USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1056 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 105 HIS : no HE2:sc= 0.875 K(o=0.88,f=-4.6!) USER MOD Set 1.2: A 116 LYS NZ :NH3+ -122:sc= 0.00163 (180deg=0) USER MOD Set 2.1: A 25 GLN : amide:sc= -0.104 K(o=-0.97,f=-2.7) USER MOD Set 2.2: A 96 LYS NZ :NH3+ 157:sc= -0.862 (180deg=-1.38) USER MOD Set 3.1: A 17 ASN : amide:sc= -0.221 X(o=-0.99,f=-0.55) USER MOD Set 3.2: A 20 ASN : amide:sc= -0.77 K(o=-0.99,f=-1.8) USER MOD Set 4.1: A 13 MET CE :methyl -117:sc= 0 (180deg=-0.796) USER MOD Set 4.2: A 32 THR OG1 : rot 180:sc=-0.00229 USER MOD Single : A 10 TYR OH : rot -96:sc= -0.0961 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot -104:sc= 0.275 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 20:sc= -0.73 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 133:sc= -2.85! USER MOD Single : A 33 THR OG1 : rot 180:sc= -1.06 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -6.41! C(o=-6.4!,f=-11!) USER MOD Single : A 39 LYS NZ :NH3+ -144:sc= 1.12 (180deg=0.383) USER MOD Single : A 41 ASN : amide:sc= -8.28! C(o=-8.3!,f=-16!) USER MOD Single : A 47 SER OG : rot -134:sc= 1.12 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= -0.165 USER MOD Single : A 57 GLN : amide:sc= -1.51 K(o=-1.5,f=-12!) USER MOD Single : A 61 HIS : no HE2:sc= -1.12 K(o=-1.1,f=-1.6!) USER MOD Single : A 63 GLN : amide:sc= -1.38 X(o=-1.4,f=-1.8!) USER MOD Single : A 66 SER OG : rot -116:sc= 0.414 USER MOD Single : A 68 MET CE :methyl -176:sc= -0.318 (180deg=-0.375) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= -0.0549 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot 180:sc=0.000979 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 HIS : no HE2:sc= -4.15! C(o=-4.2!,f=-7.8!) USER MOD Single : A 109 ASN : amide:sc= -0.907 K(o=-0.91,f=-4!) USER MOD Single : A 112 ASN : amide:sc= -1.2 X(o=-1.2,f=-0.78) USER MOD Single : A 114 ASN : amide:sc= -4.49! C(o=-4.5!,f=-6!) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN :FLIP amide:sc= -1.1 F(o=-3.6,f=-1.1) USER MOD Single : A 120 SER OG : rot 180:sc= -0.0981 USER MOD Single : A 124 GLN : amide:sc= -1.8 K(o=-1.8,f=-6.4!) USER MOD Single : A 129 GLN : amide:sc= -0.0559 X(o=-0.056,f=0) USER MOD Single : A 133 GLN :FLIP amide:sc= -2.18 F(o=-2.7!,f=-2.2) USER MOD Single : A 136 GLN : amide:sc= -2.51! C(o=-2.5!,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 -14.096 -7.623 4.064 1.00 0.00 N ATOM 60 CA GLY A 7 -13.602 -7.179 2.774 1.00 0.00 C ATOM 61 C GLY A 7 -12.135 -6.800 2.814 1.00 0.00 C ATOM 62 O GLY A 7 -11.480 -6.932 3.848 1.00 0.00 O ATOM 0 HA2 GLY A 7 -13.750 -7.971 2.040 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.187 -6.322 2.440 1.00 0.00 H new ATOM 66 N VAL A 8 -11.616 -6.328 1.685 1.00 0.00 N ATOM 67 CA VAL A 8 -10.216 -5.929 1.595 1.00 0.00 C ATOM 68 C VAL A 8 -10.009 -4.523 2.146 1.00 0.00 C ATOM 69 O VAL A 8 -10.852 -3.644 1.966 1.00 0.00 O ATOM 70 CB VAL A 8 -9.711 -5.978 0.140 1.00 0.00 C ATOM 71 CG1 VAL A 8 -10.622 -5.167 -0.769 1.00 0.00 C ATOM 72 CG2 VAL A 8 -8.278 -5.476 0.057 1.00 0.00 C ATOM 0 H VAL A 8 -12.144 -6.212 0.820 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.645 -6.639 2.194 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.729 -7.014 -0.198 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.250 -5.213 -1.792 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -11.632 -5.576 -0.731 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -10.639 -4.129 -0.436 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -7.937 -5.517 -0.978 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.232 -4.447 0.413 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.636 -6.103 0.676 1.00 0.00 H new ATOM 82 N ARG A 9 -8.881 -4.318 2.818 1.00 0.00 N ATOM 83 CA ARG A 9 -8.563 -3.018 3.398 1.00 0.00 C ATOM 84 C ARG A 9 -7.520 -2.289 2.556 1.00 0.00 C ATOM 85 O ARG A 9 -7.039 -2.815 1.552 1.00 0.00 O ATOM 86 CB ARG A 9 -8.052 -3.185 4.830 1.00 0.00 C ATOM 87 CG ARG A 9 -9.049 -3.860 5.758 1.00 0.00 C ATOM 88 CD ARG A 9 -8.515 -3.950 7.178 1.00 0.00 C ATOM 89 NE ARG A 9 -8.751 -2.721 7.931 1.00 0.00 N ATOM 90 CZ ARG A 9 -8.580 -2.619 9.245 1.00 0.00 C ATOM 91 NH1 ARG A 9 -8.174 -3.668 9.947 1.00 0.00 N ATOM 92 NH2 ARG A 9 -8.816 -1.467 9.858 1.00 0.00 N ATOM 0 H ARG A 9 -8.172 -5.035 2.974 1.00 0.00 H new ATOM 0 HA ARG A 9 -9.475 -2.422 3.413 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -7.132 -3.769 4.813 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -7.800 -2.204 5.233 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -9.986 -3.303 5.755 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -9.272 -4.861 5.388 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -8.990 -4.786 7.691 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -7.445 -4.158 7.150 1.00 0.00 H new ATOM 0 HE ARG A 9 -9.064 -1.896 7.420 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -7.992 -4.556 9.479 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -8.043 -3.587 10.955 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -9.129 -0.658 9.321 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -8.685 -1.390 10.867 1.00 0.00 H new ATOM 106 N TYR A 10 -7.177 -1.074 2.971 1.00 0.00 N ATOM 107 CA TYR A 10 -6.194 -0.271 2.253 1.00 0.00 C ATOM 108 C TYR A 10 -5.181 0.338 3.217 1.00 0.00 C ATOM 109 O TYR A 10 -5.550 0.965 4.210 1.00 0.00 O ATOM 110 CB TYR A 10 -6.890 0.837 1.461 1.00 0.00 C ATOM 111 CG TYR A 10 -7.834 0.320 0.399 1.00 0.00 C ATOM 112 CD1 TYR A 10 -8.941 -0.448 0.739 1.00 0.00 C ATOM 113 CD2 TYR A 10 -7.620 0.600 -0.945 1.00 0.00 C ATOM 114 CE1 TYR A 10 -9.805 -0.923 -0.228 1.00 0.00 C ATOM 115 CE2 TYR A 10 -8.480 0.131 -1.919 1.00 0.00 C ATOM 116 CZ TYR A 10 -9.571 -0.631 -1.556 1.00 0.00 C ATOM 117 OH TYR A 10 -10.431 -1.101 -2.522 1.00 0.00 O ATOM 0 H TYR A 10 -7.565 -0.624 3.800 1.00 0.00 H new ATOM 0 HA TYR A 10 -5.663 -0.925 1.561 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -7.446 1.472 2.151 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -6.134 1.465 0.989 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -9.129 -0.677 1.777 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -6.766 1.195 -1.233 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -10.660 -1.520 0.054 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -8.299 0.360 -2.959 1.00 0.00 H new ATOM 0 HH TYR A 10 -10.073 -1.930 -2.904 1.00 0.00 H new ATOM 127 N PHE A 11 -3.900 0.149 2.916 1.00 0.00 N ATOM 128 CA PHE A 11 -2.831 0.679 3.755 1.00 0.00 C ATOM 129 C PHE A 11 -1.824 1.465 2.921 1.00 0.00 C ATOM 130 O PHE A 11 -1.505 1.085 1.794 1.00 0.00 O ATOM 131 CB PHE A 11 -2.122 -0.458 4.493 1.00 0.00 C ATOM 132 CG PHE A 11 -3.062 -1.384 5.212 1.00 0.00 C ATOM 133 CD1 PHE A 11 -3.658 -2.442 4.546 1.00 0.00 C ATOM 134 CD2 PHE A 11 -3.347 -1.196 6.555 1.00 0.00 C ATOM 135 CE1 PHE A 11 -4.524 -3.294 5.205 1.00 0.00 C ATOM 136 CE2 PHE A 11 -4.211 -2.046 7.220 1.00 0.00 C ATOM 137 CZ PHE A 11 -4.800 -3.097 6.544 1.00 0.00 C ATOM 0 H PHE A 11 -3.577 -0.367 2.098 1.00 0.00 H new ATOM 0 HA PHE A 11 -3.277 1.354 4.485 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -1.534 -1.033 3.778 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -1.422 -0.033 5.213 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -3.444 -2.603 3.500 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -2.889 -0.376 7.088 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -4.985 -4.113 4.673 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -4.425 -1.889 8.267 1.00 0.00 H new ATOM 0 HZ PHE A 11 -5.475 -3.763 7.061 1.00 0.00 H new ATOM 147 N ILE A 12 -1.329 2.563 3.482 1.00 0.00 N ATOM 148 CA ILE A 12 -0.358 3.402 2.791 1.00 0.00 C ATOM 149 C ILE A 12 1.061 3.109 3.268 1.00 0.00 C ATOM 150 O ILE A 12 1.384 3.302 4.440 1.00 0.00 O ATOM 151 CB ILE A 12 -0.659 4.898 2.998 1.00 0.00 C ATOM 152 CG1 ILE A 12 -1.948 5.286 2.271 1.00 0.00 C ATOM 153 CG2 ILE A 12 0.507 5.745 2.509 1.00 0.00 C ATOM 154 CD1 ILE A 12 -1.811 5.307 0.765 1.00 0.00 C ATOM 0 H ILE A 12 -1.584 2.892 4.413 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.437 3.167 1.730 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.795 5.083 4.064 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -2.736 4.584 2.546 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.265 6.271 2.612 1.00 0.00 H new ATOM 0 HG21 ILE A 12 0.280 6.800 2.662 1.00 0.00 H new ATOM 0 HG22 ILE A 12 1.406 5.483 3.067 1.00 0.00 H new ATOM 0 HG23 ILE A 12 0.672 5.559 1.448 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.763 5.590 0.317 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.046 6.029 0.479 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.524 4.316 0.412 1.00 0.00 H new ATOM 166 N MET A 13 1.904 2.645 2.352 1.00 0.00 N ATOM 167 CA MET A 13 3.289 2.329 2.680 1.00 0.00 C ATOM 168 C MET A 13 4.246 3.291 1.982 1.00 0.00 C ATOM 169 O MET A 13 4.325 3.322 0.753 1.00 0.00 O ATOM 170 CB MET A 13 3.614 0.888 2.280 1.00 0.00 C ATOM 171 CG MET A 13 2.491 -0.093 2.576 1.00 0.00 C ATOM 172 SD MET A 13 1.623 0.288 4.110 1.00 0.00 S ATOM 173 CE MET A 13 2.727 -0.444 5.315 1.00 0.00 C ATOM 0 H MET A 13 1.653 2.480 1.377 1.00 0.00 H new ATOM 0 HA MET A 13 3.415 2.437 3.757 1.00 0.00 H new ATOM 0 HB2 MET A 13 3.840 0.858 1.214 1.00 0.00 H new ATOM 0 HB3 MET A 13 4.513 0.568 2.806 1.00 0.00 H new ATOM 0 HG2 MET A 13 1.780 -0.086 1.750 1.00 0.00 H new ATOM 0 HG3 MET A 13 2.901 -1.101 2.636 1.00 0.00 H new ATOM 0 HE1 MET A 13 2.210 -1.247 5.841 1.00 0.00 H new ATOM 0 HE2 MET A 13 3.603 -0.848 4.808 1.00 0.00 H new ATOM 0 HE3 MET A 13 3.040 0.316 6.030 1.00 0.00 H new ATOM 183 N LYS A 14 4.971 4.075 2.772 1.00 0.00 N ATOM 184 CA LYS A 14 5.923 5.037 2.231 1.00 0.00 C ATOM 185 C LYS A 14 7.313 4.420 2.114 1.00 0.00 C ATOM 186 O LYS A 14 7.693 3.566 2.914 1.00 0.00 O ATOM 187 CB LYS A 14 5.980 6.283 3.118 1.00 0.00 C ATOM 188 CG LYS A 14 4.642 6.650 3.738 1.00 0.00 C ATOM 189 CD LYS A 14 3.734 7.341 2.735 1.00 0.00 C ATOM 190 CE LYS A 14 4.354 8.631 2.219 1.00 0.00 C ATOM 191 NZ LYS A 14 3.343 9.510 1.568 1.00 0.00 N ATOM 0 H LYS A 14 4.917 4.063 3.791 1.00 0.00 H new ATOM 0 HA LYS A 14 5.586 5.323 1.234 1.00 0.00 H new ATOM 0 HB2 LYS A 14 6.707 6.120 3.914 1.00 0.00 H new ATOM 0 HB3 LYS A 14 6.340 7.124 2.526 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.154 5.750 4.112 1.00 0.00 H new ATOM 0 HG3 LYS A 14 4.804 7.304 4.595 1.00 0.00 H new ATOM 0 HD2 LYS A 14 3.537 6.671 1.898 1.00 0.00 H new ATOM 0 HD3 LYS A 14 2.773 7.559 3.202 1.00 0.00 H new ATOM 0 HE2 LYS A 14 4.821 9.166 3.046 1.00 0.00 H new ATOM 0 HE3 LYS A 14 5.143 8.395 1.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.804 10.379 1.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.915 9.010 0.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.603 9.757 2.256 1.00 0.00 H new ATOM 205 N SER A 15 8.068 4.859 1.112 1.00 0.00 N ATOM 206 CA SER A 15 9.415 4.348 0.889 1.00 0.00 C ATOM 207 C SER A 15 10.422 5.491 0.798 1.00 0.00 C ATOM 208 O SER A 15 10.189 6.485 0.111 1.00 0.00 O ATOM 209 CB SER A 15 9.461 3.511 -0.391 1.00 0.00 C ATOM 210 OG SER A 15 8.315 2.685 -0.501 1.00 0.00 O ATOM 0 H SER A 15 7.769 5.568 0.442 1.00 0.00 H new ATOM 0 HA SER A 15 9.682 3.718 1.737 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.523 4.169 -1.258 1.00 0.00 H new ATOM 0 HB3 SER A 15 10.360 2.894 -0.394 1.00 0.00 H new ATOM 0 HG SER A 15 8.554 1.762 -0.274 1.00 0.00 H new ATOM 216 N SER A 16 11.542 5.341 1.497 1.00 0.00 N ATOM 217 CA SER A 16 12.584 6.362 1.500 1.00 0.00 C ATOM 218 C SER A 16 13.038 6.678 0.078 1.00 0.00 C ATOM 219 O SER A 16 13.053 7.836 -0.337 1.00 0.00 O ATOM 220 CB SER A 16 13.778 5.900 2.338 1.00 0.00 C ATOM 221 OG SER A 16 13.514 6.043 3.723 1.00 0.00 O ATOM 0 H SER A 16 11.752 4.523 2.069 1.00 0.00 H new ATOM 0 HA SER A 16 12.169 7.269 1.941 1.00 0.00 H new ATOM 0 HB2 SER A 16 14.003 4.857 2.113 1.00 0.00 H new ATOM 0 HB3 SER A 16 14.661 6.481 2.071 1.00 0.00 H new ATOM 0 HG SER A 16 14.291 5.740 4.237 1.00 0.00 H new ATOM 227 N ASN A 17 13.408 5.639 -0.663 1.00 0.00 N ATOM 228 CA ASN A 17 13.864 5.805 -2.038 1.00 0.00 C ATOM 229 C ASN A 17 13.040 4.945 -2.992 1.00 0.00 C ATOM 230 O ASN A 17 12.131 4.228 -2.571 1.00 0.00 O ATOM 231 CB ASN A 17 15.345 5.439 -2.155 1.00 0.00 C ATOM 232 CG ASN A 17 16.172 6.007 -1.017 1.00 0.00 C ATOM 233 OD1 ASN A 17 16.229 7.221 -0.823 1.00 0.00 O ATOM 234 ND2 ASN A 17 16.818 5.128 -0.260 1.00 0.00 N ATOM 0 H ASN A 17 13.401 4.673 -0.335 1.00 0.00 H new ATOM 0 HA ASN A 17 13.732 6.851 -2.314 1.00 0.00 H new ATOM 0 HB2 ASN A 17 15.448 4.354 -2.170 1.00 0.00 H new ATOM 0 HB3 ASN A 17 15.734 5.809 -3.104 1.00 0.00 H new ATOM 0 HD21 ASN A 17 17.391 5.450 0.520 1.00 0.00 H new ATOM 0 HD22 ASN A 17 16.741 4.130 -0.458 1.00 0.00 H new ATOM 241 N LEU A 18 13.363 5.021 -4.278 1.00 0.00 N ATOM 242 CA LEU A 18 12.654 4.249 -5.292 1.00 0.00 C ATOM 243 C LEU A 18 13.258 2.856 -5.439 1.00 0.00 C ATOM 244 O LEU A 18 12.540 1.858 -5.477 1.00 0.00 O ATOM 245 CB LEU A 18 12.693 4.978 -6.636 1.00 0.00 C ATOM 246 CG LEU A 18 11.670 4.523 -7.678 1.00 0.00 C ATOM 247 CD1 LEU A 18 11.264 3.078 -7.430 1.00 0.00 C ATOM 248 CD2 LEU A 18 10.450 5.432 -7.661 1.00 0.00 C ATOM 0 H LEU A 18 14.112 5.610 -4.643 1.00 0.00 H new ATOM 0 HA LEU A 18 11.617 4.143 -4.972 1.00 0.00 H new ATOM 0 HB2 LEU A 18 12.546 6.043 -6.453 1.00 0.00 H new ATOM 0 HB3 LEU A 18 13.690 4.862 -7.061 1.00 0.00 H new ATOM 0 HG LEU A 18 12.131 4.586 -8.664 1.00 0.00 H new ATOM 0 HD11 LEU A 18 10.536 2.771 -8.181 1.00 0.00 H new ATOM 0 HD12 LEU A 18 12.143 2.437 -7.494 1.00 0.00 H new ATOM 0 HD13 LEU A 18 10.822 2.990 -6.438 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.733 5.093 -8.409 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.987 5.401 -6.675 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.754 6.454 -7.887 1.00 0.00 H new ATOM 260 N ARG A 19 14.584 2.798 -5.519 1.00 0.00 N ATOM 261 CA ARG A 19 15.285 1.528 -5.660 1.00 0.00 C ATOM 262 C ARG A 19 14.685 0.470 -4.739 1.00 0.00 C ATOM 263 O ARG A 19 14.351 -0.631 -5.176 1.00 0.00 O ATOM 264 CB ARG A 19 16.773 1.705 -5.349 1.00 0.00 C ATOM 265 CG ARG A 19 17.505 0.395 -5.108 1.00 0.00 C ATOM 266 CD ARG A 19 17.505 -0.481 -6.352 1.00 0.00 C ATOM 267 NE ARG A 19 18.678 -1.348 -6.410 1.00 0.00 N ATOM 268 CZ ARG A 19 19.904 -0.909 -6.673 1.00 0.00 C ATOM 269 NH1 ARG A 19 20.116 0.380 -6.900 1.00 0.00 N ATOM 270 NH2 ARG A 19 20.922 -1.760 -6.709 1.00 0.00 N ATOM 0 H ARG A 19 15.193 3.615 -5.489 1.00 0.00 H new ATOM 0 HA ARG A 19 15.173 1.193 -6.691 1.00 0.00 H new ATOM 0 HB2 ARG A 19 17.249 2.230 -6.177 1.00 0.00 H new ATOM 0 HB3 ARG A 19 16.879 2.338 -4.468 1.00 0.00 H new ATOM 0 HG2 ARG A 19 18.532 0.601 -4.807 1.00 0.00 H new ATOM 0 HG3 ARG A 19 17.033 -0.141 -4.285 1.00 0.00 H new ATOM 0 HD2 ARG A 19 16.602 -1.091 -6.366 1.00 0.00 H new ATOM 0 HD3 ARG A 19 17.476 0.150 -7.240 1.00 0.00 H new ATOM 0 HE ARG A 19 18.549 -2.345 -6.239 1.00 0.00 H new ATOM 0 HH11 ARG A 19 19.337 1.038 -6.873 1.00 0.00 H new ATOM 0 HH12 ARG A 19 21.058 0.714 -7.102 1.00 0.00 H new ATOM 0 HH21 ARG A 19 20.764 -2.752 -6.535 1.00 0.00 H new ATOM 0 HH22 ARG A 19 21.863 -1.422 -6.911 1.00 0.00 H new ATOM 284 N ASN A 20 14.551 0.811 -3.462 1.00 0.00 N ATOM 285 CA ASN A 20 13.992 -0.109 -2.478 1.00 0.00 C ATOM 286 C ASN A 20 12.680 -0.707 -2.978 1.00 0.00 C ATOM 287 O ASN A 20 12.361 -1.861 -2.687 1.00 0.00 O ATOM 288 CB ASN A 20 13.764 0.610 -1.147 1.00 0.00 C ATOM 289 CG ASN A 20 14.878 1.584 -0.818 1.00 0.00 C ATOM 290 OD1 ASN A 20 16.007 1.435 -1.287 1.00 0.00 O ATOM 291 ND2 ASN A 20 14.566 2.589 -0.008 1.00 0.00 N ATOM 0 H ASN A 20 14.822 1.719 -3.084 1.00 0.00 H new ATOM 0 HA ASN A 20 14.706 -0.918 -2.327 1.00 0.00 H new ATOM 0 HB2 ASN A 20 12.816 1.146 -1.185 1.00 0.00 H new ATOM 0 HB3 ASN A 20 13.682 -0.127 -0.348 1.00 0.00 H new ATOM 0 HD21 ASN A 20 15.275 3.276 0.249 1.00 0.00 H new ATOM 0 HD22 ASN A 20 13.618 2.674 0.358 1.00 0.00 H new ATOM 298 N LEU A 21 11.924 0.084 -3.730 1.00 0.00 