USER MOD reduce.3.24.130724 H: found=0, std=0, add=1220, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1224 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 147 ASN : amide:sc= -3.83! K(o=-4.4!,f=-0.61) USER MOD Set 1.2: A 165 ASN : amide:sc= -0.313 K(o=-4.4,f=-2.1) USER MOD Set 1.3: A 166 SER OG : rot 180:sc= -0.25 USER MOD Set 2.1: A 54 SER OG : rot 127:sc= 0.491 USER MOD Set 2.2: A 84 THR OG1 : rot -12:sc= 1.11 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ -169:sc= -0.0297 (180deg=-0.178) USER MOD Single : A 21 THR OG1 : rot 65:sc= 0.587 USER MOD Single : A 28 ASN : amide:sc= -0.0323 K(o=-0.032,f=-1.2) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -145:sc= 0.38 (180deg=-0.942) USER MOD Single : A 39 ASN : amide:sc= -0.764 K(o=-0.76,f=-1.9) USER MOD Single : A 41 SER OG : rot 20:sc= -1.09 USER MOD Single : A 43 LYS NZ :NH3+ 147:sc= -1.73 (180deg=-3.12!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.02 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -1.52 K(o=-1.5,f=-2.8) USER MOD Single : A 50 THR OG1 : rot 150:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.0242 USER MOD Single : A 57 SER OG : rot 26:sc= 0.923 USER MOD Single : A 63 HIS : no HE2:sc= 0.289 K(o=0.29,f=-3.1!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS : no HD1:sc= -2.46! K(o=-2.5!,f=-0.26) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot 165:sc=-0.00343 USER MOD Single : A 74 ASN : amide:sc= -0.33 X(o=-0.33,f=-0.68) USER MOD Single : A 76 GLN : amide:sc= -0.99! K(o=-0.99!,f=-0.28) USER MOD Single : A 77 LYS NZ :NH3+ -105:sc= -3.61! (180deg=-6.67!) USER MOD Single : A 92 TYR OH : rot 73:sc= -0.692 USER MOD Single : A 94 MET CE :methyl 137:sc= -2.22! (180deg=-2.92!) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.357 X(o=-0.36,f=-0.039) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= -0.688 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 26:sc= 0.0374 USER MOD Single : A 115 ASN : amide:sc= -2.77 X(o=-2.8,f=-2.9!) USER MOD Single : A 118 ASN : amide:sc= -0.128 X(o=-0.13,f=0) USER MOD Single : A 122 TYR OH : rot 37:sc= 0.17 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 GLN : amide:sc= -2.8 K(o=-2.8,f=-3.6!) USER MOD Single : A 132 MET CE :methyl -134:sc= -4.26! (180deg=-8.52!) USER MOD Single : A 133 TYR OH : rot 130:sc= 0.0454 USER MOD Single : A 141 SER OG : rot 180:sc= 0.0161 USER MOD Single : A 150 HIS : no HE2:sc= -2.83! C(o=-2.8!,f=-5.4!) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0.0856 USER MOD Single : A 153 ASN : amide:sc= 0.0724 K(o=0.072,f=-7.4!) USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 SER OG : rot 50:sc= -1.38 USER MOD Single : A 164 MET CE :methyl 162:sc= -0.217 (180deg=-0.841) USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 169 HIS : no HD1:sc= -0.248 X(o=-0.25,f=-0.51) USER MOD Single : A 175 HIS : no HD1:sc= -0.527 K(o=-0.53,f=-6.1!) USER MOD Single : A 177 THR OG1 : rot -140:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 79 N VAL A 8 9.949 13.348 -4.312 1.00 0.00 N ATOM 80 CA VAL A 8 10.650 12.137 -3.904 1.00 0.00 C ATOM 81 C VAL A 8 12.044 12.495 -3.378 1.00 0.00 C ATOM 82 O VAL A 8 12.705 13.391 -3.908 1.00 0.00 O ATOM 83 CB VAL A 8 10.750 11.117 -5.073 1.00 0.00 C ATOM 84 CG1 VAL A 8 11.502 11.701 -6.258 1.00 0.00 C ATOM 85 CG2 VAL A 8 11.397 9.813 -4.620 1.00 0.00 C ATOM 0 HA VAL A 8 10.078 11.664 -3.106 1.00 0.00 H new ATOM 0 HB VAL A 8 9.732 10.897 -5.394 1.00 0.00 H new ATOM 0 HG11 VAL A 8 11.553 10.961 -7.057 1.00 0.00 H new ATOM 0 HG12 VAL A 8 10.981 12.588 -6.618 1.00 0.00 H new ATOM 0 HG13 VAL A 8 12.512 11.973 -5.950 1.00 0.00 H new ATOM 0 HG21 VAL A 8 11.451 9.122 -5.461 1.00 0.00 H new ATOM 0 HG22 VAL A 8 12.402 10.015 -4.251 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.800 9.368 -3.824 1.00 0.00 H new ATOM 95 N ILE A 9 12.469 11.816 -2.316 1.00 0.00 N ATOM 96 CA ILE A 9 13.767 12.076 -1.697 1.00 0.00 C ATOM 97 C ILE A 9 14.466 10.777 -1.301 1.00 0.00 C ATOM 98 O ILE A 9 13.840 9.714 -1.251 1.00 0.00 O ATOM 99 CB ILE A 9 13.663 12.985 -0.437 1.00 0.00 C ATOM 100 CG1 ILE A 9 12.699 12.406 0.621 1.00 0.00 C ATOM 101 CG2 ILE A 9 13.252 14.396 -0.824 1.00 0.00 C ATOM 102 CD1 ILE A 9 11.220 12.644 0.342 1.00 0.00 C ATOM 0 H ILE A 9 11.930 11.077 -1.863 1.00 0.00 H new ATOM 0 HA ILE A 9 14.351 12.598 -2.455 1.00 0.00 H new ATOM 0 HB ILE A 9 14.654 13.021 0.016 1.00 0.00 H new ATOM 0 HG12 ILE A 9 12.871 11.332 0.699 1.00 0.00 H new ATOM 0 HG13 ILE A 9 12.945 12.839 1.591 1.00 0.00 H new ATOM 0 HG21 ILE A 9 13.185 15.014 0.071 1.00 0.00 H new ATOM 0 HG22 ILE A 9 13.994 14.818 -1.502 1.00 0.00 H new ATOM 0 HG23 ILE A 9 12.281 14.369 -1.319 1.00 0.00 H new ATOM 0 HD11 ILE A 9 10.623 12.201 1.140 1.00 0.00 H new ATOM 0 HD12 ILE A 9 11.026 13.716 0.296 1.00 0.00 H new ATOM 0 HD13 ILE A 9 10.951 12.186 -0.610 1.00 0.00 H new ATOM 114 N ASP A 10 15.763 10.882 -1.019 1.00 0.00 N ATOM 115 CA ASP A 10 16.580 9.738 -0.611 1.00 0.00 C ATOM 116 C ASP A 10 16.029 9.077 0.638 1.00 0.00 C ATOM 117 O ASP A 10 15.440 9.748 1.493 1.00 0.00 O ATOM 118 CB ASP A 10 18.030 10.169 -0.369 1.00 0.00 C ATOM 119 CG ASP A 10 18.756 10.535 -1.650 1.00 0.00 C ATOM 120 OD1 ASP A 10 18.427 11.575 -2.253 1.00 0.00 O ATOM 121 OD2 ASP A 10 19.656 9.774 -2.074 1.00 0.00 O ATOM 0 H ASP A 10 16.278 11.761 -1.066 1.00 0.00 H new ATOM 0 HA ASP A 10 16.551 9.013 -1.424 1.00 0.00 H new ATOM 0 HB2 ASP A 10 18.042 11.024 0.307 1.00 0.00 H new ATOM 0 HB3 ASP A 10 18.566 9.361 0.129 1.00 0.00 H new ATOM 126 N GLY A 11 16.225 7.761 0.723 1.00 0.00 N ATOM 127 CA GLY A 11 15.749 6.977 1.857 1.00 0.00 C ATOM 128 C GLY A 11 16.494 7.263 3.147 1.00 0.00 C ATOM 129 O GLY A 11 16.978 6.355 3.824 1.00 0.00 O ATOM 0 H GLY A 11 16.714 7.215 0.014 1.00 0.00 H new ATOM 0 HA2 GLY A 11 14.688 7.178 2.007 1.00 0.00 H new ATOM 0 HA3 GLY A 11 15.842 5.917 1.620 1.00 0.00 H new ATOM 133 N ALA A 12 16.586 8.533 3.486 1.00 0.00 N ATOM 134 CA ALA A 12 17.271 8.952 4.698 1.00 0.00 C ATOM 135 C ALA A 12 16.838 10.350 5.119 1.00 0.00 C ATOM 136 O ALA A 12 16.843 10.685 6.303 1.00 0.00 O ATOM 137 CB ALA A 12 18.777 8.912 4.492 1.00 0.00 C ATOM 0 H ALA A 12 16.194 9.298 2.938 1.00 0.00 H new ATOM 0 HA ALA A 12 17.001 8.258 5.494 1.00 0.00 H new ATOM 0 HB1 ALA A 12 19.278 9.228 5.407 1.00 0.00 H new ATOM 0 HB2 ALA A 12 19.083 7.896 4.243 1.00 0.00 H new ATOM 0 HB3 ALA A 12 19.051 9.583 3.678 1.00 0.00 H new ATOM 143 N SER A 13 16.495 11.170 4.141 1.00 0.00 N ATOM 144 CA SER A 13 16.091 12.547 4.400 1.00 0.00 C ATOM 145 C SER A 13 14.694 12.650 5.037 1.00 0.00 C ATOM 146 O SER A 13 14.403 13.620 5.736 1.00 0.00 O ATOM 147 CB SER A 13 16.131 13.343 3.094 1.00 0.00 C ATOM 148 OG SER A 13 17.306 13.045 2.357 1.00 0.00 O ATOM 0 H SER A 13 16.487 10.908 3.155 1.00 0.00 H new ATOM 0 HA SER A 13 16.796 12.963 5.120 1.00 0.00 H new ATOM 0 HB2 SER A 13 15.251 13.110 2.494 1.00 0.00 H new ATOM 0 HB3 SER A 13 16.094 14.410 3.312 1.00 0.00 H new ATOM 0 HG SER A 13 17.311 13.563 1.525 1.00 0.00 H new ATOM 154 N LEU A 14 13.821 11.676 4.781 1.00 0.00 N ATOM 155 CA LEU A 14 12.456 11.714 5.322 1.00 0.00 C ATOM 156 C LEU A 14 12.394 11.564 6.851 1.00 0.00 C ATOM 157 O LEU A 14 13.331 11.085 7.493 1.00 0.00 O ATOM 158 CB LEU A 14 11.513 10.693 4.626 1.00 0.00 C ATOM 159 CG LEU A 14 11.914 9.196 4.606 1.00 0.00 C ATOM 160 CD1 LEU A 14 13.203 8.972 3.833 1.00 0.00 C ATOM 161 CD2 LEU A 14 12.020 8.612 6.011 1.00 0.00 C ATOM 0 H LEU A 14 14.028 10.857 4.209 1.00 0.00 H new ATOM 0 HA LEU A 14 12.093 12.716 5.093 1.00 0.00 H new ATOM 0 HB2 LEU A 14 10.537 10.766 5.105 1.00 0.00 H new ATOM 0 HB3 LEU A 14 11.385 11.014 3.592 1.00 0.00 H new ATOM 0 HG LEU A 14 11.113 8.667 4.089 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.452 7.911 3.841 1.00 0.00 H new ATOM 0 HD12 LEU A 14 13.073 9.307 2.804 1.00 0.00 H new ATOM 0 HD13 LEU A 14 14.010 9.538 4.299 1.00 0.00 H new ATOM 0 HD21 LEU A 14 12.303 7.561 5.948 1.00 0.00 H new ATOM 0 HD22 LEU A 14 12.775 9.158 6.576 1.00 0.00 H new ATOM 0 HD23 LEU A 14 11.057 8.699 6.515 1.00 0.00 H new ATOM 173 N SER A 15 11.260 11.985 7.406 1.00 0.00 N ATOM 174 CA SER A 15 10.997 11.925 8.842 1.00 0.00 C ATOM 175 C SER A 15 9.491 11.858 9.084 1.00 0.00 C ATOM 176 O SER A 15 8.705 12.166 8.181 1.00 0.00 O ATOM 177 CB SER A 15 11.582 13.147 9.564 1.00 0.00 C ATOM 178 OG SER A 15 12.989 13.227 9.404 1.00 0.00 O ATOM 0 H SER A 15 10.490 12.381 6.867 1.00 0.00 H new ATOM 0 HA SER A 15 11.476 11.031 9.241 1.00 0.00 H new ATOM 0 HB2 SER A 15 11.119 14.055 9.176 1.00 0.00 H new ATOM 0 HB3 SER A 15 11.339 13.094 10.625 1.00 0.00 H new ATOM 0 HG SER A 15 13.327 14.017 9.875 1.00 0.00 H new ATOM 184 N PHE A 16 9.100 11.455 10.295 1.00 0.00 N ATOM 185 CA PHE A 16 7.682 11.339 10.667 1.00 0.00 C ATOM 186 C PHE A 16 6.937 12.640 10.399 1.00 0.00 C ATOM 187 O PHE A 16 5.765 12.628 10.042 1.00 0.00 O ATOM 188 CB PHE A 16 7.512 10.999 12.153 1.00 0.00 C ATOM 189 CG PHE A 16 8.183 9.734 12.612 1.00 0.00 C ATOM 190 CD1 PHE A 16 9.563 9.649 12.712 1.00 0.00 C ATOM 191 CD2 PHE A 16 7.421 8.635 12.976 1.00 0.00 C ATOM 192 CE1 PHE A 16 10.169 8.491 13.162 1.00 0.00 C ATOM 193 CE2 PHE A 16 8.020 7.478 13.429 1.00 0.00 C ATOM 194 CZ PHE A 16 9.396 7.405 13.521 1.00 0.00 C ATOM 0 H PHE A 16 9.748 11.201 11.041 1.00 0.00 H new ATOM 0 HA PHE A 16 7.270 10.535 10.057 1.00 0.00 H new ATOM 0 HB2 PHE A 16 7.899 11.829 12.744 1.00 0.00 H new ATOM 0 HB3 PHE A 16 6.447 10.923 12.370 1.00 0.00 H new ATOM 0 HD1 PHE A 16 10.172 10.497 12.435 1.00 0.00 H new ATOM 0 HD2 PHE A 16 6.345 8.685 12.904 1.00 0.00 H new ATOM 0 HE1 PHE A 16 11.245 8.436 13.233 1.00 0.00 H new ATOM 0 HE2 PHE A 16 7.414 6.630 13.711 1.00 0.00 H new ATOM 0 HZ PHE A 16 9.867 6.499 13.873 1.00 0.00 H new ATOM 204 N ASP A 17 7.624 13.761 10.595 1.00 0.00 N ATOM 205 CA ASP A 17 7.019 15.080 10.392 1.00 0.00 C ATOM 206 C ASP A 17 6.613 15.283 8.935 1.00 0.00 C ATOM 207 O ASP A 17 5.494 15.712 8.655 1.00 0.00 O ATOM 208 CB ASP A 17 7.984 16.180 10.837 1.00 0.00 C ATOM 209 CG ASP A 17 7.312 17.529 10.995 1.00 0.00 C ATOM 210 OD1 ASP A 17 6.857 18.104 9.986 1.00 0.00 O ATOM 211 OD2 ASP A 17 7.224 18.010 12.144 1.00 0.00 O ATOM 0 H ASP A 17 8.599 13.786 10.894 1.00 0.00 H new ATOM 0 HA ASP A 17 6.117 15.136 11.001 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.440 15.894 11.785 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.790 16.265 10.108 1.00 0.00 H new ATOM 216 N ILE A 18 7.509 14.945 8.014 1.00 0.00 N ATOM 217 CA ILE A 18 7.219 15.067 6.585 1.00 0.00 C ATOM 218 C ILE A 18 6.023 14.190 6.247 1.00 0.00 C ATOM 219 O ILE A 18 5.127 14.595 5.510 1.00 0.00 O ATOM 220 CB ILE A 18 8.434 14.671 5.699 1.00 0.00 C ATOM 221 CG1 ILE A 18 9.574 15.688 5.845 1.00 0.00 C ATOM 222 CG2 ILE A 18 8.021 14.552 4.236 1.00 0.00 C ATOM 223 CD1 ILE A 18 10.378 15.546 7.122 1.00 0.00 C ATOM 0 H ILE A 18 8.439 14.585 8.227 1.00 0.00 H new ATOM 0 HA ILE A 18 6.998 16.113 6.374 1.00 0.00 H new ATOM 0 HB ILE A 18 8.792 13.700 6.040 1.00 0.00 H new ATOM 0 HG12 ILE A 18 10.246 15.587 4.993 1.00 0.00 H new ATOM 0 HG13 ILE A 18 9.155 16.694 5.803 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.887 14.274 3.635 1.00 0.00 H new ATOM 0 HG22 ILE A 18 7.250 13.788 4.137 1.00 0.00 H new ATOM 0 HG23 ILE A 18 7.631 15.509 3.889 1.00 0.00 H new ATOM 0 HD11 ILE A 18 11.162 16.303 7.144 1.00 0.00 H new ATOM 0 HD12 ILE A 18 9.721 15.678 7.982 1.00 0.00 H new ATOM 0 HD13 ILE A 18 10.829 14.555 7.159 1.00 0.00 H new ATOM 235 N LEU A 19 5.999 13.003 6.837 1.00 0.00 N ATOM 236 CA LEU A 19 4.894 12.077 6.648 1.00 0.00 C ATOM 237 C LEU A 19 3.613 12.665 7.230 1.00 0.00 C ATOM 238 O LEU A 19 2.547 12.542 6.637 1.00 0.00 O ATOM 239 CB LEU A 19 5.213 10.726 7.285 1.00 0.00 C ATOM 240 CG LEU A 19 6.128 9.835 6.447 1.00 0.00 C ATOM 241 CD1 LEU A 19 6.751 8.743 7.305 1.00 0.00 C ATOM 242 CD2 LEU A 19 5.353 9.221 5.292 1.00 0.00 C ATOM 0 H LEU A 19 6.736 12.659 7.453 1.00 0.00 H new ATOM 0 HA LEU A 19 4.746 11.918 5.580 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.680 10.896 8.255 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.279 10.195 7.470 1.00 0.00 H new ATOM 0 HG LEU A 19 6.930 10.452 6.043 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.399 8.120 6.688 1.00 0.00 H new ATOM 0 HD12 LEU A 19 7.338 9.198 8.103 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.963 8.128 7.739 1.00 0.00 H new ATOM 0 HD21 LEU A 19 6.018 8.589 4.703 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.532 8.620 5.683 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.953 10.014 4.660 1.00 0.00 H new ATOM 254 N LYS A 20 3.730 13.339 8.374 1.00 0.00 N ATOM 255 CA LYS A 20 2.580 13.978 9.003 1.00 0.00 C ATOM 256 C LYS A 20 2.082 15.110 8.105 1.00 0.00 C ATOM 257 O LYS A 20 0.882 15.356 7.994 1.00 0.00 O ATOM 258 CB LYS A 20 2.948 14.494 10.400 1.00 0.00 C ATOM 259 CG LYS A 20 1.799 15.160 11.143 1.00 0.00 C ATOM 260 CD LYS A 20 2.215 15.574 12.546 1.00 0.00 C ATOM 261 CE LYS A 20 1.063 16.208 13.310 1.00 0.00 C ATOM 262 NZ LYS A 20 0.574 17.445 12.646 1.00 0.00 N ATOM 0 H LYS A 20 4.608 13.455 8.881 1.00 0.00 H new ATOM 0 HA LYS A 20 1.779 13.249 9.126 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.317 13.660 10.997 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.767 15.207 10.307 1.00 0.00 H new ATOM 0 HG2 LYS A 20 1.463 16.036 10.588 1.00 0.00 H new ATOM 0 HG3 LYS A 20 0.953 14.474 11.199 1.00 0.00 H new ATOM 0 HD2 LYS A 20 2.577 14.702 13.091 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.044 16.279 12.487 1.00 0.00 H new ATOM 0 HE2 LYS A 20 0.245 15.493 13.393 1.00 0.00 H new ATOM 0 HE3 LYS A 20 1.385 16.443 14.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -0.077 17.947 13.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 1.381 18.061 12.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.075 17.194 11.769 1.00 0.00 H new ATOM 276 N THR A 21 3.017 15.769 7.431 1.00 0.00 N ATOM 277 CA THR A 21 2.682 16.839 6.504 1.00 0.00 C ATOM 278 C THR A 21 1.953 16.257 5.289 1.00 0.00 C ATOM 279 O THR A 21 0.885 16.736 4.901 1.00 0.00 O ATOM 280 CB THR A 21 3.945 17.594 6.049 1.00 0.00 C ATOM 281 OG1 THR A 21 4.633 18.123 7.192 1.00 0.00 O ATOM 282 CG2 THR A 21 3.583 18.726 5.098 1.00 0.00 C ATOM 0 H THR A 21 4.016 15.579 7.511 1.00 0.00 H new ATOM 0 HA THR A 21 2.031 17.548 7.016 1.00 0.00 H new ATOM 0 HB THR A 21 4.595 16.895 5.524 1.00 0.00 H new ATOM 0 HG1 THR A 21 4.959 17.385 7.748 1.00 0.00 H new ATOM 0 HG21 THR A 21 4.490 19.246 4.789 1.00 0.00 H new ATOM 0 HG22 THR A 21 3.082 18.318 4.220 1.00 0.00 H new ATOM 0 HG23 THR A 21 2.917 19.426 5.603 1.00 0.00 H new ATOM 290 N VAL A 22 2.521 15.192 4.726 1.00 0.00 N ATOM 291 CA VAL A 22 1.919 14.501 3.588 1.00 0.00 C ATOM 292 C VAL A 22 0.528 13.988 3.977 1.00 0.00 C ATOM 293 O VAL A 22 -0.416 14.011 3.185 1.00 0.00 O ATOM 294 CB VAL A 22 2.811 13.318 3.111 1.00 0.00 C ATOM 295 CG1 VAL A 22 2.103 12.497 2.040 1.00 0.00 C ATOM 296 CG2 VAL A 22 4.142 13.836 2.580 1.00 0.00 C ATOM 0 H VAL A 22 3.402 14.787 5.042 1.00 0.00 H new ATOM 0 HA VAL A 22 1.831 15.208 2.763 1.00 0.00 H new ATOM 0 HB VAL A 22 3.000 12.672 3.968 1.00 0.00 H new ATOM 0 HG11 VAL A 22 2.748 11.677 1.724 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.175 12.093 2.445 1.00 0.00 H new ATOM 0 HG13 VAL A 22 1.879 13.133 1.183 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.754 12.996 2.251 1.00 0.00 H new ATOM 0 HG22 VAL A 22 3.962 14.506 1.739 1.00 0.00 H new ATOM 0 HG23 VAL A 22 4.663 14.377 3.370 1.00 0.00 H new ATOM 306 N LEU A 23 0.424 13.550 5.223 1.00 0.00 N ATOM 307 CA LEU A 23 -0.816 13.039 5.798 1.00 0.00 C ATOM 308 C LEU A 23 -1.896 14.125 5.849 1.00 0.00 C ATOM 309 O LEU A 23 -3.045 13.900 5.456 1.00 0.00 O ATOM 310 CB LEU A 23 -0.513 12.539 7.215 1.00 0.00 C ATOM 311 CG LEU A 23 -1.672 11.899 7.972 1.00 0.00 C ATOM 312 CD1 LEU A 23 -1.882 10.474 7.499 1.00 0.00 C ATOM 313 CD2 LEU A 23 -1.409 11.934 9.471 1.00 0.00 C ATOM 0 H LEU A 23 1.209 13.539 5.874 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.195 12.229 5.175 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.298 11.813 7.155 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.145 13.380 7.802 1.00 0.00 H new ATOM 0 HG LEU A 23 -2.580 12.467 7.770 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -2.712 10.027 8.047 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -2.109 10.474 6.433 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -0.976 9.894 7.677 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.245 11.474 9.998 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -0.494 11.385 9.693 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.300 12.968 9.797 1.00 0.00 H new ATOM 325 N GLU A 24 -1.516 15.294 6.346 1.00 0.00 N ATOM 326 CA GLU A 24 -2.432 16.430 6.476 1.00 0.00 C ATOM 327 C GLU A 24 -2.967 16.882 5.113 1.00 0.00 C ATOM 328 O GLU A 24 -4.081 17.408 5.015 1.00 0.00 O ATOM 329 CB GLU A 24 -1.721 17.595 7.171 1.00 0.00 C ATOM 330 CG GLU A 24 -2.663 18.626 7.777 1.00 0.00 C ATOM 331 CD GLU A 24 -3.526 18.052 8.889 1.00 0.00 C ATOM 332 OE1 GLU A 24 -4.357 17.157 8.608 1.00 0.00 O ATOM 333 OE2 GLU A 24 -3.366 18.480 10.050 1.00 0.00 O ATOM 0 H GLU A 24 -0.568 15.486 6.671 1.00 0.00 H new ATOM 0 HA GLU A 24 -3.282 16.108 7.078 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -1.080 17.198 7.958 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -1.071 18.092 6.451 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -2.079 19.459 8.169 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -3.306 19.028 6.994 1.00 0.00 H new ATOM 340 N ALA A 25 -2.166 16.675 4.070 1.00 0.00 N ATOM 341 CA ALA A 25 -2.546 17.059 2.708 1.00 0.00 C ATOM 342 C ALA A 25 -3.882 16.431 2.297 1.00 0.00 C ATOM 343 O ALA A 25 -4.658 17.025 1.546 1.00 0.00 O ATOM 344 CB ALA A 25 -1.460 16.664 1.716 1.00 0.00 C ATOM 0 H ALA A 25 -1.245 16.242 4.141 1.00 0.00 H new ATOM 0 HA ALA A 25 -2.663 18.143 