 0 HB2 CYS A 76 6.459 -1.188 -6.227 1.00 0.00 H new ATOM 0 HB3 CYS A 76 7.684 -2.181 -6.991 1.00 0.00 H new ATOM 0 HG CYS A 76 5.496 -4.360 -6.164 1.00 0.00 H new ATOM 1172 N GLY A 77 5.734 -1.469 -3.543 1.00 0.00 N ATOM 1173 CA GLY A 77 4.639 -1.402 -2.591 1.00 0.00 C ATOM 1174 C GLY A 77 3.475 -0.590 -3.109 1.00 0.00 C ATOM 1175 O GLY A 77 3.656 0.279 -3.964 1.00 0.00 O ATOM 0 H GLY A 77 6.050 -0.567 -3.898 1.00 0.00 H new ATOM 0 HA2 GLY A 77 4.300 -2.412 -2.360 1.00 0.00 H new ATOM 0 HA3 GLY A 77 4.997 -0.965 -1.659 1.00 0.00 H new ATOM 1179 N VAL A 78 2.271 -0.860 -2.602 1.00 0.00 N ATOM 1180 CA VAL A 78 1.100 -0.120 -3.052 1.00 0.00 C ATOM 1181 C VAL A 78 0.341 0.522 -1.890 1.00 0.00 C ATOM 1182 O VAL A 78 0.271 -0.025 -0.787 1.00 0.00 O ATOM 1183 CB VAL A 78 0.124 -1.006 -3.863 1.00 0.00 C ATOM 1184 CG1 VAL A 78 -1.075 -0.205 -4.352 1.00 0.00 C ATOM 1185 CG2 VAL A 78 0.840 -1.679 -5.023 1.00 0.00 C ATOM 0 H VAL A 78 2.086 -1.571 -1.894 1.00 0.00 H new ATOM 0 HA VAL A 78 1.485 0.667 -3.701 1.00 0.00 H new ATOM 0 HB VAL A 78 -0.249 -1.785 -3.198 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -1.741 -0.856 -4.918 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -1.611 0.207 -3.497 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -0.733 0.608 -4.992 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.133 -2.296 -5.578 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.255 -0.919 -5.685 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.645 -2.305 -4.639 1.00 0.00 H new ATOM 1195 N LEU A 79 -0.239 1.687 -2.169 1.00 0.00 N ATOM 1196 CA LEU A 79 -1.020 2.431 -1.184 1.00 0.00 C ATOM 1197 C LEU A 79 -2.316 2.926 -1.821 1.00 0.00 C ATOM 1198 O LEU A 79 -2.282 3.680 -2.791 1.00 0.00 O ATOM 1199 CB LEU A 79 -0.218 3.621 -0.644 1.00 0.00 C ATOM 1200 CG LEU A 79 1.303 3.488 -0.746 1.00 0.00 C ATOM 1201 CD1 LEU A 79 1.755 3.651 -2.189 1.00 0.00 C ATOM 1202 CD2 LEU A 79 1.981 4.515 0.146 1.00 0.00 C ATOM 0 H LEU A 79 -0.181 2.140 -3.081 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.255 1.766 -0.353 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -0.524 4.518 -1.182 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.483 3.771 0.403 1.00 0.00 H new ATOM 0 HG LEU A 79 1.590 2.492 -0.408 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.839 3.554 -2.244 1.00 0.00 H new ATOM 0 HD12 LEU A 79 1.290 2.881 -2.805 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.460 4.635 -2.554 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.063 4.410 0.065 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.689 5.518 -0.167 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.678 4.355 1.181 1.00 0.00 H new ATOM 1214 N ILE A 80 -3.455 2.494 -1.289 1.00 0.00 N ATOM 1215 CA ILE A 80 -4.750 2.902 -1.842 1.00 0.00 C ATOM 1216 C ILE A 80 -5.508 3.819 -0.886 1.00 0.00 C ATOM 1217 O ILE A 80 -5.827 3.438 0.239 1.00 0.00 O ATOM 1218 CB ILE A 80 -5.640 1.686 -2.212 1.00 0.00 C ATOM 1219 CG1 ILE A 80 -4.974 0.372 -1.804 1.00 0.00 C ATOM 1220 CG2 ILE A 80 -5.935 1.680 -3.706 1.00 0.00 C ATOM 1221 CD1 ILE A 80 -3.752 0.025 -2.629 1.00 0.00 C ATOM 0 H ILE A 80 -3.513 1.869 -0.485 1.00 0.00 H new ATOM 0 HA ILE A 80 -4.527 3.453 -2.756 1.00 0.00 H new ATOM 0 HB ILE A 80 -6.578 1.778 -1.665 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.687 0.431 -0.754 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -5.701 -0.435 -1.891 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -6.560 0.821 -3.950 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -6.457 2.598 -3.977 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -4.999 1.617 -4.261 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -3.334 -0.920 -2.281 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -4.035 -0.068 -3.677 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -3.006 0.812 -2.523 1.00 0.00 H new ATOM 1233 N THR A 81 -5.776 5.039 -1.352 1.00 0.00 N ATOM 1234 CA THR A 81 -6.478 6.045 -0.558 1.00 0.00 C ATOM 1235 C THR A 81 -7.598 6.705 -1.363 1.00 0.00 C ATOM 1236 O THR A 81 -7.915 6.273 -2.467 1.00 0.00 O ATOM 1237 CB THR A 81 -5.487 7.103 -0.079 1.00 0.00 C ATOM 1238 OG1 THR A 81 -6.158 8.208 0.497 1.00 0.00 O ATOM 1239 CG2 THR A 81 -4.613 7.620 -1.189 1.00 0.00 C ATOM 0 H THR A 81 -5.514 5.356 -2.285 1.00 0.00 H new ATOM 0 HA THR A 81 -6.929 5.549 0.301 1.00 0.00 H new ATOM 0 HB THR A 81 -4.862 6.606 0.663 1.00 0.00 H new ATOM 0 HG1 THR A 81 -5.507 8.790 0.942 1.00 0.00 H new ATOM 0 HG21 THR A 81 -3.927 8.369 -0.793 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.042 6.796 -1.617 1.00 0.00 H new ATOM 0 HG23 THR A 81 -5.235 8.070 -1.963 1.00 0.00 H new ATOM 1247 N ASP A 82 -8.200 7.748 -0.795 1.00 0.00 N ATOM 1248 CA ASP A 82 -9.289 8.465 -1.452 1.00 0.00 C ATOM 1249 C ASP A 82 -8.753 9.488 -2.450 1.00 0.00 C ATOM 1250 O ASP A 82 -7.546 9.714 -2.538 1.00 0.00 O ATOM 1251 CB ASP A 82 -10.163 9.162 -0.408 1.00 0.00 C ATOM 1252 CG ASP A 82 -11.598 9.324 -0.871 1.00 0.00 C ATOM 1253 OD1 ASP A 82 -12.253 8.296 -1.146 1.00 0.00 O ATOM 1254 OD2 ASP A 82 -12.068 10.477 -0.955 1.00 0.00 O ATOM 0 H ASP A 82 -7.950 8.116 0.123 1.00 0.00 H new ATOM 0 HA ASP A 82 -9.890 7.739 -1.999 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -10.146 8.588 0.518 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -9.744 10.143 -0.183 1.00 0.00 H new ATOM 1259 N LYS A 83 -9.662 10.102 -3.203 1.00 0.00 N ATOM 1260 CA LYS A 83 -9.292 11.100 -4.201 1.00 0.00 C ATOM 1261 C LYS A 83 -8.624 12.314 -3.558 1.00 0.00 C ATOM 1262 O LYS A 83 -7.927 13.074 -4.231 1.00 0.00 O ATOM 1263 CB LYS A 83 -10.525 11.540 -4.992 1.00 0.00 C ATOM 1264 CG LYS A 83 -10.308 11.555 -6.497 1.00 0.00 C ATOM 1265 CD LYS A 83 -9.493 12.765 -6.933 1.00 0.00 C ATOM 1266 CE LYS A 83 -8.244 12.355 -7.697 1.00 0.00 C ATOM 1267 NZ LYS A 83 -7.048 13.131 -7.267 1.00 0.00 N ATOM 0 H LYS A 83 -10.664 9.924 -3.140 1.00 0.00 H new ATOM 0 HA LYS A 83 -8.574 10.640 -4.880 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.354 10.871 -4.759 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -10.819 12.538 -4.666 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -9.796 10.642 -6.801 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.273 11.563 -7.004 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -10.108 13.411 -7.560 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -9.209 13.348 -6.057 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -8.060 11.291 -7.546 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -8.407 12.502 -8.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -6.185 12.611 -7.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -7.047 14.058 -7.