N ATOM 299 CA LEU A 21 10.647 -0.366 -4.271 1.00 0.00 C ATOM 300 C LEU A 21 10.856 -1.386 -5.386 1.00 0.00 C ATOM 301 O LEU A 21 10.075 -2.324 -5.537 1.00 0.00 O ATOM 302 CB LEU A 21 9.845 0.825 -4.798 1.00 0.00 C ATOM 303 CG LEU A 21 8.358 0.574 -5.053 1.00 0.00 C ATOM 304 CD1 LEU A 21 7.597 0.494 -3.739 1.00 0.00 C ATOM 305 CD2 LEU A 21 7.778 1.664 -5.942 1.00 0.00 C ATOM 0 H LEU A 21 12.173 1.041 -3.979 1.00 0.00 H new ATOM 0 HA LEU A 21 10.089 -0.844 -3.466 1.00 0.00 H new ATOM 0 HB2 LEU A 21 9.937 1.644 -4.084 1.00 0.00 H new ATOM 0 HB3 LEU A 21 10.301 1.161 -5.729 1.00 0.00 H new ATOM 0 HG LEU A 21 8.254 -0.381 -5.568 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.541 0.315 -3.941 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.995 -0.323 -3.137 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.709 1.433 -3.196 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.719 1.469 -6.113 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.895 2.632 -5.454 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.304 1.673 -6.897 1.00 0.00 H new ATOM 317 N GLU A 22 11.918 -1.195 -6.163 1.00 0.00 N ATOM 318 CA GLU A 22 12.231 -2.100 -7.263 1.00 0.00 C ATOM 319 C GLU A 22 12.320 -3.542 -6.773 1.00 0.00 C ATOM 320 O GLU A 22 11.939 -4.474 -7.483 1.00 0.00 O ATOM 321 CB GLU A 22 13.548 -1.693 -7.928 1.00 0.00 C ATOM 322 CG GLU A 22 13.480 -0.356 -8.646 1.00 0.00 C ATOM 323 CD GLU A 22 12.320 -0.273 -9.618 1.00 0.00 C ATOM 324 OE1 GLU A 22 12.463 -0.770 -10.755 1.00 0.00 O ATOM 325 OE2 GLU A 22 11.270 0.288 -9.243 1.00 0.00 O ATOM 0 H GLU A 22 12.575 -0.423 -6.051 1.00 0.00 H new ATOM 0 HA GLU A 22 11.426 -2.033 -7.995 1.00 0.00 H new ATOM 0 HB2 GLU A 22 14.330 -1.649 -7.170 1.00 0.00 H new ATOM 0 HB3 GLU A 22 13.839 -2.464 -8.641 1.00 0.00 H new ATOM 0 HG2 GLU A 22 13.390 0.443 -7.910 1.00 0.00 H new ATOM 0 HG3 GLU A 22 14.413 -0.190 -9.185 1.00 0.00 H new ATOM 332 N ILE A 23 12.825 -3.718 -5.557 1.00 0.00 N ATOM 333 CA ILE A 23 12.964 -5.045 -4.972 1.00 0.00 C ATOM 334 C ILE A 23 11.618 -5.760 -4.907 1.00 0.00 C ATOM 335 O ILE A 23 11.551 -6.987 -4.984 1.00 0.00 O ATOM 336 CB ILE A 23 13.566 -4.977 -3.556 1.00 0.00 C ATOM 337 CG1 ILE A 23 15.031 -4.543 -3.622 1.00 0.00 C ATOM 338 CG2 ILE A 23 13.437 -6.324 -2.861 1.00 0.00 C ATOM 339 CD1 ILE A 23 15.215 -3.094 -4.016 1.00 0.00 C ATOM 0 H ILE A 23 13.145 -2.957 -4.957 1.00 0.00 H new ATOM 0 HA ILE A 23 13.640 -5.605 -5.618 1.00 0.00 H new ATOM 0 HB ILE A 23 13.014 -4.237 -2.977 1.00 0.00 H new ATOM 0 HG12 ILE A 23 15.495 -4.708 -2.649 1.00 0.00 H new ATOM 0 HG13 ILE A 23 15.557 -5.175 -4.337 1.00 0.00 H new ATOM 0 HG21 ILE A 23 13.867 -6.260 -1.861 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.384 -6.596 -2.787 1.00 0.00 H new ATOM 0 HG23 ILE A 23 13.968 -7.083 -3.436 1.00 0.00 H new ATOM 0 HD11 ILE A 23 16.278 -2.856 -4.042 1.00 0.00 H new ATOM 0 HD12 ILE A 23 14.781 -2.927 -5.002 1.00 0.00 H new ATOM 0 HD13 ILE A 23 14.718 -2.453 -3.288 1.00 0.00 H new ATOM 351 N SER A 24 10.548 -4.984 -4.766 1.00 0.00 N ATOM 352 CA SER A 24 9.204 -5.543 -4.688 1.00 0.00 C ATOM 353 C SER A 24 8.644 -5.808 -6.082 1.00 0.00 C ATOM 354 O SER A 24 7.722 -6.606 -6.251 1.00 0.00 O ATOM 355 CB SER A 24 8.277 -4.593 -3.927 1.00 0.00 C ATOM 356 OG SER A 24 7.124 -5.271 -3.460 1.00 0.00 O ATOM 0 H SER A 24 10.586 -3.967 -4.703 1.00 0.00 H new ATOM 0 HA SER A 24 9.262 -6.490 -4.152 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.812 -4.156 -3.084 1.00 0.00 H new ATOM 0 HB3 SER A 24 7.980 -3.770 -4.578 1.00 0.00 H new ATOM 0 HG SER A 24 7.298 -6.235 -3.436 1.00 0.00 H new ATOM 362 N GLN A 25 9.209 -5.133 -7.078 1.00 0.00 N ATOM 363 CA GLN A 25 8.767 -5.295 -8.458 1.00 0.00 C ATOM 364 C GLN A 25 9.468 -6.477 -9.120 1.00 0.00 C ATOM 365 O GLN A 25 8.918 -7.111 -10.019 1.00 0.00 O ATOM 366 CB GLN A 25 9.034 -4.017 -9.255 1.00 0.00 C ATOM 367 CG GLN A 25 8.173 -2.840 -8.825 1.00 0.00 C ATOM 368 CD GLN A 25 8.457 -1.585 -9.627 1.00 0.00 C ATOM 369 OE1 GLN A 25 9.469 -1.495 -10.322 1.00 0.00 O ATOM 370 NE2 GLN A 25 7.563 -0.608 -9.534 1.00 0.00 N ATOM 0 H GLN A 25 9.973 -4.469 -6.955 1.00 0.00 H new ATOM 0 HA GLN A 25 7.695 -5.491 -8.448 1.00 0.00 H new ATOM 0 HB2 GLN A 25 10.084 -3.746 -9.149 1.00 0.00 H new ATOM 0 HB3 GLN A 25 8.861 -4.216 -10.313 1.00 0.00 H new ATOM 0 HG2 GLN A 25 7.121 -3.105 -8.933 1.00 0.00 H new ATOM 0 HG3 GLN A 25 8.343 -2.637 -7.768 1.00 0.00 H new ATOM 0 HE21 GLN A 25 6.738 -0.726 -8.946 1.00 0.00 H new ATOM 0 HE22 GLN A 25 7.701 0.260 -10.051 1.00 0.00 H new ATOM 379 N GLN A 26 10.684 -6.766 -8.667 1.00 0.00 N ATOM 380 CA GLN A 26 11.459 -7.872 -9.217 1.00 0.00 C ATOM 381 C GLN A 26 11.315 -9.120 -8.353 1.00 0.00 C ATOM 382 O GLN A 26 10.910 -10.178 -8.835 1.00 0.00 O ATOM 383 CB GLN A 26 12.934 -7.481 -9.328 1.00 0.00 C ATOM 384 CG GLN A 26 13.161 -6.150 -10.025 1.00 0.00 C ATOM 385 CD GLN A 26 13.188 -6.279 -11.535 1.00 0.00 C ATOM 386 OE1 GLN A 26 14.212 -6.631 -12.122 1.00 0.00 O ATOM 387 NE2 GLN A 26 12.059 -5.994 -12.174 1.00 0.00 N ATOM 0 H GLN A 26 11.153 -6.251 -7.922 1.00 0.00 H new ATOM 0 HA GLN A 26 11.073 -8.095 -10.212 1.00 0.00 H new ATOM 0 HB2 GLN A 26 13.365 -7.436 -8.328 1.00 0.00 H new ATOM 0 HB3 GLN A 26 13.468 -8.261 -9.870 1.00 0.00 H new ATOM 0 HG2 GLN A 26 12.372 -5.455 -9.738 1.00 0.00 H new ATOM 0 HG3 GLN A 26 14.103 -5.722 -9.684 1.00 0.00 H new ATOM 0 HE21 GLN A 26 11.234 -5.706 -11.648 1.00 0.00 H new ATOM 0 HE22 GLN A 26 12.017 -6.063 -13.191 1.00 0.00 H new ATOM 396 N LYS A 27 11.649 -8.990 -7.074 1.00 0.00 N ATOM 397 CA LYS A 27 11.556 -10.107 -6.141 1.00 0.00 C ATOM 398 C LYS A 27 10.099 -10.447 -5.842 1.00 0.00 C ATOM 399 O LYS A 27 9.762 -11.600 -5.580 1.00 0.00 O ATOM 400 CB LYS A 27 12.291 -9.775 -4.841 1.00 0.00 C ATOM 401 CG LYS A 27 13.626 -9.084 -5.056 1.00 0.00 C ATOM 402 CD LYS A 27 14.428 -9.752 -6.160 1.00 0.00 C ATOM 403 CE LYS A 27 15.793 -9.102 -6.330 1.00 0.00 C ATOM 404 NZ LYS A 27 16.793 -10.051 -6.892 1.00 0.00 N ATOM 0 H LYS A 27 11.987 -8.122 -6.659 1.00 0.00 H new ATOM 0 HA LYS A 27 12.025 -10.975 -6.605 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.656 -9.136 -4.227 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.454 -10.696 -4.280 1.00 0.00 H new ATOM 0 HG2 LYS A 27 13.458 -8.037 -5.309 1.00 0.00 H new ATOM 0 HG3 LYS A 27 14.198 -9.100 -4.129 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.554 -10.810 -5.930 1.00 0.00 H new ATOM 0 HD3 LYS A 27 13.876 -9.693 -7.098 1.00 0.00 H new ATOM 0 HE2 LYS A 27 15.704 -8.237 -6.987 1.00 0.00 H new ATOM 0 HE3 LYS A 27 16.143 -8.735 -5.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 17.710 -9.570 -6.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 16.897 -10.865 -6.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 16.472 -10.382 -7.824 1.00 0.00 H new ATOM 418 N GLY A 28 9.239 -9.433 -5.884 1.00 0.00 N ATOM 419 CA GLY A 28 7.829 -9.646 -5.617 1.00 0.00 C ATOM 420 C GLY A 28 7.515 -9.656 -4.134 1.00 0.00 C ATOM 421 O GLY A 28 6.482 -10.180 -3.715 1.00 0.00 O ATOM 0 H GLY A 28 9.494 -8.469 -6.098 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.248 -8.862 -6.103 1.00 0.00 H new ATOM 0 HA3 GLY A 28 7.518 -10.593 -6.058 1.00 0.00 H new ATOM 425 N ILE A 29 8.409 -9.080 -3.338 1.00 0.00 N ATOM 426 CA ILE A 29 8.222 -9.026 -1.893 1.00 0.00 C ATOM 427 C ILE A 29 8.495 -7.625 -1.355 1.00 0.00 C ATOM 428 O ILE A 29 9.199 -6.835 -1.984 1.00 0.00 O ATOM 429 CB ILE A 29 9.138 -10.029 -1.169 1.00 0.00 C ATOM 430 CG1 ILE A 29 10.528 -10.038 -1.809 1.00 0.00 C ATOM 431 CG2 ILE A 29 8.526 -11.422 -1.199 1.00 0.00 C ATOM 432 CD1 ILE A 29 11.360 -8.823 -1.464 1.00 0.00 C ATOM 0 H ILE A 29 9.270 -8.644 -3.669 1.00 0.00 H new ATOM 0 HA ILE A 29 7.182 -9.291 -1.699 1.00 0.00 H new ATOM 0 HB ILE A 29 9.240 -9.720 -0.129 1.00 0.00 H new ATOM 0 HG12 ILE A 29 11.060 -10.935 -1.491 1.00 0.00 H new ATOM 0 HG13 ILE A 29 10.420 -10.099 -2.892 1.00 0.00 H new ATOM 0 HG21 ILE A 29 9.185 -12.120 -0.683 1.00 0.00 H new ATOM 0 HG22 ILE A 29 7.556 -11.404 -0.702 1.00 0.00 H new ATOM 0 HG23 ILE A 29 8.398 -11.741 -2.233 1.00 0.00 H new ATOM 0 HD11 ILE A 29 12.332 -8.897 -1.952 1.00 0.00 H new ATOM 0 HD12 ILE A 29 10.849 -7.923 -1.807 1.00 0.00 H new ATOM 0 HD13 ILE A 29 11.499 -8.772 -0.384 1.00 0.00 H new ATOM 444 N TRP A 30 7.935 -7.326 -0.189 1.00 0.00 N ATOM 445 CA TRP A 30 8.120 -6.021 0.435 1.00 0.00 C ATOM 446 C TRP A 30 8.531 -6.169 1.896 1.00 0.00 C ATOM 447 O TRP A 30 8.153 -7.133 2.562 1.00 0.00 O ATOM 448 CB TRP A 30 6.835 -5.198 0.335 1.00 0.00 C ATOM 449 CG TRP A 30 6.959 -3.827 0.928 1.00 0.00 C ATOM 450 CD1 TRP A 30 6.197 -3.295 1.929 1.00 0.00 C ATOM 451 CD2 TRP A 30 7.900 -2.815 0.556 1.00 0.00 C ATOM 452 NE1 TRP A 30 6.608 -2.013 2.201 1.00 0.00 N ATOM 453 CE2 TRP A 30 7.652 -1.695 1.373 1.00 0.00 C ATOM 454 CE3 TRP A 30 8.929 -2.746 -0.386 1.00 0.00 C ATOM 455 CZ2 TRP A 30 8.395 -0.521 1.274 1.00 0.00 C ATOM 456 CZ3 TRP A 30 9.666 -1.581 -0.484 1.00 0.00 C ATOM 457 CH2 TRP A 30 9.397 -0.482 0.343 1.00 0.00 C ATOM 0 H TRP A 30 7.349 -7.969 0.344 1.00 0.00 H new ATOM 0 HA TRP A 30 8.918 -5.502 -0.096 1.00 0.00 H new ATOM 0 HB2 TRP A 30 6.551 -5.108 -0.713 1.00 0.00 H new ATOM 0 HB3 TRP A 30 6.030 -5.732 0.839 1.00 0.00 H new ATOM 0 HD1 TRP A 30 5.390 -3.807 2.432 1.00 0.00 H new ATOM 0 HE1 TRP A 30 6.202 -1.397 2.905 1.00 0.00 H new ATOM 0 HE3 TRP A 30 9.145 -3.588 -1.027 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 8.188 0.328 1.909 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 10.463 -1.516 -1.210 1.00 0.00 H new ATOM 0 HH2 TRP A 30 9.992 0.414 0.243 1.00 0.00 H new ATOM 468 N SER A 31 9.306 -5.209 2.389 1.00 0.00 N ATOM 469 CA SER A 31 9.771 -5.235 3.771 1.00 0.00 C ATOM 470 C SER A 31 9.417 -3.936 4.488 1.00 0.00 C ATOM 471 O SER A 31 9.937 -2.869 4.159 1.00 0.00 O ATOM 472 CB SER A 31 11.283 -5.461 3.818 1.00 0.00 C ATOM 473 OG SER A 31 11.591 -6.843 3.876 1.00 0.00 O ATOM 0 H SER A 31 9.626 -4.403 1.852 1.00 0.00 H new ATOM 0 HA SER A 31 9.272 -6.059 4.281 1.00 0.00 H new ATOM 0 HB2 SER A 31 11.747 -5.018 2.937 1.00 0.00 H new ATOM 0 HB3 SER A 31 11.703 -4.955 4.688 1.00 0.00 H new ATOM 0 HG SER A 31 12.294 -7.049 3.225 1.00 0.00 H new ATOM 479 N THR A 32 8.527 -4.033 5.471 1.00 0.00 N ATOM 480 CA THR A 32 8.101 -2.867 6.234 1.00 0.00 C ATOM 481 C THR A 32 8.399 -3.043 7.719 1.00 0.00 C ATOM 482 O THR A 32 8.780 -4.127 8.162 1.00 0.00 O ATOM 483 CB THR A 32 6.596 -2.596 6.053 1.00 0.00 C ATOM 484 OG1 THR A 32 6.297 -1.239 6.401 1.00 0.00 O ATOM 485 CG2 THR A 32 5.769 -3.539 6.914 1.00 0.00 C ATOM 0 H THR A 32 8.087 -4.908 5.757 1.00 0.00 H new ATOM 0 HA THR A 32 8.664 -2.016 5.851 1.00 0.00 H new ATOM 0 HB THR A 32 6.342 -2.767 5.007 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.338 -1.074 6.282 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.709 -3.329 6.769 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.977 -4.570 6.627 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.028 -3.395 7.963 1.00 0.00 H new ATOM 493 N THR A 33 8.224 -1.971 8.485 1.00 0.00 N ATOM 494 CA THR A 33 8.474 -2.007 9.920 1.00 0.00 C ATOM 495 C THR A 33 7.614 -3.065 10.602 1.00 0.00 C ATOM 496 O THR A 33 6.446 -3.262 10.264 1.00 0.00 O ATOM 497 CB THR A 33 8.200 -0.639 10.573 1.00 0.00 C ATOM 498 OG1 THR A 33 8.868 -0.557 11.837 1.00 0.00 O ATOM 499 CG2 THR A 33 6.707 -0.422 10.767 1.00 0.00 C ATOM 0 H THR A 33 7.910 -1.066 8.135 1.00 0.00 H new ATOM 0 HA THR A 33 9.526 -2.259 10.051 1.00 0.00 H new ATOM 0 HB THR A 33 8.581 0.138 9.911 1.00 0.00 H new ATOM 0 HG1 THR A 33 8.690 0.316 12.245 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.538 0.550 11.230 1.00 0.00 H new ATOM 0 HG22 THR A 33 6.206 -0.456 9.800 1.00 0.00 H new ATOM 0 HG23 THR A 33 6.306 -1.205 11.411 1.00 0.00 H new ATOM 507 N PRO A 34 8.200 -3.761 11.587 1.00 0.00 N ATOM 508 CA PRO A 34 7.504 -4.810 12.338 1.00 0.00 C ATOM 509 C PRO A 34 6.419 -4.247 13.249 1.00 0.00 C ATOM 510 O PRO A 34 5.766 -4.988 13.983 1.00 0.00 O ATOM 511 CB PRO A 34 8.619 -5.453 13.167 1.00 0.00 C ATOM 512 CG PRO A 34 9.647 -4.384 13.311 1.00 0.00 C ATOM 513 CD PRO A 34 9.588 -3.579 12.043 1.00 0.00 C ATOM 0 HA PRO A 34 6.988 -5.509 11.680 1.00 0.00 H new ATOM 0 HB2 PRO A 34 8.251 -5.782 14.139 1.00 0.00 H new ATOM 0 HB3 PRO A 34 9.028 -6.331 12.667 1.00 0.00 H new ATOM 0 HG2 PRO A 34 9.441 -3.759 14.180 1.00 0.00 H new ATOM 0 HG3 PRO A 34 10.639 -4.813 13.455 1.00 0.00 H new ATOM 0 HD2 PRO A 34 9.817 -2.529 12.223 1.00 0.00 H new ATOM 0 HD3 PRO A 34 10.304 -3.940 11.305 1.00 0.00 H new ATOM 521 N SER A 35 6.233 -2.932 13.197 1.00 0.00 N ATOM 522 CA SER A 35 5.229 -2.269 14.022 1.00 0.00 C ATOM 523 C SER A 35 3.909 -2.135 13.268 1.00 0.00 C ATOM 524 O SER A 35 2.874 -1.826 13.857 1.00 0.00 O ATOM 525 CB SER A 35 5.725 -0.888 14.455 1.00 0.00 C ATOM 526 OG SER A 35 5.121 -0.488 15.673 1.00 0.00 O ATOM 0 H SER A 35 6.764 -2.305 12.593 1.00 0.00 H new ATOM 0 HA SER A 35 5.061 -2.881 14.908 1.00 0.00 H new ATOM 0 HB2 SER A 35 6.809 -0.908 14.572 1.00 0.00 H new ATOM 0 HB3 SER A 35 5.501 -0.158 13.677 1.00 0.00 H new ATOM 0 HG SER A 35 5.456 0.397 15.929 1.00 0.00 H new ATOM 532 N ASN A 36 3.956 -2.370 11.961 1.00 0.00 N ATOM 533 CA ASN A 36 2.764 -2.275 11.124 1.00 0.00 C ATOM 534 C ASN A 36 2.530 -3.576 10.362 1.00 0.00 C ATOM 535 O ASN A 36 1.831 -3.595 9.350 1.00 0.00 O ATOM 536 CB ASN A 36 2.898 -1.111 10.140 1.00 0.00 C ATOM 537 CG ASN A 36 3.657 0.061 10.731 1.00 0.00 C ATOM 538 OD1 ASN A 36 3.809 0.167 11.948 1.00 0.00 O ATOM 539 ND2 ASN A 36 4.138 0.949 9.868 1.00 0.00 N ATOM 0 H ASN A 36 4.805 -2.627 11.458 1.00 0.00 H new ATOM 0 HA ASN A 36 1.907 -2.096 11.773 1.00 0.00 H new ATOM 0 HB2 ASN A 36 3.410 -1.456 9.241 1.00 0.00 H new ATOM 0 HB3 ASN A 36 1.905 -0.781 9.835 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.657 1.759 10.206 1.00 0.00 H new ATOM 0 HD22 ASN A 36 3.988 0.821 8.867 1.00 0.00 H new ATOM 546 N GLU A 37 3.118 -4.660 10.858 1.00 0.00 N ATOM 547 CA GLU A 37 2.972 -5.965 10.224 1.00 0.00 C ATOM 548 C GLU A 37 1.760 -6.707 10.778 1.00 0.00 C ATOM 549 O GLU A 37 0.957 -7.257 10.024 1.00 0.00 O ATOM 550 CB GLU A 37 4.236 -6.802 10.432 1.00 0.00 C ATOM 551 CG GLU A 37 5.389 -6.400 9.528 1.00 0.00 C ATOM 552 CD GLU A 37 6.646 -7.205 9.792 1.00 0.00 C ATOM 553 OE1 GLU A 37 6.531 -8.427 10.023 1.00 0.00 O ATOM 554 OE2 GLU A 37 7.745 -6.613 9.767 1.00 0.00 O ATOM 0 H GLU A 37 3.699 -4.660 11.696 1.00 0.00 H new ATOM 0 HA GLU A 37 2.822 -5.807 9.156 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.553 -6.714 11.471 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.999 -7.852 10.259 1.00 0.00 H new ATOM 0 HG2 GLU A 37 5.092 -6.529 8.487 1.00 0.00 H new ATOM 0 HG3 GLU A 37 5.604 -5.341 9.669 1.00 0.00 H new ATOM 561 N ARG A 38 1.634 -6.719 12.101 1.00 0.00 N ATOM 562 CA ARG A 38 0.522 -7.395 12.757 1.00 0.00 C ATOM 563 C ARG A 38 -0.768 -7.217 11.961 1.00 0.00 C ATOM 564 O ARG A 38 -1.537 -8.163 11.784 1.00 0.00 O ATOM 565 CB ARG A 38 0.335 -6.856 14.177 1.00 0.00 C ATOM 566 CG ARG A 38 -0.041 -5.384 14.225 1.00 0.00 C ATOM 567 CD ARG A 38 -1.550 -5.194 14.213 1.00 0.00 C ATOM 568 NE ARG A 38 -2.142 -5.434 15.526 1.00 0.00 N ATOM 569 CZ ARG A 38 -3.411 -5.174 15.819 1.00 0.00 C ATOM 570 NH1 ARG A 38 -4.217 -4.667 14.896 1.00 0.00 N ATOM 571 NH2 ARG A 38 -3.877 -5.420 17.037 1.00 0.00 N ATOM 0 H ARG A 38 2.289 -6.268 12.740 1.00 0.00 H new ATOM 0 HA ARG A 38 0.755 -8.459 12.807 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -0.440 -7.437 14.678 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.258 -7.005 14.738 1.00 0.00 H new ATOM 0 HG2 ARG A 38 0.377 -4.930 15.123 1.00 0.00 H new ATOM 0 HG3 ARG A 38 0.399 -4.867 13.372 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -1.785 -4.180 13.889 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -1.995 -5.872 13.485 1.00 0.00 H new ATOM 0 HE ARG A 38 -1.548 -5.823 16.259 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -3.863 -4.476 13.959 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -5.191 -4.468 15.123 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -3.260 -5.809 17.750 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -4.852 -5.220 17.260 1.00 0.00 H new ATOM 585 N LYS A 39 -0.999 -5.999 11.483 1.00 0.00 N ATOM 586 CA LYS A 39 -2.195 -5.696 10.705 1.00 0.00 C ATOM 587 C LYS A 39 -2.203 -6.476 9.394 1.00 0.00 C ATOM 588 O LYS A 39 -2.975 -7.421 9.226 1.00 0.00 O ATOM 589 CB LYS A 39 -2.275 -4.195 10.419 1.00 0.00 C ATOM 590 CG LYS A 39 -0.920 -3.510 10.381 1.00 0.00 C ATOM 591 CD LYS A 39 -0.912 -2.343 9.407 1.00 0.00 C ATOM 592 CE LYS A 39 -1.908 -1.269 9.817 1.00 0.00 C ATOM 593 NZ LYS A 39 -1.316 -0.305 10.785 1.00 0.00 N ATOM 0 H LYS A 39 -0.374 -5.205 11.621 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.065 -5.995 11.290 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -2.777 -4.042 9.464 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -2.891 -3.720 11.183 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -0.663 -3.154 11.379 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -0.155 -4.231 10.093 1.00 0.00 H new ATOM 0 HD2 LYS A 39 0.089 -1.914 9.360 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -1.153 -2.701 8.406 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -2.248 -0.732 8.932 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -2.785 -1.738 10.