2.696 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -1.761 16.958 0.711 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -0.529 17.166 1.977 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -1.312 15.585 1.750 1.00 0.00 H new ATOM 350 N LEU A 26 -4.156 15.231 2.802 1.00 0.00 N ATOM 351 CA LEU A 26 -5.407 14.538 2.498 1.00 0.00 C ATOM 352 C LEU A 26 -6.545 15.096 3.363 1.00 0.00 C ATOM 353 O LEU A 26 -7.173 14.370 4.137 1.00 0.00 O ATOM 354 CB LEU A 26 -5.262 13.023 2.717 1.00 0.00 C ATOM 355 CG LEU A 26 -4.468 12.251 1.647 1.00 0.00 C ATOM 356 CD1 LEU A 26 -4.998 12.564 0.257 1.00 0.00 C ATOM 357 CD2 LEU A 26 -2.973 12.545 1.731 1.00 0.00 C ATOM 0 H LEU A 26 -3.530 14.718 3.423 1.00 0.00 H new ATOM 0 HA LEU A 26 -5.646 14.708 1.448 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -4.782 12.861 3.682 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -6.260 12.590 2.781 1.00 0.00 H new ATOM 0 HG LEU A 26 -4.604 11.187 1.841 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.424 12.009 -0.485 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -6.047 12.275 0.194 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.903 13.633 0.064 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.448 11.982 0.960 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.803 13.611 1.581 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.599 12.253 2.712 1.00 0.00 H new ATOM 369 N GLY A 27 -6.783 16.403 3.249 1.00 0.00 N ATOM 370 CA GLY A 27 -7.812 17.069 4.038 1.00 0.00 C ATOM 371 C GLY A 27 -9.223 16.941 3.490 1.00 0.00 C ATOM 372 O GLY A 27 -9.941 17.935 3.384 1.00 0.00 O ATOM 0 H GLY A 27 -6.274 17.020 2.616 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -7.793 16.663 5.049 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -7.562 18.127 4.114 1.00 0.00 H new ATOM 376 N ASN A 28 -9.627 15.727 3.165 1.00 0.00 N ATOM 377 CA ASN A 28 -10.973 15.479 2.649 1.00 0.00 C ATOM 378 C ASN A 28 -11.711 14.519 3.576 1.00 0.00 C ATOM 379 O ASN A 28 -12.780 14.827 4.103 1.00 0.00 O ATOM 380 CB ASN A 28 -10.903 14.896 1.234 1.00 0.00 C ATOM 381 CG ASN A 28 -12.224 14.981 0.487 1.00 0.00 C ATOM 382 OD1 ASN A 28 -13.260 14.507 0.955 1.00 0.00 O ATOM 383 ND2 ASN A 28 -12.190 15.578 -0.694 1.00 0.00 N ATOM 0 H ASN A 28 -9.046 14.892 3.247 1.00 0.00 H new ATOM 0 HA ASN A 28 -11.515 16.424 2.607 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -10.137 15.426 0.667 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -10.592 13.853 1.292 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -13.041 15.658 -1.250 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -11.312 15.958 -1.048 1.00 0.00 H new ATOM 390 N VAL A 29 -11.110 13.360 3.778 1.00 0.00 N ATOM 391 CA VAL A 29 -11.670 12.338 4.645 1.00 0.00 C ATOM 392 C VAL A 29 -11.205 12.530 6.085 1.00 0.00 C ATOM 393 O VAL A 29 -10.187 13.184 6.343 1.00 0.00 O ATOM 394 CB VAL A 29 -11.302 10.919 4.170 1.00 0.00 C ATOM 395 CG1 VAL A 29 -12.037 10.593 2.879 1.00 0.00 C ATOM 396 CG2 VAL A 29 -9.794 10.781 3.990 1.00 0.00 C ATOM 0 H VAL A 29 -10.223 13.101 3.347 1.00 0.00 H new ATOM 0 HA VAL A 29 -12.754 12.445 4.600 1.00 0.00 H new ATOM 0 HB VAL A 29 -11.611 10.205 4.933 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.770 9.588 2.552 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -13.112 10.645 3.049 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.756 11.312 2.109 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -9.559 9.771 3.654 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -9.449 11.500 3.247 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -9.295 10.973 4.940 1.00 0.00 H new ATOM 406 N LYS A 30 -11.967 11.966 7.018 1.00 0.00 N ATOM 407 CA LYS A 30 -11.661 12.069 8.442 1.00 0.00 C ATOM 408 C LYS A 30 -10.337 11.370 8.783 1.00 0.00 C ATOM 409 O LYS A 30 -9.374 12.015 9.192 1.00 0.00 O ATOM 410 CB LYS A 30 -12.803 11.469 9.281 1.00 0.00 C ATOM 411 CG LYS A 30 -14.069 12.326 9.346 1.00 0.00 C ATOM 412 CD LYS A 30 -14.925 12.221 8.083 1.00 0.00 C ATOM 413 CE LYS A 30 -16.193 13.062 8.207 1.00 0.00 C ATOM 414 NZ LYS A 30 -17.053 12.989 6.993 1.00 0.00 N ATOM 0 H LYS A 30 -12.808 11.428 6.811 1.00 0.00 H new ATOM 0 HA LYS A 30 -11.558 13.127 8.682 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -13.062 10.493 8.871 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -12.441 11.303 10.296 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -14.663 12.022 10.208 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -13.789 13.368 9.503 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -14.348 12.553 7.220 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -15.192 11.179 7.906 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -16.764 12.725 9.072 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -15.918 14.101 8.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -17.899 13.578 7.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -16.521 13.335 6.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -17.340 12.003 6.830 1.00 0.00 H new ATOM 428 N ARG A 31 -10.289 10.054 8.584 1.00 0.00 N ATOM 429 CA ARG A 31 -9.075 9.283 8.846 1.00 0.00 C ATOM 430 C ARG A 31 -8.095 9.480 7.693 1.00 0.00 C ATOM 431 O ARG A 31 -8.510 9.635 6.549 1.00 0.00 O ATOM 432 CB ARG A 31 -9.386 7.787 9.002 1.00 0.00 C ATOM 433 CG ARG A 31 -10.362 7.445 10.120 1.00 0.00 C ATOM 434 CD ARG A 31 -9.882 7.901 11.486 1.00 0.00 C ATOM 435 NE ARG A 31 -10.734 7.367 12.551 1.00 0.00 N ATOM 436 CZ ARG A 31 -10.610 7.681 13.834 1.00 0.00 C ATOM 437 NH1 ARG A 31 -9.752 8.610 14.210 1.00 0.00 N ATOM 438 NH2 ARG A 31 -11.378 7.088 14.736 1.00 0.00 N ATOM 0 H ARG A 31 -11.075 9.500 8.243 1.00 0.00 H new ATOM 0 HA ARG A 31 -8.638 9.638 9.779 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -9.791 7.415 8.061 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -8.452 7.254 9.180 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -11.326 7.907 9.907 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -10.522 6.367 10.138 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -8.854 7.574 11.641 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -9.881 8.990 11.529 1.00 0.00 H new ATOM 0 HE ARG A 31 -11.470 6.711 12.289 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -9.181 9.089 13.513 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -9.659 8.849 15.197 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -12.063 6.391 14.444 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -11.284 7.328 15.723 1.00 0.00 H new ATOM 452 N LYS A 32 -6.805 9.480 7.991 1.00 0.00 N ATOM 453 CA LYS A 32 -5.785 9.667 6.962 1.00 0.00 C ATOM 454 C LYS A 32 -4.685 8.613 7.115 1.00 0.00 C ATOM 455 O LYS A 32 -4.289 8.284 8.239 1.00 0.00 O ATOM 456 CB LYS A 32 -5.176 11.075 7.069 1.00 0.00 C ATOM 457 CG LYS A 32 -6.201 12.193 7.191 1.00 0.00 C ATOM 458 CD LYS A 32 -5.540 13.508 7.569 1.00 0.00 C ATOM 459 CE LYS A 32 -6.568 14.552 7.973 1.00 0.00 C ATOM 460 NZ LYS A 32 -7.433 14.959 6.836 1.00 0.00 N ATOM 0 H LYS A 32 -6.437 9.353 8.934 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.251 9.556 5.983 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -4.515 11.107 7.935 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.558 11.259 6.190 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.731 12.308 6.246 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -6.944 11.928 7.943 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -4.844 13.343 8.392 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -4.956 13.878 6.727 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -7.189 14.155 8.776 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -6.056 15.429 8.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -7.667 15.969 6.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -6.930 14.795 5.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.309 14.398 6.848 1.00 0.00 H new ATOM 474 N ILE A 33 -4.205 8.075 5.995 1.00 0.00 N ATOM 475 CA ILE A 33 -3.159 7.051 6.031 1.00 0.00 C ATOM 476 C ILE A 33 -1.909 7.506 5.278 1.00 0.00 C ATOM 477 O ILE A 33 -1.988 7.926 4.132 1.00 0.00 O ATOM 478 CB ILE A 33 -3.661 5.692 5.454 1.00 0.00 C ATOM 479 CG1 ILE A 33 -4.820 5.123 6.291 1.00 0.00 C ATOM 480 CG2 ILE A 33 -2.532 4.669 5.384 1.00 0.00 C ATOM 481 CD1 ILE A 33 -6.177 5.719 5.974 1.00 0.00 C ATOM 0 H ILE A 33 -4.520 8.327 5.058 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.901 6.903 7.080 1.00 0.00 H new ATOM 0 HB ILE A 33 -4.020 5.889 4.444 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -4.866 4.045 6.138 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -4.603 5.286 7.347 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.914 3.733 4.978 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.738 5.047 4.740 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -2.136 4.495 6.384 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -6.934 5.260 6.610 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -6.154 6.794 6.155 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -6.421 5.533 4.928 1.00 0.00 H new ATOM 493 N ALA A 34 -0.757 7.408 5.936 1.00 0.00 N ATOM 494 CA ALA A 34 0.517 7.790 5.336 1.00 0.00 C ATOM 495 C ALA A 34 1.561 6.707 5.601 1.00 0.00 C ATOM 496 O ALA A 34 1.606 6.127 6.687 1.00 0.00 O ATOM 497 CB ALA A 34 0.992 9.131 5.875 1.00 0.00 C ATOM 0 H ALA A 34 -0.681 7.064 6.893 1.00 0.00 H new ATOM 0 HA ALA A 34 0.377 7.892 4.260 1.00 0.00 H new ATOM 0 HB1 ALA A 34 1.943 9.393 5.412 1.00 0.00 H new ATOM 0 HB2 ALA A 34 0.253 9.898 5.644 1.00 0.00 H new ATOM 0 HB3 ALA A 34 1.120 9.064 6.955 1.00 0.00 H new ATOM 503 N VAL A 35 2.376 6.405 4.604 1.00 0.00 N ATOM 504 CA VAL A 35 3.388 5.360 4.741 1.00 0.00 C ATOM 505 C VAL A 35 4.689 5.734 4.030 1.00 0.00 C ATOM 506 O VAL A 35 4.674 6.343 2.963 1.00 0.00 O ATOM 507 CB VAL A 35 2.880 4.011 4.161 1.00 0.00 C ATOM 508 CG1 VAL A 35 3.930 2.922 4.310 1.00 0.00 C ATOM 509 CG2 VAL A 35 1.576 3.575 4.817 1.00 0.00 C ATOM 0 H VAL A 35 2.361 6.864 3.693 1.00 0.00 H new ATOM 0 HA VAL A 35 3.581 5.255 5.809 1.00 0.00 H new ATOM 0 HB VAL A 35 2.690 4.169 3.099 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.548 1.989 3.896 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.834 3.213 3.775 1.00 0.00 H new ATOM 0 HG13 VAL A 35 4.162 2.782 5.366 1.00 0.00 H new ATOM 0 HG21 VAL A 35 1.251 2.628 4.386 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.731 3.452 5.889 1.00 0.00 H new ATOM 0 HG23 VAL A 35 0.811 4.333 4.646 1.00 0.00 H new ATOM 519 N GLY A 36 5.806 5.340 4.624 1.00 0.00 N ATOM 520 CA GLY A 36 7.110 5.594 4.045 1.00 0.00 C ATOM 521 C GLY A 36 8.069 4.481 4.418 1.00 0.00 C ATOM 522 O GLY A 36 8.375 4.280 5.591 1.00 0.00 O ATOM 0 H GLY A 36 5.831 4.840 5.513 1.00 0.00 H new ATOM 0 HA2 GLY A 36 7.028 5.666 2.960 1.00 0.00 H new ATOM 0 HA3 GLY A 36 7.494 6.550 4.400 1.00 0.00 H new ATOM 526 N VAL A 37 8.510 3.726 3.425 1.00 0.00 N ATOM 527 CA VAL A 37 9.406 2.605 3.671 1.00 0.00 C ATOM 528 C VAL A 37 10.765 2.834 3.045 1.00 0.00 C ATOM 529 O VAL A 37 10.881 2.979 1.829 1.00 0.00 O ATOM 530 CB VAL A 37 8.810 1.288 3.127 1.00 0.00 C ATOM 531 CG1 VAL A 37 9.707 0.106 3.470 1.00 0.00 C ATOM 532 CG2 VAL A 37 7.400 1.086 3.662 1.00 0.00 C ATOM 0 H VAL A 37 8.264 3.867 2.445 1.00 0.00 H new ATOM 0 HA VAL A 37 9.526 2.526 4.752 1.00 0.00 H new ATOM 0 HB VAL A 37 8.754 1.354 2.040 1.00 0.00 H new ATOM 0 HG11 VAL A 37 9.267 -0.811 3.077 1.00 0.00 H new ATOM 0 HG12 VAL A 37 10.691 0.255 3.026 1.00 0.00 H new ATOM 0 HG13 VAL A 37 9.805 0.026 4.553 1.00 0.00 H new ATOM 0 HG21 VAL A 37 6.992 0.154 3.270 1.00 0.00 H new ATOM 0 HG22 VAL A 37 7.427 1.041 4.751 1.00 0.00 H new ATOM 0 HG23 VAL A 37 6.769 1.918 3.349 1.00 0.00 H new ATOM 542 N ASP A 38 11.789 2.856 3.887 1.00 0.00 N ATOM 543 CA ASP A 38 13.148 3.057 3.419 1.00 0.00 C ATOM 544 C ASP A 38 13.732 1.760 2.902 1.00 0.00 C ATOM 545 O ASP A 38 14.272 0.952 3.661 1.00 0.00 O ATOM 546 CB ASP A 38 14.047 3.618 4.518 1.00 0.00 C ATOM 547 CG ASP A 38 13.793 5.080 4.783 1.00 0.00 C ATOM 548 OD1 ASP A 38 13.896 5.878 3.837 1.00 0.00 O ATOM 549 OD2 ASP A 38 13.499 5.431 5.939 1.00 0.00 O ATOM 0 H ASP A 38 11.702 2.737 4.896 1.00 0.00 H new ATOM 0 HA ASP A 38 13.104 3.784 2.608 1.00 0.00 H new ATOM 0 HB2 ASP A 38 13.888 3.053 5.436 1.00 0.00 H new ATOM 0 HB3 ASP A 38 15.090 3.480 4.235 1.00 0.00 H new ATOM 554 N ASN A 39 13.606 1.562 1.609 1.00 0.00 N ATOM 555 CA ASN A 39 14.112 0.363 0.964 1.00 0.00 C ATOM 556 C ASN A 39 15.634 0.433 0.761 1.00 0.00 C ATOM 557 O ASN A 39 16.126 1.024 -0.211 1.00 0.00 O ATOM 558 CB ASN A 39 13.379 0.146 -0.365 1.00 0.00 C ATOM 559 CG ASN A 39 11.954 -0.334 -0.152 1.00 0.00 C ATOM 560 OD1 ASN A 39 11.203 0.239 0.629 1.00 0.00 O ATOM 561 ND2 ASN A 39 11.559 -1.384 -0.858 1.00 0.00 N ATOM 0 H ASN A 39 13.154 2.221 0.975 1.00 0.00 H new ATOM 0 HA ASN A 39 13.920 -0.491 1.614 1.00 0.00 H new ATOM 0 HB2 ASN A 39 13.368 1.078 -0.930 1.00 0.00 H new ATOM 0 HB3 ASN A 39 13.923 -0.584 -0.965 1.00 0.00 H new ATOM 0 HD21 ASN A 39 10.607 -1.736 -0.759 1.00 0.00 H new ATOM 0 HD22 ASN A 39 12.207 -1.840 -1.500 1.00 0.00 H new ATOM 568 N GLU A 40 16.371 -0.168 1.701 1.00 0.00 N ATOM 569 CA GLU A 40 17.837 -0.193 1.669 1.00 0.00 C ATOM 570 C GLU A 40 18.365 -1.632 1.559 1.00 0.00 C ATOM 571 O GLU A 40 18.976 -2.147 2.494 1.00 0.00 O ATOM 572 CB GLU A 40 18.421 0.445 2.934 1.00 0.00 C ATOM 573 CG GLU A 40 18.054 1.904 3.142 1.00 0.00 C ATOM 574 CD GLU A 40 18.935 2.563 4.188 1.00 0.00 C ATOM 575 OE1 GLU A 40 20.163 2.650 3.954 1.00 0.00 O ATOM 576 OE2 GLU A 40 18.416 2.972 5.249 1.00 0.00 O ATOM 0 H GLU A 40 15.969 -0.650 2.505 1.00 0.00 H new ATOM 0 HA GLU A 40 18.148 0.375 0.792 1.00 0.00 H new ATOM 0 HB2 GLU A 40 18.085 -0.126 3.800 1.00 0.00 H new ATOM 0 HB3 GLU A 40 19.507 0.360 2.898 1.00 0.00 H new ATOM 0 HG2 GLU A 40 18.147 2.441 2.198 1.00 0.00 H new ATOM 0 HG3 GLU A 40 17.010 1.976 3.448 1.00 0.00 H new ATOM 583 N SER A 41 18.129 -2.282 0.425 1.00 0.00 N ATOM 584 CA SER A 41 18.592 -3.662 0.229 1.00 0.00 C ATOM 585 C SER A 41 19.505 -3.785 -0.985 1.00 0.00 C ATOM 586 O SER A 41 20.516 -4.479 -0.954 1.00 0.00 O ATOM 587 CB SER A 41 17.399 -4.592 0.039 1.00 0.00 C ATOM 588 OG SER A 41 17.802 -5.935 -0.122 1.00 0.00 O ATOM 0 H SER A 41 17.626 -1.886 -0.369 1.00 0.00 H new ATOM 0 HA SER A 41 19.155 -3.943 1.119 1.00 0.00 H new ATOM 0 HB2 SER A 41 16.735 -4.512 0.900 1.00 0.00 H new ATOM 0 HB3 SER A 41 16.828 -4.277 -0.834 1.00 0.00 H new ATOM 0 HG SER A 41 18.710 -6.048 0.229 1.00 0.00 H new ATOM 594 N GLY A 42 19.108 -3.143 -2.068 1.00 0.00 N ATOM 595 CA GLY A 42 19.868 -3.229 -3.294 1.00 0.00 C ATOM 596 C GLY A 42 19.179 -4.134 -4.288 1.00 0.00 C ATOM 597 O GLY A 42 19.815 -4.787 -5.110 1.00 0.00 O ATOM 0 H GLY A 42 18.271 -2.562 -2.121 1.00 0.00 H new ATOM 0 HA2 GLY A 42 19.989 -2.234 -3.723 1.00 0.00 H new ATOM 0 HA3 GLY A 42 20.868 -3.608 -3.082 1.00 0.00 H new ATOM 601 N LYS A 43 17.863 -4.151 -4.197 1.00 0.00 N ATOM 602 CA LYS A 43 17.029 -4.955 -5.069 1.00 0.00 C ATOM 603 C LYS A 43 16.093 -4.032 -5.845 1.00 0.00 C ATOM 604 O LYS A 43 15.395 -3.217 -5.239 1.00 0.00 O ATOM 605 CB LYS A 43 16.232 -5.956 -4.213 1.00 0.00 C ATOM 606 CG LYS A 43 15.392 -5.285 -3.136 1.00 0.00 C ATOM 607 CD LYS A 43 15.098 -6.212 -1.967 1.00 0.00 C ATOM 608 CE LYS A 43 14.021 -5.635 -1.060 1.00 0.00 C ATOM 609 NZ LYS A 43 14.322 -4.238 -0.637 1.00 0.00 N ATOM 0 H LYS A 43 17.340 -3.605 -3.513 1.00 0.00 H new ATOM 0 HA LYS A 43 17.638 -5.513 -5.780 1.00 0.00 H new ATOM 0 HB2 LYS A 43 15.580 -6.541 -4.862 1.00 0.00 H new ATOM 0 HB3 LYS A 43 16.924 -6.655 -3.743 1.00 0.00 H new ATOM 0 HG2 LYS A 43 15.913 -4.400 -2.772 1.00 0.00 H new ATOM 0 HG3 LYS A 43 14.452 -4.945 -3.571 1.00 0.00 H new ATOM 0 HD2 LYS A 43 14.778 -7.184 -2.343 1.00 0.00 H new ATOM 0 HD3 LYS A 43 16.010 -6.377 -1.393 1.00 0.00 H new ATOM 0 HE2 LYS A 43 13.063 -5.656 -1.580 1.00 0.00 H new ATOM 0 HE3 LYS A 43 13.918 -6.265 -0.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 13.433 -3.708 -0.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 14.826 -4.252 0.