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -7.075 13.267 -6.236 1.00 0.00 H new ATOM 1281 N GLN A 84 -8.835 12.494 -2.258 1.00 0.00 N ATOM 1282 CA GLN A 84 -8.244 13.618 -1.540 1.00 0.00 C ATOM 1283 C GLN A 84 -6.887 13.235 -0.954 1.00 0.00 C ATOM 1284 O GLN A 84 -6.539 13.646 0.152 1.00 0.00 O ATOM 1285 CB GLN A 84 -9.181 14.090 -0.427 1.00 0.00 C ATOM 1286 CG GLN A 84 -10.452 14.746 -0.943 1.00 0.00 C ATOM 1287 CD GLN A 84 -11.640 13.805 -0.929 1.00 0.00 C ATOM 1288 OE1 GLN A 84 -12.229 13.514 -1.970 1.00 0.00 O ATOM 1289 NE2 GLN A 84 -11.999 13.321 0.254 1.00 0.00 N ATOM 0 H GLN A 84 -9.409 11.878 -1.682 1.00 0.00 H new ATOM 0 HA GLN A 84 -8.096 14.433 -2.248 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -9.449 13.238 0.198 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -8.649 14.797 0.210 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -10.679 15.621 -0.333 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -10.286 15.101 -1.960 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -11.483 13.588 1.092 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -12.791 12.682 0.325 1.00 0.00 H new ATOM 1298 N TYR A 85 -6.127 12.447 -1.705 1.00 0.00 N ATOM 1299 CA TYR A 85 -4.815 12.005 -1.271 1.00 0.00 C ATOM 1300 C TYR A 85 -3.802 12.160 -2.400 1.00 0.00 C ATOM 1301 O TYR A 85 -3.836 11.414 -3.377 1.00 0.00 O ATOM 1302 CB TYR A 85 -4.877 10.544 -0.840 1.00 0.00 C ATOM 1303 CG TYR A 85 -4.382 10.296 0.563 1.00 0.00 C ATOM 1304 CD1 TYR A 85 -5.214 10.489 1.657 1.00 0.00 C ATOM 1305 CD2 TYR A 85 -3.084 9.860 0.791 1.00 0.00 C ATOM 1306 CE1 TYR A 85 -4.765 10.257 2.941 1.00 0.00 C ATOM 1307 CE2 TYR A 85 -2.627 9.625 2.071 1.00 0.00 C ATOM 1308 CZ TYR A 85 -3.471 9.824 3.143 1.00 0.00 C ATOM 1309 OH TYR A 85 -3.020 9.598 4.421 1.00 0.00 O ATOM 0 H TYR A 85 -6.403 12.101 -2.624 1.00 0.00 H new ATOM 0 HA TYR A 85 -4.502 12.620 -0.427 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -5.907 10.197 -0.917 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -4.286 9.946 -1.534 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -6.228 10.826 1.501 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -2.421 9.702 -0.047 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -5.423 10.414 3.783 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -1.614 9.287 2.233 1.00 0.00 H new ATOM 0 HH TYR A 85 -2.061 9.395 4.399 1.00 0.00 H new ATOM 1319 N PRO A 86 -2.884 13.130 -2.288 1.00 0.00 N ATOM 1320 CA PRO A 86 -1.872 13.363 -3.313 1.00 0.00 C ATOM 1321 C PRO A 86 -0.727 12.355 -3.234 1.00 0.00 C ATOM 1322 O PRO A 86 -0.512 11.723 -2.200 1.00 0.00 O ATOM 1323 CB PRO A 86 -1.394 14.774 -2.996 1.00 0.00 C ATOM 1324 CG PRO A 86 -1.548 14.895 -1.520 1.00 0.00 C ATOM 1325 CD PRO A 86 -2.759 14.075 -1.161 1.00 0.00 C ATOM 0 HA PRO A 86 -2.261 13.251 -4.325 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -0.358 14.920 -3.301 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -1.989 15.522 -3.520 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -0.661 14.528 -1.004 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -1.680 15.936 -1.225 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -2.624 13.553 -0.213 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -3.648 14.697 -1.058 1.00 0.00 H new ATOM 1333 N VAL A 87 -0.013 12.194 -4.342 1.00 0.00 N ATOM 1334 CA VAL A 87 1.093 11.245 -4.418 1.00 0.00 C ATOM 1335 C VAL A 87 2.272 11.652 -3.536 1.00 0.00 C ATOM 1336 O VAL A 87 2.926 10.797 -2.939 1.00 0.00 O ATOM 1337 CB VAL A 87 1.592 11.090 -5.867 1.00 0.00 C ATOM 1338 CG1 VAL A 87 2.576 9.936 -5.973 1.00 0.00 C ATOM 1339 CG2 VAL A 87 0.421 10.891 -6.818 1.00 0.00 C ATOM 0 H VAL A 87 -0.181 12.711 -5.205 1.00 0.00 H new ATOM 0 HA VAL A 87 0.700 10.295 -4.056 1.00 0.00 H new ATOM 0 HB VAL A 87 2.110 12.006 -6.152 1.00 0.00 H new ATOM 0 HG11 VAL A 87 2.917 9.842 -7.004 1.00 0.00 H new ATOM 0 HG12 VAL A 87 3.431 10.126 -5.324 1.00 0.00 H new ATOM 0 HG13 VAL A 87 2.087 9.011 -5.667 1.00 0.00 H new ATOM 0 HG21 VAL A 87 0.794 10.783 -7.837 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.128 9.993 -6.536 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.243 11.754 -6.764 1.00 0.00 H new ATOM 1349 N ARG A 88 2.553 12.953 -3.474 1.00 0.00 N ATOM 1350 CA ARG A 88 3.677 13.465 -2.677 1.00 0.00 C ATOM 1351 C ARG A 88 3.830 12.718 -1.350 1.00 0.00 C ATOM 1352 O ARG A 88 4.868 12.106 -1.099 1.00 0.00 O ATOM 1353 CB ARG A 88 3.553 14.978 -2.417 1.00 0.00 C ATOM 1354 CG ARG A 88 2.180 15.574 -2.702 1.00 0.00 C ATOM 1355 CD ARG A 88 2.146 16.278 -4.048 1.00 0.00 C ATOM 1356 NE ARG A 88 3.031 17.441 -4.080 1.00 0.00 N ATOM 1357 CZ ARG A 88 2.919 18.437 -4.956 1.00 0.00 C ATOM 1358 NH1 ARG A 88 1.960 18.418 -5.874 1.00 0.00 N ATOM 1359 NH2 ARG A 88 3.766 19.456 -4.912 1.00 0.00 N ATOM 0 H ARG A 88 2.022 13.673 -3.963 1.00 0.00 H new ATOM 0 HA ARG A 88 4.574 13.289 -3.271 1.00 0.00 H new ATOM 0 HB2 ARG A 88 3.807 15.174 -1.375 1.00 0.00 H new ATOM 0 HB3 ARG A 88 4.291 15.497 -3.028 1.00 0.00 H new ATOM 0 HG2 ARG A 88 1.429 14.784 -2.684 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.918 16.280 -1.914 1.00 0.00 H new ATOM 0 HD2 ARG A 88 2.439 15.578 -4.831 1.00 0.00 H new ATOM 0 HD3 ARG A 88 1.126 16.593 -4.267 1.00 0.00 H new ATOM 0 HE ARG A 88 3.780 17.492 -3.389 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.304 17.638 -5.910 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.879 19.184 -6.543 1.00 0.00 H new ATOM 0 HH21 ARG A 88 4.503 19.476 -4.207 1.00 0.00 H new ATOM 0 HH22 ARG A 88 3.681 20.219 -5.583 1.00 0.00 H new ATOM 1373 N PRO A 89 2.808 12.743 -0.480 1.00 0.00 N ATOM 1374 CA PRO A 89 2.871 12.052 0.807 1.00 0.00 C ATOM 1375 C PRO A 89 2.904 10.544 0.630 1.00 0.00 C ATOM 1376 O PRO A 89 3.480 9.828 1.448 1.00 0.00 O ATOM 1377 CB PRO A 89 1.593 12.492 1.523 1.00 0.00 C ATOM 1378 CG PRO A 89 0.660 12.881 0.428 1.00 0.00 C ATOM 1379 CD PRO A 89 1.521 13.432 -0.676 1.00 0.00 C ATOM 0 HA PRO A 89 3.775 12.297 1.365 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.180 11.684 2.127 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.784 13.328 2.196 1.00 0.00 H new ATOM 0 HG2 PRO A 89 0.085 12.022 0.082 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -0.057 13.627 0.773 1.00 0.00 H new ATOM 0 HD2 PRO A 89 1.098 13.222 -1.658 1.00 0.00 H new ATOM 0 HD3 PRO A 89 1.629 14.514 -0.600 1.00 0.00 H new ATOM 1387 N ALA A 90 2.318 10.066 -0.461 1.00 0.00 N ATOM 1388 CA ALA A 90 2.330 8.645 -0.747 1.00 0.00 C ATOM 1389 C ALA A 90 3.752 8.232 -1.070 1.00 0.00 C ATOM 1390 O ALA A 90 4.167 7.111 -0.783 1.00 0.00 O ATOM 1391 CB ALA A 90 1.388 8.312 -1.895 1.00 0.00 C ATOM 0 H ALA A 90 1.834 10.638 -1.153 1.00 0.00 H new ATOM 0 HA ALA A 90 1.978 8.092 0.124 1.00 0.00 H new ATOM 0 HB1 ALA A 90 1.416 7.240 -2.089 1.00 0.00 H new ATOM 0 HB2 ALA A 90 0.373 8.606 -1.630 1.00 0.00 H new ATOM 0 HB3 ALA A 90 1.700 8.851 -2.790 1.00 0.00 H new ATOM 1397 N TYR A 91 4.511 9.171 -1.634 1.00 0.00 N ATOM 1398 CA TYR A 91 5.900 8.919 -1.948 1.00 0.00 C ATOM 1399 C TYR A 91 6.675 8.821 -0.642 1.00 0.00 C ATOM 1400 O TYR A 91 7.497 7.922 -0.453 1.00 0.00 O ATOM 1401 CB TYR A 91 6.472 10.036 -2.826 1.00 0.00 C ATOM 1402 CG TYR A 91 7.961 9.920 -3.082 1.00 0.00 C ATOM 1403 CD1 TYR A 91 8.595 8.682 -3.087 1.00 0.00 C ATOM 1404 CD2 TYR A 91 8.732 11.051 -3.319 1.00 0.00 C ATOM 1405 CE1 TYR A 91 9.953 8.577 -3.321 1.00 0.00 C ATOM 1406 CE2 TYR A 91 10.091 10.953 -3.554 1.00 0.00 C ATOM 1407 CZ TYR A 91 10.696 9.715 -3.554 1.00 0.00 C ATOM 1408 OH TYR A 91 12.047 9.614 -3.787 1.00 0.00 O ATOM 0 H TYR A 91 4.182 10.105 -1.878 1.00 0.00 H new ATOM 0 HA TYR A 91 5.986 7.987 -2.506 1.00 0.00 H new ATOM 0 HB2 TYR A 91 5.949 10.036 -3.782 1.00 0.00 H new ATOM 0 HB3 TYR A 91 6.269 10.996 -2.352 1.00 0.00 H new ATOM 0 HD1 TYR A 91 8.017 7.788 -2.905 1.00 0.00 H new ATOM 0 HD2 TYR A 91 8.262 12.023 -3.320 1.00 0.00 H new ATOM 0 HE1 TYR A 91 10.430 7.608 -3.321 1.00 0.00 H new ATOM 0 HE2 TYR A 91 10.676 11.843 -3.737 1.00 0.00 H new ATOM 0 HH TYR A 91 12.421 10.508 -3.934 1.00 0.00 H new ATOM 1418 N THR A 92 6.371 9.739 0.275 1.00 0.00 N ATOM 1419 CA THR A 92 7.009 9.745 1.580 1.00 0.00 C ATOM 1420 C THR A 92 6.671 