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -2.041 -0.014 11.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -0.526 -0.758 11.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -0.968 0.531 10.274 1.00 0.00 H new ATOM 607 N LEU A 40 -1.338 -6.076 8.468 1.00 0.00 N ATOM 608 CA LEU A 40 -1.244 -6.738 7.172 1.00 0.00 C ATOM 609 C LEU A 40 -1.376 -8.250 7.322 1.00 0.00 C ATOM 610 O LEU A 40 -2.009 -8.913 6.501 1.00 0.00 O ATOM 611 CB LEU A 40 0.084 -6.395 6.496 1.00 0.00 C ATOM 612 CG LEU A 40 0.558 -4.948 6.643 1.00 0.00 C ATOM 613 CD1 LEU A 40 1.823 -4.716 5.832 1.00 0.00 C ATOM 614 CD2 LEU A 40 -0.537 -3.982 6.215 1.00 0.00 C ATOM 0 H LEU A 40 -0.692 -5.296 8.591 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.064 -6.380 6.549 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.855 -7.052 6.900 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.003 -6.622 5.433 1.00 0.00 H new ATOM 0 HG LEU A 40 0.786 -4.765 7.693 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.145 -3.681 5.949 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.609 -5.383 6.185 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.623 -4.917 4.780 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.182 -2.957 6.326 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.796 -4.165 5.172 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.418 -4.131 6.840 1.00 0.00 H new ATOM 626 N ASN A 41 -0.775 -8.789 8.378 1.00 0.00 N ATOM 627 CA ASN A 41 -0.826 -10.223 8.637 1.00 0.00 C ATOM 628 C ASN A 41 -2.248 -10.666 8.969 1.00 0.00 C ATOM 629 O ASN A 41 -2.886 -11.373 8.189 1.00 0.00 O ATOM 630 CB ASN A 41 0.115 -10.589 9.786 1.00 0.00 C ATOM 631 CG ASN A 41 1.534 -10.843 9.314 1.00 0.00 C ATOM 632 OD1 ASN A 41 2.322 -9.912 9.153 1.00 0.00 O ATOM 633 ND2 ASN A 41 1.864 -12.110 9.089 1.00 0.00 N ATOM 0 H ASN A 41 -0.247 -8.254 9.068 1.00 0.00 H new ATOM 0 HA ASN A 41 -0.504 -10.741 7.734 1.00 0.00 H new ATOM 0 HB2 ASN A 41 0.118 -9.783 10.520 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -0.262 -11.479 10.291 1.00 0.00 H new ATOM 0 HD21 ASN A 41 2.804 -12.343 8.769 1.00 0.00 H new ATOM 0 HD22 ASN A 41 1.177 -12.850 9.236 1.00 0.00 H new ATOM 640 N ARG A 42 -2.737 -10.244 10.130 1.00 0.00 N ATOM 641 CA ARG A 42 -4.083 -10.596 10.565 1.00 0.00 C ATOM 642 C ARG A 42 -5.108 -10.269 9.483 1.00 0.00 C ATOM 643 O ARG A 42 -5.842 -11.143 9.024 1.00 0.00 O ATOM 644 CB ARG A 42 -4.435 -9.856 11.857 1.00 0.00 C ATOM 645 CG ARG A 42 -5.687 -10.382 12.539 1.00 0.00 C ATOM 646 CD ARG A 42 -5.361 -11.501 13.516 1.00 0.00 C ATOM 647 NE ARG A 42 -4.470 -11.054 14.583 1.00 0.00 N ATOM 648 CZ ARG A 42 -4.255 -11.743 15.698 1.00 0.00 C ATOM 649 NH1 ARG A 42 -4.862 -12.906 15.890 1.00 0.00 N ATOM 650 NH2 ARG A 42 -3.429 -11.270 16.623 1.00 0.00 N ATOM 0 H ARG A 42 -2.221 -9.658 10.786 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.108 -11.670 10.751 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -3.596 -9.931 12.549 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -4.570 -8.798 11.634 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.183 -9.569 13.068 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.387 -10.747 11.787 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.285 -11.883 13.951 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -4.896 -12.328 12.978 1.00 0.00 H new ATOM 0 HE ARG A 42 -3.986 -10.164 14.466 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -5.496 -13.274 15.181 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -4.695 -13.433 16.747 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -2.959 -10.377 16.478 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -3.265 -11.800 17.479 1.00 0.00 H new ATOM 664 N ALA A 43 -5.152 -9.003 9.082 1.00 0.00 N ATOM 665 CA ALA A 43 -6.086 -8.560 8.053 1.00 0.00 C ATOM 666 C ALA A 43 -6.133 -9.548 6.893 1.00 0.00 C ATOM 667 O ALA A 43 -7.207 -9.871 6.383 1.00 0.00 O ATOM 668 CB ALA A 43 -5.702 -7.174 7.554 1.00 0.00 C ATOM 0 H ALA A 43 -4.552 -8.266 9.453 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.081 -8.512 8.495 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.407 -6.855 6.786 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.726 -6.469 8.385 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.697 -7.204 7.133 1.00 0.00 H new ATOM 674 N PHE A 44 -4.964 -10.025 6.479 1.00 0.00 N ATOM 675 CA PHE A 44 -4.872 -10.975 5.377 1.00 0.00 C ATOM 676 C PHE A 44 -5.819 -12.152 5.594 1.00 0.00 C ATOM 677 O PHE A 44 -6.428 -12.655 4.649 1.00 0.00 O ATOM 678 CB PHE A 44 -3.436 -11.482 5.231 1.00 0.00 C ATOM 679 CG PHE A 44 -3.218 -12.319 4.003 1.00 0.00 C ATOM 680 CD1 PHE A 44 -3.581 -11.845 2.752 1.00 0.00 C ATOM 681 CD2 PHE A 44 -2.651 -13.580 4.099 1.00 0.00 C ATOM 682 CE1 PHE A 44 -3.381 -12.612 1.620 1.00 0.00 C ATOM 683 CE2 PHE A 44 -2.449 -14.351 2.970 1.00 0.00 C ATOM 684 CZ PHE A 44 -2.815 -13.868 1.730 1.00 0.00 C ATOM 0 H PHE A 44 -4.067 -9.769 6.891 1.00 0.00 H new ATOM 0 HA PHE A 44 -5.163 -10.460 4.461 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -2.759 -10.628 5.204 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -3.175 -12.069 6.112 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -4.025 -10.865 2.661 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -2.364 -13.964 5.067 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -3.667 -12.230 0.651 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -2.005 -15.331 3.058 1.00 0.00 H new ATOM 0 HZ PHE A 44 -2.659 -14.470 0.847 1.00 0.00 H new ATOM 694 N TRP A 45 -5.938 -12.586 6.844 1.00 0.00 N ATOM 695 CA TRP A 45 -6.810 -13.704 7.185 1.00 0.00 C ATOM 696 C TRP A 45 -8.221 -13.218 7.496 1.00 0.00 C ATOM 697 O TRP A 45 -9.203 -13.815 7.055 1.00 0.00 O ATOM 698 CB TRP A 45 -6.245 -14.470 8.383 1.00 0.00 C ATOM 699 CG TRP A 45 -4.754 -14.616 8.345 1.00 0.00 C ATOM 700 CD1 TRP A 45 -3.970 -14.729 7.234 1.00 0.00 C ATOM 701 CD2 TRP A 45 -3.870 -14.666 9.470 1.00 0.00 C ATOM 702 NE1 TRP A 45 -2.650 -14.847 7.599 1.00 0.00 N ATOM 703 CE2 TRP A 45 -2.562 -14.810 8.966 1.00 0.00 C ATOM 704 CE3 TRP A 45 -4.054 -14.602 10.854 1.00 0.00 C ATOM 705 CZ2 TRP A 45 -1.449 -14.892 9.797 1.00 0.00 C ATOM 706 CZ3 TRP A 45 -2.948 -14.683 11.678 1.00 0.00 C ATOM 707 CH2 TRP A 45 -1.659 -14.826 11.148 1.00 0.00 C ATOM 0 H TRP A 45 -5.442 -12.181 7.638 1.00 0.00 H new ATOM 0 HA TRP A 45 -6.858 -14.372 6.325 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -6.529 -13.955 9.301 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -6.699 -15.460 8.419 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -4.333 -14.726 6.217 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -1.864 -14.946 6.957 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -5.044 -14.491 11.272 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -0.455 -15.004 9.390 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -3.079 -14.635 12.749 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -0.814 -14.885 11.819 1.00 0.00 H new ATOM 718 N GLU A 46 -8.315 -12.132 8.257 1.00 0.00 N ATOM 719 CA GLU A 46 -9.608 -11.568 8.626 1.00 0.00 C ATOM 720 C GLU A 46 -10.320 -10.994 7.405 1.00 0.00 C ATOM 721 O GLU A 46 -11.524 -10.744 7.436 1.00 0.00 O ATOM 722 CB GLU A 46 -9.430 -10.478 9.686 1.00 0.00 C ATOM 723 CG GLU A 46 -8.764 -10.970 10.960 1.00 0.00 C ATOM 724 CD GLU A 46 -9.759 -11.517 11.964 1.00 0.00 C ATOM 725 OE1 GLU A 46 -10.866 -10.948 12.072 1.00 0.00 O ATOM 726 OE2 GLU A 46 -9.432 -12.513 12.643 1.00 0.00 O ATOM 0 H GLU A 46 -7.512 -11.626 8.630 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.221 -12.370 9.038 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.835 -9.667 9.265 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.406 -10.061 9.934 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -8.041 -11.746 10.711 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.208 -10.150 11.415 1.00 0.00 H new ATOM 733 N SER A 47 -9.565 -10.788 6.330 1.00 0.00 N ATOM 734 CA SER A 47 -10.122 -10.239 5.099 1.00 0.00 C ATOM 735 C SER A 47 -9.740 -11.100 3.899 1.00 0.00 C ATOM 736 O SER A 47 -8.847 -11.943 3.985 1.00 0.00 O ATOM 737 CB SER A 47 -9.633 -8.805 4.888 1.00 0.00 C ATOM 738 OG SER A 47 -10.278 -7.910 5.778 1.00 0.00 O ATOM 0 H SER A 47 -8.567 -10.993 6.287 1.00 0.00 H new ATOM 0 HA SER A 47 -11.208 -10.235 5.191 1.00 0.00 H new ATOM 0 HB2 SER A 47 -8.555 -8.759 5.039 1.00 0.00 H new ATOM 0 HB3 SER A 47 -9.824 -8.500 3.859 1.00 0.00 H new ATOM 0 HG SER A 47 -10.579 -7.119 5.285 1.00 0.00 H new ATOM 744 N SER A 48 -10.423 -10.881 2.780 1.00 0.00 N ATOM 745 CA SER A 48 -10.160 -11.639 1.563 1.00 0.00 C ATOM 746 C SER A 48 -8.838 -11.211 0.932 1.00 0.00 C ATOM 747 O SER A 48 -8.023 -12.048 0.544 1.00 0.00 O ATOM 748 CB SER A 48 -11.301 -11.451 0.562 1.00 0.00 C ATOM 749 OG SER A 48 -11.451 -12.594 -0.262 1.00 0.00 O ATOM 0 H SER A 48 -11.163 -10.184 2.691 1.00 0.00 H new ATOM 0 HA SER A 48 -10.091 -12.694 1.829 1.00 0.00 H new ATOM 0 HB2 SER A 48 -12.231 -11.261 1.098 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.105 -10.576 -0.057 1.00 0.00 H new ATOM 0 HG SER A 48 -12.188 -12.449 -0.892 1.00 0.00 H new ATOM 755 N ILE A 49 -8.635 -9.902 0.832 1.00 0.00 N ATOM 756 CA ILE A 49 -7.413 -9.361 0.249 1.00 0.00 C ATOM 757 C ILE A 49 -6.905 -8.165 1.048 1.00 0.00 C ATOM 758 O ILE A 49 -7.595 -7.658 1.932 1.00 0.00 O ATOM 759 CB ILE A 49 -7.629 -8.932 -1.214 1.00 0.00 C ATOM 760 CG1 ILE A 49 -8.515 -9.947 -1.940 1.00 0.00 C ATOM 761 CG2 ILE A 49 -6.292 -8.784 -1.926 1.00 0.00 C ATOM 762 CD1 ILE A 49 -9.014 -9.461 -3.283 1.00 0.00 C ATOM 0 H ILE A 49 -9.301 -9.196 1.147 1.00 0.00 H new ATOM 0 HA ILE A 49 -6.670 -10.158 0.279 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.132 -7.965 -1.223 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.954 -10.871 -2.082 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -9.370 -10.188 -1.309 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -6.462 -8.480 -2.959 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -5.692 -8.028 -1.419 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.764 -9.737 -1.910 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -9.635 -10.231 -3.741 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -9.603 -8.554 -3.146 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -8.164 -9.248 -3.931 1.00 0.00 H new ATOM 774 N VAL A 50 -5.695 -7.718 0.728 1.00 0.00 N ATOM 775 CA VAL A 50 -5.095 -6.580 1.414 1.00 0.00 C ATOM 776 C VAL A 50 -4.401 -5.648 0.427 1.00 0.00 C ATOM 777 O VAL A 50 -3.321 -5.954 -0.079 1.00 0.00 O ATOM 778 CB VAL A 50 -4.076 -7.037 2.475 1.00 0.00 C ATOM 779 CG1 VAL A 50 -3.411 -5.835 3.128 1.00 0.00 C ATOM 780 CG2 VAL A 50 -4.751 -7.915 3.517 1.00 0.00 C ATOM 0 H VAL A 50 -5.111 -8.126 -0.002 1.00 0.00 H new ATOM 0 HA VAL A 50 -5.906 -6.044 1.907 1.00 0.00 H new ATOM 0 HB VAL A 50 -3.303 -7.627 1.982 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.694 -6.177 3.875 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -2.893 -5.249 2.369 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -4.169 -5.217 3.609 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.017 -8.229 4.259 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.545 -7.352 4.008 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.176 -8.794 3.032 1.00 0.00 H new ATOM 790 N TYR A 51 -5.028 -4.508 0.157 1.00 0.00 N ATOM 791 CA TYR A 51 -4.472 -3.531 -0.771 1.00 0.00 C ATOM 792 C TYR A 51 -3.429 -2.657 -0.082 1.00 0.00 C ATOM 793 O TYR A 51 -3.676 -2.103 0.990 1.00 0.00 O ATOM 794 CB TYR A 51 -5.585 -2.655 -1.350 1.00 0.00 C ATOM 795 CG TYR A 51 -6.369 -3.325 -2.456 1.00 0.00 C ATOM 796 CD1 TYR A 51 -5.724 -3.872 -3.558 1.00 0.00 C ATOM 797 CD2 TYR A 51 -7.754 -3.411 -2.398 1.00 0.00 C ATOM 798 CE1 TYR A 51 -6.436 -4.484 -4.571 1.00 0.00 C ATOM 799 CE2 TYR A 51 -8.475 -4.022 -3.406 1.00 0.00 C ATOM 800 CZ TYR A 51 -7.811 -4.557 -4.491 1.00 0.00 C ATOM 801 OH TYR A 51 -8.525 -5.167 -5.497 1.00 0.00 O ATOM 0 H TYR A 51 -5.922 -4.238 0.568 1.00 0.00 H new ATOM 0 HA TYR A 51 -3.987 -4.074 -1.582 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -6.269 -2.375 -0.549 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -5.148 -1.733 -1.733 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -4.647 -3.818 -3.624 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -8.277 -2.993 -1.550 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -5.919 -4.903 -5.421 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -9.552 -4.081 -3.345 1.00 0.00 H new ATOM 0 HH TYR A 51 -9.481 -5.134 -5.286 1.00 0.00 H new ATOM 811 N LEU A 52 -2.262 -2.538 -0.705 1.00 0.00 N ATOM 812 CA LEU A 52 -1.179 -1.731 -0.154 1.00 0.00 C ATOM 813 C LEU A 52 -0.657 -0.740 -1.189 1.00 0.00 C ATOM 814 O LEU A 52 0.068 -1.113 -2.111 1.00 0.00 O ATOM 815 CB LEU A 52 -0.039 -2.631 0.327 1.00 0.00 C ATOM 816 CG LEU A 52 -0.451 -3.860 1.138 1.00 0.00 C ATOM 817 CD1 LEU A 52 0.657 -4.901 1.130 1.00 0.00 C ATOM 818 CD2 LEU A 52 -0.804 -3.465 2.564 1.00 0.00 C ATOM 0 H LEU A 52 -2.041 -2.990 -1.592 1.00 0.00 H new ATOM 0 HA LEU A 52 -1.573 -1.170 0.693 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.524 -2.967 -0.544 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.640 -2.031 0.933 1.00 0.00 H new ATOM 0 HG LEU A 52 -1.335 -4.297 0.674 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.346 -5.768 1.712 1.00 0.00 H new ATOM 0 HD12 LEU A 52 0.861 -5.207 0.104 1.00 0.00 H new ATOM 0 HD13 LEU A 52 1.560 -4.475 1.568 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.095 -4.353 3.126 1.00 0.00 H new ATOM 0 HD22 LEU A 52 0.062 -3.003 3.038 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.632 -2.756 2.551 1.00 0.00 H new ATOM 830 N VAL A 53 -1.028 0.527 -1.028 1.00 0.00 N ATOM 831 CA VAL A 53 -0.595 1.573 -1.946 1.00 0.00 C ATOM 832 C VAL A 53 0.791 2.090 -1.576 1.00 0.00 C ATOM 833 O VAL A 53 0.971 2.729 -0.540 1.00 0.00 O ATOM 834 CB VAL A 53 -1.584 2.753 -1.960 1.00 0.00 C ATOM 835 CG1 VAL A 53 -1.088 3.855 -2.883 1.00 0.00 C ATOM 836 CG2 VAL A 53 -2.970 2.282 -2.375 1.00 0.00 C ATOM 0 H VAL A 53 -1.628 0.853 -0.270 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.560 1.127 -2.940 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.651 3.160 -0.951 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.800 4.680 -2.880 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.118 4.211 -2.536 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.990 3.465 -3.896 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -3.656 3.129 -2.379 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -2.923 1.848 -3.374 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -3.325 1.531 -1.670 1.00 0.00 H new ATOM 846 N