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 14.917 -3.778 -1.356 1.00 0.00 H new ATOM 623 N THR A 44 16.089 -4.137 -7.165 1.00 0.00 N ATOM 624 CA THR A 44 15.231 -3.287 -7.971 1.00 0.00 C ATOM 625 C THR A 44 13.849 -3.898 -8.139 1.00 0.00 C ATOM 626 O THR A 44 13.699 -5.028 -8.598 1.00 0.00 O ATOM 627 CB THR A 44 15.835 -2.999 -9.353 1.00 0.00 C ATOM 628 OG1 THR A 44 16.416 -4.191 -9.892 1.00 0.00 O ATOM 629 CG2 THR A 44 16.877 -1.889 -9.268 1.00 0.00 C ATOM 0 H THR A 44 16.663 -4.794 -7.694 1.00 0.00 H new ATOM 0 HA THR A 44 15.142 -2.343 -7.433 1.00 0.00 H new ATOM 0 HB THR A 44 15.038 -2.664 -10.017 1.00 0.00 H new ATOM 0 HG1 THR A 44 16.797 -3.999 -10.774 1.00 0.00 H new ATOM 0 HG21 THR A 44 17.291 -1.702 -10.259 1.00 0.00 H new ATOM 0 HG22 THR A 44 16.409 -0.979 -8.893 1.00 0.00 H new ATOM 0 HG23 THR A 44 17.676 -2.191 -8.592 1.00 0.00 H new ATOM 637 N TRP A 45 12.851 -3.140 -7.745 1.00 0.00 N ATOM 638 CA TRP A 45 11.469 -3.594 -7.821 1.00 0.00 C ATOM 639 C TRP A 45 10.779 -3.152 -9.103 1.00 0.00 C ATOM 640 O TRP A 45 11.227 -2.231 -9.788 1.00 0.00 O ATOM 641 CB TRP A 45 10.670 -3.073 -6.625 1.00 0.00 C ATOM 642 CG TRP A 45 11.058 -3.718 -5.342 1.00 0.00 C ATOM 643 CD1 TRP A 45 12.198 -4.407 -5.099 1.00 0.00 C ATOM 644 CD2 TRP A 45 10.313 -3.720 -4.129 1.00 0.00 C ATOM 645 NE1 TRP A 45 12.203 -4.868 -3.809 1.00 0.00 N ATOM 646 CE2 TRP A 45 11.054 -4.453 -3.189 1.00 0.00 C ATOM 647 CE3 TRP A 45 9.085 -3.179 -3.750 1.00 0.00 C ATOM 648 CZ2 TRP A 45 10.606 -4.657 -1.892 1.00 0.00 C ATOM 649 CZ3 TRP A 45 8.642 -3.380 -2.463 1.00 0.00 C ATOM 650 CH2 TRP A 45 9.400 -4.115 -1.545 1.00 0.00 C ATOM 0 H TRP A 45 12.965 -2.200 -7.366 1.00 0.00 H new ATOM 0 HA TRP A 45 11.500 -4.684 -7.811 1.00 0.00 H new ATOM 0 HB2 TRP A 45 10.812 -1.996 -6.541 1.00 0.00 H new ATOM 0 HB3 TRP A 45 9.608 -3.241 -6.803 1.00 0.00 H new ATOM 0 HD1 TRP A 45 12.988 -4.569 -5.817 1.00 0.00 H new ATOM 0 HE1 TRP A 45 12.940 -5.428 -3.381 1.00 0.00 H new ATOM 0 HE3 TRP A 45 8.493 -2.613 -4.454 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 11.189 -5.224 -1.182 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 7.694 -2.964 -2.156 1.00 0.00 H new ATOM 0 HH2 TRP A 45 9.025 -4.257 -0.542 1.00 0.00 H new ATOM 661 N THR A 46 9.660 -3.799 -9.379 1.00 0.00 N ATOM 662 CA THR A 46 8.826 -3.498 -10.531 1.00 0.00 C ATOM 663 C THR A 46 7.367 -3.647 -10.100 1.00 0.00 C ATOM 664 O THR A 46 7.007 -4.652 -9.498 1.00 0.00 O ATOM 665 CB THR A 46 9.108 -4.451 -11.717 1.00 0.00 C ATOM 666 OG1 THR A 46 10.517 -4.524 -11.981 1.00 0.00 O ATOM 667 CG2 THR A 46 8.382 -3.983 -12.970 1.00 0.00 C ATOM 0 H THR A 46 9.300 -4.559 -8.802 1.00 0.00 H new ATOM 0 HA THR A 46 9.044 -2.485 -10.870 1.00 0.00 H new ATOM 0 HB THR A 46 8.742 -5.441 -11.444 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.678 -5.132 -12.733 1.00 0.00 H new ATOM 0 HG21 THR A 46 8.595 -4.668 -13.791 1.00 0.00 H new ATOM 0 HG22 THR A 46 7.308 -3.964 -12.783 1.00 0.00 H new ATOM 0 HG23 THR A 46 8.722 -2.982 -13.235 1.00 0.00 H new ATOM 675 N ALA A 47 6.539 -2.647 -10.367 1.00 0.00 N ATOM 676 CA ALA A 47 5.136 -2.699 -9.957 1.00 0.00 C ATOM 677 C ALA A 47 4.403 -3.880 -10.594 1.00 0.00 C ATOM 678 O ALA A 47 4.222 -3.928 -11.812 1.00 0.00 O ATOM 679 CB ALA A 47 4.436 -1.389 -10.299 1.00 0.00 C ATOM 0 H ALA A 47 6.807 -1.796 -10.861 1.00 0.00 H new ATOM 0 HA ALA A 47 5.112 -2.843 -8.877 1.00 0.00 H new ATOM 0 HB1 ALA A 47 3.393 -1.442 -9.988 1.00 0.00 H new ATOM 0 HB2 ALA A 47 4.928 -0.567 -9.779 1.00 0.00 H new ATOM 0 HB3 ALA A 47 4.486 -1.220 -11.375 1.00 0.00 H new ATOM 685 N LEU A 48 3.979 -4.827 -9.764 1.00 0.00 N ATOM 686 CA LEU A 48 3.260 -6.001 -10.249 1.00 0.00 C ATOM 687 C LEU A 48 1.752 -5.770 -10.187 1.00 0.00 C ATOM 688 O LEU A 48 1.037 -5.967 -11.174 1.00 0.00 O ATOM 689 CB LEU A 48 3.626 -7.244 -9.434 1.00 0.00 C ATOM 690 CG LEU A 48 2.920 -8.532 -9.876 1.00 0.00 C ATOM 691 CD1 LEU A 48 3.328 -8.916 -11.291 1.00 0.00 C ATOM 692 CD2 LEU A 48 3.218 -9.665 -8.909 1.00 0.00 C ATOM 0 H LEU A 48 4.120 -4.805 -8.754 1.00 0.00 H new ATOM 0 HA LEU A 48 3.553 -6.165 -11.286 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.703 -7.397 -9.495 1.00 0.00 H new ATOM 0 HB3 LEU A 48 3.389 -7.057 -8.386 1.00 0.00 H new ATOM 0 HG LEU A 48 1.846 -8.348 -9.870 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.814 -9.832 -11.582 1.00 0.00 H new ATOM 0 HD12 LEU A 48 3.057 -8.114 -11.978 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.405 -9.077 -11.328 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.708 -10.570 -9.240 1.00 0.00 H new ATOM 0 HD22 LEU A 48 4.293 -9.845 -8.879 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.867 -9.395 -7.913 1.00 0.00 H new ATOM 704 N ASN A 49 1.280 -5.350 -9.018 1.00 0.00 N ATOM 705 CA ASN A 49 -0.135 -5.086 -8.799 1.00 0.00 C ATOM 706 C ASN A 49 -0.349 -4.470 -7.425 1.00 0.00 C ATOM 707 O ASN A 49 0.507 -4.569 -6.540 1.00 0.00 O ATOM 708 CB ASN A 49 -0.981 -6.362 -8.947 1.00 0.00 C ATOM 709 CG ASN A 49 -0.631 -7.445 -7.943 1.00 0.00 C ATOM 710 OD1 ASN A 49 -0.823 -7.287 -6.741 1.00 0.00 O ATOM 711 ND2 ASN A 49 -0.114 -8.560 -8.437 1.00 0.00 N ATOM 0 H ASN A 49 1.866 -5.184 -8.200 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.462 -4.381 -9.563 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -2.034 -6.104 -8.837 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.853 -6.758 -9.955 1.00 0.00 H new ATOM 0 HD21 ASN A 49 0.140 -9.325 -7.812 1.00 0.00 H new ATOM 0 HD22 ASN A 49 0.030 -8.653 -9.442 1.00 0.00 H new ATOM 718 N THR A 50 -1.489 -3.833 -7.264 1.00 0.00 N ATOM 719 CA THR A 50 -1.857 -3.188 -6.014 1.00 0.00 C ATOM 720 C THR A 50 -3.371 -3.151 -5.892 1.00 0.00 C ATOM 721 O THR A 50 -4.051 -2.618 -6.769 1.00 0.00 O ATOM 722 CB THR A 50 -1.300 -1.750 -5.935 1.00 0.00 C ATOM 723 OG1 THR A 50 -1.368 -1.121 -7.224 1.00 0.00 O ATOM 724 CG2 THR A 50 0.136 -1.744 -5.429 1.00 0.00 C ATOM 0 H THR A 50 -2.192 -3.745 -7.998 1.00 0.00 H new ATOM 0 HA THR A 50 -1.427 -3.764 -5.195 1.00 0.00 H new ATOM 0 HB THR A 50 -1.913 -1.190 -5.229 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.486 -0.155 -7.111 1.00 0.00 H new ATOM 0 HG21 THR A 50 0.502 -0.718 -5.384 1.00 0.00 H new ATOM 0 HG22 THR A 50 0.173 -2.186 -4.434 1.00 0.00 H new ATOM 0 HG23 THR A 50 0.763 -2.323 -6.107 1.00 0.00 H new ATOM 732 N TYR A 51 -3.901 -3.731 -4.827 1.00 0.00 N ATOM 733 CA TYR A 51 -5.340 -3.774 -4.638 1.00 0.00 C ATOM 734 C TYR A 51 -5.726 -3.646 -3.171 1.00 0.00 C ATOM 735 O TYR A 51 -5.145 -4.295 -2.298 1.00 0.00 O ATOM 736 CB TYR A 51 -5.909 -5.077 -5.205 1.00 0.00 C ATOM 737 CG TYR A 51 -6.804 -4.882 -6.412 1.00 0.00 C ATOM 738 CD1 TYR A 51 -6.277 -4.526 -7.649 1.00 0.00 C ATOM 739 CD2 TYR A 51 -8.176 -5.067 -6.319 1.00 0.00 C ATOM 740 CE1 TYR A 51 -7.092 -4.358 -8.752 1.00 0.00 C ATOM 741 CE2 TYR A 51 -8.999 -4.903 -7.419 1.00 0.00 C ATOM 742 CZ TYR A 51 -8.451 -4.549 -8.632 1.00 0.00 C ATOM 743 OH TYR A 51 -9.264 -4.384 -9.733 1.00 0.00 O ATOM 0 H TYR A 51 -3.360 -4.175 -4.085 1.00 0.00 H new ATOM 0 HA TYR A 51 -5.762 -2.923 -5.172 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -5.083 -5.734 -5.479 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -6.474 -5.585 -4.424 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -5.212 -4.378 -7.749 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -8.610 -5.344 -5.370 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -6.666 -4.078 -9.704 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -10.065 -5.052 -7.327 1.00 0.00 H new ATOM 0 HH TYR A 51 -10.195 -4.556 -9.481 1.00 0.00 H new ATOM 753 N PHE A 52 -6.724 -2.814 -2.908 1.00 0.00 N ATOM 754 CA PHE A 52 -7.214 -2.599 -1.556 1.00 0.00 C ATOM 755 C PHE A 52 -8.662 -3.059 -1.439 1.00 0.00 C ATOM 756 O PHE A 52 -9.442 -2.926 -2.381 1.00 0.00 O ATOM 757 CB PHE A 52 -7.111 -1.125 -1.143 1.00 0.00 C ATOM 758 CG PHE A 52 -5.712 -0.579 -1.118 1.00 0.00 C ATOM 759 CD1 PHE A 52 -4.974 -0.443 -2.283 1.00 0.00 C ATOM 760 CD2 PHE A 52 -5.140 -0.193 0.080 1.00 0.00 C ATOM 761 CE1 PHE A 52 -3.691 0.064 -2.251 1.00 0.00 C ATOM 762 CE2 PHE A 52 -3.859 0.316 0.119 1.00 0.00 C ATOM 763 CZ PHE A 52 -3.133 0.444 -1.047 1.00 0.00 C ATOM 0 H PHE A 52 -7.213 -2.273 -3.621 1.00 0.00 H new ATOM 0 HA PHE A 52 -6.587 -3.186 -0.885 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -7.708 -0.526 -1.830 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -7.551 -1.007 -0.153 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -5.408 -0.737 -3.227 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -5.703 -0.291 0.996 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -3.125 0.163 -3.165 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.424 0.614 1.062 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.129 0.841 -1.018 1.00 0.00 H new ATOM 773 N ARG A 53 -9.004 -3.609 -0.287 1.00 0.00 N ATOM 774 CA ARG A 53 -10.362 -4.095 -0.042 1.00 0.00 C ATOM 775 C ARG A 53 -11.325 -2.944 0.274 1.00 0.00 C ATOM 776 O ARG A 53 -12.431 -2.883 -0.261 1.00 0.00 O ATOM 777 CB ARG A 53 -10.385 -5.095 1.118 1.00 0.00 C ATOM 778 CG ARG A 53 -11.764 -5.695 1.353 1.00 0.00 C ATOM 779 CD ARG A 53 -11.813 -6.552 2.607 1.00 0.00 C ATOM 780 NE ARG A 53 -10.862 -7.658 2.560 1.00 0.00 N ATOM 781 CZ ARG A 53 -10.885 -8.685 3.405 1.00 0.00 C ATOM 782 NH1 ARG A 53 -11.788 -8.723 4.375 1.00 0.00 N ATOM 783 NH2 ARG A 53 -10.004 -9.664 3.286 1.00 0.00 N ATOM 0 H ARG A 53 -8.364 -3.733 0.497 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.690 -4.589 -0.957 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -9.675 -5.897 0.915 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -10.051 -4.597 2.028 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -12.498 -4.893 1.435 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.047 -6.299 0.491 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -11.602 -5.931 3.477 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -12.821 -6.947 2.735 1.00 0.00 H new ATOM 0 HE ARG A 53 -10.140 -7.643 1.840 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -12.464 -7.965 4.473 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -11.807 -9.510 5.024 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -9.304 -9.633 2.545 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -10.024 -10.450 3.936 1.00 0.00 H new ATOM 797 N SER A 54 -10.916 -2.051 1.163 1.00 0.00 N ATOM 798 CA SER A 54 -11.771 -0.930 1.552 1.00 0.00 C ATOM 799 C SER A 54 -11.308 0.383 0.907 1.00 0.00 C ATOM 800 O SER A 54 -11.743 0.736 -0.187 1.00 0.00 O ATOM 801 CB SER A 54 -11.807 -0.792 3.078 1.00 0.00 C ATOM 802 OG SER A 54 -12.710 0.226 3.487 1.00 0.00 O ATOM 0 H SER A 54 -10.008 -2.076 1.627 1.00 0.00 H new ATOM 0 HA SER A 54 -12.778 -1.139 1.191 1.00 0.00 H new ATOM 0 HB2 SER A 54 -12.102 -1.742 3.524 1.00 0.00 H new ATOM 0 HB3 SER A 54 -10.807 -0.563 3.448 1.00 0.00 H new ATOM 0 HG SER A 54 -13.344 -0.141 4.138 1.00 0.00 H new ATOM 808 N GLY A 55 -10.426 1.103 1.599 1.00 0.00 N ATOM 809 CA GLY A 55 -9.919 2.366 1.091 1.00 0.00 C ATOM 810 C GLY A 55 -8.940 2.166 -0.050 1.00 0.00 C ATOM 811 O GLY A 55 -8.951 1.129 -0.703 1.00 0.00 O ATOM 0 H GLY A 55 -10.052 0.831 2.508 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -10.752 2.981 0.751 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -9.429 2.911 1.898 1.00 0.00 H new ATOM 815 N THR A 56 -8.080 3.140 -0.282 1.00 0.00 N ATOM 816 CA THR A 56 -7.098 3.026 -1.348 1.00 0.00 C ATOM 817 C THR A 56 -6.070 4.135 -1.293 1.00 0.00 C ATOM 818 O THR A 56 -6.359 5.267 -0.903 1.00 0.00 O ATOM 819 CB THR A 56 -7.745 2.991 -2.754 1.00 0.00 C ATOM 820 OG1 THR A 56 -6.750 3.160 -3.777 1.00 0.00 O ATOM 821 CG2 THR A 56 -8.822 4.062 -2.908 1.00 0.00 C ATOM 0 H THR A 56 -8.040 4.011 0.247 1.00 0.00 H new ATOM 0 HA THR A 56 -6.597 2.072 -1.180 1.00 0.00 H new ATOM 0 HB THR A 56 -8.215 2.014 -2.865 1.00 0.00 H new ATOM 0 HG1 THR A 56 -7.179 3.133 -4.658 1.00 0.00 H new ATOM 0 HG21 THR A 56 -9.252 4.005 -3.908 1.00 0.00 H new ATOM 0 HG22 THR A 56 -9.605 3.900 -2.167 1.00 0.00 H new ATOM 0 HG23 THR A 56 -8.380 5.047 -2.759 1.00 0.00 H new ATOM 829 N SER A 57 -4.871 3.790 -1.699 1.00 0.00 N ATOM 830 CA SER A 57 -3.770 4.734 -1.729 1.00 0.00 C ATOM 831 C SER A 57 -3.657 5.317 -3.131 1.00 0.00 C ATOM 832 O SER A 57 -3.523 6.529 -3.314 1.00 0.00 O ATOM 833 CB SER A 57 -2.469 4.036 -1.323 1.00 0.00 C ATOM 834 OG SER A 57 -1.405 4.955 -1.160 1.00 0.00 O ATOM 0 H SER A 57 -4.628 2.852 -2.017 1.00 0.00 H new ATOM 0 HA SER A 57 -3.954 5.542 -1.020 1.00 0.00 H new ATOM 0 HB2 SER A 57 -2.625 3.492 -0.391 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.200 3.300 -2.081 1.00 0.00 H new ATOM 0 HG SER A 57 -1.767 5.838 -0.935 1.00 0.00 H new ATOM 840 N ASP A 58 -3.735 4.434 -4.114 1.00 0.00 N ATOM 841 CA ASP A 58 -3.662 4.813 -5.515 1.00 0.00 C ATOM 842 C ASP A 58 -3.937 3.586 -6.365 1.00 0.00 C ATOM 843 O ASP A 58 -3.722 2.460 -5.916 1.00 0.00 O ATOM 844 CB ASP A 58 -2.284 5.380 -5.857 1.00 0.00 C ATOM 845 CG ASP A 58 -2.305 6.274 -7.082 1.00 0.00 C ATOM 846 OD1 ASP A 58 -2.768 5.833 -8.155 1.00 0.00 O ATOM 847 OD2 ASP A 58 -1.860 7.439 -6.973 1.00 0.00 O ATOM 0 H ASP A 58 -3.851 3.432 -3.962 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.404 5.586 -5.715 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.908 5.947 -5.005 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -1.589 4.557 -6.025 1.00 0.00 H new ATOM 852 N ILE A 59 -4.406 3.798 -7.575 1.00 0.00 N ATOM 853 CA ILE A 59 -4.689 2.691 -8.466 1.00 0.00 C ATOM 854 C ILE A 59 -3.441 2.304 -9.258 1.00 0.00 C ATOM 855 O ILE A 59 -3.344 1.189 -9.772 1.00 0.00 O ATOM 856 CB ILE A 59 -5.852 2.971 -9.445 1.00 0.00 C ATOM 857 CG1 ILE A 59 -5.575 4.204 -10.319 1.00 0.00 C ATOM 858 CG2 ILE A 59 -7.163 3.131 -8.687 1.00 0.00 C ATOM 859 CD1 ILE A 59 -5.802 5.531 -9.618 1.00 0.00 C ATOM 0 H ILE A 59 -4.599 4.721 -7.964 1.00 0.00 H new ATOM 0 HA ILE A 59 -4.999 1.865 -7.825 1.00 0.00 H new ATOM 0 HB ILE A 59 -5.937 2.112 -10.110 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -4.543 4.163 -10.668 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -6.212 4.159 -11.202 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.970 3.328 -9.393 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -7.378 2.216 -8.135 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.080 3.964 -7.989 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -5.584 6.348 -10.306 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.840 5.598 -9.293 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -5.145 5.601 -8.751 1.00 0.00 H new ATOM 871 N VAL A 60 -2.488 3.223 -9.354 1.00 0.00 N ATOM 872 CA VAL A 60 -1.253 2.958 -10.081 1.00 0.00 C ATOM 873 C VAL A 60 -0.042 3.390 -9.252 1.00 0.00 C ATOM 874 O VAL A 60 -0.137 4.299 -8.430 1.00 0.00 O ATOM 875 CB VAL A 60 -1.223 3.670 -11.453 1.00 0.00 C ATOM 876 CG1 VAL A 60 -2.215 3.032 -12.420 1.00 0.00 C ATOM 877 CG2 VAL A 60 -1.519 5.153 -11.292 1.00 0.00 C ATOM 0 H VAL A 60 -2.546 4.153 -8.940 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.211 1.883 -10.259 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.222 3.558 -11.869 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -2.175 3.551 -13.378 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.958 1.983 -12.565 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.222 3.106 -12.010 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -1.493 5.637 -12.268 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -2.507 5.281 -10.849 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -0.769 5.605 -10.643 1.00 0.00 H new ATOM 887 N LEU A 61 1.088 2.727 -9.453 1.00 0.00 N ATOM 888 CA LEU A 61 2.295 3.040 -8.700 1.00 0.00 C ATOM 889 C LEU A 61 3.548 2.866 -9.552 1.00 0.00 C ATOM 890 O LEU A 61 3.552 2.083 -10.508 1.00 0.00 O ATOM 891 CB LEU A 61 2.372 2.151 -7.459 1.00 0.00 C ATOM 892 CG LEU A 61 1.649 2.705 -6.233 1.00 0.00 C ATOM 893 CD1 LEU A 61 0.798 1.630 -5.584 1.00 0.00 C ATOM 894 CD2 LEU A 61 2.655 3.257 -5.236 1.00 0.00 C ATOM 0 H LEU A 61 1.195 1.971 -10.129 1.00 0.00 H new ATOM 0 HA LEU A 61 2.245 4.086 -8.397 1.00 0.00 H new ATOM 0 HB2 LEU A 61 1.952 1.175 -7.701 1.00 0.00 H new ATOM 0 HB3 LEU A 61 3.420 1.994 -7.206 1.00 0.00 H new ATOM 0 HG LEU A 61 0.993 3.514 -6.554 1.00 0.00 H new ATOM 0 HD11 LEU A 61 0.291 2.044 -4.712 1.00 0.00 H new ATOM 0 HD12 LEU A 61 0.057 1.272 -6.299 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.434 0.801 -5.274 1.00 0.00 H new ATOM 0 HD21 LEU A 61 2.128 3.649 -4.366 1.00 0.00 H new ATOM 0 HD22 LEU A 61 3.331 2.461 -4.922 1.00 0.00 H new ATOM 0 HD23 LEU A 61 3.229 4.057 -5.703 1.00 0.00 H new ATOM 906 N PRO A 62 4.624 3.612 -9.225 1.00 0.00 N ATOM 907 CA PRO A 62 5.892 3.551 -9.964 1.00 0.00 C ATOM 908 C PRO A 62 6.489 2.145 -9.985 1.00 0.00 C ATOM 909 O PRO A 62 6.717 1.534 -8.940 1.00 0.00 O ATOM 910 CB PRO A 62 6.806 4.504 -9.196 1.00 0.00 C ATOM 911 CG PRO A 62 5.884 5.410 -8.455 1.00 0.00 C ATOM 912 CD PRO A 62 4.680 4.582 -8.117 1.00 0.00 C ATOM 0 HA PRO A 62 5.759 3.820 -11.012 1.00 0.00 H new ATOM 0 HB2 PRO A 62 7.458 3.960 -8.513 1.00 0.00 H new ATOM 0 HB3 PRO A 62 7.450 5.065 -9.873 1.00 0.00 H new ATOM 0 HG2 PRO A 62 6.358 5.797 -7.553 1.00 0.00 H new ATOM 0 HG3 PRO A 62 5.608 6.270 -9.065 1.00 0.00 H new ATOM 0 HD2 PRO A 62 4.789 4.087 -7.152 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.775 5.188 -8.065 1.00 0.00 H new ATOM 920 N HIS A 63 6.716 1.631 -11.185 1.00 0.00 N ATOM 921 CA HIS A 63 7.250 0.282 -11.368 1.00 0.00 C ATOM 922 C HIS A 63 8.765 0.175 -11.105 1.00 0.00 C ATOM 923 O HIS A 63 9.485 -0.416 -11.910 1.00 0.00 O ATOM 924 CB HIS A 63 6.917 -0.235 -12.787 1.00 0.00 C ATOM 925 CG HIS A 63 7.437 0.615 -13.920 1.00 0.00 C ATOM 926 ND1 HIS A 63 8.779 0.780 -14.186 1.00 0.00 N ATOM 927 CD2 HIS A 63 6.784 1.353 -14.853 1.00 0.00 C ATOM 928 CE1 HIS A 63 8.930 1.580 -15.225 1.00 0.00 C ATOM 929 NE2 HIS A 63 7.736 1.942 -15.652 1.00 0.00 N ATOM 0 H HIS A 63 6.538 2.130 -12.056 1.00 0.00 H new ATOM 0 HA HIS A 63 6.765 -0.343 -10.618 1.00 0.00 H new ATOM 0 HB2 HIS A 63 7.322 -1.241 -12.894 1.00 0.00 H new ATOM 0 HB3 HIS A 63 5.834 -0.315 -12.882 1.00 0.00 H new ATOM 0 HD1 HIS A 63 9.540 0.350 -13.660 1.00 0.00 H new ATOM 0 HD2 HIS A 63 5.714 1.458 -14.950 1.00 0.00 H new ATOM 0 HE1 HIS A 63 9.873 1.887 -15.653 1.00 0.00 H new ATOM 938 N LYS A 64 9.259 0.716 -9.985 1.00 0.00 N ATOM 939 CA LYS A 64 10.696 0.624 -9.693 1.00 0.00 C ATOM 940 C LYS A 64 11.053 1.106 -8.284 1.00 0.00 C ATOM 941 O LYS A 64 10.794 2.254 -7.930 1.00 0.00 O ATOM 942 CB LYS A 64 11.479 1.444 -10.732 1.00 0.00 C ATOM 943 CG LYS A 64 12.959 1.102 -10.837 1.00 0.00 C ATOM 944 CD LYS A 64 13.559 1.722 -12.092 1.00 0.00 C ATOM 945 CE LYS A 64 15.013 1.321 -12.300 1.00 0.00 C ATOM 946 NZ LYS A 64 15.920 1.966 -11.313 1.00 0.00 N ATOM 0 H LYS A 64 8.705 1.208 -9.284 1.00 0.00 H new ATOM 0 HA LYS A 64 10.969 -0.430 -9.746 1.00 0.00 H new ATOM 0 HB2 LYS A 64 11.018 1.300 -11.709 1.00 0.00 H new ATOM 0 HB3 LYS A 64 11.382 2.502 -10.486 1.00 0.00 H new ATOM 0 HG2 LYS A 64 13.487 1.467 -9.956 1.00 0.00 H new ATOM 0 HG3 LYS A 64 13.088 0.020 -10.861 1.00 0.00 H new ATOM 0 HD2 LYS A 64 12.974 1.418 -12.960 1.00 0.00 H new ATOM 0 HD3 LYS A 64 13.490 2.808 -12.026 1.00 0.00 H new ATOM 0 HE2 LYS A 64 15.104 0.238 -12.221 1.00 0.00 H new ATOM 0 HE3 LYS A 64 15.323 1.594 -13.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 16.899 1.664 -11.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 15.854 3.000 -11.