8.461 2.320 1.00 0.00 C ATOM 1421 O THR A 92 7.541 7.823 2.914 1.00 0.00 O ATOM 1422 CB THR A 92 6.538 10.945 2.396 1.00 0.00 C ATOM 1423 OG1 THR A 92 6.534 12.120 1.605 1.00 0.00 O ATOM 1424 CG2 THR A 92 7.392 11.211 3.615 1.00 0.00 C ATOM 0 H THR A 92 5.688 10.484 0.134 1.00 0.00 H new ATOM 0 HA THR A 92 8.088 9.814 1.443 1.00 0.00 H new ATOM 0 HB THR A 92 5.531 10.692 2.728 1.00 0.00 H new ATOM 0 HG1 THR A 92 6.227 12.877 2.146 1.00 0.00 H new ATOM 0 HG21 THR A 92 7.003 12.077 4.150 1.00 0.00 H new ATOM 0 HG22 THR A 92 7.372 10.340 4.270 1.00 0.00 H new ATOM 0 HG23 THR A 92 8.418 11.408 3.304 1.00 0.00 H new ATOM 1432 N LEU A 93 5.396 8.084 2.270 1.00 0.00 N ATOM 1433 CA LEU A 93 4.939 6.870 2.927 1.00 0.00 C ATOM 1434 C LEU A 93 5.615 5.658 2.317 1.00 0.00 C ATOM 1435 O LEU A 93 6.245 4.866 3.020 1.00 0.00 O ATOM 1436 CB LEU A 93 3.418 6.726 2.830 1.00 0.00 C ATOM 1437 CG LEU A 93 2.886 5.327 3.154 1.00 0.00 C ATOM 1438 CD1 LEU A 93 3.268 4.920 4.567 1.00 0.00 C ATOM 1439 CD2 LEU A 93 1.379 5.271 2.968 1.00 0.00 C ATOM 0 H LEU A 93 4.665 8.602 1.782 1.00 0.00 H new ATOM 0 HA LEU A 93 5.207 6.937 3.981 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.955 7.442 3.509 1.00 0.00 H new ATOM 0 HB3 LEU A 93 3.105 6.994 1.821 1.00 0.00 H new ATOM 0 HG LEU A 93 3.343 4.620 2.462 1.00 0.00 H new ATOM 0 HD11 LEU A 93 2.880 3.923 4.776 1.00 0.00 H new ATOM 0 HD12 LEU A 93 4.354 4.914 4.663 1.00 0.00 H new ATOM 0 HD13 LEU A 93 2.845 5.630 5.277 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.020 4.269 3.203 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.903 5.992 3.633 1.00 0.00 H new ATOM 0 HD23 LEU A 93 1.131 5.512 1.934 1.00 0.00 H new ATOM 1451 N LEU A 94 5.495 5.521 1.004 1.00 0.00 N ATOM 1452 CA LEU A 94 6.114 4.406 0.316 1.00 0.00 C ATOM 1453 C LEU A 94 7.636 4.493 0.425 1.00 0.00 C ATOM 1454 O LEU A 94 8.348 3.544 0.094 1.00 0.00 O ATOM 1455 CB LEU A 94 5.674 4.350 -1.151 1.00 0.00 C ATOM 1456 CG LEU A 94 5.225 2.965 -1.634 1.00 0.00 C ATOM 1457 CD1 LEU A 94 6.424 2.051 -1.818 1.00 0.00 C ATOM 1458 CD2 LEU A 94 4.231 2.345 -0.659 1.00 0.00 C ATOM 0 H LEU A 94 4.979 6.163 0.402 1.00 0.00 H new ATOM 0 HA LEU A 94 5.785 3.484 0.796 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.855 5.054 -1.297 1.00 0.00 H new ATOM 0 HB3 LEU A 94 6.500 4.688 -1.777 1.00 0.00 H new ATOM 0 HG LEU A 94 4.728 3.087 -2.597 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.087 1.073 -2.161 1.00 0.00 H new ATOM 0 HD12 LEU A 94 7.100 2.481 -2.557 1.00 0.00 H new ATOM 0 HD13 LEU A 94 6.947 1.942 -0.868 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.928 1.364 -1.024 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.699 2.240 0.320 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.355 2.988 -0.575 1.00 0.00 H new ATOM 1470 N ASN A 95 8.128 5.631 0.920 1.00 0.00 N ATOM 1471 CA ASN A 95 9.563 5.825 1.095 1.00 0.00 C ATOM 1472 C ASN A 95 10.053 5.064 2.322 1.00 0.00 C ATOM 1473 O ASN A 95 10.887 4.163 2.219 1.00 0.00 O ATOM 1474 CB ASN A 95 9.888 7.314 1.236 1.00 0.00 C ATOM 1475 CG ASN A 95 10.816 7.810 0.144 1.00 0.00 C ATOM 1476 OD1 ASN A 95 11.800 7.154 -0.195 1.00 0.00 O ATOM 1477 ND2 ASN A 95 10.505 8.975 -0.412 1.00 0.00 N ATOM 0 H ASN A 95 7.555 6.426 1.204 1.00 0.00 H new ATOM 0 HA ASN A 95 10.074 5.438 0.213 1.00 0.00 H new ATOM 0 HB2 ASN A 95 8.962 7.889 1.211 1.00 0.00 H new ATOM 0 HB3 ASN A 95 10.348 7.492 2.208 1.00 0.00 H new ATOM 0 HD21 ASN A 95 11.092 9.360 -1.152 1.00 0.00 H new ATOM 0 HD22 ASN A 95 9.679 9.485 -0.099 1.00 0.00 H new ATOM 1484 N LYS A 96 9.521 5.433 3.482 1.00 0.00 N ATOM 1485 CA LYS A 96 9.892 4.787 4.734 1.00 0.00 C ATOM 1486 C LYS A 96 9.612 3.289 4.664 1.00 0.00 C ATOM 1487 O LYS A 96 10.449 2.475 5.048 1.00 0.00 O ATOM 1488 CB LYS A 96 9.128 5.414 5.903 1.00 0.00 C ATOM 1489 CG LYS A 96 10.031 5.998 6.976 1.00 0.00 C ATOM 1490 CD LYS A 96 10.543 7.375 6.584 1.00 0.00 C ATOM 1491 CE LYS A 96 9.525 8.459 6.899 1.00 0.00 C ATOM 1492 NZ LYS A 96 8.762 8.874 5.689 1.00 0.00 N ATOM 0 H LYS A 96 8.831 6.177 3.581 1.00 0.00 H new ATOM 0 HA LYS A 96 10.960 4.934 4.895 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.477 6.200 5.521 1.00 0.00 H new ATOM 0 HB3 LYS A 96 8.485 4.658 6.353 1.00 0.00 H new ATOM 0 HG2 LYS A 96 9.484 6.066 7.916 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.875 5.330 7.146 1.00 0.00 H new ATOM 0 HD2 LYS A 96 11.473 7.583 7.114 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.773 7.389 5.519 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.832 8.096 7.658 1.00 0.00 H new ATOM 0 HE3 LYS A 96 10.036 9.325 7.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 9.044 9.837 5.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 8.965 8.217 4.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.743 8.858 5.899 1.00 0.00 H new ATOM 1506 N ILE A 97 8.431 2.935 4.164 1.00 0.00 N ATOM 1507 CA ILE A 97 8.038 1.545 4.034 1.00 0.00 C ATOM 1508 C ILE A 97 9.075 0.754 3.250 1.00 0.00 C ATOM 1509 O ILE A 97 9.527 -0.295 3.694 1.00 0.00 O ATOM 1510 CB ILE A 97 6.668 1.448 3.344 1.00 0.00 C ATOM 1511 CG1 ILE A 97 6.046 0.073 3.520 1.00 0.00 C ATOM 1512 CG2 ILE A 97 6.768 1.787 1.873 1.00 0.00 C ATOM 1513 CD1 ILE A 97 4.789 -0.089 2.701 1.00 0.00 C ATOM 0 H ILE A 97 7.729 3.601 3.842 1.00 0.00 H new ATOM 0 HA ILE A 97 7.968 1.116 5.034 1.00 0.00 H new ATOM 0 HB ILE A 97 6.019 2.179 3.826 1.00 0.00 H new ATOM 0 HG12 ILE A 97 6.768 -0.691 3.231 1.00 0.00 H new ATOM 0 HG13 ILE A 97 5.816 -0.088 4.573 1.00 0.00 H new ATOM 0 HG21 ILE A 97 5.783 1.709 1.414 1.00 0.00 H new ATOM 0 HG22 ILE A 97 7.142 2.804 1.759 1.00 0.00 H new ATOM 0 HG23 ILE A 97 7.452 1.092 1.385 1.00 0.00 H new ATOM 0 HD11 ILE A 97 4.379 -1.087 2.858 1.00 0.00 H new ATOM 0 HD12 ILE A 97 4.056 0.657 3.008 1.00 0.00 H new ATOM 0 HD13 ILE A 97 5.023 0.045 1.645 1.00 0.00 H new ATOM 1525 N LEU A 98 9.448 1.269 2.083 1.00 0.00 N ATOM 1526 CA LEU A 98 10.441 0.607 1.242 1.00 0.00 C ATOM 1527 C LEU A 98 11.697 0.286 2.044 1.00 0.00 C ATOM 1528 O LEU A 98 12.136 -0.864 2.098 1.00 0.00 O ATOM 1529 CB LEU A 98 10.799 1.485 0.039 1.00 0.00 C ATOM 1530 CG LEU A 98 10.579 0.831 -1.328 1.00 0.00 C ATOM 1531 CD1 LEU A 98 11.205 -0.555 -1.365 1.00 0.00 C ATOM 1532 CD2 LEU A 98 9.095 0.756 -1.645 1.00 0.00 C ATOM 0 H LEU A 98 9.080 2.139 1.699 1.00 0.00 H new ATOM 0 HA LEU A 98 10.009 -0.326 0.880 1.00 0.00 H new ATOM 0 HB2 LEU A 98 10.208 2.399 0.087 1.00 0.00 H new ATOM 0 HB3 LEU A 98 11.846 1.778 0.121 1.00 0.00 H new ATOM 0 HG LEU A 98 11.064 1.445 -2.087 1.00 0.00 H new ATOM 0 HD11 LEU A 98 11.038 -1.004 -2.344 1.00 0.00 H new ATOM 0 HD12 LEU A 98 12.276 -0.475 -1.180 1.00 0.00 H new ATOM 0 HD13 LEU A 98 10.750 -1.180 -0.597 1.00 0.00 H new ATOM 0 HD21 LEU A 98 8.954 0.289 -2.620 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.590 0.164 -0.882 1.00 0.00 H new ATOM 0 HD23 LEU A 98 8.675 1.762 -1.661 1.00 0.00 H new ATOM 1544 N ASP A 99 12.258 1.307 2.688 1.00 0.00 N ATOM 1545 CA ASP A 99 13.450 1.126 3.507 1.00 0.00 C ATOM 1546 C ASP A 99 13.131 0.195 4.665 1.00 0.00 C ATOM 1547 O ASP A 99 13.998 -0.514 5.176 1.00 0.00 O ATOM 1548 CB ASP A 99 13.948 2.473 4.034 1.00 0.00 C ATOM 1549 CG ASP A 99 14.530 3.343 2.938 1.00 0.00 C ATOM 1550 OD1 ASP A 99 13.755 3.814 2.079 1.00 0.00 O ATOM 1551 OD2 ASP A 99 15.760 3.556 2.939 1.00 0.00 O ATOM 0 H ASP A 99 11.907 2.264 2.658 1.00 0.00 H new ATOM 0 HA ASP A 99 14.238 0.686 2.896 1.00 0.00 H new ATOM 