USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 949 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 115 ASN : amide:sc= -2! C(o=-2!,f=-15!) USER MOD Set 1.2: A 117 LYS NZ :NH3+ -122:sc= 0 (180deg=0) USER MOD Set 2.1: A 18 ASN : amide:sc= 0 X(o=0.3,f=0.046) USER MOD Set 2.2: A 124 THR OG1 : rot 27:sc= 0.299 USER MOD Set 3.1: A 17 SER OG : rot -82:sc= 1.06 USER MOD Set 3.2: A 50 ASN : amide:sc= -3.82! C(o=-2.8!,f=-7.4!) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl -154:sc= -0.874 (180deg=-1.17) USER MOD Single : A 15 SER OG : rot -27:sc= 0.806 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -117:sc= 0.0584 (180deg=-0.129) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 103:sc= 1.26 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 141:sc= 1.12 (180deg=0.246) USER MOD Single : A 47 ASN : amide:sc= 0.0333 K(o=0.033,f=-1.6) USER MOD Single : A 54 ASN : amide:sc= -1.53 K(o=-1.5,f=-4!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot -76:sc= 0.861 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 48:sc= 0.14 USER MOD Single : A 105 SER OG : rot 42:sc= 0.438 USER MOD Single : A 108 TYR OH : rot 180:sc= -0.135 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= -0.468 K(o=-0.47,f=-3.9!) USER MOD Single : A 121 THR OG1 : rot -49:sc= 1.09 USER MOD Single : A 131 TYR OH : rot 180:sc= -0.103 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -8.218 -22.571 2.337 1.00 0.00 N ATOM 49 CA SER A 6 -8.097 -22.482 0.886 1.00 0.00 C ATOM 50 C SER A 6 -7.100 -21.398 0.489 1.00 0.00 C ATOM 51 O SER A 6 -7.190 -20.823 -0.594 1.00 0.00 O ATOM 52 CB SER A 6 -9.461 -22.191 0.257 1.00 0.00 C ATOM 53 OG SER A 6 -10.178 -23.390 0.016 1.00 0.00 O ATOM 0 HA SER A 6 -7.731 -23.440 0.517 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.039 -21.544 0.917 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.325 -21.650 -0.680 1.00 0.00 H new ATOM 0 HG SER A 6 -11.047 -23.177 -0.384 1.00 0.00 H new ATOM 59 N GLY A 7 -6.148 -21.125 1.376 1.00 0.00 N ATOM 60 CA GLY A 7 -5.147 -20.111 1.102 1.00 0.00 C ATOM 61 C GLY A 7 -5.753 -18.734 0.913 1.00 0.00 C ATOM 62 O GLY A 7 -6.715 -18.569 0.164 1.00 0.00 O ATOM 0 H GLY A 7 -6.052 -21.588 2.280 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.431 -20.080 1.924 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.591 -20.386 0.206 1.00 0.00 H new ATOM 66 N MET A 8 -5.189 -17.743 1.596 1.00 0.00 N ATOM 67 CA MET A 8 -5.681 -16.373 1.500 1.00 0.00 C ATOM 68 C MET A 8 -4.569 -15.374 1.804 1.00 0.00 C ATOM 69 O MET A 8 -3.812 -15.544 2.760 1.00 0.00 O ATOM 70 CB MET A 8 -6.851 -16.160 2.463 1.00 0.00 C ATOM 71 CG MET A 8 -6.992 -14.723 2.939 1.00 0.00 C ATOM 72 SD MET A 8 -8.626 -14.373 3.617 1.00 0.00 S ATOM 73 CE MET A 8 -9.551 -14.049 2.118 1.00 0.00 C ATOM 0 H MET A 8 -4.392 -17.863 2.221 1.00 0.00 H new ATOM 0 HA MET A 8 -6.025 -16.207 0.479 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.775 -16.464 1.972 1.00 0.00 H new ATOM 0 HB3 MET A 8 -6.722 -16.810 3.328 1.00 0.00 H new ATOM 0 HG2 MET A 8 -6.237 -14.520 3.698 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.796 -14.048 2.106 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.394 -13.396 2.344 1.00 0.00 H new ATOM 0 HE2 MET A 8 -8.903 -13.565 1.388 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.921 -14.989 1.708 1.00 0.00 H new ATOM 83 N LEU A 9 -4.476 -14.333 0.985 1.00 0.00 N ATOM 84 CA LEU A 9 -3.456 -13.306 1.165 1.00 0.00 C ATOM 85 C LEU A 9 -4.044 -12.065 1.830 1.00 0.00 C ATOM 86 O LEU A 9 -5.123 -11.603 1.460 1.00 0.00 O ATOM 87 CB LEU A 9 -2.837 -12.931 -0.182 1.00 0.00 C ATOM 88 CG LEU A 9 -1.700 -11.909 -0.138 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.379 -12.593 0.173 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.614 -11.150 -1.455 1.00 0.00 C ATOM 0 H LEU A 9 -5.095 -14.177 0.189 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.680 -13.711 1.814 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.463 -13.840 -0.653 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.625 -12.540 -0.825 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.910 -11.194 0.657 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.418 -11.850 0.200 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.445 -13.089 1.141 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.161 -13.331 -0.599 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.800 -10.427 -1.406 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.428 -11.852 -2.268 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.553 -10.627 -1.635 1.00 0.00 H new ATOM 102 N ARG A 10 -3.326 -11.530 2.812 1.00 0.00 N ATOM 103 CA ARG A 10 -3.776 -10.342 3.528 1.00 0.00 C ATOM 104 C ARG A 10 -2.825 -9.172 3.292 1.00 0.00 C ATOM 105 O ARG A 10 -1.643 -9.243 3.626 1.00 0.00 O ATOM 106 CB ARG A 10 -3.882 -10.633 5.026 1.00 0.00 C ATOM 107 CG ARG A 10 -5.248 -11.146 5.452 1.00 0.00 C ATOM 108 CD ARG A 10 -5.514 -10.866 6.923 1.00 0.00 C ATOM 109 NE ARG A 10 -6.748 -11.496 7.385 1.00 0.00 N ATOM 110 CZ ARG A 10 -7.129 -11.519 8.657 1.00 0.00 C ATOM 111 NH1 ARG A 10 -6.377 -10.950 9.589 1.00 0.00 N ATOM 112 NH2 ARG A 10 -8.266 -12.112 9.000 1.00 0.00 N ATOM 0 H ARG A 10 -2.430 -11.900 3.130 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.760 -10.070 3.147 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.126 -11.369 5.299 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.656 -9.723 5.581 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.021 -10.674 4.845 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.309 -12.219 5.268 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.676 -11.229 7.518 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.575 -9.789 7.082 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.350 -11.943 6.693 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -5.503 -10.493 9.330 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -6.673 -10.970 10.565 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.848 -12.551 8.286 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.558 -12.129 9.977 1.00 0.00 H new ATOM 126 N VAL A 11 -3.351 -8.097 2.713 1.00 0.00 N ATOM 127 CA VAL A 11 -2.550 -6.912 2.433 1.00 0.00 C ATOM 128 C VAL A 11 -2.972 -5.742 3.315 1.00 0.00 C ATOM 129 O VAL A 11 -3.983 -5.089 3.055 1.00 0.00 O ATOM 130 CB VAL A 11 -2.664 -6.494 0.955 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.733 -5.329 0.655 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.365 -7.674 0.043 1.00 0.00 C ATOM 0 H VAL A 11 -4.328 -8.023 2.429 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.514 -7.172 2.651 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.687 -6.168 0.766 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.828 -5.048 -0.394 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -1.999 -4.479 1.284 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.704 -5.624 0.860 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.450 -7.360 -0.997 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.353 -8.033 0.232 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -3.077 -8.476 0.240 1.00 0.00 H new ATOM 142 N ILE A 12 -2.191 -5.482 4.358 1.00 0.00 N ATOM 143 CA ILE A 12 -2.483 -4.389 5.277 1.00 0.00 C ATOM 144 C ILE A 12 -1.891 -3.076 4.776 1.00 0.00 C ATOM 145 O ILE A 12 -0.681 -2.964 4.577 1.00 0.00 O ATOM 146 CB ILE A 12 -1.938 -4.680 6.688 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.376 -6.071 7.151 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.412 -3.617 7.668 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.667 -6.543 8.401 1.00 0.00 C ATOM 0 H ILE A 12 -1.351 -6.013 4.588 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.568 -4.299 5.327 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.849 -4.655 6.653 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.451 -6.063 7.334 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.195 -6.786 6.348 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.019 -3.836 8.661 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.056 -2.639 7.344 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.501 -3.613 7.702 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.027 -7.536 8.671 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.593 -6.584 8.217 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.869 -5.850 9.217 1.00 0.00 H new ATOM 161 N VAL A 13 -2.752 -2.084 4.576 1.00 0.00 N ATOM 162 CA VAL A 13 -2.315 -0.776 4.101 1.00 0.00 C ATOM 163 C VAL A 13 -2.161 0.205 5.258 1.00 0.00 C ATOM 164 O VAL A 13 -3.105 0.908 5.618 1.00 0.00 O ATOM 165 CB VAL A 13 -3.303 -0.192 3.075 1.00 0.00 C ATOM 166 CG1 VAL A 13 -2.772 1.114 2.505 1.00 0.00 C ATOM 167 CG2 VAL A 13 -3.574 -1.197 1.965 1.00 0.00 C ATOM 0 H VAL A 13 -3.757 -2.161 4.735 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.348 -0.921 3.620 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.245 0.018 3.582 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.484 1.511 1.782 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.634 1.834 3.312 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.817 0.934 2.012 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -4.274 -0.768 1.249 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.640 -1.440 1.458 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -4.002 -2.104 2.392 1.00 0.00 H new ATOM 177 N GLU A 14 -0.964 0.247 5.836 1.00 0.00 N ATOM 178 CA GLU A 14 -0.687 1.143 6.953 1.00 0.00 C ATOM 179 C GLU A 14 -0.955 2.595 6.565 1.00 0.00 C ATOM 180 O GLU A 14 -1.954 3.184 6.976 1.00 0.00 O ATOM 181 CB GLU A 14 0.763 0.986 7.414 1.00 0.00 C ATOM 182 CG GLU A 14 0.997 -0.240 8.280 1.00 0.00 C ATOM 183 CD GLU A 14 2.148 -0.059 9.251 1.00 0.00 C ATOM 184 OE1 GLU A 14 2.108 0.904 10.045 1.00 0.00 O ATOM 185 OE2 GLU A 14 3.088 -0.880 9.216 1.00 0.00 O ATOM 0 H GLU A 14 -0.172 -0.328 5.550 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.352 0.876 7.774 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.410 0.931 6.538 1.00 0.00 H new ATOM 0 HB3 GLU A 14 1.057 1.876 7.971 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.088 -0.465 8.838 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.198 -1.099 7.640 1.00 0.00 H new ATOM 192 N SER A 15 -0.054 3.165 5.772 1.00 0.00 N ATOM 193 CA SER A 15 -0.189 4.548 5.331 1.00 0.00 C ATOM 194 C SER A 15 0.910 4.912 4.337 1.00 0.00 C ATOM 195 O SER A 15 1.813 4.118 4.076 1.00 0.00 O ATOM 196 CB SER A 15 -0.140 5.495 6.532 1.00 0.00 C ATOM 197 OG SER A 15 1.155 5.522 7.108 1.00 0.00 O ATOM 0 H SER A 15 0.778 2.690 5.422 1.00 0.00 H new ATOM 0 HA SER A 15 -1.153 4.652 4.833 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.423 6.500 6.218 1.00 0.00 H new ATOM 0 HB3 SER A 15 -0.867 5.178 7.279 1.00 0.00 H new ATOM 0 HG SER A 15 1.609 4.672 6.932 1.00 0.00 H new ATOM 203 N ALA A 16 0.825 6.119 3.787 1.00 0.00 N ATOM 204 CA ALA A 16 1.812 6.590 2.823 1.00 0.00 C ATOM 205 C ALA A 16 2.346 7.964 3.212 1.00 0.00 C ATOM 206 O ALA A 16 1.775 8.644 4.065 1.00 0.00 O ATOM 207 CB ALA A 16 1.209 6.631 1.427 1.00 0.00 C ATOM 0 H ALA A 16 0.083 6.788 3.992 1.00 0.00 H new ATOM 0 HA ALA A 16 2.648 5.891 2.824 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.957 6.985 0.718 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.883 5.631 1.142 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.354 7.307 1.420 1.00 0.00 H new ATOM 213 N SER A 17 3.444 8.368 2.581 1.00 0.00 N ATOM 214 CA SER A 17 4.057 9.660 2.864 1.00 0.00 C ATOM 215 C SER A 17 4.938 10.110 1.702 1.00 0.00 C ATOM 216 O SER A 17 5.316 9.308 0.850 1.00 0.00 O ATOM 217 CB SER A 17 4.885 9.585 4.148 1.00 0.00 C ATOM 218 OG SER A 17 4.054 9.621 5.294 1.00 0.00 O ATOM 0 H SER A 17 3.927 7.819 1.870 1.00 0.00 H new ATOM 0 HA SER A 17 3.260 10.391 2.997 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.474 8.668 4.151 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.589 10.417 4.179 1.00 0.00 H new ATOM 0 HG SER A 17 3.820 10.550 5.499 1.00 0.00 H new ATOM 224 N ASN A 18 5.261 11.399 1.677 1.00 0.00 N ATOM 225 CA ASN A 18 6.097 11.957 0.620 1.00 0.00 C ATOM 226 C ASN A 18 5.396 11.868 -0.732 1.00 0.00 C ATOM 227 O ASN A 18 5.981 11.417 -1.718 1.00 0.00 O ATOM 228 CB ASN A 18 7.438 11.222 0.561 1.00 0.00 C ATOM 229 CG ASN A 18 8.157 11.224 1.896 1.00 0.00 C ATOM 230 OD1 ASN A 18 8.142 12.219 2.621 1.00 0.00 O ATOM 231 ND2 ASN A 18 8.792 10.106 2.227 1.00 0.00 N ATOM 0 H ASN A 18 4.957 12.076 2.376 1.00 0.00 H new ATOM 0 HA ASN A 18 6.275 13.008 0.848 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.272 10.193 0.242 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.073 11.690 -0.191 1.00 0.00 H new ATOM 0 HD21 ASN A 18 9.294 10.048 3.113 1.00 0.00 H new ATOM 0 HD22 ASN A 18 8.778 9.305 1.595 1.00 0.00 H new ATOM 238 N ILE A 19 4.140 12.301 -0.771 1.00 0.00 N ATOM 239 CA ILE A 19 3.361 12.272 -2.003 1.00 0.00 C ATOM 240 C ILE A 19 3.479 13.591 -2.759 1.00 0.00 C ATOM 241 O ILE A 19 3.397 14.675 -2.183 1.00 0.00 O ATOM 242 CB ILE A 19 1.874 11.987 -1.721 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.708 10.600 -1.096 1.00 0.00 C ATOM 244 CG2 ILE A 19 1.061 12.097 -3.002 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.275 10.115 -1.073 1.00 0.00 C ATOM 0 H ILE A 19 3.641 12.676 0.036 1.00 0.00 H new ATOM 0 HA ILE A 19 3.768 11.467 -2.615 1.00 0.00 H new ATOM 0 HB ILE A 19 1.505 12.730 -1.015 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.316 9.885 -1.651 1.00 0.00 H new ATOM 0 HG13 ILE A 19 2.092 10.622 -0.076 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.012 11.893 -2.786 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.158 13.103 -3.409 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.429 11.374 -3.730 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.233 9.126 -0.617 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.335 10.808 -0.494 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.107 10.061 -2.092 1.00 0.00 H new ATOM 257 N PRO A 20 3.675 13.498 -4.083 1.00 0.00 N ATOM 258 CA PRO A 20 3.807 14.674 -4.948 1.00 0.00 C ATOM 259 C PRO A 20 2.493 15.433 -5.097 1.00 0.00 C ATOM 260 O PRO A 20 1.618 15.036 -5.868 1.00 0.00 O ATOM 261 CB PRO A 20 4.236 14.079 -6.292 1.00 0.00 C ATOM 262 CG PRO A 20 3.717 12.683 -6.271 1.00 0.00 C ATOM 263 CD PRO A 20 3.783 12.237 -4.837 1.00 0.00 C ATOM 0 HA PRO A 20 4.511 15.401 -4.544 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.819 14.644 -7.126 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.320 14.097 -6.405 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.694 12.641 -6.646 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.317 12.034 -6.909 1.00 0.00 H new ATOM 0 HD2 PRO A 20 2.972 11.551 -4.592 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.716 11.718 -4.620 1.00 0.00 H new ATOM 271 N LYS A 21 2.360 16.528 -4.356 1.00 0.00 N ATOM 272 CA LYS A 21 1.154 17.345 -4.407 1.00 0.00 C ATOM 273 C LYS A 21 1.074 18.118 -5.720 1.00 0.00 C ATOM 274 O LYS A 21 2.075 18.279 -6.419 1.00 0.00 O ATOM 275 CB LYS A 21 1.123 18.319 -3.227 1.00 0.00 C ATOM 276 CG LYS A 21 2.356 19.201 -3.134 1.00 0.00 C ATOM 277 CD LYS A 21 2.687 19.548 -1.692 1.00 0.00 C ATOM 278 CE LYS A 21 3.633 20.736 -1.607 1.00 0.00 C ATOM 279 NZ LYS A 21 5.051 20.332 -1.809 1.00 0.00 N ATOM 0 H LYS A 21 3.074 16.870 -3.712 1.00 0.00 H new ATOM 0 HA LYS A 21 0.293 16.680 -4.345 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.240 18.952 -3.312 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.021 17.752 -2.301 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.204 18.691 -3.590 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.192 20.117 -3.701 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.768 19.774 -1.151 1.00 0.00 H new ATOM 0 HD3 LYS A 21 3.140 18.685 -1.204 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.356 21.475 -2.358 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.527 21.215 -0.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 5.663 21.170 -1.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.324 19.646 -1.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 5.158 19.898 -2.748 1.00 0.00 H new ATOM 293 N THR A 22 -0.122 18.596 -6.049 1.00 0.00 N ATOM 294 CA THR A 22 -0.331 19.351 -7.277 1.00 0.00 C ATOM 295 C THR A 22 -0.373 20.850 -7.000 1.00 0.00 C ATOM 296 O THR A 22 -0.782 21.282 -5.922 1.00 0.00 O ATOM 297 CB THR A 22 -1.638 18.934 -7.977 1.00 0.00 C ATOM 298 OG1 THR A 22 -1.870 19.767 -9.119 1.00 0.00 O ATOM 299 CG2 THR A 22 -2.819 19.033 -7.023 1.00 0.00 C ATOM 0 H THR A 22 -0.961 18.473 -5.481 1.00 0.00 H new ATOM 0 HA THR A 22 0.511 19.128 -7.932 1.00 0.00 H new ATOM 0 HB THR A 22 -1.537 17.897 -8.298 1.00 0.00 H new ATOM 0 HG1 THR A 22 -2.702 19.494 -9.559 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.731 18.734 -7.540 1.00 0.00 H new ATOM 0 HG22 THR A 22 -2.653 18.376 -6.169 1.00 0.00 H new ATOM 0 HG23 THR A 22 -2.920 20.061 -6.675 1.00 0.00 H new ATOM 356 N LYS A 26 -3.518 19.750 -2.203 1.00 0.00 N ATOM 357 CA LYS A 26 -3.329 18.373 -1.761 1.00 0.00 C ATOM 358 C LYS A 26 -4.344 17.445 -2.420 1.00 0.00 C ATOM 359 O LYS A 26 -5.546 17.518 -2.162 1.00 0.00 O ATOM 360 CB LYS A 26 -3.452 18.283 -0.238 1.00 0.00 C ATOM 361 CG LYS A 26 -2.327 18.981 0.506 1.00 0.00 C ATOM 362 CD LYS A 26 -2.403 18.723 2.001 1.00 0.00 C ATOM 363 CE LYS A 26 -1.023 18.741 2.641 1.00 0.00 C ATOM 364 NZ LYS A 26 -0.986 17.948 3.901 1.00 0.00 N ATOM 0 HA LYS A 26 -2.329 18.057 -2.058 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.403 18.719 0.068 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.473 17.233 0.055 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.367 18.634 0.124 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.376 20.054 0.318 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -3.033 19.479 2.470 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.876 17.758 2.181 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.292 18.341 1.939 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.733 19.771 2.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.767 18.576 4.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -1.911 17.500 4.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -0.253 17.213 3.827 1.00 0.00 H new ATOM 378 N PRO A 27 -3.853 16.550 -3.289 1.00 0.00 N ATOM 379 CA PRO A 27 -4.701 15.590 -4.001 1.00 0.00 C ATOM 380 C PRO A 27 -5.271 14.522 -3.074 1.00 0.00 C ATOM 381 O PRO A 27 -4.966 14.494 -1.882 1.00 0.00 O ATOM 382 CB PRO A 27 -3.746 14.960 -5.019 1.00 0.00 C ATOM 383 CG PRO A 27 -2.393 15.118 -4.417 1.00 0.00 C ATOM 384 CD PRO A 27 -2.431 16.407 -3.645 1.00 0.00 C ATOM 0 HA PRO A 27 -5.570 16.069 -4.451 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.984 13.910 -5.188 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.810 15.461 -5.985 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -2.156 14.279 -3.763 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.624 15.148 -5.189 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.797 16.364 -2.759 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.081 17.246 -4.246 1.00 0.00 H new ATOM 392 N ASP A 28 -6.099 13.644 -3.629 1.00 0.00 N ATOM 393 CA ASP A 28 -6.711 12.572 -2.852 1.00 0.00 C ATOM 394 C ASP A 28 -6.140 11.216 -3.253 1.00 0.00 C ATOM 395 O ASP A 28 -6.625 10.558 -4.173 1.00 0.00 O ATOM 396 CB ASP A 28 -8.228 12.577 -3.043 1.00 0.00 C ATOM 397 CG ASP A 28 -8.774 13.967 -3.306 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.394 14.569 -4.331 1.00 0.00 O ATOM 399 OD2 ASP A 28 -9.582 14.453 -2.486 1.00 0.00 O ATOM 0 H ASP A 28 -6.362 13.653 -4.614 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.485 12.745 -1.800 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.489 11.924 -3.876 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.705 12.165 -2.154 1.00 0.00 H new ATOM 404 N PRO A 29 -5.082 10.787 -2.548 1.00 0.00 N ATOM 405 CA PRO A 29 -4.421 9.506 -2.813 1.00 0.00 C ATOM 406 C PRO A 29 -5.289 8.314 -2.421 1.00 0.00 C ATOM 407 O PRO A 29 -6.140 8.418 -1.538 1.00 0.00 O ATOM 408 CB PRO A 29 -3.168 9.565 -1.936 1.00 0.00 C ATOM 409 CG PRO A 29 -3.520 10.504 -0.834 1.00 0.00 C ATOM 410 CD PRO A 29 -4.450 11.520 -1.438 1.00 0.00 C ATOM 0 HA PRO A 29 -4.210 9.368 -3.873 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.909 8.580 -1.549 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.306 9.922 -2.500 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -4.000 9.976 -0.010 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.628 10.983 -0.429 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.188 11.869 -0.715 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.910 12.398 -1.792 1.00 0.00 H new ATOM 418 N ILE A 30 -5.067 7.184 -3.084 1.00 0.00 N ATOM 419 CA ILE A 30 -5.828 5.973 -2.804 1.00 0.00 C ATOM 420 C ILE A 30 -5.053 4.728 -3.220 1.00 0.00 C ATOM 421 O ILE A 30 -4.559 4.637 -4.344 1.00 0.00 O ATOM 422 CB ILE A 30 -7.188 5.983 -3.527 1.00 0.00 C ATOM 423 CG1 ILE A 30 -8.151 4.997 -2.861 1.00 0.00 C ATOM 424 CG2 ILE A 30 -7.008 5.643 -4.999 1.00 0.00 C ATOM 425 CD1 ILE A 30 -9.607 5.287 -3.150 1.00 0.00 C ATOM 0 H ILE A 30 -4.367 7.082 -3.818 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.998 5.949 -1.728 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.614 6.984 -3.455 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.916 3.988 -3.199 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.992 5.018 -1.783 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.978 5.654 -5.496 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.353 6.379 -5.465 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.564 4.652 -5.092 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -10.232 4.549 -2.647 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.858 6.284 -2.787 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.781 5.237 -4.225 1.00 0.00 H new ATOM 437 N VAL A 31 -4.951 3.768 -2.306 1.00 0.00 N ATOM 438 CA VAL A 31 -4.238 2.526 -2.578 1.00 0.00 C ATOM 439 C VAL A 31 -5.099 1.565 -3.391 1.00 0.00 C ATOM 440 O VAL A 31 -6.288 1.399 -3.119 1.00 0.00 O ATOM 441 CB VAL A 31 -3.803 1.831 -1.275 1.00 0.00 C ATOM 442 CG1 VAL A 31 -3.169 0.481 -1.575 1.00 0.00 C ATOM 443 CG2 VAL A 31 -2.845 2.717 -0.493 1.00 0.00 C ATOM 0 H VAL A 31 -5.353 3.827 -1.371 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.351 2.790 -3.153 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.688 1.661 -0.662 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.868 0.005 -0.642 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.891 -0.153 -2.090 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.294 0.623 -2.209 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.548 2.210 0.425 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.961 2.920 -1.098 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.339 3.657 -0.245 1.00 0.00 H new ATOM 453 N SER A 32 -4.490 0.934 -4.390 1.00 0.00 N ATOM 454 CA SER A 32 -5.202 -0.008 -5.245 1.00 0.00 C ATOM 455 C SER A 32 -4.388 -1.284 -5.442 1.00 0.00 C ATOM 456 O SER A 32 -3.422 -1.307 -6.206 1.00 0.00 O ATOM 457 CB SER A 32 -5.506 0.631 -6.602 1.00 0.00 C ATOM 458 OG SER A 32 -6.337 1.769 -6.454 1.00 0.00 O ATOM 0 H SER A 32 -3.506 1.058 -4.627 1.00 0.00 H new ATOM 0 HA SER A 32 -6.141 -0.268 -4.755 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.574 0.918 -7.089 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.993 -0.098 -7.250 1.00 0.00 H new ATOM 0 HG SER A 32 -6.516 2.160 -7.335 1.00 0.00 H new ATOM 464 N VAL A 33 -4.786 -2.345 -4.748 1.00 0.00 N ATOM 465 CA VAL A 33 -4.096 -3.626 -4.847 1.00 0.00 C ATOM 466 C VAL A 33 -4.755 -4.527 -5.885 1.00 0.00 C ATOM 467 O VAL A 33 -5.969 -4.477 -6.084 1.00 0.00 O ATOM 468 CB VAL A 33 -4.073 -4.356 -3.491 1.00 0.00 C ATOM 469 CG1 VAL A 33 -3.247 -5.630 -3.585 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.534 -3.441 -2.402 1.00 0.00 C ATOM 0 H VAL A 33 -5.583 -2.343 -4.111 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.072 -3.411 -5.154 1.00 0.00 H new ATOM 0 HB VAL A 33 -5.095 -4.632 -3.229 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.242 -6.133 -2.618 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -3.682 -6.291 -4.335 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.225 -5.381 -3.870 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.525 -3.973 -1.451 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.520 -3.133 -2.655 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -4.171 -2.560 -2.319 1.00 0.00 H new ATOM 480 N ILE A 34 -3.946 -5.350 -6.544 1.00 0.00 N ATOM 481 CA ILE A 34 -4.451 -6.263 -7.562 1.00 0.00 C ATOM 482 C ILE A 34 -3.740 -7.610 -7.493 1.00 0.00 C ATOM 483 O ILE A 34 -2.511 -7.676 -7.481 1.00 0.00 O ATOM 484 CB ILE A 34 -4.283 -5.679 -8.977 1.00 0.00 C ATOM 485 CG1 ILE A 34 -5.104 -4.396 -9.123 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.697 -6.701 -10.025 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.354 -3.149 -8.709 1.00 0.00 C ATOM 0 H ILE A 34 -2.939 -5.403 -6.391 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.513 -6.404 -7.360 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.232 -5.436 -9.131 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.420 -4.292 -10.161 