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 15.642 1.685 -10.351 1.00 0.00 H new ATOM 960 N VAL A 65 11.699 0.234 -7.503 1.00 0.00 N ATOM 961 CA VAL A 65 12.153 0.590 -6.154 1.00 0.00 C ATOM 962 C VAL A 65 13.602 0.134 -5.992 1.00 0.00 C ATOM 963 O VAL A 65 13.864 -1.058 -5.857 1.00 0.00 O ATOM 964 CB VAL A 65 11.284 -0.041 -5.030 1.00 0.00 C ATOM 965 CG1 VAL A 65 11.780 0.400 -3.664 1.00 0.00 C ATOM 966 CG2 VAL A 65 9.820 0.329 -5.193 1.00 0.00 C ATOM 0 H VAL A 65 11.919 -0.722 -7.781 1.00 0.00 H new ATOM 0 HA VAL A 65 12.062 1.671 -6.051 1.00 0.00 H new ATOM 0 HB VAL A 65 11.374 -1.124 -5.110 1.00 0.00 H new ATOM 0 HG11 VAL A 65 11.160 -0.051 -2.889 1.00 0.00 H new ATOM 0 HG12 VAL A 65 12.814 0.082 -3.532 1.00 0.00 H new ATOM 0 HG13 VAL A 65 11.722 1.486 -3.589 1.00 0.00 H new ATOM 0 HG21 VAL A 65 9.238 -0.127 -4.392 1.00 0.00 H new ATOM 0 HG22 VAL A 65 9.711 1.413 -5.149 1.00 0.00 H new ATOM 0 HG23 VAL A 65 9.458 -0.033 -6.156 1.00 0.00 H new ATOM 976 N PRO A 66 14.569 1.070 -6.075 1.00 0.00 N ATOM 977 CA PRO A 66 16.003 0.759 -5.995 1.00 0.00 C ATOM 978 C PRO A 66 16.546 0.619 -4.564 1.00 0.00 C ATOM 979 O PRO A 66 15.866 0.116 -3.669 1.00 0.00 O ATOM 980 CB PRO A 66 16.665 1.963 -6.697 1.00 0.00 C ATOM 981 CG PRO A 66 15.542 2.837 -7.172 1.00 0.00 C ATOM 982 CD PRO A 66 14.360 2.497 -6.314 1.00 0.00 C ATOM 0 HA PRO A 66 16.211 -0.210 -6.449 1.00 0.00 H new ATOM 0 HB2 PRO A 66 17.317 2.504 -6.011 1.00 0.00 H new ATOM 0 HB3 PRO A 66 17.284 1.635 -7.532 1.00 0.00 H new ATOM 0 HG2 PRO A 66 15.802 3.891 -7.078 1.00 0.00 H new ATOM 0 HG3 PRO A 66 15.325 2.655 -8.225 1.00 0.00 H new ATOM 0 HD2 PRO A 66 14.349 3.070 -5.387 1.00 0.00 H new ATOM 0 HD3 PRO A 66 13.416 2.693 -6.822 1.00 0.00 H new ATOM 990 N HIS A 67 17.791 1.057 -4.367 1.00 0.00 N ATOM 991 CA HIS A 67 18.459 0.980 -3.062 1.00 0.00 C ATOM 992 C HIS A 67 18.626 2.375 -2.455 1.00 0.00 C ATOM 993 O HIS A 67 19.097 3.299 -3.115 1.00 0.00 O ATOM 994 CB HIS A 67 19.835 0.281 -3.221 1.00 0.00 C ATOM 995 CG HIS A 67 20.659 0.110 -1.957 1.00 0.00 C ATOM 996 ND1 HIS A 67 21.809 -0.653 -1.909 1.00 0.00 N ATOM 997 CD2 HIS A 67 20.499 0.600 -0.700 1.00 0.00 C ATOM 998 CE1 HIS A 67 22.309 -0.625 -0.685 1.00 0.00 C ATOM 999 NE2 HIS A 67 21.532 0.127 0.066 1.00 0.00 N ATOM 0 H HIS A 67 18.364 1.473 -5.101 1.00 0.00 H new ATOM 0 HA HIS A 67 17.841 0.393 -2.382 1.00 0.00 H new ATOM 0 HB2 HIS A 67 19.669 -0.705 -3.656 1.00 0.00 H new ATOM 0 HB3 HIS A 67 20.426 0.850 -3.939 1.00 0.00 H new ATOM 0 HD2 HIS A 67 19.701 1.246 -0.365 1.00 0.00 H new ATOM 0 HE1 HIS A 67 23.204 -1.133 -0.357 1.00 0.00 H new ATOM 0 HE2 HIS A 67 21.676 0.325 1.056 1.00 0.00 H new ATOM 1008 N GLY A 68 18.251 2.508 -1.188 1.00 0.00 N ATOM 1009 CA GLY A 68 18.384 3.778 -0.499 1.00 0.00 C ATOM 1010 C GLY A 68 17.325 4.774 -0.902 1.00 0.00 C ATOM 1011 O GLY A 68 17.615 5.950 -1.109 1.00 0.00 O ATOM 0 H GLY A 68 17.856 1.756 -0.624 1.00 0.00 H new ATOM 0 HA2 GLY A 68 18.329 3.610 0.577 1.00 0.00 H new ATOM 0 HA3 GLY A 68 19.369 4.197 -0.706 1.00 0.00 H new ATOM 1015 N LYS A 69 16.088 4.318 -1.003 1.00 0.00 N ATOM 1016 CA LYS A 69 14.996 5.207 -1.370 1.00 0.00 C ATOM 1017 C LYS A 69 13.713 4.802 -0.671 1.00 0.00 C ATOM 1018 O LYS A 69 13.330 3.631 -0.679 1.00 0.00 O ATOM 1019 CB LYS A 69 14.797 5.234 -2.891 1.00 0.00 C ATOM 1020 CG LYS A 69 15.743 6.189 -3.616 1.00 0.00 C ATOM 1021 CD LYS A 69 15.558 6.147 -5.127 1.00 0.00 C ATOM 1022 CE LYS A 69 16.512 7.104 -5.831 1.00 0.00 C ATOM 1023 NZ LYS A 69 16.274 7.158 -7.302 1.00 0.00 N ATOM 0 H LYS A 69 15.815 3.349 -0.838 1.00 0.00 H new ATOM 0 HA LYS A 69 15.260 6.213 -1.045 1.00 0.00 H new ATOM 0 HB2 LYS A 69 14.938 4.228 -3.285 1.00 0.00 H new ATOM 0 HB3 LYS A 69 13.768 5.520 -3.109 1.00 0.00 H new ATOM 0 HG2 LYS A 69 15.574 7.205 -3.259 1.00 0.00 H new ATOM 0 HG3 LYS A 69 16.774 5.932 -3.371 1.00 0.00 H new ATOM 0 HD2 LYS A 69 15.726 5.132 -5.488 1.00 0.00 H new ATOM 0 HD3 LYS A 69 14.529 6.407 -5.376 1.00 0.00 H new ATOM 0 HE2 LYS A 69 16.398 8.103 -5.410 1.00 0.00 H new ATOM 0 HE3 LYS A 69 17.540 6.794 -5.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 16.946 7.821 -7.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 16.408 6.211 -7.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 15.302 7.479 -7.485 1.00 0.00 H new ATOM 1037 N ALA A 70 13.066 5.776 -0.052 1.00 0.00 N ATOM 1038 CA ALA A 70 11.832 5.532 0.671 1.00 0.00 C ATOM 1039 C ALA A 70 10.626 5.654 -0.240 1.00 0.00 C ATOM 1040 O ALA A 70 10.452 6.660 -0.934 1.00 0.00 O ATOM 1041 CB ALA A 70 11.694 6.506 1.828 1.00 0.00 C ATOM 0 H ALA A 70 13.378 6.747 -0.037 1.00 0.00 H new ATOM 0 HA ALA A 70 11.873 4.513 1.057 1.00 0.00 H new ATOM 0 HB1 ALA A 70 10.763 6.310 2.360 1.00 0.00 H new ATOM 0 HB2 ALA A 70 12.535 6.382 2.510 1.00 0.00 H new ATOM 0 HB3 ALA A 70 11.685 7.527 1.445 1.00 0.00 H new ATOM 1047 N LEU A 71 9.779 4.644 -0.226 1.00 0.00 N ATOM 1048 CA LEU A 71 8.575 4.681 -1.037 1.00 0.00 C ATOM 1049 C LEU A 71 7.480 5.442 -0.290 1.00 0.00 C ATOM 1050 O LEU A 71 7.180 5.142 0.867 1.00 0.00 O ATOM 1051 CB LEU A 71 8.117 3.262 -1.434 1.00 0.00 C ATOM 1052 CG LEU A 71 7.845 2.275 -0.291 1.00 0.00 C ATOM 1053 CD1 LEU A 71 6.387 2.336 0.150 1.00 0.00 C ATOM 1054 CD2 LEU A 71 8.212 0.863 -0.720 1.00 0.00 C ATOM 0 H LEU A 71 9.898 3.797 0.330 1.00 0.00 H new ATOM 0 HA LEU A 71 8.792 5.207 -1.967 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.207 3.353 -2.027 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.879 2.829 -2.082 1.00 0.00 H new ATOM 0 HG LEU A 71 8.465 2.558 0.560 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.222 1.627 0.961 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.153 3.343 0.496 1.00 0.00 H new ATOM 0 HD13 LEU A 71 5.742 2.082 -0.691 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.015 0.171 0.099 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.615 0.579 -1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.270 0.825 -0.980 1.00 0.00 H new ATOM 1066 N LEU A 72 6.900 6.435 -0.943 1.00 0.00 N ATOM 1067 CA LEU A 72 5.846 7.236 -0.331 1.00 0.00 C ATOM 1068 C LEU A 72 4.489 6.560 -0.529 1.00 0.00 C ATOM 1069 O LEU A 72 4.244 5.927 -1.560 1.00 0.00 O ATOM 1070 CB LEU A 72 5.814 8.659 -0.916 1.00 0.00 C ATOM 1071 CG LEU A 72 6.936 9.600 -0.450 1.00 0.00 C ATOM 1072 CD1 LEU A 72 7.053 9.579 1.070 1.00 0.00 C ATOM 1073 CD2 LEU A 72 8.265 9.247 -1.108 1.00 0.00 C ATOM 0 H LEU A 72 7.139 6.708 -1.896 1.00 0.00 H new ATOM 0 HA LEU A 72 6.059 7.312 0.735 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.855 8.586 -2.003 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.856 9.114 -0.663 1.00 0.00 H new ATOM 0 HG LEU A 72 6.678 10.613 -0.759 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.852 10.251 1.383 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.111 9.905 1.512 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.279 8.566 1.404 1.00 0.00 H new ATOM 0 HD21 LEU A 72 9.038 9.931 -0.757 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.540 8.225 -0.847 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.169 9.332 -2.190 1.00 0.00 H new ATOM 1085 N TYR A 73 3.621 6.681 0.462 1.00 0.00 N ATOM 1086 CA TYR A 73 2.300 6.072 0.408 1.00 0.00 C ATOM 1087 C TYR A 73 1.298 6.909 1.201 1.00 0.00 C ATOM 1088 O TYR A 73 1.656 7.543 2.195 1.00 0.00 O ATOM 1089 CB TYR A 73 2.363 4.656 0.979 1.00 0.00 C ATOM 1090 CG TYR A 73 1.697 3.607 0.121 1.00 0.00 C ATOM 1091 CD1 TYR A 73 1.920 3.562 -1.247 1.00 0.00 C ATOM 1092 CD2 TYR A 73 0.861 2.653 0.682 1.00 0.00 C ATOM 1093 CE1 TYR A 73 1.327 2.597 -2.032 1.00 0.00 C ATOM 1094 CE2 TYR A 73 0.260 1.684 -0.098 1.00 0.00 C ATOM 1095 CZ TYR A 73 0.499 1.659 -1.455 1.00 0.00 C ATOM 1096 OH TYR A 73 -0.090 0.695 -2.237 1.00 0.00 O ATOM 0 H TYR A 73 3.809 7.199 1.320 1.00 0.00 H new ATOM 0 HA TYR A 73 1.973 6.028 -0.631 1.00 0.00 H new ATOM 0 HB2 TYR A 73 3.408 4.381 1.122 1.00 0.00 H new ATOM 0 HB3 TYR A 73 1.895 4.653 1.964 1.00 0.00 H new ATOM 0 HD1 TYR A 73 2.568 4.295 -1.704 1.00 0.00 H new ATOM 0 HD2 TYR A 73 0.677 2.668 1.746 1.00 0.00 H new ATOM 0 HE1 TYR A 73 1.511 2.576 -3.096 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -0.393 0.951 0.353 1.00 0.00 H new ATOM 0 HH TYR A 73 -0.441 -0.020 -1.666 1.00 0.00 H new ATOM 1106 N ASN A 74 0.051 6.906 0.756 1.00 0.00 N ATOM 1107 CA ASN A 74 -1.016 7.663 1.412 1.00 0.00 C ATOM 1108 C ASN A 74 -2.368 7.089 1.012 1.00 0.00 C ATOM 1109 O ASN A 74 -2.735 7.087 -0.161 1.00 0.00 O ATOM 1110 CB ASN A 74 -0.938 9.155 1.040 1.00 0.00 C ATOM 1111 CG ASN A 74 -1.034 9.405 -0.458 1.00 0.00 C ATOM 1112 OD1 ASN A 74 -0.141 9.043 -1.223 1.00 0.00 O ATOM 1113 ND2 ASN A 74 -2.123 10.027 -0.889 1.00 0.00 N ATOM 0 H ASN A 74 -0.254 6.383 -0.065 1.00 0.00 H new ATOM 0 HA ASN A 74 -0.893 7.578 2.492 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -1.743 9.691 1.544 1.00 0.00 H new ATOM 0 HB3 ASN A 74 0.000 9.567 1.411 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -2.240 10.220 -1.884 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -2.843 10.313 -0.226 1.00 0.00 H new ATOM 1120 N GLY A 75 -3.095 6.581 1.988 1.00 0.00 N ATOM 1121 CA GLY A 75 -4.382 5.990 1.708 1.00 0.00 C ATOM 1122 C GLY A 75 -5.551 6.858 2.122 1.00 0.00 C ATOM 1123 O GLY A 75 -5.512 7.533 3.157 1.00 0.00 O ATOM 0 H GLY A 75 -2.818 6.567 2.970 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.453 5.784 0.640 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -4.452 5.032 2.222 1.00 0.00 H new ATOM 1127 N GLN A 76 -6.598 6.825 1.314 1.00 0.00 N ATOM 1128 CA GLN A 76 -7.810 7.580 1.575 1.00 0.00 C ATOM 1129 C GLN A 76 -8.976 6.607 1.763 1.00 0.00 C ATOM 1130 O GLN A 76 -8.975 5.513 1.195 1.00 0.00 O ATOM 1131 CB GLN A 76 -8.094 8.554 0.426 1.00 0.00 C ATOM 1132 CG GLN A 76 -9.101 9.635 0.779 1.00 0.00 C ATOM 1133 CD GLN A 76 -9.284 10.661 -0.320 1.00 0.00 C ATOM 1134 OE1 GLN A 76 -9.911 11.699 -0.114 1.00 0.00 O ATOM 1135 NE2 GLN A 76 -8.751 10.374 -1.497 1.00 0.00 N ATOM 0 H GLN A 76 -6.630 6.272 0.457 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.683 8.167 2.485 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -7.160 9.025 0.121 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -8.463 7.992 -0.432 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -10.062 9.170 0.997 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -8.778 10.140 1.689 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -8.238 9.502 -1.626 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -8.853 11.025 -2.275 1.00 0.00 H new ATOM 1144 N LYS A 77 -9.950 6.994 2.577 1.00 0.00 N ATOM 1145 CA LYS A 77 -11.113 6.152 2.858 1.00 0.00 C ATOM 1146 C LYS A 77 -12.015 5.990 1.628 1.00 0.00 C ATOM 1147 O LYS A 77 -12.145 6.902 0.812 1.00 0.00 O ATOM 1148 CB LYS A 77 -11.907 6.737 4.032 1.00 0.00 C ATOM 1149 CG LYS A 77 -13.193 5.988 4.363 1.00 0.00 C ATOM 1150 CD LYS A 77 -14.024 6.732 5.399 1.00 0.00 C ATOM 1151 CE LYS A 77 -13.316 6.791 6.739 1.00 0.00 C ATOM 1152 NZ LYS A 77 -13.076 5.429 7.287 1.00 0.00 N ATOM 0 H LYS A 77 -9.960 7.893 3.059 1.00 0.00 H new ATOM 0 HA LYS A 77 -10.750 5.159 3.124 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -11.270 6.746 4.916 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -12.154 7.774 3.806 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -13.780 5.852 3.454 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -12.950 4.994 4.737 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -14.225 7.744 5.047 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -14.988 6.238 5.517 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -12.365 7.312 6.627 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -13.915 7.368 7.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -13.746 5.243 8.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -13.210 4.724 6.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -12.103 5.367 7.650 1.00 0.00 H new ATOM 1249 N THR A 84 -14.592 0.448 7.915 1.00 0.00 N ATOM 1250 CA THR A 84 -13.199 0.349 7.509 1.00 0.00 C ATOM 1251 C THR A 84 -12.735 1.658 6.857 1.00 0.00 C ATOM 1252 O THR A 84 -13.499 2.322 6.155 1.00 0.00 O ATOM 1253 CB THR A 84 -12.990 -0.816 6.512 1.00 0.00 C ATOM 1254 OG1 THR A 84 -14.147 -0.958 5.676 1.00 0.00 O ATOM 1255 CG2 THR A 84 -12.705 -2.129 7.237 1.00 0.00 C ATOM 0 HA THR A 84 -12.609 0.158 8.405 1.00 0.00 H new ATOM 0 HB THR A 84 -12.123 -0.579 5.896 1.00 0.00 H new ATOM 0 HG1 THR A 84 -14.882 -0.423 6.042 1.00 0.00 H new ATOM 0 HG21 THR A 84 -12.564 -2.925 6.506 1.00 0.00 H new ATOM 0 HG22 THR A 84 -11.802 -2.024 7.838 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.546 -2.377 7.885 1.00 0.00 H new ATOM 1263 N GLY A 85 -11.489 2.039 7.097 1.00 0.00 N ATOM 1264 CA GLY A 85 -10.966 3.257 6.515 1.00 0.00 C ATOM 1265 C GLY A 85 -10.112 2.981 5.296 1.00 0.00 C ATOM 1266 O GLY A 85 -10.319 3.568 4.238 1.00 0.00 O ATOM 0 H GLY A 85 -10.831 1.526 7.684 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -11.793 3.911 6.238 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -10.374 3.790 7.259 1.00 0.00 H new ATOM 1270 N ALA A 86 -9.159 2.075 5.449 1.00 0.00 N ATOM 1271 CA ALA A 86 -8.268 1.702 4.360 1.00 0.00 C ATOM 1272 C ALA A 86 -7.548 0.401 4.678 1.00 0.00 C ATOM 1273 O ALA A 86 -6.737 0.334 5.599 1.00 0.00 O ATOM 1274 CB ALA A 86 -7.258 2.803 4.093 1.00 0.00 C ATOM 0 H ALA A 86 -8.982 1.581 6.323 1.00 0.00 H new ATOM 0 HA ALA A 86 -8.872 1.557 3.464 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.602 2.504 3.276 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.782 3.719 3.821 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.664 2.977 4.990 1.00 0.00 H new ATOM 1280 N VAL A 87 -7.850 -0.622 3.901 1.00 0.00 N ATOM 1281 CA VAL A 87 -7.246 -1.939 4.066 1.00 0.00 C ATOM 1282 C VAL A 87 -6.891 -2.471 2.686 1.00 0.00 C ATOM 1283 O VAL A 87 -7.735 -2.442 1.794 1.00 0.00 O ATOM 1284 CB VAL A 87 -8.228 -2.933 4.736 1.00 0.00 C ATOM 1285 CG1 VAL A 87 -7.554 -4.270 5.000 1.00 0.00 C ATOM 1286 CG2 VAL A 87 -8.799 -2.354 6.023 1.00 0.00 C ATOM 0 H VAL A 87 -8.522 -0.567 3.135 1.00 0.00 H new ATOM 0 HA VAL A 87 -6.366 -1.844 4.702 1.00 0.00 H new ATOM 0 HB VAL A 87 -9.054 -3.101 4.045 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -8.265 -4.949 5.471 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -7.213 -4.698 4.057 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -6.700 -4.123 5.662 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -9.485 -3.072 6.472 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -7.987 -2.143 6.719 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -9.335 -1.431 5.801 1.00 0.00 H new ATOM 1296 N GLY A 88 -5.667 -2.938 2.495 1.00 0.00 N ATOM 1297 CA GLY A 88 -5.287 -3.438 1.192 1.00 0.00 C ATOM 1298 C GLY A 88 -3.934 -4.106 1.175 1.00 0.00 C ATOM 1299 O GLY A 88 -3.292 -4.266 2.217 1.00 0.00 O ATOM 0 H GLY A 88 -4.939 -2.980 3.208 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -6.039 -4.150 0.851 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -5.284 -2.612 0.481 1.00 0.00 H new ATOM 1303 N VAL A 89 -3.517 -4.497 -0.020 1.00 0.00 N ATOM 1304 CA VAL A 89 -2.233 -5.175 -0.231 1.00 0.00 C ATOM 1305 C VAL A 89 -1.518 -4.648 -1.480 1.00 0.00 C ATOM 1306 O VAL A 89 -2.149 -4.403 -2.512 1.00 0.00 O ATOM 1307 CB VAL A 89 -2.421 -6.708 -0.403 1.00 0.00 C ATOM 1308 CG1 VAL A 89 -1.081 -7.405 -0.625 1.00 0.00 C ATOM 1309 CG2 VAL A 89 -3.132 -7.309 0.800 1.00 0.00 C ATOM 0 H VAL A 89 -4.055 -4.356 -0.875 1.00 0.00 H new ATOM 0 HA VAL A 89 -1.633 -4.970 0.655 1.00 0.00 H new ATOM 0 HB VAL A 89 -3.041 -6.865 -1.285 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -1.243 -8.476 -0.742 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -0.609 -7.009 -1.524 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -0.432 -7.228 0.233 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -3.251 -8.383 0.654 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -2.542 -7.128 1.699 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -4.113 -6.847 0.911 1.00 0.00 H new ATOM 1319 N LEU A 90 -0.199 -4.519 -1.396 1.00 0.00 N ATOM 1320 CA LEU A 90 0.607 -4.077 -2.529 1.00 0.00 C ATOM 1321 C LEU A 90 1.605 -5.176 -2.870 1.00 0.00 C ATOM 1322 O LEU A 90 2.061 -5.896 -1.978 1.00 0.00 O ATOM 1323 CB LEU A 90 1.337 -2.751 -2.248 1.00 0.00 C ATOM 1324 CG LEU A 90 2.274 -2.745 -1.039 1.00 0.00 C ATOM 1325 CD1 LEU A 90 3.338 -1.669 -1.190 1.00 0.00 C ATOM 1326 CD2 LEU A 90 1.484 -2.511 0.232 1.00 0.00 C ATOM 0 H LEU A 90 0.338 -4.715 -0.551 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.056 -3.890 -3.374 1.00 0.00 H new ATOM 0 HB2 LEU A 90 1.915 -2.483 -3.132 1.00 0.00 H new ATOM 0 HB3 LEU A 90 0.589 -1.970 -2.107 1.00 0.00 H new ATOM 0 HG LEU A 90 2.766 -3.716 -0.982 1.00 0.00 H new ATOM 0 HD11 LEU A 90 3.994 -1.681 -0.320 1.00 0.00 H new ATOM 0 HD12 LEU A 90 3.924 -1.860 -2.089 1.00 0.00 H new ATOM 0 HD13 LEU A 90 2.860 -0.693 -1.270 1.00 0.00 H new ATOM 0 HD21 LEU A 90 2.161 -2.509 1.086 1.00 0.00 H new ATOM 0 HD22 LEU A 90 0.973 -1.550 0.171 1.00 0.00 H new ATOM 0 HD23 LEU A 90 0.748 -3.306 0.355 1.00 0.00 H new ATOM 1338 N ALA A 91 1.916 -5.328 -4.150 1.00 0.00 N ATOM 1339 CA ALA A 91 2.826 -6.366 -4.583 1.00 0.00 C ATOM 1340 C ALA A 91 3.695 -5.898 -5.750 1.00 0.00 C ATOM 1341 O ALA A 91 3.197 -5.386 -6.754 1.00 0.00 O ATOM 1342 CB ALA A 91 2.032 -7.604 -4.974 1.00 0.00 C ATOM 0 H ALA A 91 1.549 -4.744 -4.902 1.00 0.00 H new ATOM 0 HA ALA A 91 3.494 -6.607 -3.756 1.00 0.00 H new ATOM 0 HB1 ALA A 91 2.716 -8.387 -5.301 1.00 0.00 H new ATOM 0 HB2 ALA A 91 1.461 -7.956 -4.115 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.349 -7.357 -5.787 1.00 0.00 H new ATOM 1348 N TYR A 92 5.000 -6.078 -5.604 1.00 0.00 N ATOM 1349 CA TYR A 92 5.961 -5.682 -6.631 1.00 0.00 C ATOM 1350 C TYR A 92 6.933 -6.821 -6.934 1.00 0.00 C ATOM 1351 O TYR A 92 7.213 -7.660 -6.076 1.00 0.00 O ATOM 1352 CB TYR A 92 6.782 -4.455 -6.199 1.00 0.00 C ATOM 1353 CG TYR A 92 5.977 -3.217 -5.867 1.00 0.00 C ATOM 1354 CD1 TYR A 92 5.166 -3.166 -4.741 1.00 0.00 C ATOM 1355 CD2 TYR A 92 6.038 -2.094 -6.679 1.00 0.00 C ATOM 1356 CE1 TYR A 92 4.443 -2.032 -4.434 1.00 0.00 C ATOM 1357 CE2 TYR A 92 5.317 -0.956 -6.380 1.00 0.00 C ATOM 1358 CZ TYR A 92 4.520 -0.933 -5.257 1.00 0.00 C ATOM 1359 OH TYR A 92 3.805 0.199 -4.952 1.00 0.00 O ATOM 0 H TYR A 92 5.423 -6.500 -4.777 1.00 0.00 H new ATOM 0 HA TYR A 92 5.381 -5.434 -7.520 1.00 0.00 H new ATOM 0 HB2 TYR A 92 7.376 -4.726 -5.326 1.00 0.00 H new ATOM 0 HB3 TYR A 92 7.482 -4.209 -6.997 1.00 0.00 H new ATOM 0 HD1 TYR A 92 5.100 -4.029 -4.095 1.00 0.00 H new ATOM 0 HD2 TYR A 92 6.661 -2.111 -7.561 1.00 0.00 H new ATOM 0 HE1 TYR A 92 3.820 -2.007 -3.552 1.00 0.00 H new ATOM 0 HE2 TYR A 92 5.377 -0.090 -7.022 1.00 0.00 H new ATOM 0 HH TYR A 92 4.219 0.651 -4.188 1.00 0.00 H new ATOM 1369 N LEU A 93 7.474 -6.820 -8.147 1.00 0.00 N ATOM 1370 CA LEU A 93 8.454 -7.825 -8.557 1.00 0.00 C ATOM 1371 C LEU A 93 9.815 -7.474 -7.975 1.00 0.00 C ATOM 1372 O LEU A 93 10.200 -6.311 -7.929 1.00 0.00 O ATOM 1373 CB LEU A 93 8.564 -7.923 -10.081 1.00 0.00 C ATOM 1374 CG LEU A 93 7.300 -8.387 -10.805 1.00 0.00 C ATOM 1375 CD1 LEU A 93 6.564 -7.208 -11.420 1.00 0.00 C ATOM 1376 CD2 LEU A 93 7.647 -9.408 -11.868 1.00 0.00 C ATOM 0 H LEU A 93 7.251 -6.133 -8.867 1.00 0.00 H new ATOM 0 HA LEU A 93 8.119 -8.791 -8.181 1.00 0.00 H new ATOM 0 HB2 LEU A 93 8.846 -6.945 -10.471 1.00 0.00 H new ATOM 0 HB3 LEU A 93 9.374 -8.610 -10.326 1.00 0.00 H new ATOM 0 HG LEU A 93 6.640 -8.854 -10.074 1.00 0.00 H new ATOM 0 HD11 LEU A 93 5.668 -7.564 -11.929 1.00 0.00 H new ATOM 0 HD12 LEU A 93 6.281 -6.507 -10.635 1.00 0.00 H new ATOM 0 HD13 LEU A 93 7.214 -6.707 -12.137 1.00 0.00 H new ATOM 0 HD21 LEU A 93 6.737 -9.729 -12.375 1.00 0.00 H new ATOM 0 HD22 LEU A 93 8.328 -8.962 -12.593 1.00 0.00 H new ATOM 0 HD23 LEU A 93 8.126 -10.269 -11.403 1.00 0.00 H new ATOM 1388 N MET A 94 10.505 -8.485 -7.494 1.00 0.00 N ATOM 1389 CA MET A 94 11.807 -8.312 -6.863 1.00 0.00 C ATOM 1390 C MET A 94 12.955 -8.323 -7.869 1.00 0.00 C ATOM 1391 O MET A 94 13.952 -7.630 -7.685 1.00 0.00 O ATOM 1392 CB MET A 94 12.010 -9.421 -5.837 1.00 0.00 C ATOM 1393 CG MET A 94 13.299 -9.310 -5.051 1.00 0.00 C ATOM 1394 SD MET A 94 13.260 -7.952 -3.868 1.00 0.00 S ATOM 1395 CE MET A 94 11.829 -8.402 -2.890 1.00 0.00 C ATOM 0 H MET A 94 10.184 -9.453 -7.526 1.00 0.00 H new ATOM 0 HA MET A 94 11.816 -7.334 -6.383 1.00 0.00 H new ATOM 0 HB2 MET A 94 11.171 -9.415 -5.141 1.00 0.00 H new ATOM 0 HB3 MET A 94 11.992 -10.383 -6.350 1.00 0.00 H new ATOM 0 HG2 MET A 94 13.482 -10.245 -4.522 1.00 0.00 H new ATOM 0 HG3 MET A 94 14.131 -9.166 -5.740 1.00 0.00 H new ATOM 0 HE1 MET A 94 12.047 -8.247 -1.833 1.00 0.00 H new ATOM 0 HE2 MET A 94 10.980 -7.782 -3.180 1.00 0.00 H new ATOM 0 HE3 MET A 94 11.587 -9.451 -3.060 1.00 0.00 H new ATOM 1405 N SER A 95 12.832 -9.126 -8.913 1.00 0.00 N ATOM 1406 CA SER A 95 13.886 -9.221 -9.917 1.00 0.00 C ATOM 1407 C SER A 95 13.423 -10.036 -11.112 1.00 0.00 C ATOM 1408 O SER A 95 13.176 -9.498 -12.193 1.00 0.00 O ATOM 1409 CB SER A 95 15.146 -9.858 -9.305 1.00 0.00 C ATOM 1410 OG SER A 95 16.195 -9.955 -10.254 1.00 0.00 O ATOM 0 H SER A 95 12.021 -9.718 -9.089 1.00 0.00 H new ATOM 0 HA SER A 95 14.123 -8.213 -10.257 1.00 0.00 H new ATOM 0 HB2 SER A 95 15.478 -9.264 -8.454 1.00 0.00 H new ATOM 0 HB3 SER A 95 14.905 -10.851 -8.926 1.00 0.00 H new ATOM 0 HG SER A 95 16.981 -10.362 -9.833 1.00 0.00 H new ATOM 1416 N ASP A 96 13.310 -11.333 -10.906 1.00 0.00 N ATOM 1417 CA ASP A 96 12.883 -12.239 -11.962 1.00 0.00 C ATOM 1418 C ASP A 96 11.373 -12.396 -11.946 1.00 0.00 C ATOM 1419 O ASP A 96 10.709 -12.266 -12.973 1.00 0.00 O ATOM 1420 CB ASP A 96 13.539 -13.607 -11.796 1.00 0.00 C ATOM 1421 CG ASP A 96 15.051 -13.530 -11.742 1.00 0.00 C ATOM 1422 OD1 ASP A 96 15.667 -13.074 -12.725 1.00 0.00 O ATOM 1423 OD2 ASP A 96 15.629 -13.929 -10.709 1.00 0.00 O ATOM 0 H ASP A 96 13.508 -11.788 -10.015 1.00 0.00 H new ATOM 0 HA ASP A 96 13.190 -11.813 -12.917 1.00 0.00 H new ATOM 0 HB2 ASP A 96 13.171 -14.073 -10.882 1.00 0.00 H new ATOM 0 HB3 ASP A 96 13.242 -14.250 -12.624 1.00 0.00 H new ATOM 1428 N GLY A 97 10.835 -12.685 -10.769 1.00 0.00 N ATOM 1429 CA GLY A 97 9.402 -12.863 -10.645 1.00 0.00 C ATOM 1430 C GLY A 97 8.947 -13.087 -9.216 1.00 0.00 C ATOM 1431 O GLY A 97 7.873 -13.630 -8.983 1.00 0.00 O ATOM 0 H GLY A 97 11.361 -12.799 -9.903 1.00 0.00 H new ATOM 0 HA2 GLY A 97 8.898 -11.984 -11.046 1.00 0.00 H new ATOM 0 HA3 GLY A 97 9.094 -13.713 -11.254 1.00 0.00 H new ATOM 1435 N ASN A 98 9.741 -12.627 -8.258 1.00 0.00 N ATOM 1436 CA ASN A 98 9.383 -12.742 -6.860 1.00 0.00 C ATOM 1437 C ASN A 98 8.541 -11.541 -6.503 1.00 0.00 C ATOM 1438 O ASN A 98 8.685 -10.481 -7.107 1.00 0.00 O ATOM 1439 CB ASN A 98 10.616 -12.802 -5.956 1.00 0.00 C ATOM 1440 CG ASN A 98 11.338 -14.136 -6.008 1.00 0.00 C ATOM 1441 OD1 ASN A 98 11.851 -14.543 -7.048 1.00 0.00 O ATOM 1442 ND2 ASN A 98 11.381 -14.827 -4.876 1.00 0.00 N ATOM 0 H ASN A 98 10.637 -12.171 -8.429 1.00 0.00 H new ATOM 0 HA ASN A 98 8.833 -13.670 -6.706 1.00 0.00 H new ATOM 0 HB2 ASN A 98 11.308 -12.011 -6.245 1.00 0.00 H new ATOM 0 HB3 ASN A 98 10.314 -12.601 -4.928 1.00 0.00 H new ATOM 0 HD21 ASN A 98 11.852 -15.731 -4.848 1.00 0.00 H new ATOM 0 HD22 ASN A 98 10.943 -14.454 -4.034 1.00 0.00 H new ATOM 1449 N THR A 99 7.644 -11.707 -5.567 1.00 0.00 N ATOM 1450 CA THR A 99 6.756 -10.625 -5.186 1.00 0.00 C ATOM 1451 C THR A 99 6.743 -10.369 -3.679 1.00 0.00 C ATOM 1452 O THR A 99 6.348 -11.233 -2.902 1.00 0.00 O ATOM 1453 CB THR A 99 5.325 -10.954 -5.643 1.00 0.00 C ATOM 1454 OG1 THR A 99 5.341 -11.384 -7.010 1.00 0.00 O ATOM 1455 CG2 THR A 99 4.418 -9.751 -5.501 1.00 0.00 C ATOM 0 H THR A 99 7.504 -12.576 -5.052 1.00 0.00 H new ATOM 0 HA THR A 99 7.128 -9.723 -5.671 1.00 0.00 H new ATOM 0 HB THR A 99 4.939 -11.752 -5.009 1.00 0.00 H new ATOM 0 HG1 THR A 99 4.428 -11.594 -7.297 1.00 0.00 H new ATOM 0 HG21 THR A 99 3.413 -10.012 -5.831 1.00 0.00 H new ATOM 0 HG22 THR A 99 4.387 -9.440 -4.457 1.00 0.00 H new ATOM 0 HG23 THR A 99 4.800 -8.933 -6.112 1.00 0.00 H new ATOM 1463 N LEU A 100 7.134 -9.165 -3.274 1.00 0.00 N ATOM 1464 CA LEU A 100 7.107 -8.799 -1.863 1.00 0.00 C ATOM 1465 C LEU A 100 5.737 -8.198 -1.553 1.00 0.00 C ATOM 1466 O LEU A 100 5.429 -7.083 -1.975 1.00 0.00 O ATOM 1467 CB LEU A 100 8.238 -7.808 -1.528 1.00 0.00 C ATOM 1468 CG LEU A 100 8.657 -7.749 -0.049 1.00 0.00 C ATOM 1469 CD1 LEU A 100 10.095 -7.268 0.076 1.00 0.00 C ATOM 1470 CD2 LEU A 100 7.743 -6.831 0.752 1.00 0.00 C ATOM 0 H LEU A 100 7.471 -8.431 -3.898 1.00 0.00 H new ATOM 0 HA LEU A 100 7.269 -9.683 -1.247 1.00 0.00 H new ATOM 0 HB2 LEU A 100 9.113 -8.068 -2.124 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.926 -6.811 -1.838 1.00 0.00 H new ATOM 0 HG LEU A 100 8.574 -8.758 0.356 1.00 0.00 H new ATOM 0 HD11 LEU A 100 10.376 -7.232 1.128 1.00 0.00 H new ATOM 0 HD12 LEU A 100 10.756 -7.955 -0.453 1.00 0.00 H new ATOM 0 HD13 LEU A 100 10.185 -6.272 -0.358 1.00 0.00 H new ATOM 0 HD21 LEU A 100 8.067 -6.812 1.792 1.00 0.00 H new ATOM 0 HD22 LEU A 100 7.788 -5.823 0.340 1.00 0.00 H new ATOM 0 HD23 LEU A 100 6.719 -7.200 0.698 1.00 0.00 H new ATOM 1482 N ALA A 101 4.911 -8.952 -0.846 1.00 0.00 N ATOM 1483 CA ALA A 101 3.567 -8.512 -0.504 1.00 0.00 C ATOM 1484 C ALA A 101 3.538 -7.816 0.844 1.00 0.00 C ATOM 1485 O ALA A 101 4.152 -8.279 1.808 1.00 0.00 O ATOM 1486 CB ALA A 101 2.615 -9.695 -0.508 1.00 0.00 C ATOM 0 H ALA A 101 5.150 -9.879 -0.495 1.00 0.00 H new ATOM 0 HA ALA A 101 3.246 -7.792 -1.256 1.00 0.00 H new ATOM 0 HB1 ALA A 101 1.612 -9.355 -0.251 1.00 0.00 H new ATOM 0 HB2 ALA A 101 2.602 -10.148 -1.499 1.00 0.00 H new ATOM 0 HB3 ALA A 101 2.947 -10.432 0.223 1.00 0.00 H new ATOM 1492 N VAL A 102 2.810 -6.712 0.905 1.00 0.00 N ATOM 1493 CA VAL A 102 2.675 -5.943 2.132 1.00 0.00 C ATOM 1494 C VAL A 102 1.197 -5.636 2.379 1.00 0.00 C ATOM 1495 O VAL A 102 0.485 -5.223 1.463 1.00 0.00 O ATOM 1496 CB VAL A 102 3.454 -4.610 2.062 1.00 0.00 C ATOM 1497 CG1 VAL A 102 3.433 -3.895 3.406 1.00 0.00 C ATOM 1498 CG2 VAL A 102 4.887 -4.827 1.592 1.00 0.00 C ATOM 0 H VAL A 102 2.299 -6.326 0.111 1.00 0.00 H new ATOM 0 HA VAL A 102 3.088 -6.540 2.945 1.00 0.00 H new ATOM 0 HB VAL A 102 2.954 -3.977 1.329 1.00 0.00 H new ATOM 0 HG11 VAL A 102 3.988 -2.960 3.329 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.402 -3.683 3.689 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.894 -4.530 4.163 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.406 -3.869 1.554 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.401 -5.491 2.287 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.880 -5.276 0.599 1.00 0.00 H new ATOM 1508 N LEU A 103 0.737 -5.848 3.603 1.00 0.00 N ATOM 1509 CA LEU A 103 -0.659 -5.598 3.949 1.00 0.00 C ATOM 1510 C LEU A 103 -0.802 -4.387 4.869 1.00 0.00 C ATOM 1511 O LEU A 103 0.084 -4.103 5.672 1.00 0.00 O ATOM 1512 CB LEU A 103 -1.285 -6.819 4.642 1.00 0.00 C ATOM 1513 CG LEU A 103 -1.524 -8.051 3.760 1.00 0.00 C ATOM 1514 CD1 LEU A 103 -0.227 -8.797 3.487 1.00 0.00 C ATOM 1515 CD2 LEU A 103 -2.541 -8.977 4.412 1.00 0.00 C ATOM 0 H LEU A 103 1.308 -6.192 4.375 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.181 -5.400 3.013 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.639 -7.111 5.470 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.239 -6.516 5.073 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.919 -7.708 2.804 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -0.431 -9.664 2.859 1.00 0.00 H new ATOM 0 HD12 LEU A 103 0.472 -8.136 2.975 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.209 -9.126 4.430 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -2.701 -9.847 3.776 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.167 -9.302 5.383 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.484 -8.446 4.545 1.00 0.00 H new ATOM 1527 N PHE A 104 -1.942 -3.706 4.757 1.00 0.00 N ATOM 1528 CA PHE A 104 -2.265 -2.541 5.586 1.00 0.00 C ATOM 1529 C PHE A 104 -3.736 -2.608 5.967 1.00 0.00 C ATOM 1530 O PHE A 104 -4.546 -3.133 5.203 1.00 0.00 O ATOM 1531 CB PHE A 104 -2.006 -1.214 4.860 1.00 0.00 C ATOM 1532 CG PHE A 104 -0.561 -0.908 4.605 1.00 0.00 C ATOM 1533 CD1 PHE A 104 0.077 -1.391 3.475 1.00 0.00 C ATOM 1534 CD2 PHE A 104 0.155 -0.124 5.492 1.00 0.00 C ATOM 1535 CE1 PHE A 104 1.404 -1.097 3.237 1.00 0.00 C ATOM 1536 CE2 PHE A 104 1.479 0.169 5.258 1.00 0.00 C ATOM 1537 CZ PHE A 104 2.106 -0.316 4.128 1.00 0.00 C ATOM 0 H PHE A 104 -2.672 -3.946 4.086 1.00 0.00 H new ATOM 0 HA PHE A 104 -1.621 -2.570 6.465 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -2.533 -1.229 3.906 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -2.436 -0.404 5.449 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -0.469 -2.004 2.773 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -0.330 0.262 6.377 1.00 0.00 H new ATOM 0 HE1 PHE A 104 1.892 -1.479 2.352 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.028 0.779 5.960 1.00 0.00 H new ATOM 0 HZ PHE A 104 3.144 -0.084 3.943 1.00 0.00 H new ATOM 1547 N SER A 105 -4.083 -2.103 7.144 1.00 0.00 N ATOM 1548 CA SER A 105 -5.461 -2.139 7.597 1.00 0.00 C ATOM 1549 C SER A 105 -5.743 -1.041 8.620 1.00 0.00 C ATOM 1550 O SER A 105 -5.001 -0.870 9.588 1.00 0.00 O ATOM 1551 CB SER A 105 -5.766 -3.504 8.217 1.00 0.00 C ATOM 1552 OG SER A 105 -7.157 -3.676 8.435 1.00 0.00 O ATOM 0 H SER A 105 -3.431 -1.667 7.796 1.00 0.00 H new ATOM 0 HA SER A 105 -6.102 -1.971 6.732 1.00 0.00 H new ATOM 0 HB2 SER A 105 -5.399 -4.293 7.561 1.00 0.00 H new ATOM 0 HB3 SER A 105 -5.233 -3.603 9.163 1.00 0.00 H new ATOM 0 HG SER A 105 -7.320 -4.558 8.830 1.00 0.00 H new ATOM 1558 N VAL A 106 -6.836 -0.316 8.398 1.00 0.00 N ATOM 1559 CA VAL A 106 -7.270 0.758 9.289 1.00 0.00 C ATOM 1560 C VAL A 106 -8.796 0.733 9.400 1.00 0.00 C ATOM 1561 O VAL A 106 -9.495 0.948 8.407 1.00 0.00 O ATOM 1562 CB VAL A 106 -6.822 2.157 8.788 1.00 0.00 C ATOM 1563 CG1 VAL A 106 -7.360 3.256 9.696 1.00 0.00 C ATOM 1564 CG2 VAL A 106 -5.306 2.247 8.694 1.00 0.00 C ATOM 0 H VAL A 106 -7.447 -0.456 7.594 1.00 0.00 H new ATOM 0 HA VAL A 106 -6.805 0.588 10.260 1.00 0.00 H new ATOM 0 HB VAL A 106 -7.235 2.298 7.789 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -7.033 4.227 9.325 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -8.449 3.219 9.706 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -6.983 3.109 10.708 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -5.022 3.238 8.340 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -4.870 2.074 9.678 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -4.939 1.494 7.996 1.00 0.00 H new ATOM 1574 N PRO A 107 -9.329 0.436 10.595 1.00 0.00 N ATOM 1575 CA PRO A 107 -10.775 0.348 10.843 1.00 0.00 C ATOM 1576 C PRO A 107 -11.457 1.713 11.004 1.00 0.00 C ATOM 1577 O PRO A 107 -10.805 2.728 11.249 1.00 0.00 O ATOM 1578 CB PRO A 107 -10.866 -0.443 12.158 1.00 0.00 C ATOM 1579 CG PRO A 107 -9.466 -0.870 12.479 1.00 0.00 C ATOM 1580 CD PRO A 107 -8.569 0.118 11.804 1.00 0.00 C ATOM 0 HA PRO A 107 -11.287 -0.115 9.999 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -11.279 0.173 12.957 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -11.522 -1.306 12.050 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -9.298 -0.878 13.556 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -9.274 -1.881 12.119 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -8.394 1.000 12.421 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -7.593 -0.308 11.573 1.00 0.00 H new ATOM 1588 N TYR A 108 -12.782 1.712 10.883 1.00 0.00 N ATOM 1589 CA TYR A 108 -13.584 2.916 11.031 1.00 0.00 C ATOM 1590 C TYR A 108 -14.178 2.953 12.437 1.00 0.00 C ATOM 1591 O TYR A 108 -14.175 1.940 13.134 1.00 0.00 O ATOM 1592 CB TYR A 108 -14.698 2.925 9.975 1.00 0.00 C ATOM 1593 CG TYR A 108 -15.553 4.176 9.939 1.00 0.00 C ATOM 1594 CD1 TYR A 108 -15.008 5.407 9.611 1.00 0.00 C ATOM 1595 CD2 TYR A 108 -16.916 4.115 10.208 1.00 0.00 C ATOM 1596 CE1 TYR A 108 -15.791 6.544 9.554 1.00 0.00 C ATOM 1597 CE2 TYR A 108 -17.707 5.245 10.147 1.00 0.00 C ATOM 1598 CZ TYR A 108 -17.139 6.458 9.821 1.00 0.00 C ATOM 1599 OH TYR A 108 -17.925 7.583 9.743 1.00 0.00 O ATOM 0 H TYR A 108 -13.327 0.874 10.679 1.00 0.00 H new ATOM 0 HA TYR A 108 -12.961 3.799 10.886 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -14.245 2.787 8.993 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -15.347 2.067 10.150 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -13.952 5.479 9.396 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -17.364 3.167 10.469 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -15.348 7.496 9.301 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -18.765 5.179 10.354 1.00 0.00 H new ATOM 0 HH TYR A 108 -18.852 7.350 9.960 1.00 0.00 H new ATOM 1701 N SER A 114 -7.122 -1.263 15.875 1.00 0.00 N ATOM 1702 CA SER A 114 -5.677 -1.242 15.723 1.00 0.00 C ATOM 1703 C SER A 114 -5.293 -1.462 14.262 1.00 0.00 C ATOM 1704 O SER A 114 -5.962 -2.196 13.544 1.00 0.00 O ATOM 1705 CB SER A 114 -5.032 -2.315 16.604 1.00 0.00 C ATOM 1706 OG SER A 114 -5.306 -2.081 17.975 1.00 0.00 O ATOM 0 HA SER A 114 -5.311 -0.265 16.038 1.00 0.00 H new ATOM 0 HB2 SER A 114 -5.406 -3.298 16.318 1.00 0.00 H new ATOM 0 HB3 SER A 114 -3.954 -2.324 16.442 1.00 0.00 H new ATOM 0 HG SER A 114 -6.143 -1.578 18.060 1.00 0.00 H new ATOM 1712 N ASN A 115 -4.218 -0.821 13.834 1.00 0.00 N ATOM 1713 CA ASN A 115 -3.730 -0.950 12.460 1.00 0.00 C ATOM 1714 C ASN A 115 -3.110 -2.325 12.254 1.00 0.00 C ATOM 1715 O ASN A 115 -2.641 -2.947 13.206 1.00 0.00 O ATOM 1716 CB ASN A 115 -2.689 0.130 12.163 1.00 0.00 C ATOM 1717 CG ASN A 115 -3.260 1.536 12.177 1.00 0.00 C ATOM 1718 OD1 ASN A 115 -2.517 2.509 12.140 1.00 0.00 O ATOM 1719 ND2 ASN A 115 -4.579 1.659 12.220 1.00 0.00 N ATOM 0 H ASN A 115 -3.659 -0.200 14.419 1.00 0.00 H new ATOM 0 HA ASN A 115 -4.573 -0.828 11.780 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -1.887 0.064 12.899 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -2.243 -0.064 11.187 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -5.005 2.586 12.223 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -5.168 0.827 12.250 1.00 0.00 H new ATOM 1726 N TRP A 116 -3.105 -2.801 11.022 1.00 0.00 N ATOM 1727 CA TRP A 116 -2.529 -4.102 10.724 1.00 0.00 C ATOM 1728 C TRP A 116 -1.616 -4.006 9.509 1.00 0.00 C ATOM 1729 O TRP A 116 -1.937 -3.318 8.540 1.00 0.00 O ATOM 1730 CB TRP A 116 -3.631 -5.144 10.498 1.00 0.00 C ATOM 1731 CG TRP A 116 -4.403 -5.475 11.745 1.00 0.00 C ATOM 1732 CD1 TRP A 116 -3.962 -6.219 12.801 1.00 0.00 C ATOM 1733 CD2 TRP A 116 -5.751 -5.094 12.060 1.00 0.00 C ATOM 1734 NE1 TRP A 116 -4.941 -6.297 13.765 1.00 0.00 N ATOM 1735 CE2 TRP A 116 -6.049 -5.624 13.329 1.00 0.00 C ATOM 1736 CE3 TRP A 116 -6.732 -4.352 11.398 1.00 0.00 C ATOM 1737 CZ2 TRP A 116 -7.282 -5.437 13.946 1.00 0.00 C ATOM 1738 CZ3 TRP A 116 -7.958 -4.168 12.011 1.00 0.00 C ATOM 1739 CH2 TRP A 116 -8.224 -4.709 13.274 1.00 0.00 C ATOM 0 H TRP A 116 -3.491 -2.310 10.215 1.00 0.00 H new ATOM 0 HA TRP A 116 -1.934 -4.424 11.579 1.00 0.00 H new ATOM 0 HB2 TRP A 116 -4.321 -4.774 9.740 1.00 0.00 H new ATOM 0 HB3 TRP A 116 -3.183 -6.056 10.104 1.00 0.00 H new ATOM 0 HD1 TRP A 116 -2.987 -6.679 12.870 1.00 0.00 H new ATOM 0 HE1 TRP A 116 -4.854 -6.779 14.660 1.00 0.00 H new ATOM 0 HE3 TRP A 116 -6.536 -3.929 10.424 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 -7.488 -5.852 14.921 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 -8.723 -3.597 11.506 1.00 0.00 H new ATOM 0 HH2 TRP A 116 -9.192 -4.548 13.726 1.00 0.00 H new ATOM 1750 N TRP A 117 -0.474 -4.677 9.580 1.00 0.00 N ATOM 1751 CA TRP A 117 0.500 -4.660 8.498 1.00 0.00 C ATOM 1752 C TRP A 117 1.247 -5.987 8.440 1.00 0.00 C ATOM 1753 O TRP A 117 1.516 -6.600 9.470 1.00 0.00 O ATOM 1754 CB TRP A 117 1.492 -3.499 8.688 1.00 0.00 C ATOM 1755 CG TRP A 117 2.354 -3.641 9.910 1.00 0.00 C ATOM 1756 CD1 TRP