0 HB2 ASP A 99 13.123 3.000 4.513 1.00 0.00 H new ATOM 0 HB3 ASP A 99 14.705 2.303 4.800 1.00 0.00 H new ATOM 1556 N GLU A 100 11.864 0.202 5.055 1.00 0.00 N ATOM 1557 CA GLU A 100 11.379 -0.633 6.134 1.00 0.00 C ATOM 1558 C GLU A 100 11.284 -2.085 5.677 1.00 0.00 C ATOM 1559 O GLU A 100 11.553 -3.007 6.445 1.00 0.00 O ATOM 1560 CB GLU A 100 10.021 -0.114 6.592 1.00 0.00 C ATOM 1561 CG GLU A 100 9.622 -0.548 7.996 1.00 0.00 C ATOM 1562 CD GLU A 100 9.822 -2.031 8.243 1.00 0.00 C ATOM 1563 OE1 GLU A 100 9.304 -2.842 7.448 1.00 0.00 O ATOM 1564 OE2 GLU A 100 10.499 -2.380 9.233 1.00 0.00 O ATOM 0 H GLU A 100 11.147 0.789 4.629 1.00 0.00 H new ATOM 0 HA GLU A 100 12.075 -0.594 6.972 1.00 0.00 H new ATOM 0 HB2 GLU A 100 10.029 0.975 6.550 1.00 0.00 H new ATOM 0 HB3 GLU A 100 9.260 -0.454 5.890 1.00 0.00 H new ATOM 0 HG2 GLU A 100 10.205 0.017 8.723 1.00 0.00 H new ATOM 0 HG3 GLU A 100 8.575 -0.297 8.163 1.00 0.00 H new ATOM 1571 N TYR A 101 10.925 -2.282 4.410 1.00 0.00 N ATOM 1572 CA TYR A 101 10.822 -3.622 3.856 1.00 0.00 C ATOM 1573 C TYR A 101 12.202 -4.258 3.780 1.00 0.00 C ATOM 1574 O TYR A 101 12.348 -5.471 3.924 1.00 0.00 O ATOM 1575 CB TYR A 101 10.184 -3.601 2.468 1.00 0.00 C ATOM 1576 CG TYR A 101 9.673 -4.960 2.041 1.00 0.00 C ATOM 1577 CD1 TYR A 101 10.551 -5.946 1.608 1.00 0.00 C ATOM 1578 CD2 TYR A 101 8.318 -5.262 2.088 1.00 0.00 C ATOM 1579 CE1 TYR A 101 10.093 -7.193 1.232 1.00 0.00 C ATOM 1580 CE2 TYR A 101 7.852 -6.509 1.716 1.00 0.00 C ATOM 1581 CZ TYR A 101 8.746 -7.471 1.289 1.00 0.00 C ATOM 1582 OH TYR A 101 8.296 -8.718 0.921 1.00 0.00 O ATOM 0 H TYR A 101 10.703 -1.533 3.754 1.00 0.00 H new ATOM 0 HA TYR A 101 10.184 -4.212 4.514 1.00 0.00 H new ATOM 0 HB2 TYR A 101 9.359 -2.889 2.462 1.00 0.00 H new ATOM 0 HB3 TYR A 101 10.915 -3.247 1.741 1.00 0.00 H new ATOM 0 HD1 TYR A 101 11.609 -5.733 1.565 1.00 0.00 H new ATOM 0 HD2 TYR A 101 7.617 -4.510 2.421 1.00 0.00 H new ATOM 0 HE1 TYR A 101 10.789 -7.947 0.895 1.00 0.00 H new ATOM 0 HE2 TYR A 101 6.796 -6.730 1.759 1.00 0.00 H new ATOM 0 HH TYR A 101 7.745 -9.092 1.640 1.00 0.00 H new ATOM 1592 N LEU A 102 13.216 -3.425 3.551 1.00 0.00 N ATOM 1593 CA LEU A 102 14.590 -3.905 3.455 1.00 0.00 C ATOM 1594 C LEU A 102 15.168 -4.217 4.831 1.00 0.00 C ATOM 1595 O LEU A 102 15.986 -5.126 4.976 1.00 0.00 O ATOM 1596 CB LEU A 102 15.487 -2.883 2.742 1.00 0.00 C ATOM 1597 CG LEU A 102 14.774 -1.915 1.796 1.00 0.00 C ATOM 1598 CD1 LEU A 102 15.785 -1.098 1.008 1.00 0.00 C ATOM 1599 CD2 LEU A 102 13.845 -2.670 0.855 1.00 0.00 C ATOM 0 H LEU A 102 13.111 -2.418 3.429 1.00 0.00 H new ATOM 0 HA LEU A 102 14.565 -4.824 2.869 1.00 0.00 H new ATOM 0 HB2 LEU A 102 16.013 -2.300 3.498 1.00 0.00 H new ATOM 0 HB3 LEU A 102 16.243 -3.425 2.174 1.00 0.00 H new ATOM 0 HG LEU A 102 14.172 -1.232 2.395 1.00 0.00 H new ATOM 0 HD11 LEU A 102 15.260 -0.415 0.340 1.00 0.00 H new ATOM 0 HD12 LEU A 102 16.407 -0.526 1.697 1.00 0.00 H new ATOM 0 HD13 LEU A 102 16.415 -1.767 0.421 1.00 0.00 H new ATOM 0 HD21 LEU A 102 13.348 -1.964 0.191 1.00 0.00 H new ATOM 0 HD22 LEU A 102 14.424 -3.379 0.263 1.00 0.00 H new ATOM 0 HD23 LEU A 102 13.097 -3.209 1.437 1.00 0.00 H new ATOM 1611 N VAL A 103 14.755 -3.456 5.839 1.00 0.00 N ATOM 1612 CA VAL A 103 15.256 -3.662 7.193 1.00 0.00 C ATOM 1613 C VAL A 103 14.807 -5.002 7.755 1.00 0.00 C ATOM 1614 O VAL A 103 15.618 -5.764 8.281 1.00 0.00 O ATOM 1615 CB VAL A 103 14.807 -2.545 8.152 1.00 0.00 C ATOM 1616 CG1 VAL A 103 14.907 -3.021 9.595 1.00 0.00 C ATOM 1617 CG2 VAL A 103 15.637 -1.289 7.936 1.00 0.00 C ATOM 0 H VAL A 103 14.080 -2.697 5.746 1.00 0.00 H new ATOM 0 HA VAL A 103 16.343 -3.646 7.118 1.00 0.00 H new ATOM 0 HB VAL A 103 13.766 -2.300 7.942 1.00 0.00 H new ATOM 0 HG11 VAL A 103 14.587 -2.223 10.264 1.00 0.00 H new ATOM 0 HG12 VAL A 103 14.267 -3.892 9.736 1.00 0.00 H new ATOM 0 HG13 VAL A 103 15.939 -3.290 9.819 1.00 0.00 H new ATOM 0 HG21 VAL A 103 15.305 -0.511 8.623 1.00 0.00 H new ATOM 0 HG22 VAL A 103 16.688 -1.511 8.120 1.00 0.00 H new ATOM 0 HG23 VAL A 103 15.514 -0.944 6.910 1.00 0.00 H new ATOM 1627 N ALA A 104 13.513 -5.286 7.649 1.00 0.00 N ATOM 1628 CA ALA A 104 12.965 -6.541 8.153 1.00 0.00 C ATOM 1629 C ALA A 104 13.817 -7.731 7.714 1.00 0.00 C ATOM 1630 O ALA A 104 13.738 -8.813 8.296 1.00 0.00 O ATOM 1631 CB ALA A 104 11.529 -6.715 7.684 1.00 0.00 C ATOM 0 H ALA A 104 12.826 -4.666 7.220 1.00 0.00 H new ATOM 0 HA ALA A 104 12.978 -6.503 9.242 1.00 0.00 H new ATOM 0 HB1 ALA A 104 11.133 -7.655 8.067 1.00 0.00 H new ATOM 0 HB2 ALA A 104 10.923 -5.888 8.054 1.00 0.00 H new ATOM 0 HB3 ALA A 104 11.501 -6.727 6.594 1.00 0.00 H new ATOM 1637 N HIS A 105 14.627 -7.522 6.680 1.00 0.00 N ATOM 1638 CA HIS A 105 15.487 -8.566 6.157 1.00 0.00 C ATOM 1639 C HIS A 105 16.363 -8.026 5.027 1.00 0.00 C ATOM 1640 O HIS A 105 15.855 -7.406 4.093 1.00 0.00 O ATOM 1641 CB HIS A 105 14.641 -9.732 5.642 1.00 0.00 C ATOM 1642 CG HIS A 105 13.431 -9.302 4.864 1.00 0.00 C ATOM 1643 ND1 HIS A 105 12.603 -10.191 4.212 1.00 0.00 N ATOM 1644 CD2 HIS A 105 12.909 -8.069 4.636 1.00 0.00 C ATOM 1645 CE1 HIS A 105 11.628 -9.529 3.616 1.00 0.00 C ATOM 1646 NE2 HIS A 105 11.789 -8.241 3.859 1.00 0.00 N ATOM 0 H HIS A 105 14.702 -6.631 6.189 1.00 0.00 H new ATOM 0 HA HIS A 105 16.132 -8.916 6.963 1.00 0.00 H new ATOM 0 HB2 HIS A 105 15.261 -10.368 5.010 1.00 0.00 H new ATOM 0 HB3 HIS A 105 14.321 -10.339 6.489 1.00 0.00 H new ATOM 0 HD2 HIS A 105 13.301 -7.130 4.998 1.00 0.00 H new ATOM 0 HE1 HIS A 105 10.834 -9.967 3.029 1.00 0.00 H new ATOM 0 HE2 HIS A 105 11.180 -7.494 3.524 1.00 0.00 H new ATOM 1655 N PRO A 106 17.692 -8.252 5.097 1.00 0.00 N ATOM 1656 CA PRO A 106 18.639 -7.790 4.080 1.00 0.00 C ATOM 1657 C PRO A 106 18.050 -7.789 2.668 1.00 0.00 C ATOM 1658 O PRO A 106 17.109 -8.525 2.370 1.00 0.00 O ATOM 1659 CB PRO A 106 19.774 -8.800 4.199 1.00 0.00 C ATOM 1660 CG PRO A 106 19.782 -9.201 5.641 1.00 0.00 C ATOM 1661 CD PRO A 106 18.383 -8.977 6.179 1.00 0.00 C ATOM 0 HA PRO A 106 18.943 -6.755 4.239 1.00 0.00 H new ATOM 0 HB2 PRO A 106 19.607 -9.660 3.551 1.00 0.00 H new ATOM 0 HB3 PRO A 106 20.727 -8.360 3.906 1.00 0.00 H new ATOM 0 HG2 PRO A 106 20.072 -10.246 5.748 1.00 0.00 H new ATOM 0 HG3 PRO A 106 20.508 -8.610 6.200 1.00 0.00 H new ATOM 0 HD2 PRO A 106 17.887 -9.921 6.406 1.00 0.00 H new ATOM 0 HD3 PRO A 106 18.399 -8.396 7.101 1.00 0.00 H new ATOM 1669 N LYS A 107 18.601 -6.934 1.816 1.00 0.00 N ATOM 1670 CA LYS A 107 18.133 -6.785 0.439 1.00 0.00 C ATOM 1671 C LYS A 107 17.839 -8.121 -0.253 1.00 0.00 C ATOM 1672 O LYS A 107 16.710 -8.376 -0.668 1.00 0.00 O ATOM 1673 CB LYS A 107 19.162 -6.002 -0.377 1.00 0.00 C ATOM 1674 CG LYS A 107 19.095 -4.499 -0.159 1.00 0.00 C ATOM 1675 CD LYS A 107 20.376 -3.812 -0.604 1.00 0.00 C ATOM 1676 CE LYS A 107 20.404 -2.354 -0.174 1.00 0.00 C ATOM 1677 NZ LYS A 107 21.787 -1.802 -0.167 1.00 0.00 N ATOM 0 H LYS A 107 19.383 -6.325 2.057 1.00 0.00 H new ATOM 0 HA LYS A 107 17.189 -6.242 0.490 1.00 0.00 H new ATOM 0 HB2 LYS A 107 20.161 -6.354 -0.120 1.00 0.00 H new ATOM 0 HB3 LYS A 107 19.012 -6.214 -1.436 1.00 0.00 H new ATOM 0 HG2 LYS A 107 18.250 -4.088 -0.711 1.00 0.00 H new ATOM 0 HG3 LYS A 107 18.918 -4.291 0.896 1.00 0.00 H new ATOM 0 HD2 LYS A 107 21.235 -4.333 -0.182 1.00 0.00 H new ATOM 0 HD3 LYS A 107 20.466 -3.874 -1.688 1.00 0.00 H new ATOM 0 HE2 LYS A 107 19.782 -1.765 -0.848 1.00 0.00 H new ATOM 0 HE3 LYS A 107 19.971 -2.261 0.