PHE A 54 1.769 1.809 -2.431 1.00 0.00 N ATOM 847 CA PHE A 54 3.140 2.245 -2.194 1.00 0.00 C ATOM 848 C PHE A 54 3.394 3.610 -2.827 1.00 0.00 C ATOM 849 O PHE A 54 2.934 3.888 -3.935 1.00 0.00 O ATOM 850 CB PHE A 54 4.128 1.219 -2.754 1.00 0.00 C ATOM 851 CG PHE A 54 3.917 -0.169 -2.221 1.00 0.00 C ATOM 852 CD1 PHE A 54 2.889 -0.962 -2.704 1.00 0.00 C ATOM 853 CD2 PHE A 54 4.747 -0.680 -1.236 1.00 0.00 C ATOM 854 CE1 PHE A 54 2.693 -2.241 -2.216 1.00 0.00 C ATOM 855 CE2 PHE A 54 4.555 -1.958 -0.744 1.00 0.00 C ATOM 856 CZ PHE A 54 3.526 -2.738 -1.234 1.00 0.00 C ATOM 0 H PHE A 54 1.637 1.281 -3.294 1.00 0.00 H new ATOM 0 HA PHE A 54 3.286 2.330 -1.117 1.00 0.00 H new ATOM 0 HB2 PHE A 54 4.042 1.199 -3.840 1.00 0.00 H new ATOM 0 HB3 PHE A 54 5.143 1.539 -2.520 1.00 0.00 H new ATOM 0 HD1 PHE A 54 2.233 -0.577 -3.471 1.00 0.00 H new ATOM 0 HD2 PHE A 54 5.552 -0.074 -0.848 1.00 0.00 H new ATOM 0 HE1 PHE A 54 1.889 -2.850 -2.603 1.00 0.00 H new ATOM 0 HE2 PHE A 54 5.209 -2.346 0.023 1.00 0.00 H new ATOM 0 HZ PHE A 54 3.373 -3.736 -0.849 1.00 0.00 H new ATOM 866 N SER A 55 4.129 4.458 -2.116 1.00 0.00 N ATOM 867 CA SER A 55 4.441 5.796 -2.605 1.00 0.00 C ATOM 868 C SER A 55 5.737 6.312 -1.988 1.00 0.00 C ATOM 869 O SER A 55 5.868 6.392 -0.766 1.00 0.00 O ATOM 870 CB SER A 55 3.294 6.758 -2.288 1.00 0.00 C ATOM 871 OG SER A 55 3.208 7.787 -3.259 1.00 0.00 O ATOM 0 H SER A 55 4.520 4.243 -1.199 1.00 0.00 H new ATOM 0 HA SER A 55 4.571 5.740 -3.686 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.354 6.208 -2.252 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.445 7.196 -1.301 1.00 0.00 H new ATOM 0 HG SER A 55 2.466 8.387 -3.035 1.00 0.00 H new ATOM 877 N VAL A 56 6.694 6.661 -2.842 1.00 0.00 N ATOM 878 CA VAL A 56 7.981 7.170 -2.383 1.00 0.00 C ATOM 879 C VAL A 56 7.856 8.603 -1.878 1.00 0.00 C ATOM 880 O VAL A 56 7.179 9.429 -2.488 1.00 0.00 O ATOM 881 CB VAL A 56 9.036 7.122 -3.504 1.00 0.00 C ATOM 882 CG1 VAL A 56 10.289 7.878 -3.090 1.00 0.00 C ATOM 883 CG2 VAL A 56 9.367 5.681 -3.862 1.00 0.00 C ATOM 0 H VAL A 56 6.602 6.600 -3.856 1.00 0.00 H new ATOM 0 HA VAL A 56 8.303 6.526 -1.565 1.00 0.00 H new ATOM 0 HB VAL A 56 8.624 7.607 -4.389 1.00 0.00 H new ATOM 0 HG11 VAL A 56 11.023 7.833 -3.894 1.00 0.00 H new ATOM 0 HG12 VAL A 56 10.036 8.919 -2.887 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.707 7.425 -2.191 1.00 0.00 H new ATOM 0 HG21 VAL A 56 10.114 5.666 -4.656 1.00 0.00 H new ATOM 0 HG22 VAL A 56 9.760 5.169 -2.984 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.464 5.174 -4.204 1.00 0.00 H new ATOM 893 N GLN A 57 8.515 8.890 -0.759 1.00 0.00 N ATOM 894 CA GLN A 57 8.477 10.224 -0.172 1.00 0.00 C ATOM 895 C GLN A 57 8.891 11.279 -1.192 1.00 0.00 C ATOM 896 O GLN A 57 8.218 12.295 -1.358 1.00 0.00 O ATOM 897 CB GLN A 57 9.394 10.292 1.050 1.00 0.00 C ATOM 898 CG GLN A 57 8.719 9.861 2.342 1.00 0.00 C ATOM 899 CD GLN A 57 8.773 8.361 2.557 1.00 0.00 C ATOM 900 OE1 GLN A 57 8.419 7.582 1.672 1.00 0.00 O ATOM 901 NE2 GLN A 57 9.220 7.948 3.737 1.00 0.00 N ATOM 0 H GLN A 57 9.081 8.217 -0.242 1.00 0.00 H new ATOM 0 HA GLN A 57 7.452 10.428 0.139 1.00 0.00 H new ATOM 0 HB2 GLN A 57 10.265 9.660 0.876 1.00 0.00 H new ATOM 0 HB3 GLN A 57 9.759 11.313 1.164 1.00 0.00 H new ATOM 0 HG2 GLN A 57 9.199 10.362 3.183 1.00 0.00 H new ATOM 0 HG3 GLN A 57 7.678 10.185 2.329 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.503 8.629 4.442 1.00 0.00 H new ATOM 0 HE22 GLN A 57 9.280 6.950 3.939 1.00 0.00 H new ATOM 935 N HIS A 61 4.203 11.569 -6.828 1.00 0.00 N ATOM 936 CA HIS A 61 3.189 10.734 -7.461 1.00 0.00 C ATOM 937 C HIS A 61 3.110 9.368 -6.786 1.00 0.00 C ATOM 938 O HIS A 61 4.016 8.975 -6.051 1.00 0.00 O ATOM 939 CB HIS A 61 3.495 10.563 -8.950 1.00 0.00 C ATOM 940 CG HIS A 61 3.633 11.860 -9.686 1.00 0.00 C ATOM 941 ND1 HIS A 61 4.541 12.835 -9.329 1.00 0.00 N ATOM 942 CD2 HIS A 61 2.972 12.340 -10.765 1.00 0.00 C ATOM 943 CE1 HIS A 61 4.432 13.859 -10.157 1.00 0.00 C ATOM 944 NE2 HIS A 61 3.487 13.584 -11.038 1.00 0.00 N ATOM 0 HA HIS A 61 2.225 11.230 -7.350 1.00 0.00 H new ATOM 0 HB2 HIS A 61 4.417 9.993 -9.060 1.00 0.00 H new ATOM 0 HB3 HIS A 61 2.700 9.976 -9.411 1.00 0.00 H new ATOM 0 HD1 HIS A 61 5.194 12.775 -8.548 1.00 0.00 H new ATOM 0 HD2 HIS A 61 2.186 11.838 -11.310 1.00 0.00 H new ATOM 0 HE1 HIS A 61 5.016 14.767 -10.120 1.00 0.00 H new ATOM 952 N PHE A 62 2.022 8.650 -7.040 1.00 0.00 N ATOM 953 CA PHE A 62 1.824 7.329 -6.455 1.00 0.00 C ATOM 954 C PHE A 62 2.567 6.263 -7.255 1.00 0.00 C ATOM 955 O PHE A 62 2.230 5.990 -8.407 1.00 0.00 O ATOM 956 CB PHE A 62 0.333 6.991 -6.396 1.00 0.00 C ATOM 957 CG PHE A 62 -0.363 7.560 -5.193 1.00 0.00 C ATOM 958 CD1 PHE A 62 -0.034 7.130 -3.917 1.00 0.00 C ATOM 959 CD2 PHE A 62 -1.348 8.524 -5.337 1.00 0.00 C ATOM 960 CE1 PHE A 62 -0.672 7.652 -2.808 1.00 0.00 C ATOM 961 CE2 PHE A 62 -1.989 9.050 -4.231 1.00 0.00 C ATOM 962 CZ PHE A 62 -1.652 8.612 -2.966 1.00 0.00 C ATOM 0 H PHE A 62 1.263 8.960 -7.647 1.00 0.00 H new ATOM 0 HA PHE A 62 2.226 7.345 -5.442 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -0.152 7.365 -7.297 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.214 5.908 -6.396 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.730 6.378 -3.788 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -1.618 8.868 -6.324 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.405 7.310 -1.819 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -2.753 9.803 -4.356 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.154 9.020 -2.101 1.00 0.00 H new ATOM 972 N GLN A 63 3.580 5.665 -6.636 1.00 0.00 N ATOM 973 CA GLN A 63 4.371 4.630 -7.291 1.00 0.00 C ATOM 974 C GLN A 63 3.509 3.420 -7.634 1.00 0.00 C ATOM 975 O GLN A 63 3.932 2.533 -8.373 1.00 0.00 O ATOM 976 CB GLN A 63 5.535 4.204 -6.393 1.00 0.00 C ATOM 977 CG GLN A 63 6.835 4.931 -6.697 1.00 0.00 C ATOM 978 CD GLN A 63 6.609 6.306 -7.295 1.00 0.00 C ATOM 979 OE1 GLN A 63 6.450 6.449 -8.507 1.00 0.00 O ATOM 980 NE2 GLN A 63 6.594 7.326 -6.445 1.00 0.00 N ATOM 0 H GLN A 63 3.872 5.879 -5.683 1.00 0.00 H new ATOM 0 HA GLN A 63 4.768 5.044 -8.218 1.00 0.00 H new ATOM 0 HB2 GLN A 63 5.264 4.381 -5.352 1.00 0.00 H new ATOM 0 HB3 GLN A 63 5.694 3.131 -6.503 1.00 0.00 H new ATOM 0 HG2 GLN A 63 7.415 5.029 -5.779 1.00 0.00 H new ATOM 0 HG3 GLN A 63 7.429 4.332 -7.387 1.00 0.00 H new ATOM 0 HE21 GLN A 63 6.730 7.161 -5.448 1.00 0.00 H new ATOM 0 HE22 GLN A 63 6.446 8.275 -6.789 1.00 0.00 H new ATOM 989 N GLY A 64 2.295 3.391 -7.090 1.00 0.00 N ATOM 990 CA GLY A 64 1.392 2.285 -7.350 1.00 0.00 C ATOM 991 C GLY A 64 1.029 1.525 -6.090 1.00 0.00 C ATOM 992 O GLY A 64 1.446 1.894 -4.992 1.00 0.00 O ATOM 0 H GLY A 64 1.922 4.114 -6.474 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.483 2.664 -7.817 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.855 1.602 -8.062 1.00 0.00 H new ATOM 996 N PHE A 65 0.248 0.462 -6.247 1.00 0.00 N ATOM 997 CA PHE A 65 -0.175 -0.351 -5.112 1.00 0.00 C ATOM 998 C PHE A 65 -0.035 -1.837 -5.426 1.00 0.00 C ATOM 999 O PHE A 65 0.188 -2.222 -6.574 1.00 0.00 O ATOM 1000 CB PHE A 65 -1.624 -0.030 -4.740 1.00 0.00 C ATOM 1001 CG PHE A 65 -2.632 -0.648 -5.666 1.00 0.00 C ATOM 1002 CD1 PHE A 65 -2.827 -0.137 -6.939 1.00 0.00 C ATOM 1003 CD2 PHE A 65 -3.383 -1.741 -5.264 1.00 0.00 C ATOM 1004 CE1 PHE A 65 -3.755 -0.703 -7.793 1.00 0.00 C ATOM 1005 CE2 PHE A 65 -4.312 -2.311 -6.115 1.00 0.00 C ATOM 1006 CZ PHE A 65 -4.497 -1.792 -7.381 1.00 0.00 C ATOM 0 H PHE A 65 -0.105 0.143 -7.149 1.00 0.00 H new ATOM 0 HA PHE A 65 0.470 -0.114 -4.266 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -1.815 -0.377 -3.724 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -1.759 1.052 -4.738 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -2.248 0.713 -7.268 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -3.241 -2.152 -4.275 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -3.900 -0.294 -8.782 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -4.892 -3.162 -5.790 1.00 0.00 H new ATOM 0 HZ PHE A 65 -5.221 -2.237 -8.048 1.00 0.00 H new ATOM 1016 N SER A 66 -0.169 -2.668 -4.397 1.00 0.00 N ATOM 1017 CA SER A 66 -0.053 -4.113 -4.561 1.00 0.00 C ATOM 1018 C SER A 66 -0.859 -4.847 -3.493 1.00 0.00 C ATOM 1019 O SER A 66 -0.788 -4.515 -2.310 1.00 0.00 O ATOM 1020 CB SER A 66 1.414 -4.540 -4.492 1.00 0.00 C ATOM 1021 OG SER A 66 2.254 -3.582 -5.115 1.00 0.00 O ATOM 0 H SER A 66 -0.358 -2.366 -3.441 1.00 0.00 H new ATOM 0 HA SER A 66 -0.454 -4.376 -5.540 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.711 -4.666 -3.451 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.538 -5.508 -4.978 1.00 0.00 H new ATOM 0 HG SER A 66 2.692 -3.987 -5.893 1.00 0.00 H new ATOM 1027 N ARG A 67 -1.624 -5.845 -3.921 1.00 0.00 N ATOM 1028 CA ARG A 67 -2.445 -6.626 -3.003 1.00 0.00 C ATOM 1029 C ARG A 67 -1.644 -7.780 -2.406 1.00 0.00 C ATOM 1030 O ARG A 67 -1.077 -8.596 -3.132 1.00 0.00 O ATOM 1031 CB ARG A 67 -3.680 -7.168 -3.724 1.00 0.00 C ATOM 1032 CG ARG A 67 -3.351 -8.039 -4.925 1.00 0.00 C ATOM 1033 CD ARG A 67 -4.607 -8.636 -5.541 1.00 0.00 C ATOM 1034 NE ARG A 67 -4.307 -9.788 -6.387 1.00 0.00 N ATOM 1035 CZ ARG A 67 -5.238 -10.587 -6.898 1.00 0.00 C ATOM 1036 NH1 ARG A 67 -6.520 -10.360 -6.649 1.00 0.00 N ATOM 1037 NH2 ARG A 67 -4.886 -11.615 -7.659 1.00 0.00 N ATOM 0 H ARG A 67 -1.693 -6.132 -4.897 1.00 0.00 H new ATOM 0 HA ARG A 67 -2.765 -5.970 -2.193 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.277 -7.747 -3.019 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -4.296 -6.330 -4.051 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -2.824 -7.446 -5.673 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -2.677 -8.840 -4.621 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -5.292 -8.937 -4.748 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -5.118 -7.876 -6.132 1.00 0.00 H new ATOM 0 HE ARG A 67 -3.330 -9.990 -6.597 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -6.794 -9.571 -6.064 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -7.233 -10.975 -7.042 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -3.900 -11.793 -7.852 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -5.601 -12.228 -8.051 1.00 0.00 H new ATOM 1051 N MET A 68 -1.604 -7.841 -1.079 1.00 0.00 N ATOM 1052 CA MET A 68 -0.874 -8.896 -0.385 1.00 0.00 C ATOM 1053 C MET A 68 -1.284 -10.271 -0.901 1.00 0.00 C ATOM 1054 O MET A 68 -2.472 -10.575 -1.008 1.00 0.00 O ATOM 1055 CB MET A 68 -1.121 -8.809 1.123 1.00 0.00 C ATOM 1056 CG MET A 68 0.026 -9.354 1.959 1.00 0.00 C ATOM 1057 SD MET A 68 0.175 -8.528 3.555 1.00 0.00 S ATOM 1058 CE MET A 68 0.305 -9.937 4.653 1.00 0.00 C ATOM 0 H MET A 68 -2.068 -7.173 -0.463 1.00 0.00 H new ATOM 0 HA MET A 68 0.189 -8.757 -0.580 1.00 0.00 H new ATOM 0 HB2 MET A 68 -1.295 -7.768 1.395 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.030 -9.359 1.366 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.122 -10.422 2.119 1.00 0.00 H new ATOM 0 HG3 MET A 68 0.959 -9.241 1.407 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.332 -9.592 5.686 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.556 -10.590 4.511 1.00 0.00 H new ATOM 0 HE3 MET A 68 1.219 -10.488 4.431 1.00 0.00 H new ATOM 1068 N SER A 69 -0.293 -11.099 -1.219 1.00 0.00 N ATOM 1069 CA SER A 69 -0.552 -12.441 -1.728 1.00 0.00 C ATOM 1070 C SER A 69 -0.124 -13.498 -0.714 1.00 0.00 C ATOM 1071 O SER A 69 -0.642 -14.614 -0.709 1.00 0.00 O ATOM 1072 CB SER A 69 0.186 -12.658 -3.050 1.00 0.00 C ATOM 1073 OG SER A 69 0.168 -14.025 -3.425 1.00 0.00 O ATOM 0 H SER A 69 0.696 -10.864 -1.133 1.00 0.00 H new ATOM 0 HA SER A 69 -1.624 -12.539 -1.898 1.00 0.00 H new ATOM 0 HB2 SER A 69 -0.278 -12.057 -3.832 1.00 0.00 H new ATOM 0 HB3 SER A 69 1.217 -12.317 -2.955 1.00 0.00 H new ATOM 0 HG SER A 69 0.645 -14.138 -4.274 1.00 0.00 H new ATOM 1079 N SER A 70 0.825 -13.136 0.143 1.00 0.00 N ATOM 1080 CA SER A 70 1.326 -14.054 1.160 1.00 0.00 C ATOM 1081 C SER A 70 1.463 -13.350 2.507 1.00 0.00 C ATOM 1082 O SER A 70 1.521 -12.123 2.574 1.00 0.00 O ATOM 1083 CB SER A 70 2.677 -14.632 0.734 1.00 0.00 C ATOM 1084 OG SER A 70 3.160 -15.558 1.692 1.00 0.00 O ATOM 0 H SER A 70 1.262 -12.215 0.154 1.00 0.00 H new ATOM 0 HA SER A 70 0.608 -14.867 1.266 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.577 -15.124 -0.234 1.00 0.00 H new ATOM 0 HB3 SER A 70 3.398 -13.825 0.608 1.00 0.00 H new ATOM 0 HG SER A 70 4.024 -15.914 1.396 1.00 0.00 H new ATOM 1090 N GLU A 71 1.515 -14.138 3.576 1.00 0.00 N ATOM 1091 CA GLU A 71 1.645 -13.590 4.922 1.00 0.00 C ATOM 1092 C GLU A 71 3.090 -13.195 5.211 1.00 0.00 C ATOM 1093 O GLU A 71 4.000 -13.531 4.453 1.00 0.00 O ATOM 1094 CB GLU A 71 1.165 -14.608 5.959 1.00 0.00 C ATOM 1095 CG GLU A 71 1.913 -15.929 5.907 1.00 0.00 C ATOM 1096 CD GLU A 71 3.174 -15.919 6.750 1.00 0.00 C ATOM 1097 OE1 GLU A 71 3.055 -15.855 7.992 1.00 0.00 O ATOM 1098 OE2 GLU A 71 4.277 -15.976 6.169 1.00 0.00 O ATOM 0 H GLU A 71 1.469 -15.156 3.537 1.00 0.00 H new ATOM 0 HA GLU A 71 1.023 -12.697 4.985 1.00 0.00 H new ATOM 0 HB2 GLU A 71 1.273 -14.178 6.955 1.00 0.00 H new ATOM 0 HB3 GLU A 71 0.102 -14.796 5.806 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.256 -16.728 6.252 1.00 0.00 H new ATOM 0 HG3 GLU A 71 2.174 -16.154 4.873 1.00 0.00 H new ATOM 1105 N ILE A 72 3.292 -12.480 6.313 1.00 0.00 N ATOM 1106 CA ILE A 72 4.626 -12.039 6.703 1.00 0.00 C ATOM 1107 C ILE A 72 5.291 -13.054 7.627 1.00 0.00 C ATOM 1108 O ILE A 72 4.625 -13.715 8.422 1.00 0.00 O ATOM 1109 CB ILE A 72 4.583 -10.671 7.408 1.00 0.00 C ATOM 1110 CG1 ILE A 72 3.681 -9.704 6.638 1.00 0.00 C ATOM 1111 CG2 ILE A 72 5.987 -10.100 7.543 1.00 0.00 C ATOM 1112 CD1 ILE A 72 3.448 -8.393 7.356 1.00 0.00 C ATOM 0 H ILE A 72 2.549 -12.194 6.951 1.00 0.00 H new ATOM 0 HA ILE A 72 5.209 -11.948 5.787 1.00 0.00 H new ATOM 0 HB ILE A 72 4.169 -10.807 8.407 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.127 -9.501 5.664 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.720 -10.184 6.455 1.00 0.00 H new ATOM 0 HG21 ILE A 72 5.940 -9.133 8.043 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.602 -10.782 8.129 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.426 -9.975 6.553 1.00 0.00 H new ATOM 0 HD11 ILE A 72 2.800 -7.758 6.752 1.00 0.00 H new ATOM 0 HD12 ILE A 72 2.973 -8.585 8.318 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.402 -7.891 7.516 1.00 0.00 H new ATOM 1124 N GLY A 73 6.611 -13.170 7.517 1.00 0.00 N ATOM 1125 CA GLY A 73 7.346 -14.104 8.349 1.00 0.00 C ATOM 1126 C GLY A 73 8.154 -15.095 7.535 1.00 0.00 C ATOM 1127 O GLY A 73 9.263 -14.788 7.095 1.00 0.00 O ATOM 0 H GLY A 73 7.184 -12.633 6.866 1.00 0.00 H new ATOM 0 HA2 GLY A 73 8.014 -13.550 9.008 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.647 -14.646 8.986 1.00 0.00 H new ATOM 1131 N ARG A 74 7.600 -16.286 7.335 1.00 0.00 N ATOM 1132 CA ARG A 74 8.278 -17.325 6.571 1.00 0.00 C ATOM 1133 C ARG A 74 9.101 -16.718 5.438 1.00 0.00 C ATOM 1134 O ARG A 74 10.273 -17.051 5.263 1.00 0.00 O ATOM 1135 CB ARG A 74 7.261 -18.316 6.002 1.00 0.00 C ATOM 1136 CG ARG A 74 7.877 -19.371 5.098 1.00 0.00 C ATOM 1137 CD ARG A 74 8.347 -20.579 5.892 1.00 0.00 C ATOM 1138 NE ARG A 74 9.194 -21.463 5.095 1.00 0.00 N ATOM 1139 CZ ARG A 74 10.432 -21.155 4.723 1.00 0.00 C ATOM 1140 NH1 ARG A 74 10.964 -19.992 5.074 1.00 0.00 N ATOM 1141 NH2 ARG A 74 11.140 -22.011 3.998 1.00 0.00 N ATOM 0 H ARG A 74 6.683 -16.555 7.692 1.00 0.00 H new ATOM 0 HA ARG A 74 8.953 -17.854 7.244 1.00 0.00 H new ATOM 0 HB2 ARG A 74 6.749 -18.811 6.827 1.00 0.00 H new ATOM 0 HB3 ARG A 74 6.505 -17.766 5.441 1.00 0.00 H new ATOM 0 HG2 ARG A 74 7.146 -19.686 4.353 1.00 0.00 H new ATOM 0 HG3 ARG A 74 8.719 -18.941 4.556 1.00 0.00 H new ATOM 0 HD2 ARG A 74 8.899 -20.243 6.770 1.00 0.00 H new ATOM 0 HD3 ARG A 74 7.481 -21.135 6.253 1.00 0.00 H new ATOM 0 HE ARG A 74 8.815 -22.365 4.809 1.00 0.00 H new ATOM 0 HH11 ARG A 74 10.423 -19.331 5.631 1.00 0.00 H new ATOM 0 HH12 ARG A 74 11.915 -19.759 4.787 1.00 0.00 H new ATOM 0 HH21 ARG A 74 10.734 -22.906 3.726 1.00 0.00 H new ATOM 0 HH22 ARG A 74 12.090 -21.774 3.713 1.00 0.00 H new ATOM 1155 N GLU A 75 8.479 -15.827 4.673 1.00 0.00 N ATOM 1156 CA GLU A 75 9.154 -15.175 3.557 1.00 0.00 C ATOM 1157 C GLU A 75 10.339 -14.347 4.047 1.00 0.00 C ATOM 1158 O GLU A 75 10.233 -13.609 5.026 1.00 0.00 O ATOM 1159 CB GLU A 75 8.175 -14.282 2.791 1.00 0.00 C ATOM 1160 CG GLU A 75 7.418 -15.011 1.694 1.00 0.00 C ATOM 1161 CD GLU A 75 8.339 -15.729 0.727 1.00 0.00 C ATOM 1162 OE1 GLU A 75 9.118 -15.046 0.030 1.00 0.00 O ATOM 1163 OE2 GLU A 75 8.280 -16.975 0.668 1.00 0.00 O ATOM 0 H GLU A 75 7.509 -15.540 4.805 1.00 0.00 H new ATOM 0 HA GLU A 75 9.527 -15.950 2.888 1.00 0.00 H new ATOM 0 HB2 GLU A 75 7.459 -13.856 3.494 1.00 0.00 H new ATOM 0 HB3 GLU A 75 8.724 -13.449 2.351 1.00 0.00 H new ATOM 0 HG2 GLU A 75 6.737 -15.733 2.146 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.806 -14.297 1.144 1.00 0.00 H new ATOM 1170 N LYS A 76 11.468 -14.476 3.358 1.00 0.00 N ATOM 1171 CA LYS A 76 12.673 -13.740 3.720 1.00 0.00 C ATOM 1172 C LYS A 76 13.515 -13.433 2.485 1.00 0.00 C ATOM 1173 O LYS A 76 13.536 -14.208 1.529 1.00 0.00 O ATOM 1174 CB LYS A 76 13.501 -14.541 4.728 1.00 0.00 C ATOM 1175 CG LYS A 76 13.097 -14.301 6.173 1.00 0.00 C ATOM 1176 CD LYS A 76 13.608 -12.962 6.679 1.00 0.00 C ATOM 1177 CE LYS A 76 12.692 -12.384 7.747 1.00 0.00 C ATOM 1178 NZ LYS A 76 12.979 -12.955 9.092 1.00 0.00 N ATOM 0 H LYS A 76 11.573 -15.084 2.546 1.00 0.00 H new ATOM 0 HA LYS A 76 12.370 -12.797 4.175 1.00 0.00 H new ATOM 0 HB2 LYS A 76 13.403 -15.603 4.504 1.00 0.00 H new ATOM 0 HB3 LYS A 76 14.553 -14.285 4.606 1.00 0.00 H new ATOM 0 HG2 LYS A 76 12.011 -14.333 6.258 1.00 0.00 H new ATOM 0 HG3 LYS A 76 13.490 -15.102 6.800 1.00 0.00 H new ATOM 0 HD2 LYS A 76 14.612 -13.085 7.086 1.00 0.00 H new ATOM 0 HD3 LYS A 76 13.685 -12.263 5.847 1.00 0.00 H new ATOM 0 HE2 LYS A 76 12.810 -11.301 7.779 1.00 0.00 H new ATOM 0 HE3 LYS A 76 11.654 -12.583 7.