A 117 2.053 -3.229 11.175 1.00 0.00 C ATOM 1757 CD2 TRP A 117 3.667 -4.219 9.978 1.00 0.00 C ATOM 1758 NE1 TRP A 117 3.080 -3.538 12.031 1.00 0.00 N ATOM 1759 CE2 TRP A 117 4.084 -4.142 11.320 1.00 0.00 C ATOM 1760 CE3 TRP A 117 4.526 -4.802 9.037 1.00 0.00 C ATOM 1761 CZ2 TRP A 117 5.318 -4.627 11.741 1.00 0.00 C ATOM 1762 CZ3 TRP A 117 5.751 -5.279 9.461 1.00 0.00 C ATOM 1763 CH2 TRP A 117 6.136 -5.190 10.803 1.00 0.00 C ATOM 0 H TRP A 117 -0.199 -5.244 10.382 1.00 0.00 H new ATOM 0 HA TRP A 117 -0.029 -4.515 7.556 1.00 0.00 H new ATOM 0 HB2 TRP A 117 2.132 -3.430 7.808 1.00 0.00 H new ATOM 0 HB3 TRP A 117 0.936 -2.564 8.752 1.00 0.00 H new ATOM 0 HD1 TRP A 117 1.138 -2.731 11.462 1.00 0.00 H new ATOM 0 HE1 TRP A 117 3.094 -3.349 13.033 1.00 0.00 H new ATOM 0 HE3 TRP A 117 4.236 -4.877 7.999 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 5.620 -4.561 12.776 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 6.423 -5.728 8.745 1.00 0.00 H new ATOM 0 HH2 TRP A 117 7.100 -5.574 11.104 1.00 0.00 H new ATOM 1774 N ASN A 118 1.576 -6.445 7.242 1.00 0.00 N ATOM 1775 CA ASN A 118 2.293 -7.713 7.105 1.00 0.00 C ATOM 1776 C ASN A 118 3.109 -7.785 5.814 1.00 0.00 C ATOM 1777 O ASN A 118 2.554 -7.772 4.719 1.00 0.00 O ATOM 1778 CB ASN A 118 1.317 -8.890 7.157 1.00 0.00 C ATOM 1779 CG ASN A 118 2.022 -10.226 7.041 1.00 0.00 C ATOM 1780 OD1 ASN A 118 2.939 -10.522 7.802 1.00 0.00 O ATOM 1781 ND2 ASN A 118 1.593 -11.043 6.095 1.00 0.00 N ATOM 0 H ASN A 118 1.365 -5.972 6.363 1.00 0.00 H new ATOM 0 HA ASN A 118 2.988 -7.772 7.943 1.00 0.00 H new ATOM 0 HB2 ASN A 118 0.759 -8.856 8.093 1.00 0.00 H new ATOM 0 HB3 ASN A 118 0.591 -8.793 6.350 1.00 0.00 H new ATOM 0 HD21 ASN A 118 2.027 -11.958 5.976 1.00 0.00 H new ATOM 0 HD22 ASN A 118 0.828 -10.758 5.484 1.00 0.00 H new ATOM 1788 N VAL A 119 4.427 -7.881 5.964 1.00 0.00 N ATOM 1789 CA VAL A 119 5.345 -7.991 4.828 1.00 0.00 C ATOM 1790 C VAL A 119 5.826 -9.438 4.650 1.00 0.00 C ATOM 1791 O VAL A 119 6.175 -10.101 5.630 1.00 0.00 O ATOM 1792 CB VAL A 119 6.568 -7.059 5.000 1.00 0.00 C ATOM 1793 CG1 VAL A 119 6.162 -5.609 4.807 1.00 0.00 C ATOM 1794 CG2 VAL A 119 7.218 -7.243 6.364 1.00 0.00 C ATOM 0 H VAL A 119 4.890 -7.885 6.873 1.00 0.00 H new ATOM 0 HA VAL A 119 4.794 -7.685 3.938 1.00 0.00 H new ATOM 0 HB VAL A 119 7.299 -7.328 4.238 1.00 0.00 H new ATOM 0 HG11 VAL A 119 7.034 -4.967 4.931 1.00 0.00 H new ATOM 0 HG12 VAL A 119 5.753 -5.476 3.805 1.00 0.00 H new ATOM 0 HG13 VAL A 119 5.406 -5.341 5.546 1.00 0.00 H new ATOM 0 HG21 VAL A 119 8.074 -6.574 6.452 1.00 0.00 H new ATOM 0 HG22 VAL A 119 6.495 -7.012 7.146 1.00 0.00 H new ATOM 0 HG23 VAL A 119 7.552 -8.275 6.472 1.00 0.00 H new ATOM 1804 N ARG A 120 5.850 -9.929 3.410 1.00 0.00 N ATOM 1805 CA ARG A 120 6.302 -11.300 3.147 1.00 0.00 C ATOM 1806 C ARG A 120 6.646 -11.494 1.667 1.00 0.00 C ATOM 1807 O ARG A 120 5.998 -10.922 0.790 1.00 0.00 O ATOM 1808 CB ARG A 120 5.224 -12.306 3.564 1.00 0.00 C ATOM 1809 CG ARG A 120 5.727 -13.736 3.719 1.00 0.00 C ATOM 1810 CD ARG A 120 6.598 -13.900 4.957 1.00 0.00 C ATOM 1811 NE ARG A 120 6.946 -15.303 5.192 1.00 0.00 N ATOM 1812 CZ ARG A 120 7.602 -15.747 6.263 1.00 0.00 C ATOM 1813 NH1 ARG A 120 7.976 -14.912 7.222 1.00 0.00 N ATOM 1814 NH2 ARG A 120 7.875 -17.037 6.378 1.00 0.00 N ATOM 0 H ARG A 120 5.566 -9.408 2.581 1.00 0.00 H new ATOM 0 HA ARG A 120 7.203 -11.473 3.736 1.00 0.00 H new ATOM 0 HB2 ARG A 120 4.788 -11.982 4.509 1.00 0.00 H new ATOM 0 HB3 ARG A 120 4.425 -12.293 2.823 1.00 0.00 H new ATOM 0 HG2 ARG A 120 4.877 -14.415 3.781 1.00 0.00 H new ATOM 0 HG3 ARG A 120 6.297 -14.018 2.834 1.00 0.00 H new ATOM 0 HD2 ARG A 120 7.509 -13.313 4.841 1.00 0.00 H new ATOM 0 HD3 ARG A 120 6.073 -13.505 5.827 1.00 0.00 H new ATOM 0 HE ARG A 120 6.667 -15.986 4.488 1.00 0.00 H new ATOM 0 HH11 ARG A 120 7.762 -13.918 7.145 1.00 0.00 H new ATOM 0 HH12 ARG A 120 8.478 -15.264 8.037 1.00 0.00 H new ATOM 0 HH21 ARG A 120 7.583 -17.687 5.648 1.00 0.00 H new ATOM 0 HH22 ARG A 120 8.377 -17.381 7.196 1.00 0.00 H new ATOM 1828 N ILE A 121 7.679 -12.288 1.398 1.00 0.00 N ATOM 1829 CA ILE A 121 8.127 -12.548 0.027 1.00 0.00 C ATOM 1830 C ILE A 121 7.386 -13.736 -0.605 1.00 0.00 C ATOM 1831 O ILE A 121 7.102 -14.730 0.063 1.00 0.00 O ATOM 1832 CB ILE A 121 9.642 -12.868 -0.022 1.00 0.00 C ATOM 1833 CG1 ILE A 121 10.430 -12.032 0.999 1.00 0.00 C ATOM 1834 CG2 ILE A 121 10.182 -12.636 -1.429 1.00 0.00 C ATOM 1835 CD1 ILE A 121 10.420 -10.546 0.723 1.00 0.00 C ATOM 0 H ILE A 121 8.226 -12.766 2.114 1.00 0.00 H new ATOM 0 HA ILE A 121 7.912 -11.637 -0.532 1.00 0.00 H new ATOM 0 HB ILE A 121 9.771 -13.918 0.242 1.00 0.00 H new ATOM 0 HG12 ILE A 121 10.017 -12.208 1.992 1.00 0.00 H new ATOM 0 HG13 ILE A 121 11.463 -12.380 1.017 1.00 0.00 H new ATOM 0 HG21 ILE A 121 11.248 -12.864 -1.452 1.00 0.00 H new ATOM 0 HG22 ILE A 121 9.657 -13.283 -2.131 1.00 0.00 H new ATOM 0 HG23 ILE A 121 10.028 -11.594 -1.711 1.00 0.00 H new ATOM 0 HD11 ILE A 121 10.998 -10.030 1.489 1.00 0.00 H new ATOM 0 HD12 ILE A 121 10.861 -10.355 -0.255 1.00 0.00 H new ATOM 0 HD13 ILE A 121 9.393 -10.181 0.735 1.00 0.00 H new ATOM 1847 N TYR A 122 7.116 -13.636 -1.903 1.00 0.00 N ATOM 1848 CA TYR A 122 6.457 -14.699 -2.667 1.00 0.00 C ATOM 1849 C TYR A 122 7.301 -15.017 -3.901 1.00 0.00 C ATOM 1850 O TYR A 122 7.865 -14.113 -4.505 1.00 0.00 O ATOM 1851 CB TYR A 122 5.044 -14.285 -3.108 1.00 0.00 C ATOM 1852 CG TYR A 122 3.943 -14.680 -2.140 1.00 0.00 C ATOM 1853 CD1 TYR A 122 3.819 -14.082 -0.891 1.00 0.00 C ATOM 1854 CD2 TYR A 122 3.031 -15.677 -2.479 1.00 0.00 C ATOM 1855 CE1 TYR A 122 2.824 -14.469 -0.009 1.00 0.00 C ATOM 1856 CE2 TYR A 122 2.033 -16.063 -1.606 1.00 0.00 C ATOM 1857 CZ TYR A 122 1.936 -15.460 -0.373 1.00 0.00 C ATOM 1858 OH TYR A 122 0.949 -15.853 0.502 1.00 0.00 O ATOM 0 H TYR A 122 7.348 -12.813 -2.460 1.00 0.00 H new ATOM 0 HA TYR A 122 6.365 -15.577 -2.028 1.00 0.00 H new ATOM 0 HB2 TYR A 122 5.021 -13.204 -3.243 1.00 0.00 H new ATOM 0 HB3 TYR A 122 4.834 -14.732 -4.080 1.00 0.00 H new ATOM 0 HD1 TYR A 122 4.510 -13.303 -0.604 1.00 0.00 H new ATOM 0 HD2 TYR A 122 3.106 -16.157 -3.443 1.00 0.00 H new ATOM 0 HE1 TYR A 122 2.744 -13.997 0.959 1.00 0.00 H new ATOM 0 HE2 TYR A 122 1.332 -16.834 -1.890 1.00 0.00 H new ATOM 0 HH TYR A 122 0.617 -15.072 0.993 1.00 0.00 H new ATOM 1868 N LYS A 123 7.396 -16.285 -4.278 1.00 0.00 N ATOM 1869 CA LYS A 123 8.189 -16.666 -5.454 1.00 0.00 C ATOM 1870 C LYS A 123 7.325 -16.720 -6.715 1.00 0.00 C ATOM 1871 O LYS A 123 7.399 -17.680 -7.488 1.00 0.00 O ATOM 1872 CB LYS A 123 8.891 -18.018 -5.251 1.00 0.00 C ATOM 1873 CG LYS A 123 9.921 -18.024 -4.127 1.00 0.00 C ATOM 1874 CD LYS A 123 10.693 -19.341 -4.070 1.00 0.00 C ATOM 1875 CE LYS A 123 11.494 -19.582 -5.345 1.00 0.00 C ATOM 1876 NZ LYS A 123 12.287 -20.842 -5.293 1.00 0.00 N ATOM 0 H LYS A 123 6.943 -17.063 -3.798 1.00 0.00 H new ATOM 0 HA LYS A 123 8.950 -15.896 -5.581 1.00 0.00 H new ATOM 0 HB2 LYS A 123 8.138 -18.778 -5.043 1.00 0.00 H new ATOM 0 HB3 LYS A 123 9.383 -18.303 -6.181 1.00 0.00 H new ATOM 0 HG2 LYS A 123 10.619 -17.199 -4.270 1.00 0.00 H new ATOM 0 HG3 LYS A 123 9.420 -17.855 -3.174 1.00 0.00 H new ATOM 0 HD2 LYS A 123 11.367 -19.331 -3.213 1.00 0.00 H new ATOM 0 HD3 LYS A 123 9.996 -20.165 -3.917 1.00 0.00 H new ATOM 0 HE2 LYS A 123 10.813 -19.620 -6.196 1.00 0.00 H new ATOM 0 HE3 LYS A 123 12.166 -18.740 -5.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 12.812 -20.958 -6.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 12.957 -20.798 -4.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 11.646 -21.650 -5.161 1.00 0.00 H new ATOM 1890 N GLY A 124 6.518 -15.683 -6.911 1.00 0.00 N ATOM 1891 CA GLY A 124 5.648 -15.612 -8.073 1.00 0.00 C ATOM 1892 C GLY A 124 4.653 -16.757 -8.128 1.00 0.00 C ATOM 1893 O GLY A 124 4.303 -17.323 -7.091 1.00 0.00 O ATOM 0 H GLY A 124 6.450 -14.884 -6.281 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.107 -14.666 -8.060 1.00 0.00 H new ATOM 0 HA3 GLY A 124 6.255 -15.620 -8.978 1.00 0.00 H new ATOM 1897 N LYS A 125 4.202 -17.087 -9.344 1.00 0.00 N ATOM 1898 CA LYS A 125 3.232 -18.173 -9.589 1.00 0.00 C ATOM 1899 C LYS A 125 1.832 -17.846 -9.049 1.00 0.00 C ATOM 1900 O LYS A 125 0.832 -18.036 -9.745 1.00 0.00 O ATOM 1901 CB LYS A 125 3.726 -19.502 -9.000 1.00 0.00 C ATOM 1902 CG LYS A 125 4.938 -20.083 -9.712 1.00 0.00 C ATOM 1903 CD LYS A 125 4.598 -20.540 -11.122 1.00 0.00 C ATOM 1904 CE LYS A 125 5.768 -21.265 -11.765 1.00 0.00 C ATOM 1905 NZ LYS A 125 5.453 -21.721 -13.147 1.00 0.00 N ATOM 0 H LYS A 125 4.499 -16.608 -10.194 1.00 0.00 H new ATOM 0 HA LYS A 125 3.151 -18.272 -10.671 1.00 0.00 H new ATOM 0 HB2 LYS A 125 3.972 -19.352 -7.949 1.00 0.00 H new ATOM 0 HB3 LYS A 125 2.914 -20.228 -9.037 1.00 0.00 H new ATOM 0 HG2 LYS A 125 5.729 -19.334 -9.753 1.00 0.00 H new ATOM 0 HG3 LYS A 125 5.326 -20.926 -9.140 1.00 0.00 H new ATOM 0 HD2 LYS A 125 3.730 -21.199 -11.094 1.00 0.00 H new ATOM 0 HD3 LYS A 125 4.323 -19.678 -11.730 1.00 0.00 H new ATOM 0 HE2 LYS A 125 6.634 -20.604 -11.790 1.00 0.00 H new ATOM 0 HE3 LYS A 125 6.041 -22.125 -11.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 6.279 -22.210 -13.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 4.643 -22.373 -13.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 5.217 -20.899 -13.739 1.00 0.00 H new ATOM 1919 N ARG A 126 1.762 -17.364 -7.818 1.00 0.00 N ATOM 1920 CA ARG A 126 0.494 -17.019 -7.197 1.00 0.00 C ATOM 1921 C ARG A 126 0.393 -15.506 -7.002 1.00 0.00 C ATOM 1922 O ARG A 126 1.342 -14.868 -6.546 1.00 0.00 O ATOM 1923 CB ARG A 126 0.361 -17.732 -5.844 1.00 0.00 C ATOM 1924 CG ARG A 126 -1.049 -17.718 -5.273 1.00 0.00 C ATOM 1925 CD ARG A 126 -1.977 -18.630 -6.064 1.00 0.00 C ATOM 1926 NE ARG A 126 -3.321 -18.702 -5.485 1.00 0.00 N ATOM 1927 CZ ARG A 126 -3.603 -19.239 -4.295 1.00 0.00 C ATOM 1928 NH1 ARG A 126 -2.654 -19.783 -3.553 1.00 0.00 N ATOM 1929 NH2 ARG A 126 -4.848 -19.248 -3.849 1.00 0.00 N ATOM 0 H ARG A 126 2.576 -17.202 -7.225 1.00 0.00 H new ATOM 0 HA ARG A 126 -0.316 -17.343 -7.851 1.00 0.00 H new ATOM 0 HB2 ARG A 126 0.686 -18.766 -5.956 1.00 0.00 H new ATOM 0 HB3 ARG A 126 1.036 -17.262 -5.129 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -1.024 -18.037 -4.231 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -1.439 -16.700 -5.286 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -2.046 -18.270 -7.091 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -1.549 -19.631 -6.105 1.00 0.00 H new ATOM 0 HE ARG A 126 -4.094 -18.316 -6.027 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -1.690 -19.797 -3.887 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -2.885 -20.189 -2.646 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -5.595 -18.844 -4.414 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -5.061 -19.659 -2.940 1.00 0.00 H new ATOM 1943 N ARG A 127 -0.752 -14.937 -7.349 1.00 0.00 N ATOM 1944 CA ARG A 127 -0.964 -13.505 -7.195 1.00 0.00 C ATOM 1945 C ARG A 127 -1.478 -13.195 -5.793 1.00 0.00 C ATOM 1946 O ARG A 127 -2.435 -13.825 -5.323 1.00 0.00 O ATOM 1947 CB ARG A 127 -1.971 -12.993 -8.232 1.00 0.00 C ATOM 1948 CG ARG A 127 -1.510 -13.149 -9.671 1.00 0.00 C ATOM 1949 CD ARG A 127 -2.625 -12.813 -10.648 1.00 0.00 C ATOM 1950 NE ARG A 127 -3.063 -11.416 -10.542 1.00 0.00 N ATOM 1951 CZ ARG A 127 -2.390 -10.371 -11.028 1.00 0.00 C ATOM 1952 NH1 ARG A 127 -1.215 -10.533 -11.623 1.00 0.00 N ATOM 1953 NH2 ARG A 127 -2.899 -9.153 -10.902 1.00 0.00 N ATOM 0 H ARG A 127 -1.547 -15.443 -7.738 1.00 0.00 H new ATOM 0 HA ARG A 127 -0.009 -13.002 -7.350 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -2.913 -13.527 -8.103 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -2.173 -11.939 -8.038 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -0.655 -12.498 -9.854 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -1.173 -14.172 -9.838 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -2.284 -13.007 -11.665 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -3.474 -13.472 -10.466 1.00 0.00 H new ATOM 0 HE ARG A 127 -3.944 -11.231 -10.063 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -0.814 -11.466 -11.714 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -0.713 -9.724 -11.989 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -3.797 -9.021 -10.437 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -2.392 -8.348 -11.270 1.00 0.00 H new ATOM 1967 N ALA A 128 -0.866 -12.226 -5.131 1.00 0.00 N ATOM 1968 CA ALA A 128 -1.295 -11.833 -3.798 1.00 0.00 C ATOM 1969 C ALA A 128 -2.509 -10.925 -3.898 1.00 0.00 C ATOM 1970 O ALA A 128 -2.597 -10.086 -4.793 1.00 0.00 O ATOM 1971 CB ALA A 128 -0.169 -11.148 -3.039 1.00 0.00 C ATOM 0 H ALA A 128 -0.072 -11.698 -5.494 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.567 -12.729 -3.241 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -0.519 -10.865 -2.046 1.00 0.00 H new ATOM 0 HB2 ALA A 128 0.675 -11.831 -2.946 1.00 0.00 H new ATOM 0 HB3 ALA A 128 0.145 -10.256 -3.581 1.00 0.00 H new ATOM 1977 N ASP A 129 -3.439 -11.107 -2.986 1.00 0.00 N ATOM 1978 CA ASP A 129 -4.658 -10.319 -2.964 1.00 0.00 C ATOM 1979 C ASP A 129 -5.196 -10.320 -1.536 1.00 0.00 C ATOM 1980 O ASP A 129 -4.463 -10.627 -0.595 1.00 0.00 O ATOM 1981 CB ASP A 129 -5.681 -10.931 -3.949 1.00 0.00 C ATOM 1982 CG ASP A 129 -6.721 -9.945 -4.469 1.00 0.00 C ATOM 1983 OD1 ASP A 129 -7.431 -9.331 -3.646 1.00 0.00 O ATOM 1984 OD2 ASP A 129 -6.847 -9.805 -5.706 1.00 0.00 O ATOM 0 H ASP A 129 -3.375 -11.801 -2.241 1.00 0.00 H new ATOM 0 HA ASP A 129 -4.467 -9.292 -3.274 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -5.143 -11.354 -4.797 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -6.195 -11.756 -3.455 1.00 0.00 H new ATOM 1989 N GLN A 130 -6.460 -10.003 -1.372 1.00 0.00 N ATOM 1990 CA GLN A 130 -7.075 -9.986 -0.056 1.00 0.00 C ATOM 1991 C GLN A 130 -7.166 -11.400 0.512 1.00 0.00 C ATOM 1992 O GLN A 130 -7.062 -11.604 1.719 1.00 0.00 O ATOM 1993 CB GLN A 130 -8.457 -9.341 -0.120 1.00 0.00 C ATOM 1994 CG GLN A 130 -8.419 -7.893 -0.586 1.00 0.00 C ATOM 1995 CD GLN A 130 -7.521 -7.029 0.280 1.00 0.00 C ATOM 1996 OE1 GLN A 130 -7.745 -6.891 1.483 1.00 0.00 O ATOM 1997 NE2 GLN A 130 -6.499 -6.441 -0.325 1.00 0.00 N ATOM 0 H GLN A 130 -7.089 -9.752 -2.135 1.00 0.00 H new ATOM 0 HA GLN A 130 -6.449 -9.391 0.609 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -9.089 -9.917 -0.795 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -8.919 -9.387 0.866 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -8.069 -7.855 -1.618 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -9.430 -7.485 -0.577 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -6.348 -6.581 -1.324 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -5.863 -5.848 0.208 1.00 0.00 H new ATOM 2006 N ARG A 131 -7.359 -12.374 -0.368 1.00 0.00 N ATOM 2007 CA ARG A 131 -7.461 -13.770 0.049 1.00 0.00 C ATOM 2008 C ARG A 131 -6.088 -14.440 0.165 1.00 0.00 C ATOM 2009 O ARG A 131 -6.002 -15.664 0.250 1.00 0.00 O ATOM 2010 CB ARG A 131 -8.333 -14.575 -0.927 1.00 0.00 C ATOM 2011 CG ARG A 131 -9.815 -14.223 -0.891 1.00 0.00 C ATOM 2012 CD ARG A 131 -10.156 -13.024 -1.767 1.00 0.00 C ATOM 2013 NE ARG A 131 -11.583 -12.697 -1.700 1.00 0.00 N ATOM 2014 CZ ARG A 131 -12.201 -11.823 -2.492 1.00 0.00 C ATOM 2015 NH1 ARG A 131 -11.539 -11.199 -3.458 1.00 0.00 N ATOM 2016 NH2 ARG A 131 -13.488 -11.572 -2.309 1.00 0.00 N ATOM 0 H ARG A 131 -7.448 -12.226 -1.373 1.00 0.00 H new ATOM 0 HA ARG A 131 -7.926 -13.764 1.035 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -7.961 -14.420 -1.940 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -8.219 -15.636 -0.705 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -10.397 -15.084 -1.219 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -10.109 -14.012 0.137 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -9.569 -12.162 -1.450 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -9.879 -13.236 -2.800 1.00 0.00 H new ATOM 0 HE ARG A 131 -12.144 -13.174 -0.995 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -10.547 -11.387 -3.600 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -12.023 -10.531 -4.059 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -13.999 -12.047 -1.565 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -13.968 -10.904 -2.912 1.00 0.00 H new ATOM 2030 N MET A 132 -5.020 -13.646 0.162 1.00 0.00 N ATOM 2031 CA MET A 132 -3.666 -14.190 0.255 1.00 0.00 C ATOM 2032 C MET A 132 -3.290 -14.556 1.703 1.00 0.00 C ATOM 2033 O MET A 132 -2.233 -15.134 1.953 1.00 0.00 O ATOM 2034 CB MET A 132 -2.682 -13.191 -0.382 1.00 0.00 C ATOM 2035 CG MET A 132 -1.212 -13.563 -0.273 1.00 0.00 C ATOM 2036 SD MET A 132 -0.385 -12.735 1.104 1.00 0.00 S ATOM 2037 CE MET A 132 -0.740 -11.021 0.718 1.00 0.00 C ATOM 0 H MET A 132 -5.064 -12.629 0.097 1.00 0.00 H new ATOM 0 HA MET A 132 -3.615 -15.127 -0.299 1.00 0.00 H new ATOM 0 HB2 MET A 132 -2.934 -13.081 -1.437 1.00 0.00 H new ATOM 0 HB3 MET A 132 -2.828 -12.216 0.084 1.00 0.00 H new ATOM 0 HG2 MET A 132 -1.122 -14.642 -0.150 1.00 0.00 H new ATOM 0 HG3 MET A 132 -0.706 -13.306 -1.203 1.00 0.00 H new ATOM 0 HE1 MET A 132 0.169 -10.428 0.824 1.00 0.00 H new ATOM 0 HE2 MET A 132 -1.104 -10.947 -0.307 1.00 0.00 H new ATOM 0 HE3 MET A 132 -1.501 -10.644 1.401 1.00 0.00 H new ATOM 2047 N TYR A 133 -4.169 -14.246 2.652 1.00 0.00 N ATOM 2048 CA TYR A 133 -3.916 -14.579 4.056 1.00 0.00 C ATOM 2049 C TYR A 133 -4.172 -16.070 4.354 1.00 0.00 C ATOM 2050 O TYR A 133 -3.628 -16.944 3.685 1.00 0.00 O ATOM 2051 CB TYR A 133 -4.722 -13.680 5.018 1.00 0.00 C ATOM 2052 CG TYR A 133 -6.185 -13.436 4.665 1.00 0.00 C ATOM 2053 CD1 TYR A 133 -6.963 -14.394 4.013 1.00 0.00 C ATOM 2054 CD2 TYR A 133 -6.792 -12.241 5.019 1.00 0.00 C ATOM 2055 CE1 TYR A 133 -8.296 -14.160 3.729 1.00 0.00 C ATOM 2056 CE2 TYR A 133 -8.124 -12.003 