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 21.762 -0.806 0.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 22.375 -2.347 0.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 22.191 -1.866 -1.123 1.00 0.00 H new ATOM 1691 N GLU A 108 18.860 -8.951 -0.413 1.00 0.00 N ATOM 1692 CA GLU A 108 18.701 -10.233 -1.101 1.00 0.00 C ATOM 1693 C GLU A 108 17.701 -11.159 -0.408 1.00 0.00 C ATOM 1694 O GLU A 108 17.084 -12.003 -1.058 1.00 0.00 O ATOM 1695 CB GLU A 108 20.056 -10.932 -1.229 1.00 0.00 C ATOM 1696 CG GLU A 108 20.335 -11.470 -2.623 1.00 0.00 C ATOM 1697 CD GLU A 108 21.756 -11.207 -3.076 1.00 0.00 C ATOM 1698 OE1 GLU A 108 22.667 -11.231 -2.221 1.00 0.00 O ATOM 1699 OE2 GLU A 108 21.961 -10.977 -4.287 1.00 0.00 O ATOM 0 H GLU A 108 19.805 -8.765 -0.079 1.00 0.00 H new ATOM 0 HA GLU A 108 18.300 -10.013 -2.090 1.00 0.00 H new ATOM 0 HB2 GLU A 108 20.844 -10.231 -0.955 1.00 0.00 H new ATOM 0 HB3 GLU A 108 20.099 -11.755 -0.516 1.00 0.00 H new ATOM 0 HG2 GLU A 108 20.146 -12.543 -2.639 1.00 0.00 H new ATOM 0 HG3 GLU A 108 19.642 -11.014 -3.330 1.00 0.00 H new ATOM 1706 N GLU A 109 17.545 -11.016 0.903 1.00 0.00 N ATOM 1707 CA GLU A 109 16.620 -11.867 1.654 1.00 0.00 C ATOM 1708 C GLU A 109 15.250 -11.929 0.991 1.00 0.00 C ATOM 1709 O GLU A 109 14.633 -12.992 0.923 1.00 0.00 O ATOM 1710 CB GLU A 109 16.476 -11.368 3.086 1.00 0.00 C ATOM 1711 CG GLU A 109 17.790 -11.323 3.833 1.00 0.00 C ATOM 1712 CD GLU A 109 17.879 -12.366 4.930 1.00 0.00 C ATOM 1713 OE1 GLU A 109 16.908 -12.496 5.705 1.00 0.00 O ATOM 1714 OE2 GLU A 109 18.920 -13.052 5.014 1.00 0.00 O ATOM 0 H GLU A 109 18.041 -10.326 1.467 1.00 0.00 H new ATOM 0 HA GLU A 109 17.040 -12.873 1.663 1.00 0.00 H new ATOM 0 HB2 GLU A 109 16.037 -10.370 3.074 1.00 0.00 H new ATOM 0 HB3 GLU A 109 15.782 -12.015 3.622 1.00 0.00 H new ATOM 0 HG2 GLU A 109 18.608 -11.473 3.129 1.00 0.00 H new ATOM 0 HG3 GLU A 109 17.921 -10.332 4.268 1.00 0.00 H new ATOM 1721 N TRP A 110 14.781 -10.792 0.495 1.00 0.00 N ATOM 1722 CA TRP A 110 13.490 -10.740 -0.166 1.00 0.00 C ATOM 1723 C TRP A 110 13.670 -10.858 -1.667 1.00 0.00 C ATOM 1724 O TRP A 110 12.855 -11.479 -2.348 1.00 0.00 O ATOM 1725 CB TRP A 110 12.745 -9.442 0.173 1.00 0.00 C ATOM 1726 CG TRP A 110 13.625 -8.228 0.240 1.00 0.00 C ATOM 1727 CD1 TRP A 110 14.063 -7.601 1.367 1.00 0.00 C ATOM 1728 CD2 TRP A 110 14.164 -7.487 -0.863 1.00 0.00 C ATOM 1729 NE1 TRP A 110 14.840 -6.520 1.035 1.00 0.00 N ATOM 1730 CE2 TRP A 110 14.916 -6.427 -0.327 1.00 0.00 C ATOM 1731 CE3 TRP A 110 14.088 -7.616 -2.249 1.00 0.00 C ATOM 1732 CZ2 TRP A 110 15.583 -5.504 -1.129 1.00 0.00 C ATOM 1733 CZ3 TRP A 110 14.749 -6.702 -3.046 1.00 0.00 C ATOM 1734 CH2 TRP A 110 15.488 -5.658 -2.484 1.00 0.00 C ATOM 0 H TRP A 110 15.274 -9.900 0.539 1.00 0.00 H new ATOM 0 HA TRP A 110 12.892 -11.578 0.193 1.00 0.00 H new ATOM 0 HB2 TRP A 110 11.970 -9.275 -0.575 1.00 0.00 H new ATOM 0 HB3 TRP A 110 12.241 -9.565 1.132 1.00 0.00 H new ATOM 0 HD1 TRP A 110 13.832 -7.910 2.376 1.00 0.00 H new ATOM 0 HE1 TRP A 110 15.289 -5.888 1.698 1.00 0.00 H new ATOM 0 HE3 TRP A 110 13.520 -8.420 -2.694 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 16.154 -4.696 -0.696 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 14.694 -6.796 -4.121 1.00 0.00 H new ATOM 0 HH2 TRP A 110 15.994 -4.959 -3.133 1.00 0.00 H new ATOM 1745 N ALA A 111 14.754 -10.256 -2.166 1.00 0.00 N ATOM 1746 CA ALA A 111 15.086 -10.265 -3.597 1.00 0.00 C ATOM 1747 C ALA A 111 13.923 -10.764 -4.450 1.00 0.00 C ATOM 1748 O ALA A 111 14.031 -11.781 -5.136 1.00 0.00 O ATOM 1749 CB ALA A 111 16.319 -11.119 -3.841 1.00 0.00 C ATOM 0 H ALA A 111 15.427 -9.749 -1.591 1.00 0.00 H new ATOM 0 HA ALA A 111 15.292 -9.237 -3.894 1.00 0.00 H new ATOM 0 HB1 ALA A 111 16.557 -11.119 -4.905 1.00 0.00 H new ATOM 0 HB2 ALA A 111 17.161 -10.711 -3.281 1.00 0.00 H new ATOM 0 HB3 ALA A 111 16.125 -12.140 -3.512 1.00 0.00 H new ATOM 1755 N ASP A 112 12.803 -10.054 -4.375 1.00 0.00 N ATOM 1756 CA ASP A 112 11.605 -10.433 -5.110 1.00 0.00 C ATOM 1757 C ASP A 112 11.015 -11.687 -4.501 1.00 0.00 C ATOM 1758 O ASP A 112 11.135 -12.782 -5.051 1.00 0.00 O ATOM 1759 CB ASP A 112 11.914 -10.673 -6.586 1.00 0.00 C ATOM 1760 CG ASP A 112 12.705 -9.539 -7.208 1.00 0.00 C ATOM 1761 OD1 ASP A 112 13.873 -9.341 -6.810 1.00 0.00 O ATOM 1762 OD2 ASP A 112 12.158 -8.849 -8.093 1.00 0.00 O ATOM 0 H ASP A 112 12.701 -9.211 -3.811 1.00 0.00 H new ATOM 0 HA ASP A 112 10.888 -9.615 -5.043 1.00 0.00 H new ATOM 0 HB2 ASP A 112 12.475 -11.602 -6.690 1.00 0.00 H new ATOM 0 HB3 ASP A 112 10.980 -10.802 -7.133 1.00 0.00 H new ATOM 1767 N VAL A 113 10.391 -11.516 -3.353 1.00 0.00 N ATOM 1768 CA VAL A 113 9.793 -12.622 -2.646 1.00 0.00 C ATOM 1769 C VAL A 113 8.628 -13.215 -3.416 1.00 0.00 C ATOM 1770 O VAL A 113 7.755 -12.492 -3.896 1.00 0.00 O ATOM 1771 CB VAL A 113 9.280 -12.200 -1.262 1.00 0.00 C ATOM 1772 CG1 VAL A 113 9.117 -13.421 -0.386 1.00 0.00 C ATOM 1773 CG2 VAL A 113 10.214 -11.194 -0.616 1.00 0.00 C ATOM 0 H VAL A 113 10.286 -10.613 -2.890 1.00 0.00 H new ATOM 0 HA VAL A 113 10.581 -13.367 -2.536 1.00 0.00 H new ATOM 0 HB VAL A 113 8.310 -11.717 -1.382 1.00 0.00 H new ATOM 0 HG11 VAL A 113 8.753 -13.118 0.596 1.00 0.00 H new ATOM 0 HG12 VAL A 113 8.402 -14.104 -0.844 1.00 0.00 H new ATOM 0 HG13 VAL A 113 10.079 -13.922 -0.278 1.00 0.00 H new ATOM 0 HG21 VAL A 113 9.825 -10.913 0.363 1.00 0.00 H new ATOM 0 HG22 VAL A 113 11.203 -11.638 -0.500 1.00 0.00 H new ATOM 0 HG23 VAL A 113 10.286 -10.307 -1.246 1.00 0.00 H new ATOM 1783 N THR A 114 8.602 -14.535 -3.502 1.00 0.00 N ATOM 1784 CA THR A 114 7.518 -15.221 -4.182 1.00 0.00 C ATOM 1785 C THR A 114 6.491 -15.702 -3.163 1.00 0.00 C ATOM 1786 O THR A 114 5.660 -16.561 -3.456 1.00 0.00 O ATOM 1787 CB THR A 114 8.053 -16.404 -4.989 1.00 0.00 C ATOM 1788 OG1 THR A 114 6.995 -17.093 -5.629 1.00 0.00 O ATOM 1789 CG2 THR A 114 8.816 -17.407 -4.151 1.00 0.00 C ATOM 0 H THR A 114 9.316 -15.150 -3.111 1.00 0.00 H new ATOM 0 HA THR A 114 7.040 -14.524 -4.870 1.00 0.00 H new ATOM 0 HB THR A 114 8.739 -15.970 -5.717 1.00 0.00 H new ATOM 0 HG1 THR A 114 6.175 -16.997 -5.101 1.00 0.00 H new ATOM 0 HG21 THR A 114 9.167 -18.220 -4.787 1.00 0.00 H new ATOM 0 HG22 THR A 114 9.670 -16.916 -3.684 1.00 0.00 H new ATOM 0 HG23 THR A 114 8.161 -17.808 -3.378 1.00 0.00 H new ATOM 1797 N GLU A 115 6.568 -15.142 -1.956 1.00 0.00 N ATOM 1798 CA GLU A 115 5.669 -15.503 -0.878 1.00 0.00 C ATOM 1799 C GLU A 115 5.963 -14.657 0.357 1.00 0.00 C ATOM 1800 O GLU A 115 6.914 -14.923 1.092 1.00 0.00 O ATOM 1801 CB GLU A 115 5.827 -16.983 -0.554 1.00 0.00 C ATOM 1802 CG GLU A 115 7.229 -17.361 -0.108 1.00 0.00 C ATOM 1803 CD GLU A 115 7.510 -18.842 -0.264 1.00 0.00 C ATOM 1804 OE1 GLU A 115 6.949 -19.459 -1.193 1.00 0.00 O ATOM 1805 OE2 GLU A 115 8.291 -19.387 0.545 1.00 0.00 O ATOM 0 H GLU A 115 7.254 -14.430 -1.706 1.00 0.00 H new ATOM 0 HA GLU A 115 4.642 -15.315 -1.190 1.00 0.00 H new ATOM 0 HB2 GLU A 115 5.120 -17.252 0.231 1.00 0.00 H new ATOM 0 HB3 GLU A 115 5.564 -17.569 -1.435 1.00 0.00 H new ATOM 0 HG2 GLU A 115 7.956 -16.794 -0.689 1.00 0.00 H new ATOM 0 HG3 GLU A 115 7.363 -17.077 0.936 1.00 0.00 H new ATOM 1812 N THR A 116 5.153 -13.628 0.567 1.00 0.00 N ATOM 1813 CA THR A 116 5.336 -12.729 1.701 1.00 0.00 C ATOM 1814 C THR A 116 5.397 -13.490 3.022 1.00 0.00 C ATOM 1815 O THR A 116 5.384 -14.721 3.048 1.00 0.00 O ATOM 1816 CB THR A 116 4.211 -11.692 1.739 1.00 