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.009 -4.483 -8.521 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.572 -6.273 -11.020 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.074 -7.590 -9.932 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.742 -6.973 -9.875 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -4.996 -2.278 -8.839 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.061 -3.231 -7.662 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.463 -3.038 -9.327 1.00 0.00 H new ATOM 499 N PHE A 35 -4.521 -8.684 -7.449 1.00 0.00 N ATOM 500 CA PHE A 35 -3.967 -10.031 -7.382 1.00 0.00 C ATOM 501 C PHE A 35 -5.007 -11.069 -7.794 1.00 0.00 C ATOM 502 O PHE A 35 -6.147 -11.041 -7.331 1.00 0.00 O ATOM 503 CB PHE A 35 -3.466 -10.330 -5.967 1.00 0.00 C ATOM 504 CG PHE A 35 -2.621 -11.569 -5.879 1.00 0.00 C ATOM 505 CD1 PHE A 35 -1.302 -11.555 -6.302 1.00 0.00 C ATOM 506 CD2 PHE A 35 -3.146 -12.747 -5.373 1.00 0.00 C ATOM 507 CE1 PHE A 35 -0.523 -12.694 -6.223 1.00 0.00 C ATOM 508 CE2 PHE A 35 -2.372 -13.889 -5.291 1.00 0.00 C ATOM 509 CZ PHE A 35 -1.058 -13.862 -5.716 1.00 0.00 C ATOM 0 H PHE A 35 -5.540 -8.648 -7.459 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.129 -10.086 -8.077 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.887 -9.479 -5.608 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -4.323 -10.436 -5.302 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.878 -10.644 -6.698 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.173 -12.773 -5.039 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.504 -12.671 -6.558 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.794 -14.801 -4.895 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.450 -14.752 -5.652 1.00 0.00 H new ATOM 519 N LYS A 36 -4.605 -11.984 -8.670 1.00 0.00 N ATOM 520 CA LYS A 36 -5.500 -13.033 -9.146 1.00 0.00 C ATOM 521 C LYS A 36 -6.801 -12.438 -9.676 1.00 0.00 C ATOM 522 O LYS A 36 -7.890 -12.881 -9.311 1.00 0.00 O ATOM 523 CB LYS A 36 -5.801 -14.025 -8.021 1.00 0.00 C ATOM 524 CG LYS A 36 -4.583 -14.805 -7.556 1.00 0.00 C ATOM 525 CD LYS A 36 -4.357 -16.044 -8.406 1.00 0.00 C ATOM 526 CE LYS A 36 -2.895 -16.462 -8.404 1.00 0.00 C ATOM 527 NZ LYS A 36 -2.537 -17.235 -9.626 1.00 0.00 N ATOM 0 H LYS A 36 -3.665 -12.020 -9.065 1.00 0.00 H new ATOM 0 HA LYS A 36 -5.003 -13.559 -9.961 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.221 -13.484 -7.173 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -6.563 -14.726 -8.361 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.701 -14.166 -7.601 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.712 -15.096 -6.514 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -4.971 -16.862 -8.029 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -4.679 -15.849 -9.429 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.264 -15.576 -8.337 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.691 -17.066 -7.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.532 -17.501 -9.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.121 -18.094 -9.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -2.707 -16.650 -10.469 1.00 0.00 H new ATOM 541 N ASP A 37 -6.680 -11.435 -10.538 1.00 0.00 N ATOM 542 CA ASP A 37 -7.847 -10.782 -11.120 1.00 0.00 C ATOM 543 C ASP A 37 -8.747 -10.206 -10.031 1.00 0.00 C ATOM 544 O ASP A 37 -9.968 -10.167 -10.178 1.00 0.00 O ATOM 545 CB ASP A 37 -8.635 -11.770 -11.980 1.00 0.00 C ATOM 546 CG ASP A 37 -9.828 -11.125 -12.658 1.00 0.00 C ATOM 547 OD1 ASP A 37 -9.618 -10.222 -13.494 1.00 0.00 O ATOM 548 OD2 ASP A 37 -10.972 -11.523 -12.351 1.00 0.00 O ATOM 0 H ASP A 37 -5.786 -11.056 -10.849 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.498 -9.963 -11.749 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -7.976 -12.194 -12.737 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -8.978 -12.596 -11.357 1.00 0.00 H new ATOM 553 N GLU A 38 -8.134 -9.761 -8.938 1.00 0.00 N ATOM 554 CA GLU A 38 -8.881 -9.190 -7.824 1.00 0.00 C ATOM 555 C GLU A 38 -8.450 -7.750 -7.561 1.00 0.00 C ATOM 556 O GLU A 38 -7.409 -7.502 -6.951 1.00 0.00 O ATOM 557 CB GLU A 38 -8.682 -10.031 -6.562 1.00 0.00 C ATOM 558 CG GLU A 38 -9.867 -9.994 -5.611 1.00 0.00 C ATOM 559 CD GLU A 38 -10.992 -10.914 -6.045 1.00 0.00 C ATOM 560 OE1 GLU A 38 -11.861 -10.462 -6.820 1.00 0.00 O ATOM 561 OE2 GLU A 38 -11.003 -12.084 -5.610 1.00 0.00 O ATOM 0 H GLU A 38 -7.124 -9.785 -8.801 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.938 -9.192 -8.091 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -8.491 -11.065 -6.851 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -7.795 -9.678 -6.037 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -9.536 -10.278 -4.612 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.243 -8.973 -5.544 1.00 0.00 H new ATOM 568 N LYS A 39 -9.256 -6.802 -8.027 1.00 0.00 N ATOM 569 CA LYS A 39 -8.961 -5.386 -7.844 1.00 0.00 C ATOM 570 C LYS A 39 -9.601 -4.858 -6.564 1.00 0.00 C ATOM 571 O LYS A 39 -10.820 -4.700 -6.487 1.00 0.00 O ATOM 572 CB LYS A 39 -9.458 -4.580 -9.046 1.00 0.00 C ATOM 573 CG LYS A 39 -8.835 -3.199 -9.152 1.00 0.00 C ATOM 574 CD LYS A 39 -9.061 -2.590 -10.526 1.00 0.00 C ATOM 575 CE LYS A 39 -8.233 -3.292 -11.591 1.00 0.00 C ATOM 576 NZ LYS A 39 -8.382 -2.647 -12.924 1.00 0.00 N ATOM 0 H LYS A 39 -10.120 -6.989 -8.535 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.880 -5.274 -7.762 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.245 -5.136 -9.959 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.541 -4.477 -8.981 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.261 -2.547 -8.389 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.765 -3.265 -8.954 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -10.118 -2.655 -10.784 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.803 -1.531 -10.503 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -7.183 -3.283 -11.299 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -8.537 -4.337 -11.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.802 -3.155 -13.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.380 -2.678 -13.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -8.068 -1.657 -12.868 1.00 0.00 H new ATOM 590 N LYS A 40 -8.773 -4.585 -5.562 1.00 0.00 N ATOM 591 CA LYS A 40 -9.257 -4.072 -4.286 1.00 0.00 C ATOM 592 C LYS A 40 -8.479 -2.828 -3.869 1.00 0.00 C ATOM 593 O LYS A 40 -7.248 -2.831 -3.848 1.00 0.00 O ATOM 594 CB LYS A 40 -9.139 -5.147 -3.203 1.00 0.00 C ATOM 595 CG LYS A 40 -10.178 -6.249 -3.324 1.00 0.00 C ATOM 596 CD LYS A 40 -10.024 -7.283 -2.222 1.00 0.00 C ATOM 597 CE LYS A 40 -10.766 -8.568 -2.556 1.00 0.00 C ATOM 598 NZ LYS A 40 -12.230 -8.441 -2.316 1.00 0.00 N ATOM 0 H LYS A 40 -7.762 -4.711 -5.609 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.306 -3.800 -4.407 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -8.144 -5.590 -3.250 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.233 -4.677 -2.224 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -11.177 -5.815 -3.280 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -10.084 -6.734 -4.295 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.967 -7.501 -2.071 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.403 -6.876 -1.284 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.590 -8.828 -3.600 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.368 -9.384 -1.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.700 -9.337 -2.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -12.400 -8.218 -1.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.614 -7.679 -2.910 1.00 0.00 H new ATOM 612 N LYS A 41 -9.204 -1.766 -3.537 1.00 0.00 N ATOM 613 CA LYS A 41 -8.583 -0.515 -3.118 1.00 0.00 C ATOM 614 C LYS A 41 -9.102 -0.081 -1.751 1.00 0.00 C ATOM 615 O LYS A 41 -10.164 -0.521 -1.310 1.00 0.00 O ATOM 616 CB LYS A 41 -8.852 0.583 -4.150 1.00 0.00 C ATOM 617 CG LYS A 41 -10.306 0.673 -4.576 1.00 0.00 C ATOM 618 CD LYS A 41 -11.117 1.526 -3.615 1.00 0.00 C ATOM 619 CE LYS A 41 -12.609 1.274 -3.769 1.00 0.00 C ATOM 620 NZ LYS A 41 -13.036 0.030 -3.070 1.00 0.00 N ATOM 0 H LYS A 41 -10.224 -1.746 -3.550 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.508 -0.679 -3.043 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.543 1.543 -3.736 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.235 0.402 -5.030 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.367 1.096 -5.579 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.734 -0.328 -4.625 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.814 1.310 -2.590 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -10.905 2.580 -3.794 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -13.164 2.123 -3.370 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.857 1.199 -4.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -14.059 -0.107 -3.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -12.525 -0.784 -3.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.822 0.111 -2.055 1.00 0.00 H new ATOM 634 N THR A 42 -8.347 0.787 -1.084 1.00 0.00 N ATOM 635 CA THR A 42 -8.731 1.281 0.232 1.00 0.00 C ATOM 636 C THR A 42 -9.557 2.557 0.121 1.00 0.00 C ATOM 637 O THR A 42 -9.569 3.213 -0.921 1.00 0.00 O ATOM 638 CB THR A 42 -7.497 1.556 1.111 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.727 2.627 0.552 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.631 0.312 1.233 1.00 0.00 C ATOM 0 H THR A 42 -7.466 1.162 -1.434 1.00 0.00 H new ATOM 0 HA THR A 42 -9.333 0.501 0.699 1.00 0.00 H new ATOM 0 HB THR A 42 -7.842 1.837 2.106 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.894 3.449 1.059 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.766 0.531 1.858 1.00 0.00 H new ATOM 0 HG22 THR A 42 -7.211 -0.492 1.685 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.295 0.004 0.243 1.00 0.00 H new ATOM 648 N LYS A 43 -10.247 2.906 1.201 1.00 0.00 N ATOM 649 CA LYS A 43 -11.075 4.106 1.227 1.00 0.00 C ATOM 650 C LYS A 43 -10.241 5.349 0.932 1.00 0.00 C ATOM 651 O LYS A 43 -9.324 5.686 1.681 1.00 0.00 O ATOM 652 CB LYS A 43 -11.760 4.249 2.588 1.00 0.00 C ATOM 653 CG LYS A 43 -10.804 4.595 3.716 1.00 0.00 C ATOM 654 CD LYS A 43 -11.438 4.359 5.076 1.00 0.00 C ATOM 655 CE LYS A 43 -10.411 4.454 6.194 1.00 0.00 C ATOM 656 NZ LYS A 43 -10.222 5.858 6.656 1.00 0.00 N ATOM 0 H LYS A 43 -10.249 2.374 2.071 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.836 4.009 0.453 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -12.525 5.023 2.521 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -12.270 3.316 2.828 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.900 3.993 3.626 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -10.502 5.639 3.631 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -12.228 5.092 5.243 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -11.907 3.375 5.094 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -10.729 3.835 7.033 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.458 4.055 5.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -9.515 5.880 7.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -9.894 6.444 5.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.125 6.231 7.011 1.00 0.00 H new ATOM 670 N LYS A 44 -10.566 6.027 -0.163 1.00 0.00 N ATOM 671 CA LYS A 44 -9.850 7.235 -0.557 1.00 0.00 C ATOM 672 C LYS A 44 -9.619 8.146 0.645 1.00 0.00 C ATOM 673 O LYS A 44 -10.395 8.139 1.600 1.00 0.00 O ATOM 674 CB LYS A 44 -10.630 7.986 -1.638 1.00 0.00 C ATOM 675 CG LYS A 44 -11.774 8.822 -1.092 1.00 0.00 C ATOM 676 CD LYS A 44 -12.572 9.474 -2.210 1.00 0.00 C ATOM 677 CE LYS A 44 -13.715 10.314 -1.662 1.00 0.00 C ATOM 678 NZ LYS A 44 -14.367 11.125 -2.727 1.00 0.00 N ATOM 0 H LYS A 44 -11.321 5.760 -0.794 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.881 6.939 -0.958 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.945 8.635 -2.184 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -11.026 7.266 -2.354 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.432 8.193 -0.493 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.379 9.592 -0.429 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.913 10.101 -2.810 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.969 8.704 -2.872 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.455 9.662 -1.198 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -13.338 10.975 -0.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.395 11.139 -2.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -13.999 12.097 -2.