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 12.334 -12.536 9.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 12.842 -13.986 9.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 13.962 -12.743 9.357 1.00 0.00 H new ATOM 1192 N SER A 77 14.208 -12.300 2.514 1.00 0.00 N ATOM 1193 CA SER A 77 15.050 -11.890 1.396 1.00 0.00 C ATOM 1194 C SER A 77 16.409 -11.402 1.889 1.00 0.00 C ATOM 1195 O SER A 77 16.674 -11.382 3.091 1.00 0.00 O ATOM 1196 CB SER A 77 14.361 -10.787 0.589 1.00 0.00 C ATOM 1197 OG SER A 77 14.800 -10.791 -0.758 1.00 0.00 O ATOM 0 H SER A 77 14.203 -11.649 3.299 1.00 0.00 H new ATOM 0 HA SER A 77 15.206 -12.757 0.754 1.00 0.00 H new ATOM 0 HB2 SER A 77 13.281 -10.928 0.623 1.00 0.00 H new ATOM 0 HB3 SER A 77 14.570 -9.817 1.040 1.00 0.00 H new ATOM 0 HG SER A 77 14.344 -10.079 -1.253 1.00 0.00 H new ATOM 1203 N GLN A 78 17.265 -11.009 0.952 1.00 0.00 N ATOM 1204 CA GLN A 78 18.597 -10.522 1.291 1.00 0.00 C ATOM 1205 C GLN A 78 18.804 -9.101 0.777 1.00 0.00 C ATOM 1206 O GLN A 78 19.295 -8.234 1.501 1.00 0.00 O ATOM 1207 CB GLN A 78 19.666 -11.448 0.707 1.00 0.00 C ATOM 1208 CG GLN A 78 19.555 -11.633 -0.798 1.00 0.00 C ATOM 1209 CD GLN A 78 20.618 -12.561 -1.351 1.00 0.00 C ATOM 1210 OE1 GLN A 78 21.546 -12.124 -2.033 1.00 0.00 O ATOM 1211 NE2 GLN A 78 20.489 -13.850 -1.061 1.00 0.00 N ATOM 0 H GLN A 78 17.060 -11.018 -0.047 1.00 0.00 H new ATOM 0 HA GLN A 78 18.687 -10.513 2.377 1.00 0.00 H new ATOM 0 HB2 GLN A 78 20.651 -11.046 0.944 1.00 0.00 H new ATOM 0 HB3 GLN A 78 19.594 -12.422 1.191 1.00 0.00 H new ATOM 0 HG2 GLN A 78 18.569 -12.031 -1.040 1.00 0.00 H new ATOM 0 HG3 GLN A 78 19.636 -10.662 -1.287 1.00 0.00 H new ATOM 0 HE21 GLN A 78 19.704 -14.169 -0.492 1.00 0.00 H new ATOM 0 HE22 GLN A 78 21.174 -14.522 -1.407 1.00 0.00 H new ATOM 1220 N ASP A 79 18.427 -8.869 -0.476 1.00 0.00 N ATOM 1221 CA ASP A 79 18.571 -7.553 -1.086 1.00 0.00 C ATOM 1222 C ASP A 79 17.594 -6.558 -0.468 1.00 0.00 C ATOM 1223 O ASP A 79 16.396 -6.825 -0.375 1.00 0.00 O ATOM 1224 CB ASP A 79 18.342 -7.640 -2.596 1.00 0.00 C ATOM 1225 CG ASP A 79 19.552 -8.177 -3.335 1.00 0.00 C ATOM 1226 OD1 ASP A 79 20.310 -8.968 -2.736 1.00 0.00 O ATOM 1227 OD2 ASP A 79 19.740 -7.806 -4.512 1.00 0.00 O ATOM 0 H ASP A 79 18.019 -9.575 -1.089 1.00 0.00 H new ATOM 0 HA ASP A 79 19.586 -7.202 -0.899 1.00 0.00 H new ATOM 0 HB2 ASP A 79 17.484 -8.283 -2.794 1.00 0.00 H new ATOM 0 HB3 ASP A 79 18.095 -6.651 -2.981 1.00 0.00 H new ATOM 1232 N TRP A 80 18.114 -5.411 -0.045 1.00 0.00 N ATOM 1233 CA TRP A 80 17.287 -4.376 0.566 1.00 0.00 C ATOM 1234 C TRP A 80 18.081 -3.088 0.758 1.00 0.00 C ATOM 1235 O TRP A 80 19.237 -3.117 1.177 1.00 0.00 O ATOM 1236 CB TRP A 80 16.742 -4.859 1.911 1.00 0.00 C ATOM 1237 CG TRP A 80 15.471 -5.645 1.789 1.00 0.00 C ATOM 1238 CD1 TRP A 80 15.206 -6.864 2.344 1.00 0.00 C ATOM 1239 CD2 TRP A 80 14.295 -5.266 1.066 1.00 0.00 C ATOM 1240 NE1 TRP A 80 13.935 -7.267 2.009 1.00 0.00 N ATOM 1241 CE2 TRP A 80 13.356 -6.304 1.226 1.00 0.00 C ATOM 1242 CE3 TRP A 80 13.944 -4.152 0.300 1.00 0.00 C ATOM 1243 CZ2 TRP A 80 12.090 -6.257 0.647 1.00 0.00 C ATOM 1244 CZ3 TRP A 80 12.688 -4.108 -0.275 1.00 0.00 C ATOM 1245 CH2 TRP A 80 11.773 -5.154 -0.098 1.00 0.00 C ATOM 0 H TRP A 80 19.104 -5.174 -0.114 1.00 0.00 H new ATOM 0 HA TRP A 80 16.452 -4.170 -0.104 1.00 0.00 H new ATOM 0 HB2 TRP A 80 17.496 -5.475 2.401 1.00 0.00 H new ATOM 0 HB3 TRP A 80 16.567 -3.997 2.555 1.00 0.00 H new ATOM 0 HD1 TRP A 80 15.894 -7.429 2.956 1.00 0.00 H new ATOM 0 HE1 TRP A 80 13.495 -8.141 2.297 1.00 0.00 H new ATOM 0 HE3 TRP A 80 14.642 -3.340 0.160 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 11.384 -7.063 0.781 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 12.407 -3.252 -0.871 1.00 0.00 H new ATOM 0 HH2 TRP A 80 10.798 -5.088 -0.559 1.00 0.00 H new ATOM 1291 N LEU A 85 15.158 -3.625 8.760 1.00 0.00 N ATOM 1292 CA LEU A 85 13.886 -4.200 8.336 1.00 0.00 C ATOM 1293 C LEU A 85 13.631 -5.533 9.032 1.00 0.00 C ATOM 1294 O LEU A 85 14.462 -6.010 9.805 1.00 0.00 O ATOM 1295 CB LEU A 85 13.871 -4.394 6.819 1.00 0.00 C ATOM 1296 CG LEU A 85 13.991 -3.121 5.979 1.00 0.00 C ATOM 1297 CD1 LEU A 85 14.425 -3.457 4.560 1.00 0.00 C ATOM 1298 CD2 LEU A 85 12.671 -2.363 5.970 1.00 0.00 C ATOM 0 HA LEU A 85 13.092 -3.507 8.616 1.00 0.00 H new ATOM 0 HB2 LEU A 85 14.690 -5.062 6.550 1.00 0.00 H new ATOM 0 HB3 LEU A 85 12.945 -4.899 6.546 1.00 0.00 H new ATOM 0 HG LEU A 85 14.752 -2.482 6.428 1.00 0.00 H new ATOM 0 HD11 LEU A 85 14.505 -2.539 3.977 1.00 0.00 H new ATOM 0 HD12 LEU A 85 15.393 -3.957 4.584 1.00 0.00 H new ATOM 0 HD13 LEU A 85 13.688 -4.116 4.100 1.00 0.00 H new ATOM 0 HD21 LEU A 85 12.774 -1.460 5.368 1.00 0.00 H new ATOM 0 HD22 LEU A 85 11.891 -2.995 5.545 1.00 0.00 H new ATOM 0 HD23 LEU A 85 12.401 -2.090 6.990 1.00 0.00 H new ATOM 1310 N GLY A 86 12.478 -6.132 8.751 1.00 0.00 N ATOM 1311 CA GLY A 86 12.136 -7.405 9.357 1.00 0.00 C ATOM 1312 C GLY A 86 10.818 -7.954 8.848 1.00 0.00 C ATOM 1313 O GLY A 86 9.892 -7.197 8.560 1.00 0.00 O ATOM 0 H GLY A 86 11.774 -5.758 8.114 1.00 0.00 H new ATOM 0 HA2 GLY A 86 12.929 -8.125 9.154 1.00 0.00 H new ATOM 0 HA3 GLY A 86 12.083 -7.286 10.439 1.00 0.00 H new ATOM 1317 N GLY A 87 10.732 -9.276 8.736 1.00 0.00 N ATOM 1318 CA GLY A 87 9.514 -9.903 8.256 1.00 0.00 C ATOM 1319 C GLY A 87 9.166 -9.486 6.841 1.00 0.00 C ATOM 1320 O GLY A 87 8.602 -8.414 6.622 1.00 0.00 O ATOM 0 H GLY A 87 11.484 -9.924 8.969 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.627 -10.986 8.295 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.690 -9.645 8.921 1.00 0.00 H new ATOM 1324 N VAL A 88 9.505 -10.335 5.875 1.00 0.00 N ATOM 1325 CA VAL A 88 9.225 -10.050 4.473 1.00 0.00 C ATOM 1326 C VAL A 88 7.996 -10.811 3.992 1.00 0.00 C ATOM 1327 O VAL A 88 7.696 -11.901 4.481 1.00 0.00 O ATOM 1328 CB VAL A 88 10.424 -10.413 3.577 1.00 0.00 C ATOM 1329 CG1 VAL A 88 10.159 -9.999 2.137 1.00 0.00 C ATOM 1330 CG2 VAL A 88 11.696 -9.764 4.101 1.00 0.00 C ATOM 0 H VAL A 88 9.974 -11.226 6.038 1.00 0.00 H new ATOM 0 HA VAL A 88 9.036 -8.979 4.399 1.00 0.00 H new ATOM 0 HB VAL A 88 10.559 -11.494 3.600 1.00 0.00 H new ATOM 0 HG11 VAL A 88 11.017 -10.263 1.519 1.00 0.00 H new ATOM 0 HG12 VAL A 88 9.273 -10.515 1.767 1.00 0.00 H new ATOM 0 HG13 VAL A 88 9.997 -8.922 2.092 1.00 0.00 H new ATOM 0 HG21 VAL A 88 12.533 -10.031 3.456 1.00 0.00 H new ATOM 0 HG22 VAL A 88 11.575 -8.681 4.109 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.893 -10.114 5.114 1.00 0.00 H new ATOM 1340 N PHE A 89 7.287 -10.231 3.029 1.00 0.00 N ATOM 1341 CA PHE A 89 6.088 -10.855 2.481 1.00 0.00 C ATOM 1342 C PHE A 89 5.927 -10.517 1.002 1.00 0.00 C ATOM 1343 O PHE A 89 6.426 -9.495 0.528 1.00 0.00 O ATOM 1344 CB PHE A 89 4.850 -10.400 3.257 1.00 0.00 C ATOM 1345 CG PHE A 89 4.593 -8.923 3.163 1.00 0.00 C ATOM 1346 CD1 PHE A 89 5.414 -8.021 3.819 1.00 0.00 C ATOM 1347 CD2 PHE A 89 3.530 -8.438 2.419 1.00 0.00 C ATOM 1348 CE1 PHE A 89 5.179 -6.661 3.735 1.00 0.00 C ATOM 1349 CE2 PHE A 89 3.290 -7.079 2.330 1.00 0.00 C ATOM 1350 CZ PHE A 89 4.116 -6.190 2.989 1.00 0.00 C ATOM 0 H PHE A 89 7.522 -9.330 2.612 1.00 0.00 H new ATOM 0 HA PHE A 89 6.194 -11.935 2.580 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.979 -10.937 2.882 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.967 -10.674 4.305 1.00 0.00 H new ATOM 0 HD1 PHE A 89 6.247 -8.384 4.403 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.881 -9.129 1.902 1.00 0.00 H new ATOM 0 HE1 PHE A 89 5.826 -5.968 4.252 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.458 -6.714 1.746 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.931 -5.128 2.921 1.00 0.00 H new ATOM 1360 N LYS A 90 5.227 -11.382 0.276 1.00 0.00 N ATOM 1361 CA LYS A 90 4.999 -11.177 -1.150 1.00 0.00 C ATOM 1362 C LYS A 90 3.892 -10.153 -1.382 1.00 0.00 C ATOM 1363 O LYS A 90 3.089 -9.880 -0.490 1.00 0.00 O ATOM 1364 CB LYS A 90 4.632 -12.501 -1.824 1.00 0.00 C ATOM 1365 CG LYS A 90 5.832 -13.262 -2.363 1.00 0.00 C ATOM 1366 CD LYS A 90 5.497 -14.721 -2.621 1.00 0.00 C ATOM 1367 CE LYS A 90 5.678 -15.564 -1.368 1.00 0.00 C ATOM 1368 NZ LYS A 90 5.645 -17.022 -1.671 1.00 0.00 N ATOM 0 H LYS A 90 4.807 -12.232 0.652 1.00 0.00 H new ATOM 0 HA LYS A 90 5.921 -10.796 -1.589 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.105 -13.130 -1.107 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.940 -12.303 -2.643 1.00 0.00 H new ATOM 0 HG2 LYS A 90 6.173 -12.797 -3.288 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.655 -13.197 -1.651 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.468 -14.803 -2.970 1.00 0.00 H new ATOM 0 HD3 LYS A 90 6.135 -15.107 -3.416 1.00 0.00 H new ATOM 0 HE2 LYS A 90 6.627 -15.313 -0.895 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.892 -15.324 -0.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 5.772 -17.562 -0.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.729 -17.267 -2.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 6.411 -17.256 -2.334 1.00 0.00 H new ATOM 1382 N VAL A 91 3.855 -9.591 -2.586 1.00 0.00 N ATOM 1383 CA VAL A 91 2.845 -8.600 -2.935 1.00 0.00 C ATOM 1384 C VAL A 91 2.529 -8.640 -4.426 1.00 0.00 C ATOM 1385 O VAL A 91 3.432 -8.677 -5.261 1.00 0.00 O ATOM 1386 CB VAL A 91 3.300 -7.178 -2.556 1.00 0.00 C ATOM 1387 CG1 VAL A 91 3.337 -7.014 -1.045 1.00 0.00 C ATOM 1388 CG2 VAL A 91 4.659 -6.873 -3.167 1.00 0.00 C ATOM 0 H VAL A 91 4.513 -9.805 -3.336 1.00 0.00 H new ATOM 0 HA VAL A 91 1.947 -8.849 -2.369 1.00 0.00 H new ATOM 0 HB VAL A 91 2.579 -6.466 -2.957 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.661 -6.003 -0.797 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.342 -7.187 -0.636 1.00 0.00 H new ATOM 0 HG13 VAL A 91 4.035 -7.734 -0.618 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.965 -5.864 -2.889 1.00 0.00 H new ATOM 0 HG22 VAL A 91 5.393 -7.589 -2.798 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.595 -6.946 -4.253 1.00 0.00 H new ATOM 1398 N GLU A 92 1.240 -8.632 -4.753 1.00 0.00 N ATOM 1399 CA GLU A 92 0.805 -8.668 -6.144 1.00 0.00 C ATOM 1400 C GLU A 92 0.658 -7.256 -6.705 1.00 0.00 C ATOM 1401 O GLU A 92 -0.149 -6.465 -6.218 1.00 0.00 O ATOM 1402 CB GLU A 92 -0.523 -9.418 -6.268 1.00 0.00 C ATOM 1403 CG GLU A 92 -0.705 -10.117 -7.604 1.00 0.00 C ATOM 1404 CD GLU A 92 0.532 -10.881 -8.036 1.00 0.00 C ATOM 1405 OE1 GLU A 92 1.129 -11.572 -7.184 1.00 0.00 O ATOM 1406 OE2 GLU A 92 0.902 -10.789 -9.225 1.00 0.00 O ATOM 0 H GLU A 92 0.480 -8.601 -4.074 1.00 0.00 H new ATOM 0 HA GLU A 92 1.566 -9.193 -6.722 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.589 -10.157 -5.469 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.343 -8.715 -6.121 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -1.548 -10.805 -7.538 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.955 -9.378 -8.365 1.00 0.00 H new ATOM 1413 N TRP A 93 1.445 -6.948 -7.730 1.00 0.00 N ATOM 1414 CA TRP A 93 1.403 -5.632 -8.357 1.00 0.00 C ATOM 1415 C TRP A 93 0.299 -5.563 -9.406 1.00 0.00 C ATOM 1416 O TRP A 93 0.277 -6.355 -10.349 1.00 0.00 O ATOM 1417 CB TRP A 93 2.754 -5.307 -8.997 1.00 0.00 C ATOM 1418 CG TRP A 93 3.759 -4.770 -8.024 1.00 0.00 C ATOM 1419 CD1 TRP A 93 4.595 -5.497 -7.224 1.00 0.00 C ATOM 1420 CD2 TRP A 93 4.032 -3.392 -7.746 1.00 0.00 C ATOM 1421 NE1 TRP A 93 5.371 -4.653 -6.466 1.00 0.00 N ATOM 1422 CE2 TRP A 93 5.046 -3.358 -6.768 1.00 0.00 C ATOM 1423 CE3 TRP A 93 3.521 -2.185 -8.229 1.00 0.00 C ATOM 1424 CZ2 TRP A 93 5.555 -2.163 -6.266 1.00 0.00 C ATOM 1425 CZ3 TRP A 93 4.027 -1.000 -7.729 1.00 0.00 C ATOM 1426 CH2 TRP A 93 5.035 -0.996 -6.757 1.00 0.00 C ATOM 0 H TRP A 93 2.119 -7.591 -8.144 1.00 0.00 H new ATOM 0 HA TRP A 93 1.188 -4.895 -7.583 1.00 0.00 H new ATOM 0 HB2 TRP A 93 3.154 -6.208 -9.461 1.00 0.00 H new ATOM 0 HB3 TRP A 93 2.605 -4.578 -9.793 1.00 0.00 H new ATOM 0 HD1 TRP A 93 4.639 -6.576 -7.192 1.00 0.00 H new ATOM 0 HE1 TRP A 93 6.075 -4.944 -5.788 1.00 0.00 H new ATOM 0 HE3 TRP A 93 2.745 -2.178 -8.980 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 6.332 -2.157 -5.516 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 3.638 -0.061 -8.094 1.00 0.00 H new ATOM 0 HH2 TRP A 93 5.410 -0.053 -6.387 1.00 0.00 H new ATOM 1437 N ILE A 94 -0.614 -4.613 -9.237 1.00 0.00 N ATOM 1438 CA ILE A 94 -1.720 -4.442 -10.171 1.00 0.00 C ATOM 1439 C ILE A 94 -1.381 -3.407 -11.239 1.00 0.00 C ATOM 1440 O ILE A 94 -1.337 -3.720 -12.429 1.00 0.00 O ATOM 1441 CB ILE A 94 -3.008 -4.012 -9.445 1.00 0.00 C ATOM 1442 CG1 ILE A 94 -3.340 -4.997 -8.322 1.00 0.00 C ATOM 1443 CG2 ILE A 94 -4.163 -3.914 -10.430 1.00 0.00 C ATOM 1444 CD1 ILE A 94 -2.537 -4.768 -7.061 1.00 0.00 C ATOM 0 H ILE A 94 -0.610 -3.950 -8.462 1.00 0.00 H new ATOM 0 HA ILE A 94 -1.886 -5.409 -10.645 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.848 -3.028 -9.004 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -4.401 -4.922 -8.086 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -3.163 -6.013 -8.676 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -5.067 -3.609 -9.902 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -3.925 -3.177 -11.198 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -4.326 -4.885 -10.897 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -2.825 -5.502 -6.308 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -1.475 -4.872 -7.282 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -2.732 -3.765 -6.683 1.00 0.00 H new ATOM 1456 N ARG A 95 -1.143 -2.174 -10.805 1.00 0.00 N ATOM 1457 CA ARG A 95 -0.808 -1.093 -11.724 1.00 0.00 C ATOM 1458 C ARG A 95 0.583 -0.538 -11.427 1.00 0.00 C ATOM 1459 O ARG A 95 0.881 -0.154 -10.296 1.00 0.00 O ATOM 1460 CB ARG A 95 -1.846 0.027 -11.629 1.00 0.00 C ATOM 1461 CG ARG A 95 -3.281 -0.464 -11.725 1.00 0.00 C ATOM 1462 CD ARG A 95 -3.492 -1.334 -12.954 1.00 0.00 C ATOM 1463 NE ARG A 95 -3.367 -0.571 -14.193 1.00 0.00 N ATOM 1464 CZ ARG A 95 -4.241 0.351 -14.579 1.00 0.00 C ATOM 1465 NH1 ARG A 95 -5.299 0.623 -13.827 1.00 0.00 N ATOM 1466 NH2 ARG A 95 -4.059 1.004 -15.720 1.00 0.00 N ATOM 0 H ARG A 95 -1.176 -1.899 -9.823 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.811 -1.497 -12.736 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -1.714 0.554 -10.684 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -1.664 0.749 -12.425 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -3.533 -1.031 -10.829 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -3.957 0.390 -11.762 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -2.764 -2.145 -12.953 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -4.480 -1.792 -12.909 1.00 0.00 H new ATOM 0 HE ARG A 95 -2.564 -0.757 -14.795 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -5.443 0.123 -12.949 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -5.969 1.332 -14.126 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -3.247 0.798 -16.302 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -4.731 1.712 -16.015 1.00 0.00 H new ATOM 1480 N LYS A 96 1.429 -0.499 -12.450 1.00 0.00 N ATOM 1481 CA LYS A 96 2.788 0.009 -12.301 1.00 0.00 C ATOM 1482 C LYS A 96 2.925 1.391 -12.933 1.00 0.00 C ATOM 1483 O LYS A 96 4.024 1.813 -13.290 1.00 0.00 O ATOM 1484 CB LYS A 96 3.789 -0.957 -12.939 1.00 0.00 C ATOM 1485 CG LYS A 96 3.625 -2.395 -12.479 1.00 0.00 C ATOM 1486 CD LYS A 96 4.480 -2.690 -11.258 1.00 0.00 C ATOM 1487 CE LYS A 96 5.869 -3.168 -11.653 1.00 0.00 C ATOM 1488 NZ LYS A 96 6.693 -2.068 -12.225 1.00 0.00 N ATOM 0 H LYS A 96 1.198 -0.813 -13.392 1.00 0.00 H new ATOM 0 HA LYS A 96 3.003 0.093 -11.236 1.00 0.00 H new ATOM 0 HB2 LYS A 96 3.680 -0.916 -14.023 1.00 0.00 H new ATOM 0 HB3 LYS A 96 4.801 -0.624 -12.708 1.00 0.00 H new ATOM 0 HG2 LYS A 96 2.578 -2.586 -12.246 1.00 0.00 H new ATOM 0 HG3 LYS A 96 3.900 -3.071 -13.289 1.00 0.00 H new ATOM 0 HD2 LYS A 96 4.563 -1.792 -10.645 1.00 0.00 H new ATOM 0 HD3 LYS A 96 3.993 -3.449 -10.646 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.372 -3.582 -10.779 1.00 0.00 H new ATOM 0 HE3 LYS A 96 5.782 -3.973 -12.