0.00 C ATOM 1817 OG1 THR A 116 4.578 -10.590 2.547 1.00 0.00 O ATOM 1818 CG2 THR A 116 2.899 -12.233 2.270 1.00 0.00 C ATOM 0 H THR A 116 4.362 -13.394 -0.033 1.00 0.00 H new ATOM 0 HA THR A 116 6.291 -12.220 1.569 1.00 0.00 H new ATOM 0 HB THR A 116 4.062 -11.396 0.701 1.00 0.00 H new ATOM 0 HG1 THR A 116 3.771 -10.144 2.879 1.00 0.00 H new ATOM 0 HG21 THR A 116 2.151 -11.440 2.267 1.00 0.00 H new ATOM 0 HG22 THR A 116 2.561 -13.054 1.637 1.00 0.00 H new ATOM 0 HG23 THR A 116 3.040 -12.595 3.289 1.00 0.00 H new ATOM 1826 N ASN A 117 5.466 -12.739 4.115 1.00 0.00 N ATOM 1827 CA ASN A 117 5.533 -13.315 5.452 1.00 0.00 C ATOM 1828 C ASN A 117 5.660 -12.209 6.491 1.00 0.00 C ATOM 1829 O ASN A 117 4.739 -11.959 7.267 1.00 0.00 O ATOM 1830 CB ASN A 117 6.718 -14.279 5.563 1.00 0.00 C ATOM 1831 CG ASN A 117 6.377 -15.526 6.357 1.00 0.00 C ATOM 1832 OD1 ASN A 117 6.934 -15.766 7.427 1.00 0.00 O ATOM 1833 ND2 ASN A 117 5.459 -16.327 5.830 1.00 0.00 N ATOM 0 H ASN A 117 5.477 -11.719 4.100 1.00 0.00 H new ATOM 0 HA ASN A 117 4.615 -13.872 5.636 1.00 0.00 H new ATOM 0 HB2 ASN A 117 7.044 -14.566 4.563 1.00 0.00 H new ATOM 0 HB3 ASN A 117 7.556 -13.768 6.037 1.00 0.00 H new ATOM 0 HD21 ASN A 117 5.189 -17.182 6.316 1.00 0.00 H new ATOM 0 HD22 ASN A 117 5.023 -16.087 4.939 1.00 0.00 H new ATOM 1840 N ASP A 118 6.806 -11.541 6.483 1.00 0.00 N ATOM 1841 CA ASP A 118 7.059 -10.446 7.409 1.00 0.00 C ATOM 1842 C ASP A 118 6.315 -9.193 6.965 1.00 0.00 C ATOM 1843 O ASP A 118 5.862 -8.399 7.789 1.00 0.00 O ATOM 1844 CB ASP A 118 8.559 -10.161 7.501 1.00 0.00 C ATOM 1845 CG ASP A 118 8.911 -9.289 8.690 1.00 0.00 C ATOM 1846 OD1 ASP A 118 8.561 -8.090 8.670 1.00 0.00 O ATOM 1847 OD2 ASP A 118 9.536 -9.804 9.640 1.00 0.00 O ATOM 0 H ASP A 118 7.576 -11.739 5.844 1.00 0.00 H new ATOM 0 HA ASP A 118 6.697 -10.738 8.395 1.00 0.00 H new ATOM 0 HB2 ASP A 118 9.101 -11.104 7.573 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.890 -9.672 6.585 1.00 0.00 H new ATOM 1852 N ALA A 119 6.188 -9.025 5.650 1.00 0.00 N ATOM 1853 CA ALA A 119 5.494 -7.873 5.091 1.00 0.00 C ATOM 1854 C ALA A 119 4.041 -7.844 5.546 1.00 0.00 C ATOM 1855 O ALA A 119 3.509 -6.790 5.892 1.00 0.00 O ATOM 1856 CB ALA A 119 5.571 -7.890 3.573 1.00 0.00 C ATOM 0 H ALA A 119 6.557 -9.673 4.954 1.00 0.00 H new ATOM 0 HA ALA A 119 5.986 -6.971 5.455 1.00 0.00 H new ATOM 0 HB1 ALA A 119 5.047 -7.022 3.172 1.00 0.00 H new ATOM 0 HB2 ALA A 119 6.615 -7.860 3.261 1.00 0.00 H new ATOM 0 HB3 ALA A 119 5.106 -8.801 3.195 1.00 0.00 H new ATOM 1862 N LEU A 120 3.403 -9.009 5.555 1.00 0.00 N ATOM 1863 CA LEU A 120 2.015 -9.109 5.982 1.00 0.00 C ATOM 1864 C LEU A 120 1.846 -8.540 7.388 1.00 0.00 C ATOM 1865 O LEU A 120 0.754 -8.121 7.774 1.00 0.00 O ATOM 1866 CB LEU A 120 1.548 -10.566 5.947 1.00 0.00 C ATOM 1867 CG LEU A 120 0.102 -10.772 5.492 1.00 0.00 C ATOM 1868 CD1 LEU A 120 -0.851 -9.973 6.368 1.00 0.00 C ATOM 1869 CD2 LEU A 120 -0.057 -10.377 4.031 1.00 0.00 C ATOM 0 H LEU A 120 3.824 -9.894 5.272 1.00 0.00 H new ATOM 0 HA LEU A 120 1.403 -8.528 5.293 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.205 -11.126 5.282 1.00 0.00 H new ATOM 0 HB3 LEU A 120 1.664 -10.993 6.943 1.00 0.00 H new ATOM 0 HG LEU A 120 -0.144 -11.829 5.592 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.875 -10.131 6.030 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -0.756 -10.301 7.403 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -0.606 -8.913 6.299 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -1.091 -10.530 3.723 1.00 0.00 H new ATOM 0 HD22 LEU A 120 0.207 -9.327 3.907 1.00 0.00 H new ATOM 0 HD23 LEU A 120 0.599 -10.991 3.415 1.00 0.00 H new ATOM 1881 N LYS A 121 2.938 -8.528 8.150 1.00 0.00 N ATOM 1882 CA LYS A 121 2.915 -8.010 9.513 1.00 0.00 C ATOM 1883 C LYS A 121 3.767 -6.746 9.640 1.00 0.00 C ATOM 1884 O LYS A 121 4.362 -6.492 10.688 1.00 0.00 O ATOM 1885 CB LYS A 121 3.413 -9.077 10.492 1.00 0.00 C ATOM 1886 CG LYS A 121 2.501 -9.275 11.692 1.00 0.00 C ATOM 1887 CD LYS A 121 2.322 -10.749 12.023 1.00 0.00 C ATOM 1888 CE LYS A 121 2.425 -11.004 13.519 1.00 0.00 C ATOM 1889 NZ LYS A 121 3.134 -12.279 13.818 1.00 0.00 N ATOM 0 H LYS A 121 3.849 -8.871 7.845 1.00 0.00 H new ATOM 0 HA LYS A 121 1.885 -7.751 9.757 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.514 -10.025 9.963 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.407 -8.800 10.843 1.00 0.00 H new ATOM 0 HG2 LYS A 121 2.917 -8.756 12.555 1.00 0.00 H new ATOM 0 HG3 LYS A 121 1.529 -8.827 11.488 1.00 0.00 H new ATOM 0 HD2 LYS A 121 1.351 -11.088 11.662 1.00 0.00 H new ATOM 0 HD3 LYS A 121 3.079 -11.334 11.501 1.00 0.00 H new ATOM 0 HE2 LYS A 121 2.952 -10.176 13.993 1.00 0.00 H new ATOM 0 HE3 LYS A 121 1.425 -11.035 13.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 3.183 -12.416 14.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 2.618 -13.073 13.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 4.097 -12.240 13.428 1.00 0.00 H new ATOM 1903 N MET A 122 3.821 -5.957 8.570 1.00 0.00 N ATOM 1904 CA MET A 122 4.598 -4.719 8.570 1.00 0.00 C ATOM 1905 C MET A 122 3.860 -3.617 9.330 1.00 0.00 C ATOM 1906 O MET A 122 3.196 -2.771 8.732 1.00 0.00 O ATOM 1907 CB MET A 122 4.881 -4.267 7.134 1.00 0.00 C ATOM 1908 CG MET A 122 6.321 -3.847 6.894 1.00 0.00 C ATOM 1909 SD MET A 122 6.542 -2.062 7.003 1.00 0.00 S ATOM 1910 CE MET A 122 7.412 -1.716 5.476 1.00 0.00 C ATOM 0 H MET A 122 3.337 -6.152 7.693 1.00 0.00 H new ATOM 0 HA MET A 122 5.546 -4.912 9.073 1.00 0.00 H new ATOM 0 HB2 MET A 122 4.631 -5.080 6.452 1.00 0.00 H new ATOM 0 HB3 MET A 122 4.224 -3.432 6.890 1.00 0.00 H new ATOM 0 HG2 MET A 122 6.966 -4.336 7.624 1.00 0.00 H new ATOM 0 HG3 MET A 122 6.638 -4.190 5.909 1.00 0.00 H new ATOM 0 HE1 MET A 122 7.506 -0.638 5.347 1.00 0.00 H new ATOM 0 HE2 MET A 122 8.404 -2.165 5.513 1.00 0.00 H new ATOM 0 HE3 MET A 122 6.855 -2.134 4.637 1.00 0.00 H new ATOM 1920 N LYS A 123 3.976 -3.643 10.655 1.00 0.00 N ATOM 1921 CA LYS A 123 3.317 -2.655 11.508 1.00 0.00 C ATOM 1922 C LYS A 123 3.577 -1.228 11.026 1.00 0.00 C ATOM 1923 O LYS A 123 2.771 -0.329 11.268 1.00 0.00 O ATOM 1924 CB LYS A 123 3.791 -2.811 12.955 1.00 0.00 C ATOM 1925 CG LYS A 123 2.823 -3.591 13.831 1.00 0.00 C ATOM 1926 CD LYS A 123 3.534 -4.678 14.620 1.00 0.00 C ATOM 1927 CE LYS A 123 3.932 -5.843 13.730 1.00 0.00 C ATOM 1928 NZ LYS A 123 4.803 -6.817 14.445 1.00 0.00 N ATOM 0 H LYS A 123 4.521 -4.339 11.163 1.00 0.00 H new ATOM 0 HA LYS A 123 2.243 -2.835 11.454 1.00 0.00 H new ATOM 0 HB2 LYS A 123 4.758 -3.314 12.960 1.00 0.00 H new ATOM 0 HB3 LYS A 123 3.944 -1.822 13.387 1.00 0.00 H new ATOM 0 HG2 LYS A 123 2.323 -2.909 14.519 1.00 0.00 H new ATOM 0 HG3 LYS A 123 2.049 -4.040 13.209 1.00 0.00 H new ATOM 0 HD2 LYS A 123 4.422 -4.262 15.095 1.00 0.00 H new ATOM 0 HD3 LYS A 123 2.883 -5.035 15.418 1.00 0.00 H new ATOM 0 HE2 LYS A 123 3.035 -6.351 13.374 1.00 0.00 H new ATOM 0 HE3 LYS A 123 4.455 -5.466 12.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 5.052 -7.596 13.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 5.670 -6.339 14.