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -14.162 10.706 -3.657 1.00 0.00 H new ATOM 692 N VAL A 45 -8.548 8.931 0.589 1.00 0.00 N ATOM 693 CA VAL A 45 -8.217 9.850 1.671 1.00 0.00 C ATOM 694 C VAL A 45 -8.322 11.300 1.213 1.00 0.00 C ATOM 695 O VAL A 45 -7.689 11.701 0.236 1.00 0.00 O ATOM 696 CB VAL A 45 -6.796 9.595 2.209 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.383 10.699 3.171 1.00 0.00 C ATOM 698 CG2 VAL A 45 -6.718 8.233 2.882 1.00 0.00 C ATOM 0 H VAL A 45 -7.895 8.949 -0.194 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.938 9.671 2.469 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.102 9.600 1.369 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.377 10.502 3.541 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.398 11.658 2.653 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.078 10.729 4.010 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.707 8.069 3.256 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.423 8.197 3.713 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.968 7.456 2.160 1.00 0.00 H new ATOM 708 N ASP A 46 -9.125 12.083 1.924 1.00 0.00 N ATOM 709 CA ASP A 46 -9.313 13.490 1.592 1.00 0.00 C ATOM 710 C ASP A 46 -7.977 14.158 1.280 1.00 0.00 C ATOM 711 O ASP A 46 -6.919 13.657 1.658 1.00 0.00 O ATOM 712 CB ASP A 46 -10.006 14.221 2.743 1.00 0.00 C ATOM 713 CG ASP A 46 -10.620 15.537 2.308 1.00 0.00 C ATOM 714 OD1 ASP A 46 -11.004 15.650 1.125 1.00 0.00 O ATOM 715 OD2 ASP A 46 -10.716 16.454 3.150 1.00 0.00 O ATOM 0 H ASP A 46 -9.657 11.767 2.735 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.944 13.547 0.705 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.784 13.581 3.160 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.284 14.406 3.539 1.00 0.00 H new ATOM 720 N ASN A 47 -8.035 15.291 0.588 1.00 0.00 N ATOM 721 CA ASN A 47 -6.830 16.027 0.224 1.00 0.00 C ATOM 722 C ASN A 47 -5.768 15.904 1.313 1.00 0.00 C ATOM 723 O ASN A 47 -5.860 16.546 2.358 1.00 0.00 O ATOM 724 CB ASN A 47 -7.160 17.501 -0.018 1.00 0.00 C ATOM 725 CG ASN A 47 -8.268 18.001 0.889 1.00 0.00 C ATOM 726 OD1 ASN A 47 -9.451 17.825 0.596 1.00 0.00 O ATOM 727 ND2 ASN A 47 -7.889 18.629 1.996 1.00 0.00 N ATOM 0 H ASN A 47 -8.904 15.719 0.268 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.435 15.595 -0.695 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -6.265 18.102 0.141 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -7.456 17.639 -1.058 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -8.590 18.988 2.644 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -6.897 18.752 2.198 1.00 0.00 H new ATOM 734 N GLU A 48 -4.760 15.075 1.058 1.00 0.00 N ATOM 735 CA GLU A 48 -3.681 14.868 2.017 1.00 0.00 C ATOM 736 C GLU A 48 -2.487 14.189 1.354 1.00 0.00 C ATOM 737 O GLU A 48 -2.649 13.306 0.510 1.00 0.00 O ATOM 738 CB GLU A 48 -4.171 14.024 3.196 1.00 0.00 C ATOM 739 CG GLU A 48 -3.089 13.721 4.219 1.00 0.00 C ATOM 740 CD GLU A 48 -2.432 14.975 4.761 1.00 0.00 C ATOM 741 OE1 GLU A 48 -3.161 15.931 5.094 1.00 0.00 O ATOM 742 OE2 GLU A 48 -1.186 14.998 4.853 1.00 0.00 O ATOM 0 H GLU A 48 -4.668 14.537 0.197 1.00 0.00 H new ATOM 0 HA GLU A 48 -3.364 15.844 2.385 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -4.990 14.546 3.690 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -4.574 13.085 2.817 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.522 13.156 5.045 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.330 13.086 3.762 1.00 0.00 H new ATOM 749 N LEU A 49 -1.286 14.607 1.740 1.00 0.00 N ATOM 750 CA LEU A 49 -0.063 14.041 1.183 1.00 0.00 C ATOM 751 C LEU A 49 0.240 12.682 1.805 1.00 0.00 C ATOM 752 O LEU A 49 0.555 11.723 1.102 1.00 0.00 O ATOM 753 CB LEU A 49 1.113 14.993 1.412 1.00 0.00 C ATOM 754 CG LEU A 49 1.382 16.007 0.299 1.00 0.00 C ATOM 755 CD1 LEU A 49 0.078 16.614 -0.195 1.00 0.00 C ATOM 756 CD2 LEU A 49 2.328 17.094 0.786 1.00 0.00 C ATOM 0 H LEU A 49 -1.134 15.336 2.437 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.210 13.905 0.111 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.937 15.539 2.339 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.014 14.397 1.559 1.00 0.00 H new ATOM 0 HG LEU A 49 1.856 15.488 -0.534 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.288 17.333 -0.987 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.566 15.825 -0.583 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.424 17.119 0.630 1.00 0.00 H new ATOM 0 HD21 LEU A 49 2.508 17.807 -0.019 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.882 17.611 1.635 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.273 16.644 1.091 1.00 0.00 H new ATOM 768 N ASN A 50 0.141 12.607 3.129 1.00 0.00 N ATOM 769 CA ASN A 50 0.403 11.364 3.845 1.00 0.00 C ATOM 770 C ASN A 50 -0.895 10.750 4.362 1.00 0.00 C ATOM 771 O ASN A 50 -1.264 10.905 5.527 1.00 0.00 O ATOM 772 CB ASN A 50 1.361 11.616 5.012 1.00 0.00 C ATOM 773 CG ASN A 50 2.569 12.434 4.601 1.00 0.00 C ATOM 774 OD1 ASN A 50 3.691 11.929 4.562 1.00 0.00 O ATOM 775 ND2 ASN A 50 2.345 13.706 4.291 1.00 0.00 N ATOM 0 H ASN A 50 -0.119 13.392 3.727 1.00 0.00 H new ATOM 0 HA ASN A 50 0.864 10.663 3.149 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.829 12.134 5.810 1.00 0.00 H new ATOM 0 HB3 ASN A 50 1.693 10.661 5.418 1.00 0.00 H new ATOM 0 HD21 ASN A 50 3.120 14.306 4.007 1.00 0.00 H new ATOM 0 HD22 ASN A 50 1.398 14.083 4.337 1.00 0.00 H new ATOM 782 N PRO A 51 -1.605 10.035 3.477 1.00 0.00 N ATOM 783 CA PRO A 51 -2.871 9.382 3.821 1.00 0.00 C ATOM 784 C PRO A 51 -2.677 8.202 4.766 1.00 0.00 C ATOM 785 O PRO A 51 -1.686 7.477 4.675 1.00 0.00 O ATOM 786 CB PRO A 51 -3.401 8.902 2.467 1.00 0.00 C ATOM 787 CG PRO A 51 -2.187 8.745 1.619 1.00 0.00 C ATOM 788 CD PRO A 51 -1.225 9.808 2.072 1.00 0.00 C ATOM 0 HA PRO A 51 -3.548 10.056 4.345 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -3.940 7.960 2.564 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.095 9.623 2.035 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.755 7.751 1.737 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.431 8.863 0.563 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.190 9.477 1.984 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.321 10.717 1.478 1.00 0.00 H new ATOM 796 N VAL A 52 -3.630 8.014 5.674 1.00 0.00 N ATOM 797 CA VAL A 52 -3.564 6.920 6.636 1.00 0.00 C ATOM 798 C VAL A 52 -4.778 6.005 6.512 1.00 0.00 C ATOM 799 O VAL A 52 -5.878 6.357 6.937 1.00 0.00 O ATOM 800 CB VAL A 52 -3.478 7.447 8.080 1.00 0.00 C ATOM 801 CG1 VAL A 52 -3.460 6.292 9.070 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.250 8.328 8.253 1.00 0.00 C ATOM 0 H VAL A 52 -4.457 8.605 5.763 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.661 6.353 6.409 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.362 8.052 8.281 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.399 6.684 10.085 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.372 5.706 8.962 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -2.596 5.658 8.873 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.205 8.692 9.279 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.353 7.749 8.034 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.311 9.175 7.570 1.00 0.00 H new ATOM 812 N TRP A 53 -4.569 4.831 5.927 1.00 0.00 N ATOM 813 CA TRP A 53 -5.647 3.865 5.748 1.00 0.00 C ATOM 814 C TRP A 53 -5.693 2.879 6.910 1.00 0.00 C ATOM 815 O TRP A 53 -6.767 2.537 7.402 1.00 0.00 O ATOM 816 CB TRP A 53 -5.469 3.111 4.429 1.00 0.00 C ATOM 817 CG TRP A 53 -5.448 4.009 3.229 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.529 4.521 2.570 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.289 4.498 2.545 1.00 0.00 C ATOM 820 NE1 TRP A 53 -6.112 5.300 1.518 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.742 5.302 1.481 1.00 0.00 C ATOM 822 CE3 TRP A 53 -2.913 4.336 2.728 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -3.868 5.940 0.606 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -2.046 4.970 1.859 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.526 5.765 0.809 1.00 0.00 C ATOM 0 H TRP A 53 -3.664 4.525 5.569 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.590 4.411 5.722 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.539 2.544 4.466 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.278 2.389 4.319 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.560 4.340 2.837 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.723 5.796 0.870 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.534 3.726 3.535 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -4.236 6.552 -0.205 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -0.981 4.851 1.991 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -1.823 6.249 0.147 1.00 0.00 H new ATOM 836 N ASN A 54 -4.521 2.425 7.342 1.00 0.00 N ATOM 837 CA ASN A 54 -4.429 1.478 8.447 1.00 0.00 C ATOM 838 C ASN A 54 -5.545 0.440 8.368 1.00 0.00 C ATOM 839 O ASN A 54 -6.107 0.040 9.387 1.00 0.00 O ATOM 840 CB ASN A 54 -4.497 2.215 9.786 1.00 0.00 C ATOM 841 CG ASN A 54 -3.227 2.988 10.085 1.00 0.00 C ATOM 842 OD1 ASN A 54 -2.150 2.649 9.594 1.00 0.00 O ATOM 843 ND2 ASN A 54 -3.348 4.033 10.896 1.00 0.00 N ATOM 0 H ASN A 54 -3.622 2.697 6.944 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.471 0.963 8.372 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -5.344 2.902 9.777 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -4.678 1.496 10.585 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -2.528 4.591 11.135 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -4.261 4.278 11.280 1.00 0.00 H new ATOM 850 N GLU A 55 -5.859 0.009 7.150 1.00 0.00 N ATOM 851 CA GLU A 55 -6.908 -0.982 6.939 1.00 0.00 C ATOM 852 C GLU A 55 -6.310 -2.340 6.584 1.00 0.00 C ATOM 853 O GLU A 55 -5.105 -2.459 6.356 1.00 0.00 O ATOM 854 CB GLU A 55 -7.856 -0.525 5.829 1.00 0.00 C ATOM 855 CG GLU A 55 -7.398 -0.920 4.435 1.00 0.00 C ATOM 856 CD GLU A 55 -8.439 -0.624 3.373 1.00 0.00 C ATOM 857 OE1 GLU A 55 -9.003 0.490 3.391 1.00 0.00 O ATOM 858 OE2 GLU A 55 -8.689 -1.505 2.524 1.00 0.00 O ATOM 0 H GLU A 55 -5.403 0.330 6.296 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.469 -1.083 7.868 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.844 -0.947 6.011 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -7.959 0.559 5.875 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.478 -0.388 4.195 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.163 -1.984 4.422 1.00 0.00 H new ATOM 865 N ILE A 56 -7.159 -3.361 6.541 1.00 0.00 N ATOM 866 CA ILE A 56 -6.715 -4.711 6.214 1.00 0.00 C ATOM 867 C ILE A 56 -7.427 -5.238 4.973 1.00 0.00 C ATOM 868 O ILE A 56 -8.626 -5.018 4.791 1.00 0.00 O ATOM 869 CB ILE A 56 -6.958 -5.682 7.383 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.215 -5.206 8.633 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.518 -7.089 7.004 1.00 0.00 C ATOM 872 CD1 ILE A 56 -6.634 -5.925 9.896 1.00 0.00 C ATOM 0 H ILE A 56 -8.158 -3.279 6.728 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.644 -4.652 6.018 1.00 0.00 H new ATOM 0 HB ILE A 56 -8.026 -5.702 7.602 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.144 -5.345 8.484 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.383 -4.137 8.761 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.696 -7.764 7.841 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -7.087 -7.427 6.138 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.455 -7.085 6.761 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.066 -5.536 10.741 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.698 -5.766 10.069 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.440 -6.992 9.789 1.00 0.00 H new ATOM 884 N LEU A 57 -6.684 -5.937 4.122 1.00 0.00 N ATOM 885 CA LEU A 57 -7.244 -6.498 2.898 1.00 0.00 C ATOM 886 C LEU A 57 -7.125 -8.019 2.892 1.00 0.00 C ATOM 887 O LEU A 57 -6.321 -8.590 3.629 1.00 0.00 O ATOM 888 CB LEU A 57 -6.536 -5.915 1.675 1.00 0.00 C ATOM 889 CG LEU A 57 -6.693 -4.409 1.463 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.591 -3.879 0.559 1.00 0.00 C ATOM 891 CD2 LEU A 57 -8.062 -4.092 0.879 1.00 0.00 C ATOM 0 H LEU A 57 -5.691 -6.129 4.258 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.301 -6.234 2.858 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.473 -6.142 1.753 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -6.907 -6.427 0.787 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.610 -3.915 2.431 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.719 -2.806 0.420 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.621 -4.072 1.017 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.642 -4.379 -0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -8.156 -3.016 0.735 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.174 -4.598 -0.080 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -8.838 -4.435 1.563 1.00 0.00 H new ATOM 903 N GLU A 58 -7.928 -8.668 2.055 1.00 0.00 N ATOM 904 CA GLU A 58 -7.910 -10.122 1.953 1.00 0.00 C ATOM 905 C GLU A 58 -8.095 -10.568 0.506 1.00 0.00 C ATOM 906 O GLU A 58 -8.759 -9.895 -0.283 1.00 0.00 O ATOM 907 CB GLU A 58 -9.008 -10.730 2.830 1.00 0.00 C ATOM 908 CG GLU A 58 -9.210 -10.000 4.146 1.00 0.00 C ATOM 909 CD GLU A 58 -10.598 -10.207 4.721 1.00 0.00 C ATOM 910 OE1 GLU A 58 -10.861 -11.302 5.258 1.00 0.00 O ATOM 911 OE2 GLU A 58 -11.421 -9.271 4.633 1.00 0.00 O ATOM 0 H GLU A 58 -8.599 -8.210 1.438 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.939 -10.474 2.302 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.946 -10.728 2.276 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.761 -11.772 3.036 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.468 -10.344 4.866 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -9.038 -8.934 3.996 1.00 0.00 H new ATOM 918 N PHE A 59 -7.502 -11.707 0.164 1.00 0.00 N ATOM 919 CA PHE A 59 -7.598 -12.243 -1.189 1.00 0.00 C ATOM 920 C PHE A 59 -7.707 -13.765 -1.164 1.00 0.00 C ATOM 921 O PHE A 59 -7.061 -14.432 -0.356 1.00 0.00 O ATOM 922 CB PHE A 59 -6.382 -11.821 -2.016 1.00 0.00 C ATOM 923 CG PHE A 59 -6.362 -10.357 -2.348 1.00 0.00 C ATOM 924 CD1 PHE A 59 -5.988 -9.422 -1.397 1.00 0.00 C ATOM 925 CD2 PHE A 59 -6.718 -9.915 -3.613 1.00 0.00 C ATOM 926 CE1 PHE A 59 -5.969 -8.073 -1.699 1.00 0.00 C ATOM 927 CE2 PHE A 59 -6.700 -8.568 -3.921 1.00 0.00 C ATOM 928 CZ PHE A 59 -6.326 -7.646 -2.963 1.00 0.00 C ATOM 0 H PHE A 59 -6.950 -12.277 0.805 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.499 -11.839 -1.650 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.474 -12.073 -1.468 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.365 -12.396 -2.942 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.708 -9.751 -0.407 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.013 -10.631 -4.366 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -5.676 -7.354 -0.948 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -6.978 -8.236 -4.910 1.00 0.00 H new ATOM 0 HZ PHE A 59 -6.313 -6.593 -3.202 1.00 0.00 H new ATOM 938 N ASP A 60 -8.530 -14.308 -2.055 1.00 0.00 N ATOM 939 CA ASP A 60 -8.725 -15.751 -2.137 1.00 0.00 C ATOM 940 C ASP A 60 -7.727 -16.379 -3.105 1.00 0.00 C ATOM 941 O ASP A 60 -7.543 -15.897 -4.223 1.00 0.00 O ATOM 942 CB ASP A 60 -10.154 -16.070 -2.579 1.00 0.00 C ATOM 943 CG ASP A 60 -11.094 -16.259 -1.405 1.00 0.00 C ATOM 944 OD1 ASP A 60 -10.683 -16.896 -0.413 1.00 0.00 O ATOM 945 OD2 ASP A 60 -12.241 -15.771 -1.478 1.00 0.00 O ATOM 0 H ASP A 60 -9.073 -13.770 -2.731 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.558 -16.173 -1.146 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.524 -15.263 -3.211 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.150 -16.975 -3.187 1.00 0.00 H new ATOM 950 N LEU A 61 -7.085 -17.457 -2.667 1.00 0.00 N ATOM 951 CA LEU A 61 -6.105 -18.152 -3.495 1.00 0.00 C ATOM 952 C LEU A 61 -6.724 -19.378 -4.158 1.00 0.00 C ATOM 953 O LEU A 61 -6.201 -19.891 -5.148 1.00 0.00 O ATOM 954 CB LEU A 61 -4.900 -18.569 -2.650 1.00 0.00 C ATOM 955 CG LEU A 61 -4.206 -17.450 -1.872 1.00 0.00 C ATOM 956 CD1 LEU A 61 -3.151 -18.023 -0.939 1.00 0.00 C ATOM 957 CD2 LEU A 61 -3.584 -16.442 -2.827 1.00 0.00 C ATOM 0 H LEU A 61 -7.225 -17.868 -1.744 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.775 -17.468 -4.276 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.225 -19.330 -1.941 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.166 -19.037 -3.306 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.954 -16.936 -1.269 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.668 -17.212 -0.394 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.623 -18.705 -0.232 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.405 -18.563 -1.522 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.095 -15.653 -2.256 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -2.849 -16.943 -3.457 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.362 -16.007 -3.454 1.00 0.00 H new ATOM 969 N ARG A 62 -7.841 -19.841 -3.608 1.00 0.00 N ATOM 970 CA ARG A 62 -8.532 -21.007 -4.147 1.00 0.00 C ATOM 971 C ARG A 62 -7.645 -22.246 -4.075 1.00 0.00 C ATOM 972 O ARG A 62 -7.575 -23.028 -5.022 1.00 0.00 O ATOM 973 CB ARG A 62 -8.953 -20.751 -5.596 1.00 0.00 C ATOM 974 CG ARG A 62 -9.246 -19.291 -5.897 1.00 0.00 C ATOM 975 CD ARG A 62 -10.301 -19.147 -6.983 1.00 0.00 C ATOM 976 NE ARG A 62 -9.716 -19.170 -8.321 1.00 0.00 N ATOM 977 CZ ARG A 62 -10.401 -19.478 -9.417 1.00 0.00 C ATOM 978 NH1 ARG A 62 -11.688 -19.786 -9.334 1.00 0.00 N ATOM 979 NH2 ARG A 62 -9.798 -19.478 -10.599 1.00 0.00 N ATOM 0 H ARG A 62 -8.287 -19.427 -2.790 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.422 -21.183 -3.542 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.163 -21.099 -6.262 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -9.840 -21.344 -5.818 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.586 -18.792 -4.989 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -8.329 -18.792 -6.210 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -11.028 -19.954 -6.891 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -10.843 -18.212 -6.840 1.00 0.00 H new ATOM 0 HE ARG A 62 -8.728 -18.937 -8.419 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -12.155 -19.787 -8.427 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -12.211 -20.022 -10.177 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -8.808 -19.241 -10.667 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -10.324 -19.715 -11.440 1.00 0.00 H new ATOM 993 N GLY A 63 -6.970 -22.419 -2.943 1.00 0.00 N ATOM 994 CA GLY A 63 -6.096 -23.564 -2.767 1.00 0.00 C ATOM 995 C GLY A 63 -4.825 -23.455 -3.586 1.00 0.00 C ATOM 996 O GLY A 63 -3.971 -24.341 -3.540 1.00 0.00 O ATOM 0 H GLY A 63 -7.013 -21.786 -2.144 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.838 -23.661 -1.713 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.630 -24.471 -3.049 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.700 -22.367 -4.339 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.525 -22.147 -5.172 1.00 0.00 C ATOM 1002 C ILE A 64 -2.416 -21.455 -4.386 1.00 0.00 C ATOM 1003 O ILE A 64 -2.520 -20.285 -4.017 1.00 0.00 O ATOM 1004 CB ILE A 64 -3.864 -21.300 -6.412 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -4.995 -21.954 -7.209 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -2.631 -21.118 -7.284 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -4.601 -23.266 -7.851 1.00 0.00 C ATOM 0 H ILE A 64 -5.398 -21.625 -4.389 1.00 0.00 H new ATOM 0 HA ILE A 64 -3.180 -23.129 -5.496 1.00 0.00 H new ATOM 0 HB ILE A 64 -4.198 -20.317 -6.081 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.844 -22.123 -6.547 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.328 -21.265 -7.985 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.888 -20.517 -8.156 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.852 -20.613 -6.712 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.268 -22.093 -7.609 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -5.451 -23.673 -8.399 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.772 -23.100 -8.538 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.296 -23.972 -7.079 1.00 0.00 H new ATOM 1019 N PRO A 65 -1.327 -22.193 -4.124 1.00 0.00 N ATOM 1020 CA PRO A 65 -0.176 -21.670 -3.381 1.00 0.00 C ATOM 1021 C PRO A 65 0.602 -20.627 -4.176 1.00 0.00 C ATOM 1022 O PRO A 65 0.416 -20.488 -5.386 1.00 0.00 O ATOM 1023 CB PRO A 65 0.685 -22.913 -3.142 1.00 0.00 C ATOM 1024 CG PRO A 65 0.319 -23.846 -4.244 1.00 0.00 C ATOM 1025 CD PRO A 65 -1.135 -23.594 -4.533 1.00 0.00 C ATOM 0 HA PRO A 65 -0.478 -21.161 -2.466 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.747 -22.669 -3.166 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.481 -23.354 -2.166 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.930 -23.665 -5.128 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.485 -24.882 -3.949 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.366 -23.740 -5.588 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.779 -24.269 -3.970 1.00 0.00 H new ATOM 1033 N LEU A 66 1.474 -19.897 -3.490 1.00 0.00 N ATOM 1034 CA LEU A 66 2.281 -18.866 -4.133 1.00 0.00 C ATOM 1035 C LEU A 66 3.535 -19.468 -4.758 1.00 0.00 C ATOM 1036 O LEU A 66 3.814 -20.655 -4.594 1.00 0.00 O ATOM 1037 CB LEU A 66 2.669 -17.788 -3.119 1.00 0.00 C ATOM 1038 CG LEU A 66 1.602 -16.737 -2.815 1.00 0.00 C ATOM 1039 CD1 LEU A 66 2.172 -15.637 -1.933 1.00 0.00 C ATOM 1040 CD2 LEU A 66 1.044 -16.154 -4.105 1.00 0.00 C ATOM 0 H LEU A 66 1.640 -20.000 -2.489 1.00 0.00 H new ATOM 0 HA LEU A 66 1.684 -18.413 -4.925 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.944 -18.278 -2.185 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.560 -17.277 -3.485 1.00 0.00 H new ATOM 0 HG LEU A 66 0.787 -17.220 -2.276 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.398 -14.898 -1.727 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.521 -16.067 -0.995 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.006 -15.156 -2.444 1.00 0.00 H new ATOM 0 HD21 LEU A 66 0.286 -15.408 -3.869 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.849 -15.686 -4.671 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.597 -16.950 -4.700 1.00 0.00 H new ATOM 1052 N ASP A 67 4.289 -18.640 -5.474 1.00 0.00 N ATOM 1053 CA ASP A 67 5.516 -19.089 -6.121 1.00 0.00 C ATOM 1054 C ASP A 67 6.489 -17.929 -6.308 1.00 0.00 C ATOM 1055 O ASP A 67 6.192 -16.792 -5.940 1.00 0.00 O ATOM 1056 CB ASP A 67 5.200 -19.728 -7.474 1.00 0.00 C ATOM 1057 CG ASP A 67 4.179 -18.934 -8.265 1.00 0.00 C ATOM 1058 OD1 ASP A 67 4.581 -17.982 -8.966 1.00 0.00 O ATOM 1059 OD2 ASP A 67 2.978 -19.265 -8.184 1.00 0.00 O ATOM 0 H ASP A 67 4.071 -17.654 -5.621 1.00 0.00 H new ATOM 0 HA ASP A 67 5.985 -19.833 -5.477 1.00 0.00 H new ATOM 0 HB2 ASP A 67 6.118 -19.814 -8.055 1.00 0.00 H new ATOM 0 HB3 ASP A 67 4.826 -20.740 -7.316 1.00 0.00 H new ATOM 1064 N PHE A 68 7.651 -18.224 -6.880 1.00 0.00 N ATOM 1065 CA PHE A 68 8.668 -17.206 -7.113 1.00 0.00 C ATOM 1066 C PHE A 68 8.273 -16.297 -8.273 1.00 0.00 C ATOM 1067 O PHE A 68 8.911 -15.275 -8.521 1.00 0.00 O ATOM 1068 CB PHE A 68 10.020 -17.862 -7.403 1.00 0.00 C ATOM 1069 CG PHE A 68 10.826 -18.144 -6.167 1.00 0.00 C ATOM 1070 CD1 PHE A 68 10.301 -18.915 -5.143 1.00 0.00 C ATOM 1071 CD2 PHE A 68 12.109 -17.639 -6.031 1.00 0.00 C ATOM 1072 CE1 PHE A 68 11.041 -19.176 -4.004 1.00 0.00 C ATOM 1073 CE2 PHE A 68 12.854 -17.897 -4.895 1.00 0.00 C ATOM 1074 CZ PHE A 68 12.319 -18.667 -3.881 1.00 0.00 C ATOM 0 H PHE A 68 7.912 -19.160 -7.191 1.00 0.00 H new ATOM 0 HA PHE A 68 8.752 -16.600 -6.211 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.854 -18.796 -7.940 1.00 0.00 H new ATOM 0 HB3 PHE A 68 10.596 -17.213 -8.063 1.00 0.00 H new ATOM 0 HD1 PHE A 68 9.303 -19.317 -5.235 1.00 0.00 H new ATOM 0 HD2 PHE A 68 12.532 -17.037 -6.821 1.00 0.00 H new ATOM 0 HE1 PHE A 68 10.620 -19.777 -3.212 1.00 0.00 H new ATOM 0 HE2 PHE A 68 13.853 -17.497 -4.801 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.899 -18.871 -2.993 1.00 0.00 H new ATOM 1084 N SER A 69 7.215 -16.679 -8.982 1.00 0.00 N ATOM 1085 CA SER A 69 6.735 -15.902 -10.119 1.00 0.00 C ATOM 1086 C SER A 69 5.549 -15.030 -9.719 1.00 0.00 C ATOM 1087 O SER A 69 5.158 -14.122 -10.453 1.00 0.00 O ATOM 1088 CB SER A 69 6.336 -16.832 -11.267 1.00 0.00 C ATOM 1089 OG SER A 69 7.450 -17.569 -11.738 1.00 0.00 O ATOM 0 H SER A 69 6.674 -17.522 -8.789 1.00 0.00 H new ATOM 0 HA SER A 69 7.545 -15.253 -10.452 1.00 0.00 H new ATOM 0 HB2 SER A 69 5.559 -17.518 -10.930 1.00 0.00 H new ATOM 0 HB3 SER A 69 5.912 -16.246 -12.083 1.00 0.00 H new ATOM 0 HG SER A 69 7.168 -18.157 -12.470 1.00 0.00 H new ATOM 1095 N SER A 70 4.982 -15.312 -8.551 1.00 0.00 N ATOM 1096 CA SER A 70 3.837 -14.557 -8.055 1.00 0.00 C ATOM 1097 C SER A 70 4.288 -13.248 -7.414 1.00 0.00 C ATOM 1098 O SER A 70 5.302 -13.201 -6.718 1.00 0.00 O ATOM 1099 CB SER A 70 3.051 -15.390 -7.041 1.00 0.00 C ATOM 1100 OG SER A 70 2.133 -16.252 -7.692 1.00 0.00 O ATOM 0 H SER A 70 5.296 -16.058 -7.930 1.00 0.00 H new ATOM 0 HA SER A 70 3.191 -14.324 -8.902 1.00 0.00 H new ATOM 0 HB2 SER A 70 3.741 -15.978 -6.436 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.514 -14.729 -6.360 1.00 0.00 H new ATOM 0 HG SER A 70 1.644 -16.775 -7.023 1.00 0.00 H new ATOM 1106 N SER A 71 3.526 -12.185 -7.655 1.00 0.00 N ATOM 1107 CA SER A 71 3.848 -10.874 -7.105 1.00 0.00 C ATOM 1108 C SER A 71 2.596 -10.009 -6.996 1.00 0.00 C ATOM 1109 O SER A 71 1.559 -10.319 -7.584 1.00 0.00 O ATOM 1110 CB SER A 71 4.891 -10.173 -7.978 1.00 0.00 C ATOM 1111 OG SER A 71 4.461 -10.099 -9.326 1.00 0.00 O ATOM 0 H SER A 71 2.682 -12.207 -8.227 1.00 0.00 H new ATOM 0 HA SER A 71 4.258 -11.017 -6.105 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.074 -9.169 -7.596 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.837 -10.712 -7.924 1.00 0.00 H new ATOM 0 HG SER A 71 5.144 -9.645 -9.863 1.00 0.00 H new ATOM 1117 N LEU A 72 2.700 -8.922 -6.239 1.00 0.00 N ATOM 1118 CA LEU A 72 1.576 -8.010 -6.051 1.00 0.00 C ATOM 1119 C LEU A 72 1.858 -6.658 -6.699 1.00 0.00 C ATOM 1120 O LEU A 72 3.002 -6.208 -6.748 1.00 0.00 O ATOM 1121 CB LEU A 72 1.289 -7.824 -4.560 1.00 0.00 C ATOM 1122 CG LEU A 72 -0.047 -7.167 -4.211 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -1.199 -8.119 -4.492 1.00 0.00 C ATOM 1124 CD2 LEU A 72 -0.060 -6.725 -2.755 1.00 0.00 C ATOM 0 H LEU A 72 3.550 -8.651 -5.746 1.00 0.00 H new ATOM 0 HA LEU A 72 0.701 -8.447 -6.531 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.327 -8.801 -4.078 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.090 -7.224 -4.128 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.171 -6.284 -4.838 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.142 -7.634 -4.238 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.201 -8.385 -5.549 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -1.081 -9.021 -3.891 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.018 -6.260 -2.525 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.087 -7.592 -2.110 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.742 -6.007 -2.586 1.00 0.00 H new ATOM 1136 N GLY A 73 0.806 -6.014 -7.194 1.00 0.00 N ATOM 1137 CA GLY A 73 0.961 -4.719 -7.831 1.00 0.00 C ATOM 1138 C GLY A 73 0.272 -3.609 -7.062 1.00 0.00 C ATOM 1139 O GLY A 73 -0.956 -3.561 -6.995 1.00 0.00 O ATOM 0 H GLY A 73 -0.151 -6.366 -7.165 1.00 0.00 H new ATOM 0 HA2 GLY A 73 2.022 -4.488 -7.924 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.555 -4.763 -8.841 1.00 0.00 H new ATOM 1143 N ILE A 74 1.065 -2.716 -6.478 1.00 0.00 N ATOM 1144 CA ILE A 74 0.524 -1.602 -5.710 1.00 0.00 C ATOM 1145 C ILE A 74 0.511 -0.320 -6.535 1.00 0.00 C ATOM 1146 O ILE A 74 1.557 0.280 -6.784 1.00 0.00 O ATOM 1147 CB ILE A 74 1.332 -1.362 -4.421 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.135 -2.523 -3.445 1.00 0.00 C ATOM 1149 CG2 ILE A 74 0.923 -0.046 -3.777 1.00 0.00 C ATOM 1150 CD1 ILE A 74 -0.297 -2.690 -2.986 1.00 0.00 C ATOM 0 H ILE A 74 2.084 -2.743 -6.522 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.498 -1.870 -5.444 1.00 0.00 H new ATOM 0 HB ILE A 74 2.390 -1.305 -4.678 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.466 -3.447 -3.920 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.771 -2.367 -2.574 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.503 0.109 -2.867 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.111 0.773 -4.471 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.138 -0.076 -3.530 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.362 -3.531 -2.296 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.626 -1.781 -2.482 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.936 -2.878 -3.849 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.680 0.095 -6.954 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.829 1.308 -7.749 1.00 0.00 C ATOM 1164 C ILE A 75 -1.530 2.404 -6.953 1.00 0.00 C ATOM 1165 O ILE A 75 -2.681 2.251 -6.545 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.624 1.040 -9.041 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -1.116 -0.231 -9.723 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.520 2.231 -9.983 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -2.163 -0.923 -10.568 1.00 0.00 C ATOM 0 H ILE A 75 -1.555 -0.390 -6.756 1.00 0.00 H new ATOM 0 HA ILE A 75 0.176 1.639 -8.012 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.673 0.897 -8.782 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.262 0.020 -10.351 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.759 -0.924 -8.962 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.087 2.027 -10.891 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -1.924 3.118 -9.495 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.474 2.403 -10.239 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.733 -1.816 -11.021 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -3.008 -1.206 -9.941 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.503 -0.246 -11.352 1.00 0.00 H new ATOM 1181 N VAL A 76 -0.827 3.511 -6.736 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.381 4.635 -5.991 1.00 0.00 C ATOM 1183 C VAL A 76 -1.735 5.790 -6.921 1.00 0.00 C ATOM 1184 O VAL A 76 -0.855 6.474 -7.443 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.397 5.138 -4.918 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -1.052 6.201 -4.049 1.00 0.00 C ATOM 1187 CG2 VAL A 76 0.103 3.979 -4.070 1.00 0.00 C ATOM 0 H VAL A 76 0.128 3.653 -7.066 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.286 4.275 -5.503 1.00 0.00 H new ATOM 0 HB VAL A 76 0.460 5.589 -5.418 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.342 6.544 -3.297 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.357 7.042 -4.671 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -1.927 5.779 -3.555 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.797 4.352 -3.317 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -0.742 3.497 -3.578 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.613 3.256 -4.707 1.00 0.00 H new ATOM 1197 N LYS A 77 -3.031 6.002 -7.125 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.504 7.076 -7.991 1.00 0.00 C ATOM 1199 C LYS A 77 -4.343 8.079 -7.206 1.00 0.00 C ATOM 1200 O LYS A 77 -4.554 7.919 -6.004 1.00 0.00 O ATOM 1201 CB LYS A 77 -4.326 6.501 -9.147 1.00 0.00 C ATOM 1202 CG LYS A 77 -3.687 5.291 -9.806 1.00 0.00 C ATOM 1203 CD LYS A 77 -4.708 4.473 -10.579 1.00 0.00 C ATOM 1204 CE LYS A 77 -4.975 5.070 -11.952 1.00 0.00 C ATOM 1205 NZ LYS A 77 -6.361 4.787 -12.420 1.00 0.00 N ATOM 0 H LYS A 77 -3.773 5.444 -6.702 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.634 7.594 -8.394 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -5.313 6.224 -8.777 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.474 7.277 -9.898 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.896 5.618 -10.480 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -3.219 4.666 -9.045 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.348 3.450 -10.689 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -5.639 4.424 -10.015 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.817 6.148 -11.916 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -4.260 4.666 -12.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -6.504 5.210 -13.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -6.504 3.759 -12.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -7.044 5.194 -11.749 1.00 0.00 H new ATOM 1219 N ASP A 78 -4.819 9.111 -7.893 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.637 10.139 -7.260 1.00 0.00 C ATOM 1221 C ASP A 78 -7.115 9.927 -7.574 1.00 0.00 C ATOM 1222 O ASP A 78 -7.548 10.090 -8.715 1.00 0.00 O ATOM 1223 CB ASP A 78 -5.198 11.528 -7.726 1.00 0.00 C ATOM 1224 CG ASP A 78 -4.016 12.057 -6.938 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -3.892 11.705 -5.746 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -3.214 12.821 -7.513 1.00 0.00 O ATOM 0 H ASP A 78 -4.653 9.258 -8.889 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.499 10.066 -6.181 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.937 11.487 -8.783 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.034 12.221 -7.630 1.00 0.00 H new ATOM 1231 N PHE A 79 -7.884 9.561 -6.554 1.00 0.00 N ATOM 1232 CA PHE A 79 -9.313 9.324 -6.721 1.00 0.00 C ATOM 1233 C PHE A 79 -9.931 10.362 -7.654 1.00 0.00 C ATOM 1234 O PHE A 79 -10.797 10.042 -8.468 1.00 0.00 O ATOM 1235 CB PHE A 79 -10.019 9.357 -5.364 1.00 0.00 C ATOM 1236 CG PHE A 79 -11.492 9.072 -5.447 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -11.962 7.769 -5.411 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -12.406 10.107 -5.561 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -13.316 7.505 -5.488 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -13.762 9.849 -5.638 1.00 0.00 C ATOM 1241 CZ PHE A 79 -14.217 8.545 -5.601 1.00 0.00 C ATOM 0 H PHE A 79 -7.542 9.422 -5.603 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.443 8.338 -7.166 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -9.552 8.627 -4.703 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.872 10.337 -4.911 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -11.262 6.951 -5.322 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -12.055 11.128 -5.590 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -13.670 6.485 -5.460 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -14.464 10.665 -5.727 1.00 0.00 H new ATOM 0 HZ PHE A 79 -15.276 8.340 -5.660 1.00 0.00 H new ATOM 1378 N ILE A 88 0.175 8.355 -9.813 1.00 0.00 N ATOM 1379 CA ILE A 88 1.138 9.011 -8.938 1.00 0.00 C ATOM 1380 C ILE A 88 2.401 8.170 -8.781 1.00 0.00 C ATOM 1381 O ILE A 88 3.515 8.672 -8.919 1.00 0.00 O ATOM 1382 CB ILE A 88 0.539 9.283 -7.546 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.710 10.159 -7.666 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.572 9.945 -6.645 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.480 10.294 -6.371 1.00 0.00 C ATOM 0 HA ILE A 88 1.394 9.961 -9.406 1.00 0.00 H new ATOM 0 HB ILE A 88 0.251 8.332 -7.099 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.417 11.151 -8.010 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.367 9.739 -8.428 1.00 0.00 H new ATOM 0 HG21 ILE A 88 1.134 10.131 -5.664 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.435 9.288 -6.538 1.00 0.00 H new ATOM 0 HG23 ILE A 88 1.888 10.890 -7.087 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.352 10.928 -6.531 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.804 9.309 -6.036 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.839 10.743 -5.612 1.00 0.00 H new ATOM 1397 N GLY A 89 2.217 6.885 -8.491 1.00 0.00 N ATOM 1398 CA GLY A 89 3.350 5.994 -8.322 1.00 0.00 C ATOM 1399 C GLY A 89 2.927 4.555 -8.097 1.00 0.00 C ATOM 1400 O GLY A 89 1.968 4.287 -7.372 1.00 0.00 O ATOM 0 H GLY A 89 1.304 6.446 -8.370 1.00 0.00 H new ATOM 0 HA2 GLY A 89 3.986 6.049 -9.205 1.00 0.00 H new ATOM 0 HA3 GLY A 89 3.950 6.330 -7.476 1.00 0.00 H new ATOM 1404 N THR A 90 3.642 3.625 -8.723 1.00 0.00 N ATOM 1405 CA THR A 90 3.334 2.207 -8.590 1.00 0.00 C ATOM 1406 C THR A 90 4.527 1.435 -8.037 1.00 0.00 C ATOM 1407 O THR A 90 5.670 1.877 -8.148 1.00 0.00 O ATOM 1408 CB THR A 90 2.922 1.593 -9.941 1.00 0.00 C ATOM 1409 OG1 THR A 90 4.067 1.467 -10.792 1.00 0.00 O ATOM 1410 CG2 THR A 90 1.867 2.450 -10.625 1.00 0.00 C ATOM 0 H THR A 90 4.438 3.829 -9.327 1.00 0.00 H new ATOM 0 HA THR A 90 2.499 2.129 -7.894 1.00 0.00 H new ATOM 0 HB THR A 90 2.500 0.606 -9.753 1.00 0.00 H new ATOM 0 HG1 THR A 90 3.797 1.074 -11.648 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.591 1.997 -11.577 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.985 2.520 -9.988 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.267 3.448 -10.801 1.00 0.00 H new ATOM 1418 N ALA A 91 4.252 0.279 -7.441 1.00 0.00 N ATOM 1419 CA ALA A 91 5.304 -0.556 -6.873 1.00 0.00 C ATOM 1420 C ALA A 91 4.929 -2.032 -6.942 1.00 0.00 C ATOM 1421 O ALA A 91 3.794 -2.410 -6.649 1.00 0.00 O ATOM 1422 CB ALA A 91 5.583 -0.146 -5.435 1.00 0.00 C ATOM 0 H ALA A 91 3.311 -0.100 -7.339 1.00 0.00 H new ATOM 0 HA ALA A 91 6.209 -0.410 -7.463 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.370 -0.777 -5.023 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.902 0.896 -5.409 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.676 -0.262 -4.841 1.00 0.00 H new ATOM 1428 N THR A 92 5.890 -2.865 -7.330 1.00 0.00 N ATOM 1429 CA THR A 92 5.661 -4.300 -7.439 1.00 0.00 C ATOM 1430 C THR A 92 6.374 -5.057 -6.324 1.00 0.00 C ATOM 1431 O THR A 92 7.599 -5.009 -6.213 1.00 0.00 O ATOM 1432 CB THR A 92 6.136 -4.844 -8.799 1.00 0.00 C ATOM 1433 OG1 THR A 92 5.385 -4.239 -9.858 1.00 0.00 O ATOM 1434 CG2 THR A 92 5.983 -6.356 -8.861 