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 7.702 -2.300 -12.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 6.466 -1.953 -13.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 6.488 -1.182 -11.721 1.00 0.00 H new ATOM 1502 N GLU A 97 1.802 2.090 -13.066 1.00 0.00 N ATOM 1503 CA GLU A 97 1.798 3.424 -13.654 1.00 0.00 C ATOM 1504 C GLU A 97 1.973 4.493 -12.579 1.00 0.00 C ATOM 1505 O GLU A 97 1.767 4.235 -11.393 1.00 0.00 O ATOM 1506 CB GLU A 97 0.496 3.664 -14.421 1.00 0.00 C ATOM 1507 CG GLU A 97 0.649 4.615 -15.596 1.00 0.00 C ATOM 1508 CD GLU A 97 1.868 4.305 -16.443 1.00 0.00 C ATOM 1509 OE1 GLU A 97 1.802 3.359 -17.255 1.00 0.00 O ATOM 1510 OE2 GLU A 97 2.888 5.009 -16.293 1.00 0.00 O ATOM 0 H GLU A 97 0.884 1.755 -12.775 1.00 0.00 H new ATOM 0 HA GLU A 97 2.637 3.490 -14.347 1.00 0.00 H new ATOM 0 HB2 GLU A 97 0.117 2.709 -14.784 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -0.251 4.064 -13.736 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -0.244 4.564 -16.219 1.00 0.00 H new ATOM 0 HG3 GLU A 97 0.720 5.637 -15.224 1.00 0.00 H new ATOM 1517 N SER A 98 2.353 5.694 -13.003 1.00 0.00 N ATOM 1518 CA SER A 98 2.560 6.801 -12.077 1.00 0.00 C ATOM 1519 C SER A 98 1.366 7.752 -12.092 1.00 0.00 C ATOM 1520 O SER A 98 1.199 8.543 -13.021 1.00 0.00 O ATOM 1521 CB SER A 98 3.837 7.563 -12.437 1.00 0.00 C ATOM 1522 OG SER A 98 4.792 6.703 -13.035 1.00 0.00 O ATOM 0 H SER A 98 2.524 5.925 -13.982 1.00 0.00 H new ATOM 0 HA SER A 98 2.662 6.388 -11.073 1.00 0.00 H new ATOM 0 HB2 SER A 98 3.598 8.378 -13.121 1.00 0.00 H new ATOM 0 HB3 SER A 98 4.260 8.014 -11.540 1.00 0.00 H new ATOM 0 HG SER A 98 5.598 7.214 -13.257 1.00 0.00 H new ATOM 1528 N LEU A 99 0.538 7.668 -11.057 1.00 0.00 N ATOM 1529 CA LEU A 99 -0.641 8.520 -10.949 1.00 0.00 C ATOM 1530 C LEU A 99 -0.344 9.756 -10.107 1.00 0.00 C ATOM 1531 O LEU A 99 0.052 9.666 -8.945 1.00 0.00 O ATOM 1532 CB LEU A 99 -1.805 7.738 -10.336 1.00 0.00 C ATOM 1533 CG LEU A 99 -3.020 8.565 -9.915 1.00 0.00 C ATOM 1534 CD1 LEU A 99 -3.891 8.885 -11.120 1.00 0.00 C ATOM 1535 CD2 LEU A 99 -3.825 7.828 -8.854 1.00 0.00 C ATOM 0 H LEU A 99 0.661 7.018 -10.280 1.00 0.00 H new ATOM 0 HA LEU A 99 -0.918 8.845 -11.952 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -2.133 6.988 -11.056 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -1.436 7.201 -9.462 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.667 9.504 -9.488 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.751 9.474 -10.801 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.311 9.453 -11.847 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.236 7.957 -11.576 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.686 8.431 -8.566 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.168 6.874 -9.255 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.198 7.650 -7.980 1.00 0.00 H new ATOM 1547 N PRO A 100 -0.542 10.941 -10.705 1.00 0.00 N ATOM 1548 CA PRO A 100 -0.304 12.219 -10.027 1.00 0.00 C ATOM 1549 C PRO A 100 -1.327 12.491 -8.929 1.00 0.00 C ATOM 1550 O PRO A 100 -2.480 12.072 -9.022 1.00 0.00 O ATOM 1551 CB PRO A 100 -0.441 13.248 -11.152 1.00 0.00 C ATOM 1552 CG PRO A 100 -1.324 12.593 -12.158 1.00 0.00 C ATOM 1553 CD PRO A 100 -1.014 11.124 -12.087 1.00 0.00 C ATOM 0 HA PRO A 100 0.664 12.241 -9.526 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -0.878 14.178 -10.787 1.00 0.00 H new ATOM 0 HB3 PRO A 100 0.530 13.498 -11.580 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -2.375 12.781 -11.937 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -1.134 12.984 -13.158 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -1.895 10.517 -12.294 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -0.252 10.839 -12.813 1.00 0.00 H new ATOM 1561 N PHE A 101 -0.896 13.197 -7.888 1.00 0.00 N ATOM 1562 CA PHE A 101 -1.774 13.526 -6.771 1.00 0.00 C ATOM 1563 C PHE A 101 -2.953 14.376 -7.237 1.00 0.00 C ATOM 1564 O PHE A 101 -4.005 14.399 -6.599 1.00 0.00 O ATOM 1565 CB PHE A 101 -0.995 14.267 -5.683 1.00 0.00 C ATOM 1566 CG PHE A 101 -0.078 13.379 -4.892 1.00 0.00 C ATOM 1567 CD1 PHE A 101 -0.524 12.163 -4.400 1.00 0.00 C ATOM 1568 CD2 PHE A 101 1.230 13.760 -4.641 1.00 0.00 C ATOM 1569 CE1 PHE A 101 0.318 11.344 -3.671 1.00 0.00 C ATOM 1570 CE2 PHE A 101 2.077 12.945 -3.913 1.00 0.00 C ATOM 1571 CZ PHE A 101 1.620 11.735 -3.428 1.00 0.00 C ATOM 0 H PHE A 101 0.056 13.552 -7.795 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.161 12.594 -6.360 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.409 15.062 -6.144 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.701 14.745 -5.003 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -1.541 11.851 -4.588 1.00 0.00 H new ATOM 0 HD2 PHE A 101 1.592 14.705 -5.018 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -0.042 10.399 -3.292 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.094 13.254 -3.724 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.280 11.096 -2.860 1.00 0.00 H new ATOM 1581 N GLN A 102 -2.767 15.073 -8.353 1.00 0.00 N ATOM 1582 CA GLN A 102 -3.813 15.926 -8.904 1.00 0.00 C ATOM 1583 C GLN A 102 -5.100 15.136 -9.123 1.00 0.00 C ATOM 1584 O GLN A 102 -6.181 15.712 -9.241 1.00 0.00 O ATOM 1585 CB GLN A 102 -3.352 16.548 -10.223 1.00 0.00 C ATOM 1586 CG GLN A 102 -3.470 15.608 -11.413 1.00 0.00 C ATOM 1587 CD GLN A 102 -3.033 16.255 -12.713 1.00 0.00 C ATOM 1588 OE1 GLN A 102 -3.859 16.589 -13.562 1.00 0.00 O ATOM 1589 NE2 GLN A 102 -1.727 16.435 -12.874 1.00 0.00 N ATOM 0 H GLN A 102 -1.902 15.064 -8.893 1.00 0.00 H new ATOM 0 HA GLN A 102 -4.014 16.722 -8.186 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -3.941 17.444 -10.418 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -2.314 16.865 -10.122 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -2.864 14.720 -11.232 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -4.504 15.275 -11.507 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -1.078 16.143 -12.143 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -1.373 16.866 -13.728 1.00 0.00 H new ATOM 1598 N PHE A 103 -4.975 13.814 -9.177 1.00 0.00 N ATOM 1599 CA PHE A 103 -6.127 12.945 -9.383 1.00 0.00 C ATOM 1600 C PHE A 103 -6.854 12.683 -8.067 1.00 0.00 C ATOM 1601 O PHE A 103 -8.080 12.759 -7.996 1.00 0.00 O ATOM 1602 CB PHE A 103 -5.688 11.619 -10.008 1.00 0.00 C ATOM 1603 CG PHE A 103 -5.568 11.673 -11.504 1.00 0.00 C ATOM 1604 CD1 PHE A 103 -4.769 12.626 -12.115 1.00 0.00 C ATOM 1605 CD2 PHE A 103 -6.255 10.770 -12.300 1.00 0.00 C ATOM 1606 CE1 PHE A 103 -4.656 12.677 -13.492 1.00 0.00 C ATOM 1607 CE2 PHE A 103 -6.146 10.817 -13.677 1.00 0.00 C ATOM 1608 CZ PHE A 103 -5.347 11.772 -14.274 1.00 0.00 C ATOM 0 H PHE A 103 -4.087 13.321 -9.081 1.00 0.00 H new ATOM 0 HA PHE A 103 -6.813 13.450 -10.063 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -4.727 11.327 -9.585 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.404 10.844 -9.737 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.228 13.337 -11.508 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -6.882 10.021 -11.839 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.028 13.424 -13.956 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -6.686 10.107 -14.286 1.00 0.00 H new ATOM 0 HZ PHE A 103 -5.263 11.811 -15.350 1.00 0.00 H new ATOM 1618 N ALA A 104 -6.087 12.375 -7.026 1.00 0.00 N ATOM 1619 CA ALA A 104 -6.656 12.104 -5.711 1.00 0.00 C ATOM 1620 C ALA A 104 -6.791 13.386 -4.897 1.00 0.00 C ATOM 1621 O ALA A 104 -7.187 13.353 -3.731 1.00 0.00 O ATOM 1622 CB ALA A 104 -5.801 11.090 -4.965 1.00 0.00 C ATOM 0 H ALA A 104 -5.070 12.307 -7.068 1.00 0.00 H new ATOM 0 HA ALA A 104 -7.653 11.688 -5.852 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -6.237 10.897 -3.985 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.760 10.161 -5.533 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.793 11.485 -4.842 1.00 0.00 H new ATOM 1628 N HIS A 105 -6.461 14.514 -5.517 1.00 0.00 N ATOM 1629 CA HIS A 105 -6.545 15.807 -4.849 1.00 0.00 C ATOM 1630 C HIS A 105 -7.911 15.992 -4.193 1.00 0.00 C ATOM 1631 O HIS A 105 -8.036 16.676 -3.177 1.00 0.00 O ATOM 1632 CB HIS A 105 -6.288 16.938 -5.845 1.00 0.00 C ATOM 1633 CG HIS A 105 -5.934 18.240 -5.195 1.00 0.00 C ATOM 1634 ND1 HIS A 105 -6.292 18.558 -3.902 1.00 0.00 N ATOM 1635 CD2 HIS A 105 -5.249 19.308 -5.667 1.00 0.00 C ATOM 1636 CE1 HIS A 105 -5.844 19.765 -3.607 1.00 0.00 C ATOM 1637 NE2 HIS A 105 -5.207 20.242 -4.661 1.00 0.00 N ATOM 0 H HIS A 105 -6.133 14.559 -6.482 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.781 15.837 -4.072 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.480 16.644 -6.515 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -7.177 17.078 -6.460 1.00 0.00 H new ATOM 0 HD1 HIS A 105 -6.820 17.955 -3.271 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -4.816 19.407 -6.651 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -5.976 20.275 -2.664 1.00 0.00 H new ATOM 1645 N HIS A 106 -8.932 15.377 -4.781 1.00 0.00 N ATOM 1646 CA HIS A 106 -10.289 15.474 -4.255 1.00 0.00 C ATOM 1647 C HIS A 106 -10.522 14.437 -3.160 1.00 0.00 C ATOM 1648 O HIS A 106 -11.348 14.635 -2.268 1.00 0.00 O ATOM 1649 CB HIS A 106 -11.309 15.285 -5.377 1.00 0.00 C ATOM 1650 CG HIS A 106 -11.356 13.888 -5.915 1.00 0.00 C ATOM 1651 ND1 HIS A 106 -10.339 13.335 -6.664 1.00 0.00 N ATOM 1652 CD2 HIS A 106 -12.306 12.929 -5.808 1.00 0.00 C ATOM 1653 CE1 HIS A 106 -10.661 12.098 -6.995 1.00 0.00 C ATOM 1654 NE2 HIS A 106 -11.850 11.827 -6.488 1.00 0.00 N ATOM 0 H HIS A 106 -8.846 14.806 -5.622 1.00 0.00 H new ATOM 0 HA HIS A 106 -10.415 16.467 -3.824 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -12.298 15.557 -5.007 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -11.073 15.971 -6.191 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -9.473 13.808 -6.922 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -13.247 13.015 -5.285 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -10.055 11.423 -7.581 1.00 0.00 H new ATOM 1662 N LEU A 107 -9.789 13.331 -3.233 1.00 0.00 N ATOM 1663 CA LEU A 107 -9.916 12.262 -2.249 1.00 0.00 C ATOM 1664 C LEU A 107 -9.221 12.639 -0.944 1.00 0.00 C ATOM 1665 O LEU A 107 -8.162 13.266 -0.951 1.00 0.00 O ATOM 1666 CB LEU A 107 -9.324 10.963 -2.799 1.00 0.00 C ATOM 1667 CG LEU A 107 -9.862 10.501 -4.153 1.00 0.00 C ATOM 1668 CD1 LEU A 107 -9.113 9.268 -4.633 1.00 0.00 C ATOM 1669 CD2 LEU A 107 -11.355 10.219 -4.066 1.00 0.00 C ATOM 0 H LEU A 107 -9.100 13.151 -3.964 1.00 0.00 H new ATOM 0 HA LEU A 107 -10.976 12.113 -2.045 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -8.244 11.086 -2.882 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -9.499 10.171 -2.071 1.00 0.00 H new ATOM 0 HG LEU A 107 -9.705 11.301 -4.876 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -9.510 8.954 -5.598 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -8.054 9.503 -4.735 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -9.238 8.462 -3.910 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -11.721 9.891 -5.039 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.535 9.437 -3.328 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -11.880 11.127 -3.768 1.00 0.00 H new ATOM 1681 N LEU A 108 -9.824 12.249 0.174 1.00 0.00 N ATOM 1682 CA LEU A 108 -9.263 12.544 1.488 1.00 0.00 C ATOM 1683 C LEU A 108 -9.409 11.348 2.423 1.00 0.00 C ATOM 1684 O LEU A 108 -9.881 10.285 2.019 1.00 0.00 O ATOM 1685 CB LEU A 108 -9.950 13.768 2.096 1.00 0.00 C ATOM 1686 CG LEU A 108 -10.053 14.997 1.192 1.00 0.00 C ATOM 1687 CD1 LEU A 108 -11.094 15.967 1.727 1.00 0.00 C ATOM 1688 CD2 LEU A 108 -8.699 15.681 1.066 1.00 0.00 C ATOM 0 H LEU A 108 -10.701 11.728 0.197 1.00 0.00 H new ATOM 0 HA LEU A 108 -8.201 12.757 1.363 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -10.956 13.481 2.401 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -9.411 14.051 3.000 1.00 0.00 H new ATOM 0 HG LEU A 108 -10.367 14.670 0.201 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -11.153 16.835 1.071 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -12.065 15.474 1.765 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -10.811 16.288 2.729 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -8.791 16.554 0.419 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.357 15.995 2.052 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -7.978 14.985 0.636 1.00 0.00 H new ATOM 1700 N ASN A 109 -9.004 11.529 3.676 1.00 0.00 N ATOM 1701 CA ASN A 109 -9.092 10.465 4.670 1.00 0.00 C ATOM 1702 C ASN A 109 -9.752 10.970 5.950 1.00 0.00 C ATOM 1703 O ASN A 109 -9.175 11.748 6.709 1.00 0.00 O ATOM 1704 CB ASN A 109 -7.700 9.915 4.983 1.00 0.00 C ATOM 1705 CG ASN A 109 -7.746 8.499 5.523 1.00 0.00 C ATOM 1706 OD1 ASN A 109 -8.668 7.739 5.227 1.00 0.00 O ATOM 1707 ND2 ASN A 109 -6.747 8.138 6.321 1.00 0.00 N ATOM 0 H ASN A 109 -8.612 12.403 4.027 1.00 0.00 H new ATOM 0 HA ASN A 109 -9.706 9.665 4.257 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -7.092 9.936 4.079 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -7.212 10.563 5.711 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -6.724 7.198 6.715 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -6.003 8.801 6.539 1.00 0.00 H new ATOM 1714 N PRO A 110 -10.990 10.516 6.196 1.00 0.00 N ATOM 1715 CA PRO A 110 -11.754 10.907 7.384 1.00 0.00 C ATOM 1716 C PRO A 110 -11.177 10.315 8.665 1.00 0.00 C ATOM 1717 O PRO A 110 -11.602 10.664 9.767 1.00 0.00 O ATOM 1718 CB PRO A 110 -13.149 10.336 7.112 1.00 0.00 C ATOM 1719 CG PRO A 110 -12.916 9.195 6.183 1.00 0.00 C ATOM 1720 CD PRO A 110 -11.738 9.586 5.334 1.00 0.00 C ATOM 0 HA PRO A 110 -11.742 11.986 7.539 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -13.628 10.005 8.033 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -13.803 11.084 6.664 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -12.712 8.278 6.735 