4.744 1.00 0.00 C ATOM 2057 CZ TYR A 133 -8.872 -12.964 4.098 1.00 0.00 C ATOM 2058 OH TYR A 133 -10.198 -12.726 3.828 1.00 0.00 O ATOM 0 H TYR A 133 -5.055 -13.770 2.480 1.00 0.00 H new ATOM 0 HA TYR A 133 -2.858 -14.386 4.231 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -4.682 -14.124 6.013 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -4.221 -12.714 5.080 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -6.516 -15.334 3.725 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -6.211 -11.481 5.520 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -8.883 -14.911 3.221 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -8.578 -11.067 5.034 1.00 0.00 H new ATOM 0 HH TYR A 133 -10.646 -12.413 4.641 1.00 0.00 H new ATOM 2173 N LEU A 140 -0.685 -15.343 6.536 1.00 0.00 N ATOM 2174 CA LEU A 140 -1.815 -15.401 7.447 1.00 0.00 C ATOM 2175 C LEU A 140 -2.266 -13.977 7.812 1.00 0.00 C ATOM 2176 O LEU A 140 -2.214 -13.074 6.978 1.00 0.00 O ATOM 2177 CB LEU A 140 -1.438 -16.194 8.702 1.00 0.00 C ATOM 2178 CG LEU A 140 -2.613 -16.715 9.525 1.00 0.00 C ATOM 2179 CD1 LEU A 140 -3.187 -17.971 8.892 1.00 0.00 C ATOM 2180 CD2 LEU A 140 -2.180 -16.979 10.960 1.00 0.00 C ATOM 0 HA LEU A 140 -2.646 -15.911 6.959 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -0.821 -17.042 8.404 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -0.822 -15.560 9.340 1.00 0.00 H new ATOM 0 HG LEU A 140 -3.394 -15.955 9.540 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -4.024 -18.330 9.491 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -3.533 -17.745 7.883 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -2.416 -18.741 8.847 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -3.029 -17.350 11.534 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -1.383 -17.723 10.969 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -1.817 -16.053 11.407 1.00 0.00 H new ATOM 2192 N SER A 141 -2.699 -13.784 9.051 1.00 0.00 N ATOM 2193 CA SER A 141 -3.152 -12.480 9.517 1.00 0.00 C ATOM 2194 C SER A 141 -1.980 -11.514 9.743 1.00 0.00 C ATOM 2195 O SER A 141 -0.920 -11.912 10.225 1.00 0.00 O ATOM 2196 CB SER A 141 -3.960 -12.648 10.809 1.00 0.00 C ATOM 2197 OG SER A 141 -3.269 -13.466 11.738 1.00 0.00 O ATOM 0 H SER A 141 -2.746 -14.520 9.756 1.00 0.00 H new ATOM 0 HA SER A 141 -3.784 -12.046 8.743 1.00 0.00 H new ATOM 0 HB2 SER A 141 -4.152 -11.671 11.252 1.00 0.00 H new ATOM 0 HB3 SER A 141 -4.930 -13.090 10.581 1.00 0.00 H new ATOM 0 HG SER A 141 -3.803 -13.557 12.554 1.00 0.00 H new ATOM 2203 N PRO A 142 -2.177 -10.227 9.396 1.00 0.00 N ATOM 2204 CA PRO A 142 -1.159 -9.170 9.557 1.00 0.00 C ATOM 2205 C PRO A 142 -0.755 -8.944 11.017 1.00 0.00 C ATOM 2206 O PRO A 142 -1.378 -9.470 11.944 1.00 0.00 O ATOM 2207 CB PRO A 142 -1.859 -7.910 9.027 1.00 0.00 C ATOM 2208 CG PRO A 142 -3.314 -8.222 9.039 1.00 0.00 C ATOM 2209 CD PRO A 142 -3.425 -9.701 8.818 1.00 0.00 C ATOM 0 HA PRO A 142 -0.239 -9.433 9.036 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -1.639 -7.046 9.655 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -1.519 -7.667 8.020 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -3.766 -7.935 9.988 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -3.837 -7.671 8.257 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -4.303 -10.116 9.312 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -3.511 -9.944 7.759 1.00 0.00 H new ATOM 2217 N PHE A 143 0.272 -8.132 11.212 1.00 0.00 N ATOM 2218 CA PHE A 143 0.744 -7.795 12.543 1.00 0.00 C ATOM 2219 C PHE A 143 0.094 -6.504 13.014 1.00 0.00 C ATOM 2220 O PHE A 143 -0.137 -5.595 12.218 1.00 0.00 O ATOM 2221 CB PHE A 143 2.268 -7.650 12.568 1.00 0.00 C ATOM 2222 CG PHE A 143 2.950 -8.731 13.356 1.00 0.00 C ATOM 2223 CD1 PHE A 143 2.669 -10.066 13.112 1.00 0.00 C ATOM 2224 CD2 PHE A 143 3.861 -8.412 14.350 1.00 0.00 C ATOM 2225 CE1 PHE A 143 3.287 -11.063 13.842 1.00 0.00 C ATOM 2226 CE2 PHE A 143 4.483 -9.403 15.083 1.00 0.00 C ATOM 2227 CZ PHE A 143 4.196 -10.730 14.830 1.00 0.00 C ATOM 0 H PHE A 143 0.798 -7.691 10.457 1.00 0.00 H new ATOM 0 HA PHE A 143 0.467 -8.606 13.216 1.00 0.00 H new ATOM 0 HB2 PHE A 143 2.645 -7.661 11.545 1.00 0.00 H new ATOM 0 HB3 PHE A 143 2.528 -6.680 12.993 1.00 0.00 H new ATOM 0 HD1 PHE A 143 1.959 -10.330 12.342 1.00 0.00 H new ATOM 0 HD2 PHE A 143 4.087 -7.376 14.554 1.00 0.00 H new ATOM 0 HE1 PHE A 143 3.061 -12.100 13.642 1.00 0.00 H new ATOM 0 HE2 PHE A 143 5.193 -9.141 15.853 1.00 0.00 H new ATOM 0 HZ PHE A 143 4.681 -11.507 15.403 1.00 0.00 H new ATOM 2237 N ARG A 144 -0.218 -6.433 14.298 1.00 0.00 N ATOM 2238 CA ARG A 144 -0.858 -5.254 14.862 1.00 0.00 C ATOM 2239 C ARG A 144 0.114 -4.071 14.958 1.00 0.00 C ATOM 2240 O ARG A 144 1.217 -4.194 15.493 1.00 0.00 O ATOM 2241 CB ARG A 144 -1.429 -5.577 16.248 1.00 0.00 C ATOM 2242 CG ARG A 144 -2.335 -4.491 16.801 1.00 0.00 C ATOM 2243 CD ARG A 144 -2.843 -4.837 18.190 1.00 0.00 C ATOM 2244 NE ARG A 144 -1.768 -4.836 19.183 1.00 0.00 N ATOM 2245 CZ ARG A 144 -1.962 -4.963 20.490 1.00 0.00 C ATOM 2246 NH1 ARG A 144 -3.185 -5.119 20.977 1.00 0.00 N ATOM 2247 NH2 ARG A 144 -0.927 -4.927 21.311 1.00 0.00 N ATOM 0 H ARG A 144 -0.038 -7.178 14.971 1.00 0.00 H new ATOM 0 HA ARG A 144 -1.668 -4.965 14.193 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -1.988 -6.511 16.193 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -0.605 -5.739 16.942 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -1.791 -3.547 16.837 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -3.181 -4.346 16.130 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -3.609 -4.120 18.485 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -3.316 -5.819 18.169 1.00 0.00 H new ATOM 0 HE ARG A 144 -0.810 -4.731 18.850 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -3.986 -5.142 20.346 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -3.325 -5.216 21.983 1.00 0.00 H new ATOM 0 HH21 ARG A 144 0.015 -4.802 20.939 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -1.070 -5.024 22.316 1.00 0.00 H new ATOM 2261 N GLY A 145 -0.317 -2.925 14.447 1.00 0.00 N ATOM 2262 CA GLY A 145 0.490 -1.716 14.488 1.00 0.00 C ATOM 2263 C GLY A 145 0.321 -0.971 15.799 1.00 0.00 C ATOM 2264 O GLY A 145 -0.794 -0.870 16.316 1.00 0.00 O ATOM 0 H GLY A 145 -1.225 -2.809 13.998 1.00 0.00 H new ATOM 0 HA2 GLY A 145 1.540 -1.975 14.349 1.00 0.00 H new ATOM 0 HA3 GLY A 145 0.210 -1.064 13.661 1.00 0.00 H new ATOM 2268 N ASP A 146 1.414 -0.442 16.332 1.00 0.00 N ATOM 2269 CA ASP A 146 1.376 0.298 17.581 1.00 0.00 C ATOM 2270 C ASP A 146 2.596 1.209 17.654 1.00 0.00 C ATOM 2271 O ASP A 146 3.668 0.846 17.182 1.00 0.00 O ATOM 2272 CB ASP A 146 1.355 -0.665 18.781 1.00 0.00 C ATOM 2273 CG ASP A 146 0.814 -0.031 20.054 1.00 0.00 C ATOM 2274 OD1 ASP A 146 1.345 1.016 20.478 1.00 0.00 O ATOM 2275 OD2 ASP A 146 -0.148 -0.584 20.640 1.00 0.00 O ATOM 0 H ASP A 146 2.342 -0.514 15.914 1.00 0.00 H new ATOM 0 HA ASP A 146 0.467 0.899 17.617 1.00 0.00 H new ATOM 0 HB2 ASP A 146 0.747 -1.534 18.530 1.00 0.00 H new ATOM 0 HB3 ASP A 146 2.367 -1.026 18.965 1.00 0.00 H new ATOM 2280 N ASN A 147 2.406 2.391 18.216 1.00 0.00 N ATOM 2281 CA ASN A 147 3.466 3.396 18.355 1.00 0.00 C ATOM 2282 C ASN A 147 4.748 2.796 18.950 1.00 0.00 C ATOM 2283 O ASN A 147 4.877 2.674 20.169 1.00 0.00 O ATOM 2284 CB ASN A 147 3.015 4.544 19.275 1.00 0.00 C ATOM 2285 CG ASN A 147 1.684 5.186 18.905 1.00 0.00 C ATOM 2286 OD1 ASN A 147 1.245 6.125 19.565 1.00 0.00 O ATOM 2287 ND2 ASN A 147 1.026 4.700 17.862 1.00 0.00 N ATOM 0 H ASN A 147 1.507 2.690 18.594 1.00 0.00 H new ATOM 0 HA ASN A 147 3.670 3.768 17.351 1.00 0.00 H new ATOM 0 HB2 ASN A 147 2.947 4.166 20.295 1.00 0.00 H new ATOM 0 HB3 ASN A 147 3.786 5.315 19.272 1.00 0.00 H new ATOM 0 HD21 ASN A 147 0.131 5.106 17.589 1.00 0.00 H new ATOM 0 HD22 ASN A 147 1.415 3.920 17.332 1.00 0.00 H new ATOM 2294 N GLY A 148 5.696 2.432 18.096 1.00 0.00 N ATOM 2295 CA GLY A 148 6.939 1.870 18.589 1.00 0.00 C ATOM 2296 C GLY A 148 7.969 1.661 17.499 1.00 0.00 C ATOM 2297 O GLY A 148 8.099 2.489 16.593 1.00 0.00 O ATOM 0 H GLY A 148 5.629 2.514 17.082 1.00 0.00 H new ATOM 0 HA2 GLY A 148 7.353 2.531 19.350 1.00 0.00 H new ATOM 0 HA3 GLY A 148 6.733 0.916 19.074 1.00 0.00 H new ATOM 2301 N TRP A 149 8.699 0.553 17.590 1.00 0.00 N ATOM 2302 CA TRP A 149 9.735 0.223 16.616 1.00 0.00 C ATOM 2303 C TRP A 149 10.247 -1.197 16.865 1.00 0.00 C ATOM 2304 O TRP A 149 10.661 -1.512 17.980 1.00 0.00 O ATOM 2305 CB TRP A 149 10.891 1.226 16.763 1.00 0.00 C ATOM 2306 CG TRP A 149 11.806 1.314 15.580 1.00 0.00 C ATOM 2307 CD1 TRP A 149 11.530 1.886 14.370 1.00 0.00 C ATOM 2308 CD2 TRP A 149 13.149 0.826 15.496 1.00 0.00 C ATOM 2309 NE1 TRP A 149 12.618 1.775 13.540 1.00 0.00 N ATOM 2310 CE2 TRP A 149 13.625 1.130 14.208 1.00 0.00 C ATOM 2311 CE3 TRP A 149 13.996 0.160 16.387 1.00 0.00 C ATOM 2312 CZ2 TRP A 149 14.908 0.789 13.788 1.00 0.00 C ATOM 2313 CZ3 TRP A 149 15.270 -0.176 15.970 1.00 0.00 C ATOM 2314 CH2 TRP A 149 15.714 0.138 14.679 1.00 0.00 C ATOM 0 H TRP A 149 8.591 -0.136 18.334 1.00 0.00 H new ATOM 0 HA TRP A 149 9.325 0.277 15.608 1.00 0.00 H new ATOM 0 HB2 TRP A 149 10.473 2.214 16.954 1.00 0.00 H new ATOM 0 HB3 TRP A 149 11.479 0.954 17.639 1.00 0.00 H new ATOM 0 HD1 TRP A 149 10.594 2.356 14.106 1.00 0.00 H new ATOM 0 HE1 TRP A 149 12.668 2.118 12.581 1.00 0.00 H new ATOM 0 HE3 TRP A 149 13.661 -0.087 17.383 1.00 0.00 H new ATOM 0 HZ2 TRP A 149 15.254 1.030 12.794 1.00 0.00 H new ATOM 0 HZ3 TRP A 149 15.934 -0.689 16.650 1.00 0.00 H new ATOM 0 HH2 TRP A 149 16.714 -0.140 14.382 1.00 0.00 H new ATOM 2325 N HIS A 150 10.223 -2.054 15.845 1.00 0.00 N ATOM 2326 CA HIS A 150 10.711 -3.425 16.010 1.00 0.00 C ATOM 2327 C HIS A 150 11.162 -4.037 14.683 1.00 0.00 C ATOM 2328 O HIS A 150 10.747 -3.605 13.606 1.00 0.00 O ATOM 2329 CB HIS A 150 9.664 -4.324 16.699 1.00 0.00 C ATOM 2330 CG HIS A 150 8.392 -4.563 15.930 1.00 0.00 C ATOM 2331 ND1 HIS A 150 7.366 -5.340 16.420 1.00 0.00 N ATOM 2332 CD2 HIS A 150 7.988 -4.150 14.702 1.00 0.00 C ATOM 2333 CE1 HIS A 150 6.394 -5.399 15.534 1.00 0.00 C ATOM 2334 NE2 HIS A 150 6.744 -4.686 14.482 1.00 0.00 N ATOM 0 H HIS A 150 9.878 -1.831 14.911 1.00 0.00 H new ATOM 0 HA HIS A 150 11.584 -3.368 16.660 1.00 0.00 H new ATOM 0 HB2 HIS A 150 10.125 -5.289 16.910 1.00 0.00 H new ATOM 0 HB3 HIS A 150 9.406 -3.878 17.659 1.00 0.00 H new ATOM 0 HD1 HIS A 150 7.360 -5.800 17.331 1.00 0.00 H new ATOM 0 HD2 HIS A 150 8.542 -3.517 14.024 1.00 0.00 H new ATOM 0 HE1 HIS A 150 5.467 -5.940 15.650 1.00 0.00 H new ATOM 2343 N THR A 151 12.024 -5.034 14.777 1.00 0.00 N ATOM 2344 CA THR A 151 12.562 -5.720 13.610 1.00 0.00 C ATOM 2345 C THR A 151 11.692 -6.910 13.185 1.00 0.00 C ATOM 2346 O THR A 151 10.973 -7.498 14.003 1.00 0.00 O ATOM 2347 CB THR A 151 13.984 -6.230 13.898 1.00 0.00 C ATOM 2348 OG1 THR A 151 14.088 -6.633 15.272 1.00 0.00 O ATOM 2349 CG2 THR A 151 15.022 -5.163 13.590 1.00 0.00 C ATOM 0 H THR A 151 12.373 -5.393 15.666 1.00 0.00 H new ATOM 0 HA THR A 151 12.575 -4.993 12.798 1.00 0.00 H new ATOM 0 HB THR A 151 14.177 -7.087 13.252 1.00 0.00 H new ATOM 0 HG1 THR A 151 14.995 -6.959 15.450 1.00 0.00 H new ATOM 0 HG21 THR A 151 16.018 -5.552 13.803 1.00 0.00 H new ATOM 0 HG22 THR A 151 14.958 -4.886 12.538 1.00 0.00 H new ATOM 0 HG23 THR A 151 14.835 -4.285 14.208 1.00 0.00 H new ATOM 2357 N ARG A 152 11.778 -7.268 11.905 1.00 0.00 N ATOM 2358 CA ARG A 152 11.031 -8.393 11.347 1.00 0.00 C ATOM 2359 C ARG A 152 11.751 -8.934 10.114 1.00 0.00 C ATOM 2360 O ARG A 152 12.099 -8.177 9.213 1.00 0.00 O ATOM 2361 CB ARG A 152 9.595 -7.990 10.988 1.00 0.00 C ATOM 2362 CG ARG A 152 8.735 -9.167 10.549 1.00 0.00 C ATOM 2363 CD ARG A 152 7.286 -8.759 10.332 1.00 0.00 C ATOM 2364 NE ARG A 152 6.419 -9.914 10.077 1.00 0.00 N ATOM 2365 CZ ARG A 152 6.125 -10.853 10.980 1.00 0.00 C ATOM 2366 NH1 ARG A 152 6.598 -10.773 12.218 1.00 0.00 N ATOM 2367 NH2 ARG A 152 5.346 -11.870 10.640 1.00 0.00 N ATOM 0 H ARG A 152 12.367 -6.786 11.226 1.00 0.00 H new ATOM 0 HA ARG A 152 10.977 -9.173 12.106 1.00 0.00 H new ATOM 0 HB2 ARG A 152 9.132 -7.512 11.851 1.00 0.00 H new ATOM 0 HB3 ARG A 152 9.621 -7.249 10.189 1.00 0.00 H new ATOM 0 HG2 ARG A 152 9.136 -9.586 9.626 1.00 0.00 H new ATOM 0 HG3 ARG A 152 8.782 -9.953 11.303 1.00 0.00 H new ATOM 0 HD2 ARG A 152 6.926 -8.223 11.210 1.00 0.00 H new ATOM 0 HD3 ARG A 152 7.226 -8.069 9.490 1.00 0.00 H new ATOM 0 HE ARG A 152 6.013 -10.007 9.146 1.00 0.00 H new ATOM 0 HH11 ARG A 152 7.192 -9.989 12.487 1.00 0.00 H new ATOM 0 HH12 ARG A 152 6.367 -11.496 12.900 1.00 0.00 H new ATOM 0 HH21 ARG A 152 4.974 -11.933 9.692 1.00 0.00 H new ATOM 0 HH22 ARG A 152 5.119 -12.590 11.326 1.00 0.00 H new ATOM 2381 N ASN A 153 11.983 -10.238 10.084 1.00 0.00 N ATOM 2382 CA ASN A 153 12.671 -10.865 8.964 1.00 0.00 C ATOM 2383 C ASN A 153 11.717 -11.035 7.784 1.00 0.00 C ATOM 2384 O ASN A 153 10.590 -11.509 7.948 1.00 0.00 O ATOM 2385 CB ASN A 153 13.237 -12.227 9.384 1.00 0.00 C ATOM 2386 CG ASN A 153 14.304 -12.744 8.433 1.00 0.00 C ATOM 2387 OD1 ASN A 153 14.107 -12.785 7.222 1.00 0.00 O ATOM 2388 ND2 ASN A 153 15.438 -13.160 8.978 1.00 0.00 N ATOM 0 H ASN A 153 11.705 -10.884 10.823 1.00 0.00 H new ATOM 0 HA ASN A 153 13.495 -10.221 8.658 1.00 0.00 H new ATOM 0 HB2 ASN A 153 13.659 -12.146 10.386 1.00 0.00 H new ATOM 0 HB3 ASN A 153 12.424 -12.951 9.438 1.00 0.00 H new ATOM 0 HD21 ASN A 153 16.183 -13.529 8.387 1.00 0.00 H new ATOM 0 HD22 ASN A 153 15.566 -13.111 9.989 1.00 0.00 H new ATOM 2395 N LEU A 154 12.167 -10.650 6.601 1.00 0.00 N ATOM 2396 CA LEU A 154 11.352 -10.765 5.396 1.00 0.00 C ATOM 2397 C LEU A 154 11.264 -12.213 4.921 1.00 0.00 C ATOM 2398 O LEU A 154 10.236 -12.643 4.393 1.00 0.00 O ATOM 2399 CB LEU A 154 11.919 -9.893 4.276 1.00 0.00 C ATOM 2400 CG LEU A 154 11.412 -8.452 4.243 1.00 0.00 C ATOM 2401 CD1 LEU A 154 12.163 -7.657 3.196 1.00 0.00 C ATOM 2402 CD2 LEU A 154 9.925 -8.415 3.942 1.00 0.00 C ATOM 0 H LEU A 154 13.094 -10.254 6.446 1.00 0.00 H new ATOM 0 HA LEU A 154 10.349 -10.421 5.647 1.00 0.00 H new ATOM 0 HB2 LEU A 154 13.005 -9.876 4.367 1.00 0.00 H new ATOM 0 HB3 LEU A 154 11.687 -10.363 3.320 1.00 0.00 H new ATOM 0 HG LEU A 154 11.584 -8.008 5.223 1.00 0.00 H new ATOM 0 HD11 LEU A 154 11.792 -6.632 3.182 1.00 0.00 H new ATOM 0 HD12 LEU A 154 13.227 -7.655 3.434 1.00 0.00 H new ATOM 0 HD13 LEU A 154 12.011 -8.111 2.217 1.00 0.00 H new ATOM 0 HD21 LEU A 154 9.583 -7.380 3.923 1.00 0.00 H new ATOM 0 HD22 LEU A 154 9.738 -8.877 2.972 1.00 0.00 H new ATOM 0 HD23 LEU A 154 9.384 -8.962 4.714 1.00 0.00 H new ATOM 2414 N GLY A 155 12.344 -12.956 5.100 1.00 0.00 N ATOM 2415 CA GLY A 155 12.373 -14.341 4.678 1.00 0.00 C ATOM 2416 C GLY A 155 13.566 -14.634 3.794 1.00 0.00 C ATOM 2417 O GLY A 155 14.270 -15.622 3.994 1.00 0.00 O ATOM 0 H GLY A 155 13.206 -12.623 5.532 1.00 0.00 H new ATOM 0 HA2 GLY A 155 12.403 -14.988 5.555 1.00 0.00 H new ATOM 0 HA3 GLY A 155 11.455 -14.576 4.139 1.00 0.00 H new ATOM 2421 N TYR A 156 13.794 -13.763 2.817 1.00 0.00 N ATOM 2422 CA TYR A 156 14.914 -13.917 1.888 1.00 0.00 C ATOM 2423 C TYR A 156 16.239 -13.729 2.619 1.00 0.00 C ATOM 2424 O TYR A 156 17.214 -14.429 2.360 1.00 0.00 O ATOM 2425 CB TYR A 156 14.796 -12.895 0.750 1.00 0.00 C ATOM 2426 CG TYR A 156 15.778 -13.100 -0.385 1.00 0.00 C ATOM 2427 CD1 TYR A 156 15.851 -14.312 -1.055 1.00 0.00 C ATOM 2428 CD2 TYR A 156 16.618 -12.071 -0.798 1.00 0.00 C ATOM 2429 CE1 TYR A 156 16.729 -14.497 -2.105 1.00 0.00 C ATOM 2430 CE2 TYR A 156 17.503 -12.248 -1.844 1.00 0.00 C ATOM 2431 CZ TYR A 156 17.553 -13.464 -2.496 1.00 0.00 C ATOM 2432 OH TYR A 156 18.425 -13.640 -3.546 1.00 0.00 O ATOM 0 H TYR A 156 13.217 -12.939 2.645 1.00 0.00 H new ATOM 0 HA TYR A 156 14.884 -14.923 1.469 1.00 0.00 H new ATOM 0 HB2 TYR A 156 13.783 -12.933 0.348 1.00 0.00 H new ATOM 0 HB3 TYR A 156 14.939 -11.895 1.161 1.00 0.00 H new ATOM 0 HD1 TYR A 156 15.210 -15.126 -0.750 1.00 0.00 H new ATOM 0 HD2 TYR A 156 16.578 -11.118 -0.292 1.00 0.00 H new ATOM 0 HE1 TYR A 156 16.770 -15.447 -2.617 1.00 0.00 H new ATOM 0 HE2 TYR A 156 18.152 -11.440 -2.150 1.00 0.00 H new ATOM 0 HH TYR A 156 18.932 -12.814 -3.693 1.00 0.00 H new ATOM 2442 N GLY A 157 16.259 -12.768 3.527 1.00 0.00 N ATOM 2443 CA GLY A 157 17.457 -12.484 4.282 1.00 0.00 C ATOM 2444 C GLY A 157 17.375 -11.116 4.914 1.00 0.00 C ATOM 2445 O GLY A 157 17.843 -10.897 6.028 1.00 0.00 O ATOM 0 H GLY A 157 15.460 -12.176 3.755 1.00 0.00 H new ATOM 0 HA2 GLY A 157 17.594 -13.240 5.055 1.00 0.00 H new ATOM 0 HA3 GLY A 157 18.327 -12.537 3.627 1.00 0.00 H new ATOM 2449 N LEU A 158 16.760 -10.200 4.182 1.00 0.00 N ATOM 2450 CA LEU A 158 16.586 -8.835 4.639 1.00 0.00 C ATOM 2451 C LEU A 158 15.659 -8.787 5.848 1.00 0.00 C ATOM 2452 O LEU A 158 14.868 -9.706 6.083 1.00 0.00 O ATOM 2453 CB LEU A 158 16.022 -7.952 3.519 1.00 0.00 C ATOM 2454 CG LEU A 158 16.873 -7.852 2.245 1.00 0.00 C ATOM 2455 CD1 LEU A 158 18.354 -7.769 2.585 1.00 0.00 C ATOM 2456 CD2 LEU A 158 16.600 -9.021 1.311 1.00 0.00 C ATOM 0 H LEU A 158 16.370 -10.384 3.258 1.00 0.00 H new ATOM 0 HA LEU A 158 17.565 -8.453 4.928 1.00 0.00 H new ATOM 0 HB2 LEU A 158 15.038 -8.332 3.245 1.00 0.00 H new ATOM 0 HB3 LEU A 158 15.877 -6.947 3.915 1.00 0.00 H new ATOM 0 HG LEU A 158 16.591 -6.935 1.728 1.00 0.00 H new ATOM 0 HD11 LEU A 158 18.935 -7.699 1.665 1.00 0.00 H new ATOM 0 HD12 LEU A 158 18.538 -6.887 3.198 1.00 0.00 H new ATOM 0 HD13 LEU A 158 18.652 -8.662 3.135 1.00 0.00 H new ATOM 0 HD21 LEU A 158 17.216 -8.924 0.417 1.00 0.00 H new ATOM 0 HD22 LEU A 158 16.840 -9.956 1.818 1.00 0.00 H new ATOM 0 HD23 LEU A 158 15.547 -9.022 1.028 1.00 0.00 H new ATOM 2468 N LYS A 159 15.746 -7.705 6.598 1.00 0.00 N ATOM 2469 CA LYS A 159 14.910 -7.519 7.776 1.00 0.00 C ATOM 2470 C LYS A 159 14.384 -6.096 7.825 1.00 0.00 C ATOM 2471 O LYS A 159 15.117 -5.146 7.543 1.00 0.00 O ATOM 2472 CB LYS A 159 15.677 -7.812 9.068 1.00 0.00 C ATOM 2473 CG LYS A 159 16.166 -9.244 9.210 1.00 0.00 C ATOM 2474 CD LYS A 159 16.767 -9.474 10.588 1.00 0.00 C ATOM 2475 CE LYS A 159 17.468 -10.819 10.678 1.00 0.00 C ATOM 2476 NZ LYS A 159 18.108 -11.020 12.008 1.00 0.00 N ATOM 0 H LYS A 159 16.390 -6.936 6.414 1.00 0.00 H new ATOM 0 HA LYS A 159 14.081 -8.223 7.699 1.00 0.00 H new ATOM 0 HB2 LYS A 159 16.536 -7.143 9.124 1.00 0.00 H new ATOM 0 HB3 LYS A 159 15.034 -7.577 9.916 1.00 0.00 H new ATOM 0 HG2 LYS A 159 15.337 -9.934 9.050 1.00 0.00 H new ATOM 0 HG3 LYS A 159 16.911 -9.457 8.443 1.00 0.00 H new ATOM 0 HD2 LYS A 159 17.477 -8.678 10.813 1.00 0.00 H new ATOM 0 HD3 LYS A 159 15.981 -9.422 11.341 1.00 0.00 H new ATOM 0 HE2 LYS A 159 16.748 -11.617 10.496 1.00 0.00 H new ATOM 0 HE3 LYS A 159 18.224 -10.888 9.