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 4.295 -7.197 15.270 1.00 0.00 H new ATOM 1942 N GLN A 124 4.704 -1.024 10.353 1.00 0.00 N ATOM 1943 CA GLN A 124 5.060 0.300 9.849 1.00 0.00 C ATOM 1944 C GLN A 124 3.977 0.848 8.926 1.00 0.00 C ATOM 1945 O GLN A 124 3.231 1.753 9.297 1.00 0.00 O ATOM 1946 CB GLN A 124 6.396 0.248 9.113 1.00 0.00 C ATOM 1947 CG GLN A 124 7.375 1.322 9.560 1.00 0.00 C ATOM 1948 CD GLN A 124 8.141 0.929 10.807 1.00 0.00 C ATOM 1949 OE1 GLN A 124 7.638 0.188 11.652 1.00 0.00 O ATOM 1950 NE2 GLN A 124 9.368 1.425 10.929 1.00 0.00 N ATOM 0 H GLN A 124 5.385 -1.754 10.144 1.00 0.00 H new ATOM 0 HA GLN A 124 5.151 0.969 10.704 1.00 0.00 H new ATOM 0 HB2 GLN A 124 6.849 -0.732 9.266 1.00 0.00 H new ATOM 0 HB3 GLN A 124 6.217 0.353 8.043 1.00 0.00 H new ATOM 0 HG2 GLN A 124 8.080 1.524 8.754 1.00 0.00 H new ATOM 0 HG3 GLN A 124 6.832 2.248 9.748 1.00 0.00 H new ATOM 0 HE21 GLN A 124 9.746 2.035 10.204 1.00 0.00 H new ATOM 0 HE22 GLN A 124 9.932 1.195 11.747 1.00 0.00 H new ATOM 1959 N LEU A 125 3.898 0.296 7.719 1.00 0.00 N ATOM 1960 CA LEU A 125 2.908 0.734 6.744 1.00 0.00 C ATOM 1961 C LEU A 125 1.502 0.649 7.322 1.00 0.00 C ATOM 1962 O LEU A 125 0.623 1.429 6.957 1.00 0.00 O ATOM 1963 CB LEU A 125 2.997 -0.111 5.473 1.00 0.00 C ATOM 1964 CG LEU A 125 2.777 -1.610 5.676 1.00 0.00 C ATOM 1965 CD1 LEU A 125 1.306 -1.959 5.517 1.00 0.00 C ATOM 1966 CD2 LEU A 125 3.625 -2.407 4.697 1.00 0.00 C ATOM 0 H LEU A 125 4.507 -0.455 7.394 1.00 0.00 H new ATOM 0 HA LEU A 125 3.120 1.774 6.495 1.00 0.00 H new ATOM 0 HB2 LEU A 125 2.260 0.256 4.759 1.00 0.00 H new ATOM 0 HB3 LEU A 125 3.978 0.039 5.023 1.00 0.00 H new ATOM 0 HG LEU A 125 3.083 -1.871 6.689 1.00 0.00 H new ATOM 0 HD11 LEU A 125 1.168 -3.030 5.665 1.00 0.00 H new ATOM 0 HD12 LEU A 125 0.720 -1.412 6.256 1.00 0.00 H new ATOM 0 HD13 LEU A 125 0.973 -1.685 4.516 1.00 0.00 H new ATOM 0 HD21 LEU A 125 3.457 -3.473 4.854 1.00 0.00 H new ATOM 0 HD22 LEU A 125 3.348 -2.143 3.677 1.00 0.00 H new ATOM 0 HD23 LEU A 125 4.678 -2.178 4.858 1.00 0.00 H new ATOM 1978 N ASP A 126 1.295 -0.298 8.232 1.00 0.00 N ATOM 1979 CA ASP A 126 -0.012 -0.465 8.854 1.00 0.00 C ATOM 1980 C ASP A 126 -0.375 0.773 9.662 1.00 0.00 C ATOM 1981 O ASP A 126 -1.411 1.396 9.433 1.00 0.00 O ATOM 1982 CB ASP A 126 -0.038 -1.700 9.755 1.00 0.00 C ATOM 1983 CG ASP A 126 0.493 -2.940 9.064 1.00 0.00 C ATOM 1984 OD1 ASP A 126 0.245 -3.096 7.850 1.00 0.00 O ATOM 1985 OD2 ASP A 126 1.155 -3.757 9.737 1.00 0.00 O ATOM 0 H ASP A 126 2.007 -0.954 8.552 1.00 0.00 H new ATOM 0 HA ASP A 126 -0.746 -0.603 8.060 1.00 0.00 H new ATOM 0 HB2 ASP A 126 0.555 -1.505 10.649 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -1.061 -1.883 10.085 1.00 0.00 H new ATOM 1990 N THR A 127 0.492 1.130 10.602 1.00 0.00 N ATOM 1991 CA THR A 127 0.268 2.302 11.435 1.00 0.00 C ATOM 1992 C THR A 127 0.259 3.564 10.580 1.00 0.00 C ATOM 1993 O THR A 127 -0.414 4.542 10.903 1.00 0.00 O ATOM 1994 CB THR A 127 1.351 2.406 12.510 1.00 0.00 C ATOM 1995 OG1 THR A 127 1.379 1.238 13.310 1.00 0.00 O ATOM 1996 CG2 THR A 127 1.164 3.590 13.435 1.00 0.00 C ATOM 0 H THR A 127 1.355 0.625 10.805 1.00 0.00 H new ATOM 0 HA THR A 127 -0.702 2.200 11.922 1.00 0.00 H new ATOM 0 HB THR A 127 2.286 2.534 11.965 1.00 0.00 H new ATOM 0 HG1 THR A 127 1.823 0.516 12.819 1.00 0.00 H new ATOM 0 HG21 THR A 127 1.966 3.605 14.173 1.00 0.00 H new ATOM 0 HG22 THR A 127 1.188 4.512 12.855 1.00 0.00 H new ATOM 0 HG23 THR A 127 0.204 3.506 13.944 1.00 0.00 H new ATOM 2004 N TYR A 128 1.008 3.532 9.482 1.00 0.00 N ATOM 2005 CA TYR A 128 1.083 4.670 8.579 1.00 0.00 C ATOM 2006 C TYR A 128 -0.247 4.880 7.864 1.00 0.00 C ATOM 2007 O TYR A 128 -0.680 6.013 7.661 1.00 0.00 O ATOM 2008 CB TYR A 128 2.204 4.464 7.556 1.00 0.00 C ATOM 2009 CG TYR A 128 3.467 5.231 7.882 1.00 0.00 C ATOM 2010 CD1 TYR A 128 3.595 6.572 7.542 1.00 0.00 C ATOM 2011 CD2 TYR A 128 4.528 4.614 8.532 1.00 0.00 C ATOM 2012 CE1 TYR A 128 4.746 7.276 7.840 1.00 0.00 C ATOM 2013 CE2 TYR A 128 5.682 5.311 8.834 1.00 0.00 C ATOM 2014 CZ TYR A 128 5.786 6.641 8.485 1.00 0.00 C ATOM 2015 OH TYR A 128 6.935 7.339 8.784 1.00 0.00 O ATOM 0 H TYR A 128 1.570 2.730 9.198 1.00 0.00 H new ATOM 0 HA TYR A 128 1.302 5.560 9.169 1.00 0.00 H new ATOM 0 HB2 TYR A 128 2.439 3.401 7.495 1.00 0.00 H new ATOM 0 HB3 TYR A 128 1.847 4.768 6.572 1.00 0.00 H new ATOM 0 HD1 TYR A 128 2.782 7.072 7.037 1.00 0.00 H new ATOM 0 HD2 TYR A 128 4.450 3.572 8.806 1.00 0.00 H new ATOM 0 HE1 TYR A 128 4.831 8.318 7.569 1.00 0.00 H new ATOM 0 HE2 TYR A 128 6.498 4.817 9.341 1.00 0.00 H new ATOM 0 HH TYR A 128 7.569 6.746 9.239 1.00 0.00 H new ATOM 2025 N ILE A 129 -0.890 3.779 7.485 1.00 0.00 N ATOM 2026 CA ILE A 129 -2.167 3.842 6.795 1.00 0.00 C ATOM 2027 C ILE A 129 -3.320 4.088 7.768 1.00 0.00 C ATOM 2028 O ILE A 129 -4.368 4.604 7.380 1.00 0.00 O ATOM 2029 CB ILE A 129 -2.442 2.548 6.009 1.00 0.00 C ATOM 2030 CG1 ILE A 129 -3.722 2.712 5.185 1.00 0.00 C ATOM 2031 CG2 ILE A 129 -2.543 1.358 6.956 1.00 0.00 C ATOM 2032 CD1 ILE A 129 -4.937 2.124 5.849 1.00 0.00 C ATOM 0 H ILE A 129 -0.544 2.833 7.646 1.00 0.00 H new ATOM 0 HA ILE A 129 -2.104 4.679 6.100 1.00 0.00 H new ATOM 0 HB ILE A 129 -1.613 2.356 5.328 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -3.894 3.773 5.002 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -3.583 2.239 4.213 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -2.738 0.452 6.382 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -1.606 1.247 7.502 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -3.357 1.523 7.662 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -5.809 2.275 5.212 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -4.784 1.057 6.008 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -5.100 2.614 6.809 1.00 0.00 H new ATOM 2044 N SER A 130 -3.127 3.709 9.029 1.00 0.00 N ATOM 2045 CA SER A 130 -4.158 3.888 10.042 1.00 0.00 C ATOM 2046 C SER A 130 -4.299 5.359 10.405 1.00 0.00 C ATOM 2047 O SER A 130 -5.408 5.877 10.536 1.00 0.00 O ATOM 2048 CB SER A 130 -3.825 3.063 11.287 1.00 0.00 C ATOM 2049 OG SER A 130 -4.538 3.532 12.419 1.00 0.00 O ATOM 0 H SER A 130 -2.268 3.278 9.371 1.00 0.00 H new ATOM 0 HA SER A 130 -5.108 3.541 9.635 1.00 0.00 H new ATOM 0 HB2 SER A 130 -4.069 2.016 11.108 1.00 0.00 H new ATOM 0 HB3 SER A 130 -2.754 3.112 11.483 1.00 0.00 H new ATOM 0 HG SER A 130 -4.308 2.986 13.200 1.00 0.00 H new ATOM 2055 N LYS A 131 -3.164 6.024 10.554 1.00 0.00 N ATOM 2056 CA LYS A 131 -3.143 7.439 10.888 1.00 0.00 C ATOM 2057 C LYS A 131 -3.317 8.286 9.632 1.00 0.00 C ATOM 2058 O LYS A 131 -3.739 9.441 9.702 1.00 0.00 O ATOM 2059 CB LYS A 131 -1.835 7.795 11.593 1.00 0.00 C ATOM 2060 CG LYS A 131 -1.770 7.292 13.025 1.00 0.00 C ATOM 2061 CD LYS A 131 -1.523 5.795 13.082 1.00 0.00 C ATOM 2062 CE LYS A 131 -1.714 5.252 14.490 1.00 0.00 C ATOM 2063 NZ LYS A 131 -0.715 5.809 15.443 1.00 0.00 N ATOM 0 H LYS A 131 -2.241 5.603 10.448 1.00 0.00 H new ATOM 0 HA LYS A 131 -3.973 7.650 11.563 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -1.001 7.377 11.030 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -1.711 8.878 11.589 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -0.975 7.813 13.558 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -2.704 7.527 13.536 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -2.204 5.287 12.399 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -0.510 5.579 12.742 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -2.719 5.491 14.838 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -1.633 4.165 14.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -0.870 5.400 16.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 0.244 5.574 15.