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -13.796 9.007 5.567 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -11.136 8.720 5.059 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -12.052 10.063 4.406 1.00 0.00 H new ATOM 1728 N TRP A 111 -10.208 9.420 8.514 1.00 0.00 N ATOM 1729 CA TRP A 111 -9.572 8.781 9.660 1.00 0.00 C ATOM 1730 C TRP A 111 -8.274 9.490 10.028 1.00 0.00 C ATOM 1731 O TRP A 111 -7.601 9.114 10.986 1.00 0.00 O ATOM 1732 CB TRP A 111 -9.295 7.307 9.359 1.00 0.00 C ATOM 1733 CG TRP A 111 -10.541 6.494 9.175 1.00 0.00 C ATOM 1734 CD1 TRP A 111 -11.785 6.961 8.858 1.00 0.00 C ATOM 1735 CD2 TRP A 111 -10.663 5.073 9.299 1.00 0.00 C ATOM 1736 NE1 TRP A 111 -12.673 5.915 8.777 1.00 0.00 N ATOM 1737 CE2 TRP A 111 -12.009 4.747 9.043 1.00 0.00 C ATOM 1738 CE3 TRP A 111 -9.766 4.044 9.600 1.00 0.00 C ATOM 1739 CZ2 TRP A 111 -12.477 3.436 9.080 1.00 0.00 C ATOM 1740 CZ3 TRP A 111 -10.232 2.744 9.636 1.00 0.00 C ATOM 1741 CH2 TRP A 111 -11.577 2.448 9.377 1.00 0.00 C ATOM 0 H TRP A 111 -9.845 9.120 7.609 1.00 0.00 H new ATOM 0 HA TRP A 111 -10.254 8.850 10.507 1.00 0.00 H new ATOM 0 HB2 TRP A 111 -8.687 7.236 8.457 1.00 0.00 H new ATOM 0 HB3 TRP A 111 -8.709 6.881 10.173 1.00 0.00 H new ATOM 0 HD1 TRP A 111 -12.034 7.999 8.695 1.00 0.00 H new ATOM 0 HE1 TRP A 111 -13.665 5.996 8.555 1.00 0.00 H new ATOM 0 HE3 TRP A 111 -8.727 4.261 9.801 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -13.514 3.207 8.881 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -9.547 1.941 9.868 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -11.910 1.421 9.412 1.00 0.00 H new ATOM 1752 N ASN A 112 -7.928 10.518 9.260 1.00 0.00 N ATOM 1753 CA ASN A 112 -6.709 11.280 9.506 1.00 0.00 C ATOM 1754 C ASN A 112 -6.984 12.780 9.452 1.00 0.00 C ATOM 1755 O ASN A 112 -6.456 13.488 8.595 1.00 0.00 O ATOM 1756 CB ASN A 112 -5.636 10.910 8.480 1.00 0.00 C ATOM 1757 CG ASN A 112 -4.352 11.693 8.678 1.00 0.00 C ATOM 1758 OD1 ASN A 112 -3.916 11.917 9.808 1.00 0.00 O ATOM 1759 ND2 ASN A 112 -3.740 12.114 7.577 1.00 0.00 N ATOM 0 H ASN A 112 -8.474 10.843 8.462 1.00 0.00 H new ATOM 0 HA ASN A 112 -6.350 11.030 10.504 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -5.422 9.843 8.550 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -6.019 11.093 7.476 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.873 12.646 7.647 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -4.137 11.905 6.661 1.00 0.00 H new ATOM 1766 N ASP A 113 -7.813 13.256 10.374 1.00 0.00 N ATOM 1767 CA ASP A 113 -8.158 14.672 10.433 1.00 0.00 C ATOM 1768 C ASP A 113 -8.647 15.170 9.077 1.00 0.00 C ATOM 1769 O ASP A 113 -8.295 16.266 8.643 1.00 0.00 O ATOM 1770 CB ASP A 113 -6.951 15.494 10.887 1.00 0.00 C ATOM 1771 CG ASP A 113 -6.862 15.609 12.396 1.00 0.00 C ATOM 1772 OD1 ASP A 113 -7.923 15.605 13.055 1.00 0.00 O ATOM 1773 OD2 ASP A 113 -5.732 15.701 12.918 1.00 0.00 O ATOM 0 H ASP A 113 -8.259 12.683 11.091 1.00 0.00 H new ATOM 0 HA ASP A 113 -8.964 14.794 11.156 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -6.039 15.035 10.506 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -7.011 16.492 10.453 1.00 0.00 H new ATOM 1778 N ASN A 114 -9.460 14.356 8.412 1.00 0.00 N ATOM 1779 CA ASN A 114 -9.997 14.712 7.103 1.00 0.00 C ATOM 1780 C ASN A 114 -8.905 15.290 6.207 1.00 0.00 C ATOM 1781 O ASN A 114 -9.128 16.264 5.487 1.00 0.00 O ATOM 1782 CB ASN A 114 -11.136 15.723 7.254 1.00 0.00 C ATOM 1783 CG ASN A 114 -10.756 16.895 8.138 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -10.755 16.787 9.365 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -10.431 18.023 7.518 1.00 0.00 N ATOM 0 H ASN A 114 -9.762 13.445 8.758 1.00 0.00 H new ATOM 0 HA ASN A 114 -10.384 13.806 6.637 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -11.423 16.092 6.269 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -12.009 15.223 7.674 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -10.167 18.845 8.061 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -10.446 18.067 6.499 1.00 0.00 H new ATOM 1792 N LYS A 115 -7.725 14.682 6.255 1.00 0.00 N ATOM 1793 CA LYS A 115 -6.598 15.132 5.447 1.00 0.00 C ATOM 1794 C LYS A 115 -6.539 14.374 4.125 1.00 0.00 C ATOM 1795 O LYS A 115 -7.059 13.264 4.010 1.00 0.00 O ATOM 1796 CB LYS A 115 -5.287 14.945 6.214 1.00 0.00 C ATOM 1797 CG LYS A 115 -5.051 15.997 7.283 1.00 0.00 C ATOM 1798 CD LYS A 115 -4.720 17.349 6.672 1.00 0.00 C ATOM 1799 CE LYS A 115 -5.051 18.487 7.625 1.00 0.00 C ATOM 1800 NZ LYS A 115 -5.215 19.781 6.907 1.00 0.00 N ATOM 0 H LYS A 115 -7.524 13.875 6.846 1.00 0.00 H new ATOM 0 HA LYS A 115 -6.738 16.191 5.232 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -5.286 13.960 6.680 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -4.457 14.965 5.508 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.939 16.087 7.908 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -4.235 15.680 7.932 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.661 17.384 6.415 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -5.277 17.476 5.744 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -5.968 18.253 8.166 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -4.258 18.581 8.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -5.440 20.531 7.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -4.332 20.017 6.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -5.988 19.699 6.216 1.00 0.00 H new ATOM 1814 N LYS A 116 -5.901 14.980 3.129 1.00 0.00 N ATOM 1815 CA LYS A 116 -5.771 14.362 1.815 1.00 0.00 C ATOM 1816 C LYS A 116 -5.049 13.022 1.913 1.00 0.00 C ATOM 1817 O LYS A 116 -4.035 12.901 2.601 1.00 0.00 O ATOM 1818 CB LYS A 116 -5.015 15.292 0.863 1.00 0.00 C ATOM 1819 CG LYS A 116 -4.811 14.708 -0.524 1.00 0.00 C ATOM 1820 CD LYS A 116 -3.838 15.541 -1.342 1.00 0.00 C ATOM 1821 CE LYS A 116 -4.434 16.890 -1.712 1.00 0.00 C ATOM 1822 NZ LYS A 116 -3.498 17.703 -2.537 1.00 0.00 N ATOM 0 H LYS A 116 -5.466 15.899 3.207 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.773 14.187 1.423 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -5.562 16.231 0.776 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -4.043 15.528 1.295 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -4.436 13.688 -0.439 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -5.769 14.653 -1.041 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -2.920 15.691 -0.775 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -3.568 15.000 -2.249 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -5.363 16.738 -2.261 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -4.686 17.437 -0.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -3.309 18.607 -2.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -2.605 17.184 -2.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -3.925 17.886 -3.467 1.00 0.00 H new ATOM 1836 N VAL A 117 -5.576 12.018 1.220 1.00 0.00 N ATOM 1837 CA VAL A 117 -4.980 10.687 1.227 1.00 0.00 C ATOM 1838 C VAL A 117 -3.458 10.767 1.267 1.00 0.00 C ATOM 1839 O VAL A 117 -2.835 10.404 2.264 1.00 0.00 O ATOM 1840 CB VAL A 117 -5.408 9.874 -0.009 1.00 0.00 C ATOM 1841 CG1 VAL A 117 -5.207 8.386 0.235 1.00 0.00 C ATOM 1842 CG2 VAL A 117 -6.855 10.173 -0.369 1.00 0.00 C ATOM 0 H VAL A 117 -6.415 12.101 0.646 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.338 10.184 2.125 1.00 0.00 H new ATOM 0 HB VAL A 117 -4.781 10.168 -0.850 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.515 7.828 -0.649 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.155 8.190 0.440 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.807 8.073 1.089 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -7.140 9.590 -1.245 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -7.500 9.909 0.469 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -6.963 11.235 -0.590 1.00 0.00 H new ATOM 1852 N GLN A 118 -2.867 11.245 0.177 1.00 0.00 N ATOM 1853 CA GLN A 118 -1.417 11.372 0.088 1.00 0.00 C ATOM 1854 C GLN A 118 -0.819 11.736 1.443 1.00 0.00 C ATOM 1855 O GLN A 118 0.239 11.232 1.821 1.00 0.00 O ATOM 1856 CB GLN A 118 -1.039 12.430 -0.950 1.00 0.00 C ATOM 1857 CG GLN A 118 -0.950 13.837 -0.381 1.00 0.00 C ATOM 1858 CD GLN A 118 -0.479 14.851 -1.404 1.00 0.00 C ATOM 1859 OE1 GLN A 118 -1.099 14.841 -2.578 1.00 0.00 O flip ATOM 1860 NE2 GLN A 118 0.433 15.636 -1.143 1.00 0.00 N flip ATOM 0 H GLN A 118 -3.369 11.551 -0.656 1.00 0.00 H new ATOM 0 HA GLN A 118 -1.011 10.409 -0.221 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -0.079 12.165 -1.393 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -1.775 12.418 -1.753 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.928 14.135 -0.004 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -0.267 13.839 0.468 1.00 0.00 H new ATOM 0 HE21 GLN A 118 0.882 15.610 -0.228 1.00 0.00 H new ATOM 0 HE22 GLN A 118 0.739 16.313 -1.842 1.00 0.00 H new ATOM 1869 N ILE A 119 -1.502 12.615 2.169 1.00 0.00 N ATOM 1870 CA ILE A 119 -1.038 13.046 3.482 1.00 0.00 C ATOM 1871 C ILE A 119 -1.221 11.943 4.519 1.00 0.00 C ATOM 1872 O ILE A 119 -2.029 12.071 5.439 1.00 0.00 O ATOM 1873 CB ILE A 119 -1.781 14.309 3.955 1.00 0.00 C ATOM 1874 CG1 ILE A 119 -1.675 15.414 2.902 1.00 0.00 C ATOM 1875 CG2 ILE A 119 -1.221 14.784 5.288 1.00 0.00 C ATOM 1876 CD1 ILE A 119 -2.317 16.716 3.326 1.00 0.00 C ATOM 0 H ILE A 119 -2.379 13.043 1.870 1.00 0.00 H new ATOM 0 HA ILE A 119 0.023 13.275 3.382 1.00 0.00 H new ATOM 0 HB ILE A 119 -2.834 14.064 4.092 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -0.623 15.593 2.679 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -2.143 15.071 1.979 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.756 15.678 5.610 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -1.343 13.999 6.034 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -0.162 15.016 5.176 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -2.204 17.453 2.531 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -3.377 16.553 3.521 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -1.834 17.082 4.232 1.00 0.00 H new ATOM 1888 N SER A 120 -0.466 10.861 4.364 1.00 0.00 N ATOM 1889 CA SER A 120 -0.546 9.734 5.286 1.00 0.00 C ATOM 1890 C SER A 120 0.846 9.288 5.722 1.00 0.00 C ATOM 1891 O SER A 120 1.849 9.662 5.114 1.00 0.00 O ATOM 1892 CB SER A 120 -1.287 8.565 4.633 1.00 0.00 C ATOM 1893 OG SER A 120 -1.994 7.806 5.598 1.00 0.00 O ATOM 0 H SER A 120 0.209 10.740 3.608 1.00 0.00 H new ATOM 0 HA SER A 120 -1.098 10.058 6.169 1.00 0.00 H new ATOM 0 HB2 SER A 120 -1.982 8.944 3.884 1.00 0.00 H new ATOM 0 HB3 SER A 120 -0.575 7.924 4.112 1.00 0.00 H new ATOM 0 HG SER A 120 -2.460 7.066 5.155 1.00 0.00 H new ATOM 1899 N ARG A 121 0.899 8.486 6.780 1.00 0.00 N ATOM 1900 CA ARG A 121 2.168 7.989 7.300 1.00 0.00 C ATOM 1901 C ARG A 121 2.351 6.512 6.966 1.00 0.00 C ATOM 1902 O ARG A 121 1.398 5.825 6.599 1.00 0.00 O ATOM 1903 CB ARG A 121 2.238 8.193 8.814 1.00 0.00 C ATOM 1904 CG ARG A 121 1.309 7.278 9.596 1.00 0.00 C ATOM 1905 CD ARG A 121 1.600 7.332 11.087 1.00 0.00 C ATOM 1906 NE ARG A 121 2.586 6.333 11.490 1.00 0.00 N ATOM 1907 CZ ARG A 121 2.948 6.124 12.751 1.00 0.00 C ATOM 1908 NH1 ARG A 121 2.408 6.841 13.727 1.00 0.00 N ATOM 1909 NH2 ARG A 121 3.852 5.196 13.038 1.00 0.00 N ATOM 0 H ARG A 121 0.078 8.166 7.294 1.00 0.00 H new ATOM 0 HA ARG A 121 2.972 8.553 6.827 1.00 0.00 H new ATOM 0 HB2 ARG A 121 3.262 8.027 9.147 1.00 0.00 H new ATOM 0 HB3 ARG A 121 1.992 9.230 9.044 1.00 0.00 H new ATOM 0 HG2 ARG A 121 0.274 7.568 9.415 1.00 0.00 H new ATOM 0 HG3 ARG A 121 1.420 6.254 9.239 1.00 0.00 H new ATOM 0 HD2 ARG A 121 1.963 8.326 11.349 1.00 0.00 H new ATOM 0 HD3 ARG A 121 0.676 7.173 11.642 1.00 0.00 H new ATOM 0 HE ARG A 121 3.021 5.764 10.763 1.00 0.00 H new ATOM 0 HH11 ARG A 121 1.713 7.555 13.511 1.00 0.00 H new ATOM 0 HH12 ARG A 121 2.688 6.678 14.694 1.00 0.00 H new ATOM 0 HH21 ARG A 121 4.270 4.642 12.290 1.00 0.00 H new ATOM 0 HH22 ARG A 121 4.129 5.036 14.007 1.00 0.00 H new ATOM 1923 N ASP A 122 3.583 6.030 7.094 1.00 0.00 N ATOM 1924 CA ASP A 122 3.891 4.634 6.807 1.00 0.00 C ATOM 1925 C ASP A 122 3.178 3.707 7.786 1.00 0.00 C ATOM 1926 O ASP A 122 3.400 3.774 8.994 1.00 0.00 O ATOM 1927 CB ASP A 122 5.401 4.400 6.871 1.00 0.00 C ATOM 1928 CG ASP A 122 6.036 5.042 8.089 1.00 0.00 C ATOM 1929 OD1 ASP A 122 5.309 5.294 9.073 1.00 0.00 O ATOM 1930 OD2 ASP A 122 7.259 5.291 8.058 1.00 0.00 O ATOM 0 H ASP A 122 4.384 6.586 7.395 1.00 0.00 H new ATOM 0 HA ASP A 122 3.538 4.409 5.800 1.00 0.00 H new ATOM 0 HB2 ASP A 122 5.599 3.328 6.884 1.00 0.00 H new ATOM 0 HB3 ASP A 122 5.866 4.799 5.970 1.00 0.00 H new ATOM 1935 N GLY A 123 2.319 2.842 7.256 1.00 0.00 N ATOM 1936 CA GLY A 123 1.585 1.914 8.097 1.00 0.00 C ATOM 1937 C GLY A 123 0.298 2.510 8.631 1.00 0.00 C ATOM 1938 O GLY A 123 -0.221 2.065 9.655 1.00 0.00 O ATOM 0 H GLY A 123 2.118 2.767 6.259 1.00 0.00 H new ATOM 0 HA2 GLY A 123 1.356 1.014 7.526 1.00 0.00 H new ATOM 0 HA3 GLY A 123 2.215 1.609 8.933 1.00 0.00 H new ATOM 1942 N GLN A 124 -0.218 3.519 7.937 1.00 0.00 N ATOM 1943 CA GLN A 124 -1.452 4.178 8.350 1.00 0.00 C ATOM 1944 C GLN A 124 -2.664 3.519 7.700 1.00 0.00 C ATOM 1945 O GLN A 124 -2.674 3.268 6.495 1.00 0.00 O ATOM 1946 CB GLN A 124 -1.408 5.663 7.987 1.00 0.00 C ATOM 1947 CG GLN A 124 -2.474 6.492 8.684 1.00 0.00 C ATOM 1948 CD GLN A 124 -2.329 6.479 10.193 1.00 0.00 C ATOM 1949 OE1 GLN A 124 -1.462 7.153 10.751 1.00 0.00 O ATOM 1950 NE2 GLN A 124 -3.179 5.710 10.864 1.00 0.00 N ATOM 0 H GLN A 124 0.199 3.898 7.087 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.543 4.079 9.432 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -0.426 6.062 8.241 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -1.525 5.768 6.908 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -2.421 7.520 8.326 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -3.459 6.111 8.414 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -3.882 5.168 10.362 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -3.129 5.662 11.882 1.00 0.00 H new ATOM 1959 N GLU A 125 -3.684 3.241 8.506 1.00 0.00 N ATOM 1960 CA GLU A 125 -4.901 2.610 8.008 1.00 0.00 C ATOM 1961 C GLU A 125 -5.664 3.554 7.083 1.00 0.00 C ATOM 1962 O GLU A 125 -5.752 4.756 7.339 1.00 0.00 O ATOM 1963 CB GLU A 125 -5.796 2.187 9.174 1.00 0.00 C ATOM 1964 CG GLU A 125 -6.881 1.199 8.781 1.00 0.00 C ATOM 1965 CD GLU A 125 -6.341 -0.199 8.550 1.00 0.00 C ATOM 1966 OE1 GLU A 125 -5.911 -0.838 9.533 1.00 0.00 O ATOM 1967 OE2 GLU A 125 -6.347 -0.654 7.387 1.00 0.00 O ATOM 0 H GLU A 125 -3.692 3.443 9.506 1.00 0.00 H new ATOM 0 HA GLU A 125 -4.615 1.725 7.440 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -5.177 1.743 9.954 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -6.262 3.074 9.604 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -7.639 1.167 9.564 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -7.374 1.548 7.874 1.00 0.00 H new ATOM 1974 N LEU A 126 -6.213 3.002 6.007 1.00 0.00 N ATOM 1975 CA LEU A 126 -6.968 3.794 5.042 1.00 0.00 C ATOM 1976 C LEU A 126 -8.387 3.255 4.888 1.00 0.00 C ATOM 1977 O LEU A 126 -8.586 2.065 4.648 1.00 0.00 O ATOM 1978 CB LEU A 126 -6.260 3.793 3.686 1.00 0.00 C ATOM 1979 CG LEU A 126 -6.805 4.770 2.643 1.00 0.00 C ATOM 1980 CD1 LEU A 126 -6.678 6.203 3.137 1.00 0.00 C ATOM 1981 CD2 LEU A 126 -6.080 4.594 1.317 1.00 0.00 C ATOM 0 H LEU A 126 -6.150 2.009 5.781 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.025 4.817 5.414 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.206 4.017 3.849 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.311 2.786 3.273 1.00 0.00 H new ATOM 0 HG LEU A 126 -7.862 4.554 2.487 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -7.071 6.884 2.382 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -7.244 6.321 4.061 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.629 6.432 3.322 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.481 5.297 0.587 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -5.016 