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 18.576 -11.948 12.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 18.813 -10.273 12.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 17.383 -10.979 12.752 1.00 0.00 H new ATOM 2490 N SER A 160 13.127 -5.950 8.196 1.00 0.00 N ATOM 2491 CA SER A 160 12.519 -4.636 8.289 1.00 0.00 C ATOM 2492 C SER A 160 12.629 -4.111 9.714 1.00 0.00 C ATOM 2493 O SER A 160 12.233 -4.782 10.667 1.00 0.00 O ATOM 2494 CB SER A 160 11.048 -4.694 7.859 1.00 0.00 C ATOM 2495 OG SER A 160 10.453 -3.404 7.870 1.00 0.00 O ATOM 0 H SER A 160 12.507 -6.723 8.438 1.00 0.00 H new ATOM 0 HA SER A 160 13.049 -3.958 7.619 1.00 0.00 H new ATOM 0 HB2 SER A 160 10.976 -5.121 6.859 1.00 0.00 H new ATOM 0 HB3 SER A 160 10.498 -5.356 8.528 1.00 0.00 H new ATOM 0 HG SER A 160 11.024 -2.776 7.381 1.00 0.00 H new ATOM 2501 N ARG A 161 13.163 -2.914 9.853 1.00 0.00 N ATOM 2502 CA ARG A 161 13.318 -2.293 11.153 1.00 0.00 C ATOM 2503 C ARG A 161 12.422 -1.064 11.230 1.00 0.00 C ATOM 2504 O ARG A 161 12.750 -0.006 10.685 1.00 0.00 O ATOM 2505 CB ARG A 161 14.780 -1.900 11.385 1.00 0.00 C ATOM 2506 CG ARG A 161 15.777 -3.010 11.081 1.00 0.00 C ATOM 2507 CD ARG A 161 17.213 -2.569 11.340 1.00 0.00 C ATOM 2508 NE ARG A 161 18.186 -3.628 11.047 1.00 0.00 N ATOM 2509 CZ ARG A 161 19.507 -3.479 11.163 1.00 0.00 C ATOM 2510 NH1 ARG A 161 20.019 -2.315 11.530 1.00 0.00 N ATOM 2511 NH2 ARG A 161 20.318 -4.492 10.894 1.00 0.00 N ATOM 0 H ARG A 161 13.499 -2.348 9.074 1.00 0.00 H new ATOM 0 HA ARG A 161 13.029 -3.002 11.929 1.00 0.00 H new ATOM 0 HB2 ARG A 161 15.015 -1.035 10.765 1.00 0.00 H new ATOM 0 HB3 ARG A 161 14.902 -1.591 12.423 1.00 0.00 H new ATOM 0 HG2 ARG A 161 15.548 -3.882 11.694 1.00 0.00 H new ATOM 0 HG3 ARG A 161 15.673 -3.317 10.040 1.00 0.00 H new ATOM 0 HD2 ARG A 161 17.437 -1.695 10.729 1.00 0.00 H new ATOM 0 HD3 ARG A 161 17.314 -2.265 12.382 1.00 0.00 H new ATOM 0 HE ARG A 161 17.831 -4.532 10.736 1.00 0.00 H new ATOM 0 HH11 ARG A 161 19.403 -1.526 11.726 1.00 0.00 H new ATOM 0 HH12 ARG A 161 21.030 -2.207 11.617 1.00 0.00 H new ATOM 0 HH21 ARG A 161 19.933 -5.389 10.597 1.00 0.00 H new ATOM 0 HH22 ARG A 161 21.327 -4.375 10.984 1.00 0.00 H new ATOM 2525 N GLY A 162 11.283 -1.206 11.889 1.00 0.00 N ATOM 2526 CA GLY A 162 10.360 -0.097 12.008 1.00 0.00 C ATOM 2527 C GLY A 162 9.095 -0.475 12.740 1.00 0.00 C ATOM 2528 O GLY A 162 9.073 -1.463 13.470 1.00 0.00 O ATOM 0 H GLY A 162 10.981 -2.068 12.343 1.00 0.00 H new ATOM 0 HA2 GLY A 162 10.849 0.724 12.533 1.00 0.00 H new ATOM 0 HA3 GLY A 162 10.105 0.268 11.013 1.00 0.00 H new ATOM 2532 N PHE A 163 8.033 0.294 12.538 1.00 0.00 N ATOM 2533 CA PHE A 163 6.766 0.005 13.190 1.00 0.00 C ATOM 2534 C PHE A 163 5.672 0.957 12.706 1.00 0.00 C ATOM 2535 O PHE A 163 5.945 2.089 12.305 1.00 0.00 O ATOM 2536 CB PHE A 163 6.900 0.085 14.715 1.00 0.00 C ATOM 2537 CG PHE A 163 5.952 -0.823 15.459 1.00 0.00 C ATOM 2538 CD1 PHE A 163 4.987 -1.550 14.786 1.00 0.00 C ATOM 2539 CD2 PHE A 163 6.034 -0.955 16.836 1.00 0.00 C ATOM 2540 CE1 PHE A 163 4.122 -2.383 15.463 1.00 0.00 C ATOM 2541 CE2 PHE A 163 5.172 -1.785 17.523 1.00 0.00 C ATOM 2542 CZ PHE A 163 4.212 -2.501 16.836 1.00 0.00 C ATOM 0 H PHE A 163 8.024 1.115 11.933 1.00 0.00 H new ATOM 0 HA PHE A 163 6.483 -1.013 12.922 1.00 0.00 H new ATOM 0 HB2 PHE A 163 7.923 -0.167 14.994 1.00 0.00 H new ATOM 0 HB3 PHE A 163 6.727 1.113 15.032 1.00 0.00 H new ATOM 0 HD1 PHE A 163 4.910 -1.464 13.712 1.00 0.00 H new ATOM 0 HD2 PHE A 163 6.784 -0.400 17.380 1.00 0.00 H new ATOM 0 HE1 PHE A 163 3.375 -2.943 14.920 1.00 0.00 H new ATOM 0 HE2 PHE A 163 5.248 -1.874 18.597 1.00 0.00 H new ATOM 0 HZ PHE A 163 3.534 -3.151 17.370 1.00 0.00 H new ATOM 2552 N MET A 164 4.441 0.479 12.733 1.00 0.00 N ATOM 2553 CA MET A 164 3.290 1.262 12.302 1.00 0.00 C ATOM 2554 C MET A 164 2.667 2.019 13.472 1.00 0.00 C ATOM 2555 O MET A 164 2.311 1.419 14.480 1.00 0.00 O ATOM 2556 CB MET A 164 2.236 0.337 11.706 1.00 0.00 C ATOM 2557 CG MET A 164 1.168 1.062 10.907 1.00 0.00 C ATOM 2558 SD MET A 164 0.109 -0.071 9.990 1.00 0.00 S ATOM 2559 CE MET A 164 -0.888 1.086 9.059 1.00 0.00 C ATOM 0 H MET A 164 4.208 -0.461 13.053 1.00 0.00 H new ATOM 0 HA MET A 164 3.634 1.981 11.558 1.00 0.00 H new ATOM 0 HB2 MET A 164 2.728 -0.391 11.061 1.00 0.00 H new ATOM 0 HB3 MET A 164 1.758 -0.221 12.511 1.00 0.00 H new ATOM 0 HG2 MET A 164 0.557 1.661 11.582 1.00 0.00 H new ATOM 0 HG3 MET A 164 1.645 1.753 10.212 1.00 0.00 H new ATOM 0 HE1 MET A 164 -1.360 0.569 8.223 1.00 0.00 H new ATOM 0 HE2 MET A 164 -1.657 1.507 9.707 1.00 0.00 H new ATOM 0 HE3 MET A 164 -0.255 1.888 8.679 1.00 0.00 H new ATOM 2569 N ASN A 165 2.492 3.317 13.315 1.00 0.00 N ATOM 2570 CA ASN A 165 1.857 4.132 14.342 1.00 0.00 C ATOM 2571 C ASN A 165 0.344 4.033 14.168 1.00 0.00 C ATOM 2572 O ASN A 165 -0.174 4.322 13.086 1.00 0.00 O ATOM 2573 CB ASN A 165 2.301 5.592 14.201 1.00 0.00 C ATOM 2574 CG ASN A 165 1.733 6.509 15.265 1.00 0.00 C ATOM 2575 OD1 ASN A 165 2.310 6.658 16.333 1.00 0.00 O ATOM 2576 ND2 ASN A 165 0.594 7.124 14.985 1.00 0.00 N ATOM 0 H ASN A 165 2.780 3.834 12.485 1.00 0.00 H new ATOM 0 HA ASN A 165 2.145 3.776 15.331 1.00 0.00 H new ATOM 0 HB2 ASN A 165 3.389 5.636 14.240 1.00 0.00 H new ATOM 0 HB3 ASN A 165 2.002 5.960 13.220 1.00 0.00 H new ATOM 0 HD21 ASN A 165 0.169 7.747 15.672 1.00 0.00 H new ATOM 0 HD22 ASN A 165 0.142 6.975 14.083 1.00 0.00 H new ATOM 2583 N SER A 166 -0.341 3.611 15.218 1.00 0.00 N ATOM 2584 CA SER A 166 -1.788 3.455 15.195 1.00 0.00 C ATOM 2585 C SER A 166 -2.513 4.792 15.429 1.00 0.00 C ATOM 2586 O SER A 166 -2.288 5.755 14.701 1.00 0.00 O ATOM 2587 CB SER A 166 -2.190 2.408 16.238 1.00 0.00 C ATOM 2588 OG SER A 166 -1.304 2.447 17.351 1.00 0.00 O ATOM 0 H SER A 166 0.089 3.367 16.110 1.00 0.00 H new ATOM 0 HA SER A 166 -2.092 3.114 14.205 1.00 0.00 H new ATOM 0 HB2 SER A 166 -3.211 2.592 16.572 1.00 0.00 H new ATOM 0 HB3 SER A 166 -2.176 1.415 15.789 1.00 0.00 H new ATOM 0 HG SER A 166 -1.575 1.773 18.009 1.00 0.00 H new ATOM 2594 N SER A 167 -3.387 4.833 16.442 1.00 0.00 N ATOM 2595 CA SER A 167 -4.158 6.034 16.773 1.00 0.00 C ATOM 2596 C SER A 167 -5.177 6.363 15.678 1.00 0.00 C ATOM 2597 O SER A 167 -5.715 5.466 15.030 1.00 0.00 O ATOM 2598 CB SER A 167 -3.226 7.229 17.016 1.00 0.00 C ATOM 2599 OG SER A 167 -2.385 6.995 18.133 1.00 0.00 O ATOM 0 H SER A 167 -3.578 4.038 17.052 1.00 0.00 H new ATOM 0 HA SER A 167 -4.708 5.830 17.692 1.00 0.00 H new ATOM 0 HB2 SER A 167 -2.618 7.408 16.129 1.00 0.00 H new ATOM 0 HB3 SER A 167 -3.818 8.129 17.183 1.00 0.00 H new ATOM 0 HG SER A 167 -1.798 7.768 18.269 1.00 0.00 H new ATOM 2605 N GLY A 168 -5.459 7.651 15.488 1.00 0.00 N ATOM 2606 CA GLY A 168 -6.426 8.073 14.483 1.00 0.00 C ATOM 2607 C GLY A 168 -5.857 8.114 13.074 1.00 0.00 C ATOM 2608 O GLY A 168 -6.541 7.785 12.105 1.00 0.00 O ATOM 0 H GLY A 168 -5.033 8.414 16.014 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -7.278 7.394 14.503 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -6.801 9.063 14.744 1.00 0.00 H new ATOM 2612 N HIS A 169 -4.608 8.533 12.959 1.00 0.00 N ATOM 2613 CA HIS A 169 -3.937 8.625 11.667 1.00 0.00 C ATOM 2614 C HIS A 169 -2.812 7.606 11.614 1.00 0.00 C ATOM 2615 O HIS A 169 -1.977 7.552 12.515 1.00 0.00 O ATOM 2616 CB HIS A 169 -3.398 10.040 11.455 1.00 0.00 C ATOM 2617 CG HIS A 169 -4.470 11.092 11.403 1.00 0.00 C ATOM 2618 ND1 HIS A 169 -4.204 12.443 11.476 1.00 0.00 N ATOM 2619 CD2 HIS A 169 -5.820 10.985 11.294 1.00 0.00 C ATOM 2620 CE1 HIS A 169 -5.336 13.118 11.421 1.00 0.00 C ATOM 2621 NE2 HIS A 169 -6.334 12.259 11.310 1.00 0.00 N ATOM 0 H HIS A 169 -4.031 8.818 13.751 1.00 0.00 H new ATOM 0 HA HIS A 169 -4.647 8.410 10.868 1.00 0.00 H new ATOM 0 HB2 HIS A 169 -2.704 10.280 12.261 1.00 0.00 H new ATOM 0 HB3 HIS A 169 -2.829 10.067 10.526 1.00 0.00 H new ATOM 0 HD2 HIS A 169 -6.385 10.068 11.210 1.00 0.00 H new ATOM 0 HE1 HIS A 169 -5.431 14.193 11.460 1.00 0.00 H new ATOM 0 HE2 HIS A 169 -7.323 12.502 11.247 1.00 0.00 H new ATOM 2630 N ALA A 170 -2.814 6.783 10.581 1.00 0.00 N ATOM 2631 CA ALA A 170 -1.816 5.732 10.442 1.00 0.00 C ATOM 2632 C ALA A 170 -0.567 6.176 9.692 1.00 0.00 C ATOM 2633 O ALA A 170 -0.652 6.804 8.637 1.00 0.00 O ATOM 2634 CB ALA A 170 -2.428 4.537 9.731 1.00 0.00 C ATOM 0 H ALA A 170 -3.496 6.820 9.823 1.00 0.00 H new ATOM 0 HA ALA A 170 -1.503 5.467 11.452 1.00 0.00 H new ATOM 0 HB1 ALA A 170 -1.679 3.752 9.628 1.00 0.00 H new ATOM 0 HB2 ALA A 170 -3.271 4.161 10.311 1.00 0.00 H new ATOM 0 HB3 ALA A 170 -2.774 4.840 8.743 1.00 0.00 H new ATOM 2640 N ILE A 171 0.589 5.784 10.221 1.00 0.00 N ATOM 2641 CA ILE A 171 1.879 6.071 9.591 1.00 0.00 C ATOM 2642 C ILE A 171 2.834 4.896 9.812 1.00 0.00 C ATOM 2643 O ILE A 171 3.116 4.515 10.949 1.00 0.00 O ATOM 2644 CB ILE A 171 2.550 7.373 10.106 1.00 0.00 C ATOM 2645 CG1 ILE A 171 2.462 7.465 11.627 1.00 0.00 C ATOM 2646 CG2 ILE A 171 1.935 8.605 9.455 1.00 0.00 C ATOM 2647 CD1 ILE A 171 3.409 8.474 12.236 1.00 0.00 C ATOM 0 H ILE A 171 0.660 5.261 11.094 1.00 0.00 H new ATOM 0 HA ILE A 171 1.674 6.218 8.531 1.00 0.00 H new ATOM 0 HB ILE A 171 3.603 7.337 9.826 1.00 0.00 H new ATOM 0 HG12 ILE A 171 1.441 7.725 11.907 1.00 0.00 H new ATOM 0 HG13 ILE A 171 2.670 6.483 12.053 1.00 0.00 H new ATOM 0 HG21 ILE A 171 2.426 9.501 9.836 1.00 0.00 H new ATOM 0 HG22 ILE A 171 2.068 8.550 8.374 1.00 0.00 H new ATOM 0 HG23 ILE A 171 0.871 8.647 9.688 1.00 0.00 H new ATOM 0 HD11 ILE A 171 3.287 8.480 13.319 1.00 0.00 H new ATOM 0 HD12 ILE A 171 4.436 8.205 11.988 1.00 0.00 H new ATOM 0 HD13 ILE A 171 3.188 9.465 11.840 1.00 0.00 H new ATOM 2659 N LEU A 172 3.318 4.311 8.727 1.00 0.00 N ATOM 2660 CA LEU A 172 4.233 3.176 8.816 1.00 0.00 C ATOM 2661 C LEU A 172 5.666 3.627 8.603 1.00 0.00 C ATOM 2662 O LEU A 172 6.029 4.106 7.528 1.00 0.00 O ATOM 2663 CB LEU A 172 3.860 2.104 7.787 1.00 0.00 C ATOM 2664 CG LEU A 172 4.707 0.826 7.827 1.00 0.00 C ATOM 2665 CD1 LEU A 172 4.381 -0.003 9.058 1.00 0.00 C ATOM 2666 CD2 LEU A 172 4.493 0.004 6.567 1.00 0.00 C ATOM 0 H LEU A 172 3.095 4.600 7.775 1.00 0.00 H new ATOM 0 HA LEU A 172 4.148 2.747 9.815 1.00 0.00 H new ATOM 0 HB2 LEU A 172 2.815 1.831 7.935 1.00 0.00 H new ATOM 0 HB3 LEU A 172 3.938 2.539 6.791 1.00 0.00 H new ATOM 0 HG LEU A 172 5.756 1.119 7.879 1.00 0.00 H new ATOM 0 HD11 LEU A 172 4.995 -0.904 9.063 1.00 0.00 H new ATOM 0 HD12 LEU A 172 4.587 0.581 9.955 1.00 0.00 H new ATOM 0 HD13 LEU A 172 3.327 -0.282 9.040 1.00 0.00 H new ATOM 0 HD21 LEU A 172 5.102 -0.899 6.614 1.00 0.00 H new ATOM 0 HD22 LEU A 172 3.441 -0.272 6.487 1.00 0.00 H new ATOM 0 HD23 LEU A 172 4.782 0.592 5.696 1.00 0.00 H new ATOM 2678 N GLU A 173 6.470 3.466 9.637 1.00 0.00 N ATOM 2679 CA GLU A 173 7.871 3.846 9.604 1.00 0.00 C ATOM 2680 C GLU A 173 8.748 2.597 9.690 1.00 0.00 C ATOM 2681 O GLU A 173 9.296 2.283 10.744 1.00 0.00 O ATOM 2682 CB GLU A 173 8.163 4.792 10.778 1.00 0.00 C ATOM 2683 CG GLU A 173 9.587 5.343 10.834 1.00 0.00 C ATOM 2684 CD GLU A 173 9.830 6.496 9.884 1.00 0.00 C ATOM 2685 OE1 GLU A 173 9.130 7.522 10.004 1.00 0.00 O ATOM 2686 OE2 GLU A 173 10.746 6.380 9.042 1.00 0.00 O ATOM 0 H GLU A 173 6.170 3.067 10.526 1.00 0.00 H new ATOM 0 HA GLU A 173 8.094 4.359 8.669 1.00 0.00 H new ATOM 0 HB2 GLU A 173 7.468 5.630 10.729 1.00 0.00 H new ATOM 0 HB3 GLU A 173 7.959 4.263 11.709 1.00 0.00 H new ATOM 0 HG2 GLU A 173 9.801 5.671 11.851 1.00 0.00 H new ATOM 0 HG3 GLU A 173 10.287 4.540 10.604 1.00 0.00 H new ATOM 2693 N ILE A 174 8.869 1.869 8.584 1.00 0.00 N ATOM 2694 CA ILE A 174 9.682 0.657 8.566 1.00 0.00 C ATOM 2695 C ILE A 174 10.824 0.778 7.561 1.00 0.00 C ATOM 2696 O ILE A 174 10.617 1.109 6.395 1.00 0.00 O ATOM 2697 CB ILE A 174 8.859 -0.621 8.254 1.00 0.00 C ATOM 2698 CG1 ILE A 174 8.157 -0.518 6.895 1.00 0.00 C ATOM 2699 CG2 ILE A 174 7.844 -0.890 9.355 1.00 0.00 C ATOM 2700 CD1 ILE A 174 7.552 -1.826 6.428 1.00 0.00 C ATOM 0 H ILE A 174 8.419 2.094 7.696 1.00 0.00 H new ATOM 0 HA ILE A 174 10.085 0.555 9.574 1.00 0.00 H new ATOM 0 HB ILE A 174 9.556 -1.458 8.209 1.00 0.00 H new ATOM 0 HG12 ILE A 174 7.372 0.235 6.957 1.00 0.00 H new ATOM 0 HG13 ILE A 174 8.873 -0.171 6.150 1.00 0.00 H new ATOM 0 HG21 ILE A 174 7.278 -1.790 9.116 1.00 0.00 H new ATOM 0 HG22 ILE A 174 8.364 -1.029 10.303 1.00 0.00 H new ATOM 0 HG23 ILE A 174 7.162 -0.044 9.436 1.00 0.00 H new ATOM 0 HD11 ILE A 174 7.072 -1.680 5.460 1.00 0.00 H new ATOM 0 HD12 ILE A 174 8.337 -2.577 6.334 1.00 0.00 H new ATOM 0 HD13 ILE A 174 6.812 -2.164 7.153 1.00 0.00 H new ATOM 2712 N HIS A 175 12.034 0.511 8.022 1.00 0.00 N ATOM 2713 CA HIS A 175 13.216 0.584 7.159 1.00 0.00 C ATOM 2714 C HIS A 175 13.786 -0.821 6.967 1.00 0.00 C ATOM 2715 O HIS A 175 14.274 -1.427 7.919 1.00 0.00 O ATOM 2716 CB HIS A 175 14.304 1.490 7.767 1.00 0.00 C ATOM 2717 CG HIS A 175 13.856 2.879 8.150 1.00 0.00 C ATOM 2718 ND1 HIS A 175 14.730 3.850 8.592 1.00 0.00 N ATOM 2719 CD2 HIS A 175 12.621 3.440 8.219 1.00 0.00 C ATOM 2720 CE1 HIS A 175 14.051 4.936 8.917 1.00 0.00 C ATOM 2721 NE2 HIS A 175 12.771 4.713 8.701 1.00 0.00 N ATOM 0 H HIS A 175 12.231 0.242 8.986 1.00 0.00 H new ATOM 0 HA HIS A 175 12.912 1.009 6.202 1.00 0.00 H new ATOM 0 HB2 HIS A 175 14.706 1.000 8.654 1.00 0.00 H new ATOM 0 HB3 HIS A 175 15.122 1.576 7.052 1.00 0.00 H new ATOM 0 HD2 HIS A 175 11.690 2.968 7.944 1.00 0.00 H new ATOM 0 HE1 HIS A 175 14.475 5.854 9.297 1.00 0.00 H new ATOM 0 HE2 HIS A 175 12.016 5.379 8.866 1.00 0.00 H new ATOM 2730 N VAL A 176 13.723 -1.344 5.752 1.00 0.00 N ATOM 2731 CA VAL A 176 14.237 -2.687 5.487 1.00 0.00 C ATOM 2732 C VAL A 176 15.718 -2.643 5.152 1.00 0.00 C ATOM 2733 O VAL A 176 16.136 -1.924 4.245 1.00 0.00 O ATOM 2734 CB VAL A 176 13.477 -3.386 4.339 1.00 0.00 C ATOM 2735 CG1 VAL A 176 13.864 -4.854 4.257 1.00 0.00 C ATOM 2736 CG2 VAL A 176 11.976 -3.223 4.520 1.00 0.00 C ATOM 0 H VAL A 176 13.327 -0.869 4.941 1.00 0.00 H new ATOM 0 HA VAL A 176 14.084 -3.264 6.399 1.00 0.00 H new ATOM 0 HB VAL A 176 13.757 -2.914 3.397 1.00 0.00 H new ATOM 0 HG11 VAL A 176 13.318 -5.329 3.442 1.00 0.00 H new ATOM 0 HG12 VAL A 176 14.935 -4.938 4.074 1.00 0.00 H new ATOM 0 HG13 VAL A 176 13.617 -5.348 5.196 1.00 0.00 H new ATOM 0 HG21 VAL A 176 11.455 -3.721 3.703 1.00 0.00 H new ATOM 0 HG22 VAL A 176 11.673 -3.668 5.468 1.00 0.00 H new ATOM 0 HG23 VAL A 176 11.722 -2.163 4.519 1.00 0.00 H new ATOM 2746 N THR A 177 16.492 -3.422 5.882 1.00 0.00 N ATOM 2747 CA THR A 177 17.929 -3.490 5.681 1.00 0.00 C ATOM 2748 C THR A 177 18.384 -4.939 5.510 1.00 0.00 C ATOM 2749 O THR A 177 17.575 -5.865 5.622 1.00 0.00 O ATOM 2750 CB THR A 177 18.674 -2.853 6.868 1.00 0.00 C ATOM 2751 OG1 THR A 177 18.052 -3.259 8.095 1.00 0.00 O ATOM 2752 CG2 THR A 177 18.670 -1.334 6.772 1.00 0.00 C ATOM 0 H THR A 177 16.146 -4.024 6.629 1.00 0.00 H new ATOM 0 HA THR A 177 18.165 -2.935 4.773 1.00 0.00 H new ATOM 0 HB THR A 177 19.710 -3.192 6.844 1.00 0.00 H new ATOM 0 HG1 THR A 177 18.023 -2.500 8.714 1.00 0.00 H new ATOM 0 HG21 THR A 177 19.204 -0.914 7.625 1.00 0.00 H new ATOM 0 HG22 THR A 177 19.161 -1.026 5.849 1.00 0.00 H new ATOM 0 HG23 THR A 177 17.642 -0.972 6.774 1.00 0.00 H new ATOM 2760 N LYS A 178 19.666 -5.130 5.223 1.00 0.00 N ATOM 2761 CA LYS A 178 20.226 -6.464 5.018 1.00 0.00 C ATOM 2762 C LYS A 178 20.449 -7.210 6.349 1.00 0.00 C ATOM 2763 O LYS A 178 21.580 -7.578 6.687 1.00 0.00 O ATOM 2764 CB LYS A 178 21.531 -6.370 4.209 1.00 0.00 C ATOM 2765 CG LYS A 178 22.033 -7.710 3.680 1.00 0.00 C ATOM 2766 CD LYS A 178 23.272 -7.545 2.805 1.00 0.00 C ATOM 2767 CE LYS A 178 23.758 -8.882 2.258 1.00 0.00 C ATOM 2768 NZ LYS A 178 24.901 -8.731 1.310 1.00 0.00 N ATOM 0 H LYS A 178 20.343 -4.373 5.126 1.00 0.00 H new ATOM 0 HA LYS A 178 19.501 -7.047 4.450 1.00 0.00 H new ATOM 0 HB2 LYS A 178 21.377 -5.694 3.368 1.00 0.00 H new ATOM 0 HB3 LYS A 178 22.304 -5.927 4.837 1.00 0.00 H new ATOM 0 HG2 LYS A 178 22.265 -8.368 4.518 1.00 0.00 H new ATOM 0 HG3 LYS A 178 21.243 -8.193 3.104 1.00 0.00 H new ATOM 0 HD2 LYS A 178 23.046 -6.874 1.977 1.00 0.00 H new ATOM 0 HD3 LYS A 178 24.068 -7.078 3.385 1.00 0.00 H new ATOM 0 HE2 LYS A 178 24.060 -9.522 3.087 1.00 0.00 H new ATOM 0 HE3 LYS A 178 22.934 -9.385 1.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 25.194 -9.668 0.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 24.608 -8.143 0.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 25.699 -8.276 1.798 1.00 0.00 H new ATOM 2782 N ALA A 179 19.345 -7.433 7.069 1.00 0.00 N ATOM 2783 CA ALA A 179 19.329 -8.143 8.357 1.00 0.00 C ATOM 2784 C ALA A 179 20.061 -7.377 9.462 1.00 0.00 C ATOM 2785 O ALA A 179 19.377 -6.896 10.395 1.00 0.00 O ATOM 2786 CB ALA A 179 19.882 -9.555 8.207 1.00 0.00 C ATOM 2787 OXT ALA A 179 21.303 -7.269 9.412 1.00 0.00 O ATOM 0 H ALA A 179 18.421 -7.121 6.770 1.00 0.00 H new ATOM 0 HA ALA A 179 18.286 -8.212 8.666 1.00 0.00 H new ATOM 0 HB1 ALA A 179 19.860 -10.059 9.173 1.00 0.00 H new ATOM 0 HB2 ALA A 179 19.273 -10.110 7.494 1.00 0.00 H new ATOM 0 HB3 ALA A 179 20.910 -9.507 7.847 1.00 0.00 H new