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -0.820 6.842 15.492 1.00 0.00 H new ATOM 2077 N TYR A 132 -2.997 7.698 8.483 1.00 0.00 N ATOM 2078 CA TYR A 132 -3.127 8.386 7.208 1.00 0.00 C ATOM 2079 C TYR A 132 -4.592 8.692 6.901 1.00 0.00 C ATOM 2080 O TYR A 132 -4.894 9.499 6.023 1.00 0.00 O ATOM 2081 CB TYR A 132 -2.509 7.546 6.089 1.00 0.00 C ATOM 2082 CG TYR A 132 -1.145 8.038 5.654 1.00 0.00 C ATOM 2083 CD1 TYR A 132 -0.226 8.509 6.584 1.00 0.00 C ATOM 2084 CD2 TYR A 132 -0.779 8.035 4.314 1.00 0.00 C ATOM 2085 CE1 TYR A 132 1.019 8.963 6.191 1.00 0.00 C ATOM 2086 CE2 TYR A 132 0.465 8.486 3.913 1.00 0.00 C ATOM 2087 CZ TYR A 132 1.360 8.949 4.855 1.00 0.00 C ATOM 2088 OH TYR A 132 2.598 9.401 4.461 1.00 0.00 O ATOM 0 H TYR A 132 -2.645 6.743 8.412 1.00 0.00 H new ATOM 0 HA TYR A 132 -2.591 9.333 7.272 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -2.425 6.512 6.424 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -3.180 7.549 5.230 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -0.489 8.520 7.631 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -1.477 7.675 3.573 1.00 0.00 H new ATOM 0 HE1 TYR A 132 1.721 9.327 6.927 1.00 0.00 H new ATOM 0 HE2 TYR A 132 0.735 8.476 2.867 1.00 0.00 H new ATOM 0 HH TYR A 132 2.618 9.491 3.485 1.00 0.00 H new ATOM 2098 N GLN A 133 -5.499 8.052 7.638 1.00 0.00 N ATOM 2099 CA GLN A 133 -6.930 8.269 7.449 1.00 0.00 C ATOM 2100 C GLN A 133 -7.337 9.631 8.003 1.00 0.00 C ATOM 2101 O GLN A 133 -8.173 9.731 8.902 1.00 0.00 O ATOM 2102 CB GLN A 133 -7.730 7.157 8.132 1.00 0.00 C ATOM 2103 CG GLN A 133 -8.181 6.061 7.181 1.00 0.00 C ATOM 2104 CD GLN A 133 -9.688 6.005 7.024 1.00 0.00 C ATOM 2105 OE1 GLN A 133 -10.217 6.192 5.930 1.00 0.00 O ATOM 2106 NE2 GLN A 133 -10.387 5.748 8.124 1.00 0.00 N ATOM 0 H GLN A 133 -5.267 7.380 8.370 1.00 0.00 H new ATOM 0 HA GLN A 133 -7.147 8.249 6.381 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -7.121 6.715 8.921 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -8.606 7.593 8.612 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -7.724 6.222 6.205 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -7.822 5.099 7.546 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -9.906 5.599 9.011 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -11.405 5.699 8.082 1.00 0.00 H new ATOM 2115 N ASP A 134 -6.724 10.676 7.463 1.00 0.00 N ATOM 2116 CA ASP A 134 -6.994 12.042 7.895 1.00 0.00 C ATOM 2117 C ASP A 134 -6.207 13.025 7.028 1.00 0.00 C ATOM 2118 O ASP A 134 -5.413 12.608 6.185 1.00 0.00 O ATOM 2119 CB ASP A 134 -6.608 12.201 9.369 1.00 0.00 C ATOM 2120 CG ASP A 134 -7.820 12.288 10.278 1.00 0.00 C ATOM 2121 OD1 ASP A 134 -8.840 12.868 9.852 1.00 0.00 O ATOM 2122 OD2 ASP A 134 -7.746 11.776 11.414 1.00 0.00 O ATOM 0 H ASP A 134 -6.031 10.603 6.719 1.00 0.00 H new ATOM 0 HA ASP A 134 -8.057 12.254 7.785 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -5.989 11.357 9.673 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -6.002 13.099 9.488 1.00 0.00 H new ATOM 2127 N PRO A 135 -6.397 14.346 7.218 1.00 0.00 N ATOM 2128 CA PRO A 135 -5.676 15.357 6.439 1.00 0.00 C ATOM 2129 C PRO A 135 -4.172 15.119 6.463 1.00 0.00 C ATOM 2130 O PRO A 135 -3.451 15.521 5.550 1.00 0.00 O ATOM 2131 CB PRO A 135 -6.020 16.678 7.139 1.00 0.00 C ATOM 2132 CG PRO A 135 -6.605 16.278 8.447 1.00 0.00 C ATOM 2133 CD PRO A 135 -7.296 14.972 8.195 1.00 0.00 C ATOM 0 HA PRO A 135 -5.961 15.341 5.387 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -5.132 17.295 7.276 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -6.728 17.263 6.552 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -5.831 16.172 9.207 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -7.307 17.030 8.809 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -7.392 14.377 9.103 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -8.301 15.110 7.797 1.00 0.00 H new ATOM 2141 N SER A 136 -3.709 14.457 7.519 1.00 0.00 N ATOM 2142 CA SER A 136 -2.295 14.155 7.676 1.00 0.00 C ATOM 2143 C SER A 136 -2.055 13.331 8.933 1.00 0.00 C ATOM 2144 O SER A 136 -1.623 12.180 8.862 1.00 0.00 O ATOM 2145 CB SER A 136 -1.481 15.447 7.752 1.00 0.00 C ATOM 2146 OG SER A 136 -1.183 15.944 6.458 1.00 0.00 O ATOM 0 H SER A 136 -4.298 14.119 8.280 1.00 0.00 H new ATOM 0 HA SER A 136 -1.976 13.577 6.809 1.00 0.00 H new ATOM 0 HB2 SER A 136 -2.038 16.198 8.313 1.00 0.00 H new ATOM 0 HB3 SER A 136 -0.554 15.264 8.296 1.00 0.00 H new ATOM 0 HG SER A 136 -1.997 15.947 5.913 1.00 0.00 H new ATOM 2152 N GLN A 137 -2.323 13.940 10.087 1.00 0.00 N ATOM 2153 CA GLN A 137 -2.127 13.289 11.381 1.00 0.00 C ATOM 2154 C GLN A 137 -0.661 13.356 11.806 1.00 0.00 C ATOM 2155 O GLN A 137 -0.346 13.266 12.993 1.00 0.00 O ATOM 2156 CB GLN A 137 -2.600 11.833 11.346 1.00 0.00 C ATOM 2157 CG GLN A 137 -3.276 11.389 12.632 1.00 0.00 C ATOM 2158 CD GLN A 137 -4.313 10.306 12.406 1.00 0.00 C ATOM 2159 OE1 GLN A 137 -5.145 10.406 11.505 1.00 0.00 O ATOM 2160 NE2 GLN A 137 -4.269 9.265 13.228 1.00 0.00 N ATOM 0 H GLN A 137 -2.680 14.893 10.151 1.00 0.00 H new ATOM 0 HA GLN A 137 -2.728 13.826 12.114 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -3.294 11.704 10.516 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -1.745 11.185 11.151 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -2.520 11.023 13.327 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -3.752 12.249 13.103 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -3.561 9.224 13.961 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -4.943 8.506 13.126 1.00 0.00 H new ATOM 2169 N ALA A 138 0.232 13.522 10.833 1.00 0.00 N ATOM 2170 CA ALA A 138 1.658 13.609 11.104 1.00 0.00 C ATOM 2171 C ALA A 138 2.184 12.312 11.709 1.00 0.00 C ATOM 2172 O ALA A 138 3.127 12.323 12.501 1.00 0.00 O ATOM 2173 CB ALA A 138 1.951 14.782 12.027 1.00 0.00 C ATOM 0 H ALA A 138 -0.012 13.599 9.846 1.00 0.00 H new ATOM 0 HA ALA A 138 2.172 13.771 10.156 1.00 0.00 H new ATOM 0 HB1 ALA A 138 3.022 14.834 12.221 1.00 0.00 H new ATOM 0 HB2 ALA A 138 1.622 15.708 11.555 1.00 0.00 H new ATOM 0 HB3 ALA A 138 1.418 14.646 12.968 1.00 0.00 H new ATOM 2179 N ASP A 139 1.566 11.198 11.333 1.00 0.00 N ATOM 2180 CA ASP A 139 1.971 9.890 11.840 1.00 0.00 C ATOM 2181 C ASP A 139 1.891 9.848 13.363 1.00 0.00 C ATOM 2182 O ASP A 139 2.670 9.153 14.017 1.00 0.00 O ATOM 2183 CB ASP A 139 3.393 9.560 11.383 1.00 0.00 C ATOM 2184 CG ASP A 139 3.647 8.067 11.319 1.00 0.00 C ATOM 2185 OD1 ASP A 139 2.761 7.334 10.833 1.00 0.00 O ATOM 2186 OD2 ASP A 139 4.733 7.630 11.756 1.00 0.00 O ATOM 0 H ASP A 139 0.783 11.173 10.680 1.00 0.00 H new ATOM 0 HA ASP A 139 1.286 9.144 11.437 1.00 0.00 H new ATOM 0 HB2 ASP A 139 3.567 9.998 10.400 1.00 0.00 H new ATOM 0 HB3 ASP A 139 4.107 10.018 12.067 1.00 0.00 H new ATOM 2191 N ALA A 140 0.946 10.598 13.922 1.00 0.00 N ATOM 2192 CA ALA A 140 0.765 10.647 15.367 1.00 0.00 C ATOM 2193 C ALA A 140 0.218 9.327 15.898 1.00 0.00 C ATOM 2194 O ALA A 140 -0.887 8.930 15.470 1.00 0.00 O ATOM 2195 CB ALA A 140 -0.162 11.794 15.742 1.00 0.00 C ATOM 2196 OXT ALA A 140 0.897 8.700 16.737 1.00 0.00 O ATOM 0 H ALA A 140 0.294 11.180 13.395 1.00 0.00 H new ATOM 0 HA ALA A 140 1.739 10.815 15.825 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -0.289 11.820 16.824 1.00 0.00 H new ATOM 0 HB2 ALA A 140 0.270 12.736 15.405 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -1.132 11.649 15.266 1.00 0.00 H new TER 2202 ALA A 140