4.783 1.456 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.223 3.575 0.956 1.00 0.00 H new ATOM 1993 N GLU A 127 -9.369 4.141 5.026 1.00 0.00 N ATOM 1994 CA GLU A 127 -10.769 3.754 4.900 1.00 0.00 C ATOM 1995 C GLU A 127 -11.024 3.059 3.566 1.00 0.00 C ATOM 1996 O GLU A 127 -10.506 3.456 2.522 1.00 0.00 O ATOM 1997 CB GLU A 127 -11.674 4.981 5.030 1.00 0.00 C ATOM 1998 CG GLU A 127 -13.112 4.642 5.385 1.00 0.00 C ATOM 1999 CD GLU A 127 -13.965 5.876 5.607 1.00 0.00 C ATOM 2000 OE1 GLU A 127 -14.320 6.540 4.611 1.00 0.00 O ATOM 2001 OE2 GLU A 127 -14.277 6.177 6.778 1.00 0.00 O ATOM 0 H GLU A 127 -9.221 5.130 5.225 1.00 0.00 H new ATOM 0 HA GLU A 127 -11.000 3.055 5.704 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -11.267 5.643 5.794 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -11.661 5.533 4.090 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -13.548 4.043 4.586 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -13.125 4.029 6.286 1.00 0.00 H new ATOM 2008 N PRO A 128 -11.842 1.996 3.599 1.00 0.00 N ATOM 2009 CA PRO A 128 -12.185 1.223 2.402 1.00 0.00 C ATOM 2010 C PRO A 128 -13.079 2.004 1.444 1.00 0.00 C ATOM 2011 O PRO A 128 -13.412 1.523 0.362 1.00 0.00 O ATOM 2012 CB PRO A 128 -12.932 0.012 2.964 1.00 0.00 C ATOM 2013 CG PRO A 128 -13.489 0.480 4.264 1.00 0.00 C ATOM 2014 CD PRO A 128 -12.494 1.468 4.809 1.00 0.00 C ATOM 0 HA PRO A 128 -11.302 0.963 1.818 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -13.723 -0.313 2.289 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -12.262 -0.837 3.103 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -14.465 0.945 4.126 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -13.628 -0.354 4.952 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -12.983 2.258 5.380 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -11.777 0.990 5.476 1.00 0.00 H new ATOM 2022 N GLN A 129 -13.463 3.210 1.851 1.00 0.00 N ATOM 2023 CA GLN A 129 -14.319 4.056 1.028 1.00 0.00 C ATOM 2024 C GLN A 129 -13.486 4.938 0.104 1.00 0.00 C ATOM 2025 O GLN A 129 -13.756 5.032 -1.093 1.00 0.00 O ATOM 2026 CB GLN A 129 -15.215 4.925 1.912 1.00 0.00 C ATOM 2027 CG GLN A 129 -16.550 5.270 1.273 1.00 0.00 C ATOM 2028 CD GLN A 129 -17.158 6.538 1.839 1.00 0.00 C ATOM 2029 OE1 GLN A 129 -18.216 6.506 2.469 1.00 0.00 O ATOM 2030 NE2 GLN A 129 -16.491 7.664 1.618 1.00 0.00 N ATOM 0 H GLN A 129 -13.195 3.623 2.745 1.00 0.00 H new ATOM 0 HA GLN A 129 -14.945 3.408 0.414 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -15.396 4.406 2.853 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -14.688 5.848 2.153 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -16.415 5.385 0.198 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -17.244 4.442 1.420 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -15.618 7.645 1.091 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -16.851 8.549 1.975 1.00 0.00 H new ATOM 2039 N VAL A 130 -12.471 5.586 0.669 1.00 0.00 N ATOM 2040 CA VAL A 130 -11.598 6.460 -0.104 1.00 0.00 C ATOM 2041 C VAL A 130 -10.441 5.679 -0.718 1.00 0.00 C ATOM 2042 O VAL A 130 -9.865 6.092 -1.723 1.00 0.00 O ATOM 2043 CB VAL A 130 -11.030 7.597 0.767 1.00 0.00 C ATOM 2044 CG1 VAL A 130 -12.156 8.395 1.405 1.00 0.00 C ATOM 2045 CG2 VAL A 130 -10.093 7.039 1.827 1.00 0.00 C ATOM 0 H VAL A 130 -12.234 5.521 1.659 1.00 0.00 H new ATOM 0 HA VAL A 130 -12.205 6.890 -0.901 1.00 0.00 H new ATOM 0 HB VAL A 130 -10.458 8.270 0.128 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -11.735 9.193 2.016 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -12.783 8.827 0.625 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -12.758 7.737 2.032 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -9.701 7.856 2.433 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.638 6.343 2.465 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.267 6.517 1.344 1.00 0.00 H new ATOM 2055 N GLY A 131 -10.108 4.547 -0.106 1.00 0.00 N ATOM 2056 CA GLY A 131 -9.022 3.725 -0.607 1.00 0.00 C ATOM 2057 C GLY A 131 -9.393 2.984 -1.876 1.00 0.00 C ATOM 2058 O GLY A 131 -8.533 2.693 -2.706 1.00 0.00 O ATOM 0 H GLY A 131 -10.571 4.184 0.728 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -8.153 4.354 -0.798 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -8.732 3.005 0.159 1.00 0.00 H new ATOM 2062 N GLU A 132 -10.678 2.676 -2.024 1.00 0.00 N ATOM 2063 CA GLU A 132 -11.160 1.961 -3.200 1.00 0.00 C ATOM 2064 C GLU A 132 -11.273 2.899 -4.399 1.00 0.00 C ATOM 2065 O GLU A 132 -10.816 2.578 -5.496 1.00 0.00 O ATOM 2066 CB GLU A 132 -12.518 1.317 -2.912 1.00 0.00 C ATOM 2067 CG GLU A 132 -13.688 2.276 -3.053 1.00 0.00 C ATOM 2068 CD GLU A 132 -15.010 1.646 -2.660 1.00 0.00 C ATOM 2069 OE1 GLU A 132 -15.166 1.289 -1.473 1.00 0.00 O ATOM 2070 OE2 GLU A 132 -15.887 1.509 -3.537 1.00 0.00 O ATOM 0 H GLU A 132 -11.403 2.910 -1.345 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.439 1.179 -3.439 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.664 0.477 -3.591 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.511 0.912 -1.900 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.510 3.154 -2.432 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.747 2.622 -4.085 1.00 0.00 H new ATOM 2077 N GLN A 133 -11.886 4.058 -4.180 1.00 0.00 N ATOM 2078 CA GLN A 133 -12.060 5.042 -5.242 1.00 0.00 C ATOM 2079 C GLN A 133 -10.726 5.678 -5.619 1.00 0.00 C ATOM 2080 O GLN A 133 -10.631 6.403 -6.610 1.00 0.00 O ATOM 2081 CB GLN A 133 -13.050 6.124 -4.806 1.00 0.00 C ATOM 2082 CG GLN A 133 -12.618 6.875 -3.556 1.00 0.00 C ATOM 2083 CD GLN A 133 -13.679 7.836 -3.058 1.00 0.00 C ATOM 2084 OE1 GLN A 133 -13.318 8.663 -2.084 1.00 0.00 O flip ATOM 2085 NE2 GLN A 133 -14.811 7.835 -3.542 1.00 0.00 N flip ATOM 0 H GLN A 133 -12.270 4.338 -3.278 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.457 4.528 -6.118 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -13.180 6.836 -5.621 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -14.022 5.665 -4.626 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -12.384 6.158 -2.769 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -11.702 7.428 -3.767 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -15.045 7.182 -4.290 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -15.514 8.487 -3.195 1.00 0.00 H new ATOM 2094 N LEU A 134 -9.699 5.402 -4.823 1.00 0.00 N ATOM 2095 CA LEU A 134 -8.369 5.948 -5.073 1.00 0.00 C ATOM 2096 C LEU A 134 -7.626 5.115 -6.113 1.00 0.00 C ATOM 2097 O LEU A 134 -6.813 5.638 -6.877 1.00 0.00 O ATOM 2098 CB LEU A 134 -7.565 5.998 -3.774 1.00 0.00 C ATOM 2099 CG LEU A 134 -6.050 6.143 -3.927 1.00 0.00 C ATOM 2100 CD1 LEU A 134 -5.684 7.576 -4.284 1.00 0.00 C ATOM 2101 CD2 LEU A 134 -5.341 5.711 -2.652 1.00 0.00 C ATOM 0 H LEU A 134 -9.761 4.804 -3.999 1.00 0.00 H new ATOM 0 HA LEU A 134 -8.485 6.960 -5.460 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -7.931 6.832 -3.176 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -7.768 5.088 -3.210 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.722 5.493 -4.739 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.602 7.660 -4.389 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.162 7.850 -5.224 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -6.025 8.246 -3.495 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -4.264 5.821 -2.779 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -5.674 6.334 -1.822 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.577 4.668 -2.440 1.00 0.00 H new ATOM 2113 N LEU A 135 -7.911 3.818 -6.139 1.00 0.00 N ATOM 2114 CA LEU A 135 -7.272 2.913 -7.087 1.00 0.00 C ATOM 2115 C LEU A 135 -7.884 3.058 -8.476 1.00 0.00 C ATOM 2116 O LEU A 135 -7.168 3.159 -9.472 1.00 0.00 O ATOM 2117 CB LEU A 135 -7.402 1.466 -6.608 1.00 0.00 C ATOM 2118 CG LEU A 135 -6.936 1.187 -5.179 1.00 0.00 C ATOM 2119 CD1 LEU A 135 -6.880 -0.310 -4.918 1.00 0.00 C ATOM 2120 CD2 LEU A 135 -5.578 1.826 -4.927 1.00 0.00 C ATOM 0 H LEU A 135 -8.581 3.369 -5.514 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.216 3.176 -7.147 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -8.447 1.169 -6.692 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -6.834 0.828 -7.285 1.00 0.00 H new ATOM 0 HG LEU A 135 -7.656 1.628 -4.490 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -6.546 -0.489 -3.896 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -7.872 -0.741 -5.057 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -6.182 -0.775 -5.614 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -5.262 1.617 -3.905 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -4.848 1.415 -5.624 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.651 2.904 -5.071 1.00 0.00 H new ATOM 2132 N GLN A 136 -9.212 3.068 -8.534 1.00 0.00 N ATOM 2133 CA GLN A 136 -9.919 3.203 -9.802 1.00 0.00 C ATOM 2134 C GLN A 136 -9.310 4.314 -10.651 1.00 0.00 C ATOM 2135 O GLN A 136 -9.374 4.276 -11.880 1.00 0.00 O ATOM 2136 CB GLN A 136 -11.402 3.489 -9.555 1.00 0.00 C ATOM 2137 CG GLN A 136 -11.647 4.631 -8.582 1.00 0.00 C ATOM 2138 CD GLN A 136 -13.122 4.883 -8.338 1.00 0.00 C ATOM 2139 OE1 GLN A 136 -13.851 3.993 -7.899 1.00 0.00 O ATOM 2140 NE2 GLN A 136 -13.570 6.100 -8.623 1.00 0.00 N ATOM 0 H GLN A 136 -9.819 2.984 -7.719 1.00 0.00 H new ATOM 0 HA GLN A 136 -9.822 2.262 -10.344 1.00 0.00 H new ATOM 0 HB2 GLN A 136 -11.882 3.723 -10.505 1.00 0.00 H new ATOM 0 HB3 GLN A 136 -11.879 2.587 -9.171 1.00 0.00 H new ATOM 0 HG2 GLN A 136 -11.159 4.406 -7.634 1.00 0.00 H new ATOM 0 HG3 GLN A 136 -11.186 5.539 -8.970 1.00 0.00 H new ATOM 0 HE21 GLN A 136 -12.930 6.807 -8.985 1.00 0.00 H new ATOM 0 HE22 GLN A 136 -14.554 6.328 -8.480 1.00 0.00 H new ATOM 2149 N LEU A 137 -8.720 5.302 -9.987 1.00 0.00 N ATOM 2150 CA LEU A 137 -8.098 6.425 -10.681 1.00 0.00 C ATOM 2151 C LEU A 137 -7.124 5.935 -11.747 1.00 0.00 C ATOM 2152 O LEU A 137 -7.096 6.456 -12.862 1.00 0.00 O ATOM 2153 CB LEU A 137 -7.369 7.326 -9.683 1.00 0.00 C ATOM 2154 CG LEU A 137 -8.256 8.196 -8.792 1.00 0.00 C ATOM 2155 CD1 LEU A 137 -7.439 8.816 -7.668 1.00 0.00 C ATOM 2156 CD2 LEU A 137 -8.941 9.278 -9.615 1.00 0.00 C ATOM 0 H LEU A 137 -8.659 5.349 -8.970 1.00 0.00 H new ATOM 0 HA LEU A 137 -8.885 6.998 -11.171 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -6.750 6.698 -9.043 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -6.695 7.978 -10.238 1.00 0.00 H new ATOM 0 HG LEU A 137 -9.025 7.563 -8.349 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -8.087 9.432 -7.044 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -6.996 8.026 -7.062 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -6.648 9.435 -8.092 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -9.568 9.888 -8.965 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -8.187 9.908 -10.087 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -9.559 8.814 -10.384 1.00 0.00 H new ATOM 2168 N TRP A 138 -6.330 4.930 -11.398 1.00 0.00 N ATOM 2169 CA TRP A 138 -5.355 4.367 -12.326 1.00 0.00 C ATOM 2170 C TRP A 138 -6.025 3.950 -13.631 1.00 0.00 C ATOM 2171 O TRP A 138 -5.389 3.928 -14.685 1.00 0.00 O ATOM 2172 CB TRP A 138 -4.651 3.166 -11.693 1.00 0.00 C ATOM 2173 CG TRP A 138 -3.396 3.532 -10.960 1.00 0.00 C ATOM 2174 CD1 TRP A 138 -2.124 3.527 -11.459 1.00 0.00 C ATOM 2175 CD2 TRP A 138 -3.292 3.956 -9.596 1.00 0.00 C ATOM 2176 NE1 TRP A 138 -1.236 3.921 -10.487 1.00 0.00 N ATOM 2177 CE2 TRP A 138 -1.928 4.191 -9.336 1.00 0.00 C ATOM 2178 CE3 TRP A 138 -4.219 4.161 -8.571 1.00 0.00 C ATOM 2179 CZ2 TRP A 138 -1.471 4.619 -8.092 1.00 0.00 C ATOM 2180 CZ3 TRP A 138 -3.764 4.586 -7.337 1.00 0.00 C ATOM 2181 CH2 TRP A 138 -2.400 4.812 -7.106 1.00 0.00 C ATOM 0 H TRP A 138 -6.342 4.488 -10.479 1.00 0.00 H new ATOM 0 HA TRP A 138 -4.615 5.136 -12.548 1.00 0.00 H new ATOM 0 HB2 TRP A 138 -5.336 2.675 -11.002 1.00 0.00 H new ATOM 0 HB3 TRP A 138 -4.410 2.443 -12.472 1.00 0.00 H new ATOM 0 HD1 TRP A 138 -1.856 3.254 -12.469 1.00 0.00 H new ATOM 0 HE1 TRP A 138 -0.226 4.000 -10.604 1.00 0.00 H new ATOM 0 HE3 TRP A 138 -5.272 3.990 -8.740 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 -0.420 4.792 -7.912 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 -4.472 4.747 -6.537 1.00 0.00 H new ATOM 0 HH2 TRP A 138 -2.076 5.145 -6.131 1.00 0.00 H new ATOM 2192 N GLU A 139 -7.310 3.620 -13.553 1.00 0.00 N ATOM 2193 CA GLU A 139 -8.064 3.203 -14.729 1.00 0.00 C ATOM 2194 C GLU A 139 -8.344 4.391 -15.645 1.00 0.00 C ATOM 2195 O GLU A 139 -8.567 4.224 -16.845 1.00 0.00 O ATOM 2196 CB GLU A 139 -9.381 2.545 -14.312 1.00 0.00 C ATOM 2197 CG GLU A 139 -9.213 1.459 -13.263 1.00 0.00 C ATOM 2198 CD GLU A 139 -10.375 0.485 -13.241 1.00 0.00 C ATOM 2199 OE1 GLU A 139 -10.434 -0.387 -14.133 1.00 0.00 O ATOM 2200 OE2 GLU A 139 -11.224 0.594 -12.332 1.00 0.00 O ATOM 0 H GLU A 139 -7.850 3.633 -12.688 1.00 0.00 H new ATOM 0 HA GLU A 139 -7.462 2.478 -15.276 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -10.054 3.311 -13.926 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -9.858 2.117 -15.193 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -8.290 0.913 -13.455 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -9.112 1.920 -12.281 1.00 0.00 H new ATOM 2207 N ARG A 140 -8.330 5.589 -15.071 1.00 0.00 N ATOM 2208 CA ARG A 140 -8.585 6.805 -15.835 1.00 0.00 C ATOM 2209 C ARG A 140 -7.344 7.224 -16.619 1.00 0.00 C ATOM 2210 O ARG A 140 -7.415 8.077 -17.504 1.00 0.00 O ATOM 2211 CB ARG A 140 -9.018 7.937 -14.902 1.00 0.00 C ATOM 2212 CG ARG A 140 -10.297 7.640 -14.137 1.00 0.00 C ATOM 2213 CD ARG A 140 -10.909 8.908 -13.560 1.00 0.00 C ATOM 2214 NE ARG A 140 -11.708 9.628 -14.548 1.00 0.00 N ATOM 2215 CZ ARG A 140 -12.019 10.915 -14.444 1.00 0.00 C ATOM 2216 NH1 ARG A 140 -11.601 11.620 -13.402 1.00 0.00 N ATOM 2217 NH2 ARG A 140 -12.751 11.500 -15.384 1.00 0.00 N ATOM 0 H ARG A 140 -8.145 5.744 -14.080 1.00 0.00 H new ATOM 0 HA ARG A 140 -9.388 6.599 -16.542 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -8.217 8.136 -14.190 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -9.158 8.846 -15.488 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -11.015 7.157 -14.800 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -10.085 6.938 -13.331 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -11.534 8.652 -12.705 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -10.116 9.558 -13.192 1.00 0.00 H new ATOM 0 HE ARG A 140 -12.046 9.115 -15.362 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -11.039 11.174 -12.677 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -11.842 12.608 -13.325 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -13.075 10.961 -16.187 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -12.989 12.488 -15.303 1.00 0.00 H new ATOM 2231 N LEU A 141 -6.209 6.619 -16.287 1.00 0.00 N ATOM 2232 CA LEU A 141 -4.952 6.929 -16.959 1.00 0.00 C ATOM 2233 C LEU A 141 -4.924 6.333 -18.363 1.00 0.00 C ATOM 2234 O LEU A 141 -3.888 6.334 -19.028 1.00 0.00 O ATOM 2235 CB LEU A 141 -3.771 6.400 -16.144 1.00 0.00 C ATOM 2236 CG LEU A 141 -3.748 6.789 -14.666 1.00 0.00 C ATOM 2237 CD1 LEU A 141 -2.512 6.221 -13.984 1.00 0.00 C ATOM 2238 CD2 LEU A 141 -3.796 8.302 -14.512 1.00 0.00 C ATOM 0 H LEU A 141 -6.133 5.911 -15.557 1.00 0.00 H new ATOM 0 HA LEU A 141 -4.871 8.013 -17.043 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -3.766 5.312 -16.213 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -2.849 6.753 -16.606 1.00 0.00 H new ATOM 0 HG LEU A 141 -4.630 6.367 -14.185 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -2.512 6.508 -12.932 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -2.520 5.134 -14.063 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -1.617 6.614 -14.467 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.779 8.561 -13.453 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -2.933 8.746 -15.008 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -4.711 8.685 -14.964 1.00 0.00 H new