1.00 0.00 C ATOM 0 H THR A 92 6.835 -2.570 -7.574 1.00 0.00 H new ATOM 0 HA THR A 92 4.586 -4.455 -7.350 1.00 0.00 H new ATOM 0 HB THR A 92 7.191 -4.597 -8.916 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.694 -4.589 -10.720 1.00 0.00 H new ATOM 0 HG21 THR A 92 6.325 -6.717 -9.831 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.579 -6.815 -8.072 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.935 -6.622 -8.724 1.00 0.00 H new ATOM 1442 N VAL A 93 5.600 -5.756 -5.500 1.00 0.00 N ATOM 1443 CA VAL A 93 6.159 -6.525 -4.395 1.00 0.00 C ATOM 1444 C VAL A 93 6.248 -8.006 -4.745 1.00 0.00 C ATOM 1445 O VAL A 93 5.241 -8.642 -5.054 1.00 0.00 O ATOM 1446 CB VAL A 93 5.317 -6.361 -3.115 1.00 0.00 C ATOM 1447 CG1 VAL A 93 6.135 -6.732 -1.887 1.00 0.00 C ATOM 1448 CG2 VAL A 93 4.789 -4.939 -3.004 1.00 0.00 C ATOM 0 H VAL A 93 4.584 -5.805 -5.577 1.00 0.00 H new ATOM 0 HA VAL A 93 7.161 -6.137 -4.214 1.00 0.00 H new ATOM 0 HB VAL A 93 4.464 -7.038 -3.172 1.00 0.00 H new ATOM 0 HG11 VAL A 93 5.524 -6.610 -0.992 1.00 0.00 H new ATOM 0 HG12 VAL A 93 6.460 -7.769 -1.966 1.00 0.00 H new ATOM 0 HG13 VAL A 93 7.008 -6.083 -1.821 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.197 -4.841 -2.094 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.626 -4.242 -2.969 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.165 -4.714 -3.869 1.00 0.00 H new ATOM 1458 N ALA A 94 7.460 -8.549 -4.693 1.00 0.00 N ATOM 1459 CA ALA A 94 7.680 -9.956 -5.003 1.00 0.00 C ATOM 1460 C ALA A 94 7.264 -10.846 -3.837 1.00 0.00 C ATOM 1461 O ALA A 94 7.804 -10.736 -2.735 1.00 0.00 O ATOM 1462 CB ALA A 94 9.140 -10.196 -5.358 1.00 0.00 C ATOM 0 H ALA A 94 8.304 -8.036 -4.439 1.00 0.00 H new ATOM 0 HA ALA A 94 7.061 -10.215 -5.862 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.290 -11.251 -5.587 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.407 -9.594 -6.227 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.771 -9.915 -4.515 1.00 0.00 H new ATOM 1468 N LEU A 95 6.302 -11.728 -4.085 1.00 0.00 N ATOM 1469 CA LEU A 95 5.813 -12.637 -3.055 1.00 0.00 C ATOM 1470 C LEU A 95 6.754 -13.826 -2.886 1.00 0.00 C ATOM 1471 O LEU A 95 6.543 -14.682 -2.027 1.00 0.00 O ATOM 1472 CB LEU A 95 4.408 -13.130 -3.407 1.00 0.00 C ATOM 1473 CG LEU A 95 3.337 -12.050 -3.563 1.00 0.00 C ATOM 1474 CD1 LEU A 95 2.095 -12.622 -4.228 1.00 0.00 C ATOM 1475 CD2 LEU A 95 2.990 -11.444 -2.212 1.00 0.00 C ATOM 0 H LEU A 95 5.845 -11.833 -4.991 1.00 0.00 H new ATOM 0 HA LEU A 95 5.774 -12.091 -2.112 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.465 -13.694 -4.338 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.084 -13.825 -2.633 1.00 0.00 H new ATOM 0 HG LEU A 95 3.735 -11.261 -4.201 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.344 -11.839 -4.331 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.355 -13.007 -5.214 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.695 -13.431 -3.617 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.226 -10.677 -2.342 1.00 0.00 H new ATOM 0 HD22 LEU A 95 2.613 -12.223 -1.550 1.00 0.00 H new ATOM 0 HD23 LEU A 95 3.882 -10.996 -1.774 1.00 0.00 H new ATOM 1487 N LYS A 96 7.794 -13.871 -3.712 1.00 0.00 N ATOM 1488 CA LYS A 96 8.771 -14.952 -3.653 1.00 0.00 C ATOM 1489 C LYS A 96 9.439 -15.009 -2.283 1.00 0.00 C ATOM 1490 O LYS A 96 10.035 -16.020 -1.913 1.00 0.00 O ATOM 1491 CB LYS A 96 9.831 -14.769 -4.741 1.00 0.00 C ATOM 1492 CG LYS A 96 10.836 -13.673 -4.433 1.00 0.00 C ATOM 1493 CD LYS A 96 12.100 -13.826 -5.264 1.00 0.00 C ATOM 1494 CE LYS A 96 13.308 -13.237 -4.553 1.00 0.00 C ATOM 1495 NZ LYS A 96 14.557 -13.408 -5.346 1.00 0.00 N ATOM 0 H LYS A 96 7.982 -13.171 -4.430 1.00 0.00 H new ATOM 0 HA LYS A 96 8.245 -15.892 -3.820 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.363 -15.710 -4.880 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.335 -14.541 -5.685 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.386 -12.700 -4.629 1.00 0.00 H new ATOM 0 HG3 LYS A 96 11.091 -13.699 -3.373 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.276 -14.882 -5.469 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.966 -13.332 -6.226 1.00 0.00 H new ATOM 0 HE2 LYS A 96 13.138 -12.176 -4.367 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.427 -13.716 -3.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 15.357 -12.993 -4.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 14.733 -14.421 -5.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 14.454 -12.929 -6.263 1.00 0.00 H new ATOM 1509 N ASP A 97 9.334 -13.917 -1.533 1.00 0.00 N ATOM 1510 CA ASP A 97 9.925 -13.843 -0.202 1.00 0.00 C ATOM 1511 C ASP A 97 8.990 -14.443 0.842 1.00 0.00 C ATOM 1512 O ASP A 97 9.424 -14.847 1.922 1.00 0.00 O ATOM 1513 CB ASP A 97 10.246 -12.391 0.157 1.00 0.00 C ATOM 1514 CG ASP A 97 11.483 -11.879 -0.555 1.00 0.00 C ATOM 1515 OD1 ASP A 97 12.397 -12.689 -0.812 1.00 0.00 O ATOM 1516 OD2 ASP A 97 11.537 -10.667 -0.853 1.00 0.00 O ATOM 0 H ASP A 97 8.845 -13.071 -1.825 1.00 0.00 H new ATOM 0 HA ASP A 97 10.850 -14.420 -0.210 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.395 -11.760 -0.099 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.390 -12.309 1.234 1.00 0.00 H new ATOM 1521 N LEU A 98 7.704 -14.499 0.515 1.00 0.00 N ATOM 1522 CA LEU A 98 6.705 -15.050 1.425 1.00 0.00 C ATOM 1523 C LEU A 98 6.517 -16.545 1.187 1.00 0.00 C ATOM 1524 O LEU A 98 6.195 -17.296 2.109 1.00 0.00 O ATOM 1525 CB LEU A 98 5.371 -14.322 1.251 1.00 0.00 C ATOM 1526 CG LEU A 98 5.413 -12.800 1.394 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.305 -12.157 0.576 1.00 0.00 C ATOM 1528 CD2 LEU A 98 5.300 -12.399 2.857 1.00 0.00 C ATOM 0 H LEU A 98 7.328 -14.170 -0.374 1.00 0.00 H new ATOM 0 HA LEU A 98 7.060 -14.905 2.445 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.974 -14.563 0.265 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.667 -14.716 1.983 1.00 0.00 H new ATOM 0 HG LEU A 98 6.371 -12.444 1.014 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.350 -11.074 0.690 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.431 -12.417 -0.475 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.338 -12.518 0.926 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.332 -11.313 2.940 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.358 -12.767 3.263 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.130 -12.830 3.418 1.00 0.00 H new ATOM 1540 N THR A 99 6.722 -16.972 -0.055 1.00 0.00 N ATOM 1541 CA THR A 99 6.576 -18.376 -0.414 1.00 0.00 C ATOM 1542 C THR A 99 7.162 -19.283 0.662 1.00 0.00 C ATOM 1543 O THR A 99 8.093 -18.901 1.369 1.00 0.00 O ATOM 1544 CB THR A 99 7.261 -18.687 -1.759 1.00 0.00 C ATOM 1545 OG1 THR A 99 8.657 -18.377 -1.680 1.00 0.00 O ATOM 1546 CG2 THR A 99 6.622 -17.891 -2.887 1.00 0.00 C ATOM 0 H THR A 99 6.990 -16.365 -0.829 1.00 0.00 H new ATOM 0 HA THR A 99 5.507 -18.568 -0.506 1.00 0.00 H new ATOM 0 HB THR A 99 7.137 -19.749 -1.969 1.00 0.00 H new ATOM 0 HG1 THR A 99 8.780 -17.406 -1.736 1.00 0.00 H new ATOM 0 HG21 THR A 99 7.121 -18.126 -3.827 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.566 -18.150 -2.962 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.720 -16.825 -2.681 1.00 0.00 H new ATOM 1554 N GLY A 100 6.609 -20.487 0.781 1.00 0.00 N ATOM 1555 CA GLY A 100 7.091 -21.429 1.774 1.00 0.00 C ATOM 1556 C GLY A 100 6.003 -22.365 2.261 1.00 0.00 C ATOM 1557 O GLY A 100 4.876 -22.329 1.765 1.00 0.00 O ATOM 0 H GLY A 100 5.836 -20.826 0.208 1.00 0.00 H new ATOM 0 HA2 GLY A 100 7.906 -22.014 1.349 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.501 -20.880 2.622 1.00 0.00 H new ATOM 1561 N ASP A 101 6.339 -23.207 3.232 1.00 0.00 N ATOM 1562 CA ASP A 101 5.382 -24.158 3.785 1.00 0.00 C ATOM 1563 C ASP A 101 4.882 -23.694 5.150 1.00 0.00 C ATOM 1564 O ASP A 101 4.710 -24.499 6.064 1.00 0.00 O ATOM 1565 CB ASP A 101 6.019 -25.543 3.906 1.00 0.00 C ATOM 1566 CG ASP A 101 5.020 -26.605 4.323 1.00 0.00 C ATOM 1567 OD1 ASP A 101 3.933 -26.670 3.712 1.00 0.00 O ATOM 1568 OD2 ASP A 101 5.326 -27.371 5.260 1.00 0.00 O ATOM 0 H ASP A 101 7.267 -23.250 3.653 1.00 0.00 H new ATOM 0 HA ASP A 101 4.531 -24.216 3.106 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.462 -25.821 2.950 1.00 0.00 H new ATOM 0 HB3 ASP A 101 6.829 -25.505 4.634 1.00 0.00 H new ATOM 1573 N GLN A 102 4.652 -22.391 5.278 1.00 0.00 N ATOM 1574 CA GLN A 102 4.174 -21.820 6.532 1.00 0.00 C ATOM 1575 C GLN A 102 3.868 -20.334 6.372 1.00 0.00 C ATOM 1576 O GLN A 102 4.569 -19.620 5.655 1.00 0.00 O ATOM 1577 CB GLN A 102 5.211 -22.024 7.638 1.00 0.00 C ATOM 1578 CG GLN A 102 6.489 -21.228 7.427 1.00 0.00 C ATOM 1579 CD GLN A 102 7.653 -21.770 8.232 1.00 0.00 C ATOM 1580 OE1 GLN A 102 7.672 -21.674 9.460 1.00 0.00 O ATOM 1581 NE2 GLN A 102 8.633 -22.344 7.544 1.00 0.00 N ATOM 0 H GLN A 102 4.789 -21.712 4.530 1.00 0.00 H new ATOM 0 HA GLN A 102 3.253 -22.334 6.808 1.00 0.00 H new ATOM 0 HB2 GLN A 102 4.771 -21.742 8.594 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.459 -23.084 7.701 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.748 -21.238 6.368 1.00 0.00 H new ATOM 0 HG3 GLN A 102 6.315 -20.188 7.703 1.00 0.00 H new ATOM 0 HE21 GLN A 102 8.576 -22.402 6.527 1.00 0.00 H new ATOM 0 HE22 GLN A 102 9.443 -22.727 8.032 1.00 0.00 H new ATOM 1590 N SER A 103 2.817 -19.876 7.044 1.00 0.00 N ATOM 1591 CA SER A 103 2.416 -18.476 6.973 1.00 0.00 C ATOM 1592 C SER A 103 3.590 -17.557 7.299 1.00 0.00 C ATOM 1593 O SER A 103 4.317 -17.781 8.267 1.00 0.00 O ATOM 1594 CB SER A 103 1.260 -18.205 7.937 1.00 0.00 C ATOM 1595 OG SER A 103 0.998 -16.816 8.043 1.00 0.00 O ATOM 0 H SER A 103 2.228 -20.454 7.644 1.00 0.00 H new ATOM 0 HA SER A 103 2.087 -18.270 5.955 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.365 -18.722 7.590 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.500 -18.609 8.920 1.00 0.00 H new ATOM 0 HG SER A 103 0.950 -16.423 7.147 1.00 0.00 H new ATOM 1601 N ARG A 104 3.769 -16.523 6.483 1.00 0.00 N ATOM 1602 CA ARG A 104 4.854 -15.571 6.683 1.00 0.00 C ATOM 1603 C ARG A 104 4.408 -14.156 6.328 1.00 0.00 C ATOM 1604 O ARG A 104 4.027 -13.881 5.190 1.00 0.00 O ATOM 1605 CB ARG A 104 6.067 -15.963 5.837 1.00 0.00 C ATOM 1606 CG ARG A 104 7.374 -15.368 6.334 1.00 0.00 C ATOM 1607 CD ARG A 104 8.397 -15.257 5.214 1.00 0.00 C ATOM 1608 NE ARG A 104 9.714 -14.869 5.712 1.00 0.00 N ATOM 1609 CZ ARG A 104 10.495 -15.672 6.426 1.00 0.00 C ATOM 1610 NH1 ARG A 104 10.094 -16.900 6.724 1.00 0.00 N ATOM 1611 NH2 ARG A 104 11.681 -15.247 6.843 1.00 0.00 N ATOM 0 H ARG A 104 3.176 -16.324 5.677 1.00 0.00 H new ATOM 0 HA ARG A 104 5.133 -15.592 7.737 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.154 -17.049 5.824 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.900 -15.644 4.808 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.188 -14.381 6.757 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.776 -15.988 7.135 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.473 -16.213 4.696 1.00 0.00 H new ATOM 0 HD3 ARG A 104 8.056 -14.524 4.483 1.00 0.00 H new ATOM 0 HE ARG A 104 10.052 -13.930 5.500 1.00 0.00 H new ATOM 0 HH11 ARG A 104 9.183 -17.231 6.405 1.00 0.00 H new ATOM 0 HH12 ARG A 104 10.696 -17.514 7.272 1.00 0.00 H new ATOM 0 HH21 ARG A 104 11.993 -14.303 6.615 1.00 0.00 H new ATOM 0 HH22 ARG A 104 12.280 -15.864 7.391 1.00 0.00 H new ATOM 1625 N SER A 105 4.458 -13.261 7.309 1.00 0.00 N ATOM 1626 CA SER A 105 4.055 -11.875 7.101 1.00 0.00 C ATOM 1627 C SER A 105 5.248 -10.935 7.249 1.00 0.00 C ATOM 1628 O SER A 105 5.721 -10.682 8.358 1.00 0.00 O ATOM 1629 CB SER A 105 2.959 -11.486 8.095 1.00 0.00 C ATOM 1630 OG SER A 105 3.356 -11.763 9.427 1.00 0.00 O ATOM 0 H SER A 105 4.774 -13.471 8.256 1.00 0.00 H new ATOM 0 HA SER A 105 3.665 -11.784 6.087 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.732 -10.425 7.993 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.044 -12.032 7.864 1.00 0.00 H new ATOM 0 HG SER A 105 4.293 -11.502 9.550 1.00 0.00 H new ATOM 1636 N LEU A 106 5.729 -10.419 6.123 1.00 0.00 N ATOM 1637 CA LEU A 106 6.867 -9.506 6.125 1.00 0.00 C ATOM 1638 C LEU A 106 6.413 -8.070 5.884 1.00 0.00 C ATOM 1639 O LEU A 106 5.781 -7.754 4.876 1.00 0.00 O ATOM 1640 CB LEU A 106 7.880 -9.919 5.056 1.00 0.00 C ATOM 1641 CG LEU A 106 8.622 -11.233 5.306 1.00 0.00 C ATOM 1642 CD1 LEU A 106 9.169 -11.793 4.003 1.00 0.00 C ATOM 1643 CD2 LEU A 106 9.744 -11.027 6.313 1.00 0.00 C ATOM 0 H LEU A 106 5.349 -10.617 5.197 1.00 0.00 H new ATOM 0 HA LEU A 106 7.341 -9.558 7.105 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.360 -9.995 4.101 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.617 -9.122 4.955 1.00 0.00 H new ATOM 0 HG LEU A 106 7.917 -11.954 5.719 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.694 -12.728 4.201 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.346 -11.978 3.312 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.860 -11.076 3.560 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.262 -11.972 6.479 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.449 -10.290 5.927 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.327 -10.671 7.255 1.00 0.00 H new ATOM 1655 N PRO A 107 6.744 -7.178 6.829 1.00 0.00 N ATOM 1656 CA PRO A 107 6.383 -5.760 6.741 1.00 0.00 C ATOM 1657 C PRO A 107 7.155 -5.032 5.645 1.00 0.00 C ATOM 1658 O PRO A 107 8.336 -4.722 5.806 1.00 0.00 O ATOM 1659 CB PRO A 107 6.763 -5.210 8.118 1.00 0.00 C ATOM 1660 CG PRO A 107 7.830 -6.126 8.610 1.00 0.00 C ATOM 1661 CD PRO A 107 7.497 -7.484 8.057 1.00 0.00 C ATOM 0 HA PRO A 107 5.332 -5.623 6.488 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.123 -4.184 8.049 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.906 -5.202 8.792 1.00 0.00 H new ATOM 0 HG2 PRO A 107 8.813 -5.797 8.272 1.00 0.00 H new ATOM 0 HG3 PRO A 107 7.857 -6.144 9.700 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.396 -8.062 7.843 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.901 -8.068 8.758 1.00 0.00 H new ATOM 1669 N TYR A 108 6.481 -4.763 4.532 1.00 0.00 N ATOM 1670 CA TYR A 108 7.105 -4.074 3.409 1.00 0.00 C ATOM 1671 C TYR A 108 6.963 -2.561 3.552 1.00 0.00 C ATOM 1672 O TYR A 108 5.909 -1.994 3.260 1.00 0.00 O ATOM 1673 CB TYR A 108 6.481 -4.534 2.091 1.00 0.00 C ATOM 1674 CG TYR A 108 6.960 -5.895 1.637 1.00 0.00 C ATOM 1675 CD1 TYR A 108 8.111 -6.028 0.870 1.00 0.00 C ATOM 1676 CD2 TYR A 108 6.261 -7.047 1.974 1.00 0.00 C ATOM 1677 CE1 TYR A 108 8.552 -7.268 0.453 1.00 0.00 C ATOM 1678 CE2 TYR A 108 6.695 -8.292 1.562 1.00 0.00 C ATOM 1679 CZ TYR A 108 7.841 -8.398 0.802 1.00 0.00 C ATOM 1680 OH TYR A 108 8.276 -9.636 0.388 1.00 0.00 O ATOM 0 H TYR A 108 5.503 -5.012 4.384 1.00 0.00 H new ATOM 0 HA TYR A 108 8.166 -4.323 3.407 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.397 -4.558 2.201 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.707 -3.801 1.316 1.00 0.00 H new ATOM 0 HD1 TYR A 108 8.670 -5.146 0.595 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.363 -6.968 2.568 1.00 0.00 H new ATOM 0 HE1 TYR A 108 9.449 -7.353 -0.143 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.140 -9.178 1.834 1.00 0.00 H new ATOM 0 HH TYR A 108 7.663 -10.326 0.719 1.00 0.00 H new ATOM 1690 N LYS A 109 8.032 -1.913 4.001 1.00 0.00 N ATOM 1691 CA LYS A 109 8.030 -0.466 4.182 1.00 0.00 C ATOM 1692 C LYS A 109 9.138 0.186 3.360 1.00 0.00 C ATOM 1693 O LYS A 109 9.985 -0.500 2.787 1.00 0.00 O ATOM 1694 CB LYS A 109 8.203 -0.115 5.661 1.00 0.00 C ATOM 1695 CG LYS A 109 7.439 -1.035 6.598 1.00 0.00 C ATOM 1696 CD LYS A 109 7.115 -0.347 7.913 1.00 0.00 C ATOM 1697 CE LYS A 109 6.826 -1.357 9.014 1.00 0.00 C ATOM 1698 NZ LYS A 109 8.061 -1.740 9.752 1.00 0.00 N ATOM 0 H LYS A 109 8.912 -2.367 4.247 1.00 0.00 H new ATOM 0 HA LYS A 109 7.070 -0.083 3.835 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.263 -0.152 5.913 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.873 0.911 5.823 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.515 -1.359 6.118 1.00 0.00 H new ATOM 0 HG3 LYS A 109 8.029 -1.931 6.791 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.951 0.286 8.209 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.252 0.306 7.781 1.00 0.00 H new ATOM 0 HE2 LYS A 109 6.102 -0.937 9.712 1.00 0.00 H new ATOM 0 HE3 LYS A 109 6.371 -2.247 8.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 7.823 -2.429 10.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 8.743 -2.164 9.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 8.481 -0.894 10.188 1.00 0.00 H new ATOM 1712 N LEU A 110 9.127 1.513 3.310 1.00 0.00 N ATOM 1713 CA LEU A 110 10.132 2.259 2.560 1.00 0.00 C ATOM 1714 C LEU A 110 10.124 1.855 1.089 1.00 0.00 C ATOM 1715 O LEU A 110 11.179 1.709 0.470 1.00 0.00 O ATOM 1716 CB LEU A 110 11.520 2.024 3.158 1.00 0.00 C ATOM 1717 CG LEU A 110 11.648 2.243 4.665 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.845 1.485 5.216 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.764 3.728 4.980 1.00 0.00 C ATOM 0 H LEU A 110 8.433 2.095 3.780 1.00 0.00 H new ATOM 0 HA LEU A 110 9.889 3.319 2.628 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.822 1.001 2.933 1.00 0.00 H new ATOM 0 HB3 LEU A 110 12.227 2.683 2.654 1.00 0.00 H new ATOM 0 HG LEU A 110 10.749 1.858 5.146 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.919 1.654 6.290 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.721 0.419 5.024 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.754 1.838 4.730 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.854 3.865 6.058 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.646 4.137 4.487 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.875 4.247 4.621 1.00 0.00 H new ATOM 1731 N ILE A 111 8.929 1.678 0.535 1.00 0.00 N ATOM 1732 CA ILE A 111 8.785 1.295 -0.863 1.00 0.00 C ATOM 1733 C ILE A 111 8.848 2.514 -1.777 1.00 0.00 C ATOM 1734 O ILE A 111 8.035 3.431 -1.661 1.00 0.00 O ATOM 1735 CB ILE A 111 7.459 0.550 -1.109 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.387 -0.708 -0.242 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.317 0.194 -2.581 1.00 0.00 C ATOM 1738 CD1 ILE A 111 6.063 -1.433 -0.339 1.00 0.00 C ATOM 0 H ILE A 111 8.047 1.794 1.034 1.00 0.00 H new ATOM 0 HA ILE A 111 9.615 0.628 -1.094 1.00 0.00 H new ATOM 0 HB ILE A 111 6.634 1.206 -0.833 1.00 0.00 H new ATOM 0 HG12 ILE A 111 8.187 -1.388 -0.535 1.00 0.00 H new ATOM 0 HG13 ILE A 111 7.567 -0.434 0.798 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.375 -0.332 -2.739 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.328 1.106 -3.179 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.146 -0.447 -2.882 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.083 -2.315 0.302 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.260 -0.769 -0.018 1.00 0.00 H new ATOM 0 HD13 ILE A 111 5.890 -1.738 -1.371 1.00 0.00 H new ATOM 1750 N SER A 112 9.817 2.517 -2.686 1.00 0.00 N ATOM 1751 CA SER A 112 9.987 3.625 -3.619 1.00 0.00 C ATOM 1752 C SER A 112 9.022 3.499 -4.794 1.00 0.00 C ATOM 1753 O SER A 112 9.144 2.591 -5.618 1.00 0.00 O ATOM 1754 CB SER A 112 11.428 3.671 -4.131 1.00 0.00 C ATOM 1755 OG SER A 112 12.250 4.442 -3.271 1.00 0.00 O ATOM 0 H SER A 112 10.497 1.765 -2.797 1.00 0.00 H new ATOM 0 HA SER A 112 9.767 4.551 -3.089 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.823 2.658 -4.206 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.447 4.095 -5.135 1.00 0.00 H new ATOM 0 HG SER A 112 13.166 4.455 -3.619 1.00 0.00 H new ATOM 1761 N LEU A 113 8.063 4.415 -4.864 1.00 0.00 N ATOM 1762 CA LEU A 113 7.076 4.409 -5.938 1.00 0.00 C ATOM 1763 C LEU A 113 7.644 5.042 -7.204 1.00 0.00 C ATOM 1764 O LEU A 113 8.413 6.002 -7.140 1.00 0.00 O ATOM 1765 CB LEU A 113 5.815 5.156 -5.502 1.00 0.00 C ATOM 1766 CG LEU A 113 5.137 4.644 -4.230 1.00 0.00 C ATOM 1767 CD1 LEU A 113 4.006 5.574 -3.817 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.617 3.228 -4.436 1.00 0.00 C ATOM 0 H LEU A 113 7.948 5.172 -4.190 1.00 0.00 H new ATOM 0 HA LEU A 113 6.820 3.372 -6.157 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.071 6.205 -5.356 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.092 5.114 -6.317 1.00 0.00 H new ATOM 0 HG LEU A 113 5.876 4.626 -3.429 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.535 5.194 -2.910 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.405 6.571 -3.628 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.266 5.625 -4.616 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.138 2.880 -3.521 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.893 3.221 -5.250 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.448 2.568 -4.684 1.00 0.00 H new ATOM 1780 N LEU A 114 7.259 4.500 -8.354 1.00 0.00 N ATOM 1781 CA LEU A 114 7.728 5.013 -9.637 1.00 0.00 C ATOM 1782 C LEU A 114 6.553 5.382 -10.538 1.00 0.00 C ATOM 1783 O LEU A 114 5.454 4.850 -10.390 1.00 0.00 O ATOM 1784 CB LEU A 114 8.611 3.976 -10.331 1.00 0.00 C ATOM 1785 CG LEU A 114 9.446 3.082 -9.413 1.00 0.00 C ATOM 1786 CD1 LEU A 114 10.102 1.965 -10.208 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.494 3.904 -8.678 1.00 0.00 C ATOM 0 H LEU A 114 6.623 3.705 -8.425 1.00 0.00 H new ATOM 0 HA LEU A 114 8.314 5.912 -9.449 1.00 0.00 H new ATOM 0 HB2 LEU A 114 7.974 3.339 -10.945 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.286 4.498 -11.008 1.00 0.00 H new ATOM 0 HG LEU A 114 8.783 2.632 -8.674 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.692 1.339 -9.538 1.00 0.00 H new ATOM 0 HD12 LEU A 114 9.333 1.359 -10.687 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.752 2.394 -10.970 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.079 3.252 -8.029 1.00 0.00 H new ATOM 0 HD22 LEU A 114 11.154 4.383 -9.401 1.00 0.00 H new ATOM 0 HD23 LEU A 114 10.001 4.667 -8.076 1.00 0.00 H new ATOM 1799 N ASN A 115 6.795 6.296 -11.472 1.00 0.00 N ATOM 1800 CA ASN A 115 5.758 6.736 -12.398 1.00 0.00 C ATOM 1801 C ASN A 115 5.703 5.828 -13.623 1.00 0.00 C ATOM 1802 O ASN A 115 6.412 4.825 -13.696 1.00 0.00 O ATOM 1803 CB ASN A 115 6.011 8.181 -12.831 1.00 0.00 C ATOM 1804 CG ASN A 115 7.488 8.493 -12.971 1.00 0.00 C ATOM 1805 OD1 ASN A 115 8.283 7.631 -13.346 1.00 0.00 O ATOM 1806 ND2 ASN A 115 7.863 9.731 -12.669 1.00 0.00 N ATOM 0 H ASN A 115 7.700 6.746 -11.608 1.00 0.00 H new ATOM 0 HA ASN A 115 4.799 6.681 -11.883 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.512 8.365 -13.782 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.567 8.859 -12.102 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.844 9.999 -12.744 1.00 0.00 H new ATOM 0 HD22 ASN A 115 7.170 10.413 -12.362 1.00 0.00 H new ATOM 1813 N GLU A 116 4.858 6.190 -14.583 1.00 0.00 N ATOM 1814 CA GLU A 116 4.711 5.408 -15.805 1.00 0.00 C ATOM 1815 C GLU A 116 6.014 5.390 -16.600 1.00 0.00 C ATOM 1816 O GLU A 116 6.188 4.581 -17.511 1.00 0.00 O ATOM 1817 CB GLU A 116 3.582 5.976 -16.668 1.00 0.00 C ATOM 1818 CG GLU A 116 3.934 7.293 -17.340 1.00 0.00 C ATOM 1819 CD GLU A 116 2.872 7.749 -18.322 1.00 0.00 C ATOM 1820 OE1 GLU A 116 2.370 6.900 -19.088 1.00 0.00 O ATOM 1821 OE2 GLU A 116 2.544 8.954 -18.325 1.00 0.00 O ATOM 0 H GLU A 116 4.265 7.019 -14.538 1.00 0.00 H new ATOM 0 HA GLU A 116 4.463 4.385 -15.523 1.00 0.00 H new ATOM 0 HB2 GLU A 116 3.319 5.246 -17.433 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.698 6.120 -16.047 1.00 0.00 H new ATOM 0 HG2 GLU A 116 4.072 8.060 -16.578 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.885 7.187 -17.862 1.00 0.00 H new ATOM 1828 N LYS A 117 6.927 6.289 -16.247 1.00 0.00 N ATOM 1829 CA LYS A 117 8.215 6.377 -16.925 1.00 0.00 C ATOM 1830 C LYS A 117 9.234 5.442 -16.282 1.00 0.00 C ATOM 1831 O LYS A 117 10.113 4.908 -16.956 1.00 0.00 O ATOM 1832 CB LYS A 117 8.734 7.817 -16.890 1.00 0.00 C ATOM 1833 CG LYS A 117 7.701 8.847 -17.312 1.00 0.00 C ATOM 1834 CD LYS A 117 6.791 9.228 -16.156 1.00 0.00 C ATOM 1835 CE LYS A 117 6.295 10.661 -16.287 1.00 0.00 C ATOM 1836 NZ LYS A 117 5.823 11.205 -14.983 1.00 0.00 N ATOM 0 H LYS A 117 6.799 6.967 -15.496 1.00 0.00 H new ATOM 0 HA LYS A 117 8.074 6.072 -17.962 1.00 0.00 H new ATOM 0 HB2 LYS A 117 9.073 8.048 -15.880 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.603 7.897 -17.544 1.00 0.00 H new ATOM 0 HG2 LYS A 117 8.205 9.737 -17.688 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.103 8.449 -18.132 1.00 0.00 H new ATOM 0 HD2 LYS A 117 5.939 8.549 -16.122 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.328 9.112 -15.215 1.00 0.00 H new ATOM 0 HE2 LYS A 117 7.097 11.289 -16.674 1.00 0.00 H new ATOM 0 HE3 LYS A 117 5.482 10.699 -17.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 4.830 11.503 -15.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 5.901 10.470 -14.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 6.408 12.023 -14.716 1.00 0.00 H new ATOM 1850 N GLY A 118 9.108 5.248 -14.972 1.00 0.00 N ATOM 1851 CA GLY A 118 10.024 4.376 -14.260 1.00 0.00 C ATOM 1852 C GLY A 118 11.002 5.146 -13.394 1.00 0.00 C ATOM 1853 O GLY A 118 12.023 4.605 -12.970 1.00 0.00 O ATOM 0 H GLY A 118 8.388 5.679 -14.392 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.454 3.688 -13.636 1.00 0.00 H new ATOM 0 HA3 GLY A 118 10.577 3.771 -14.978 1.00 0.00 H new ATOM 1857 N GLN A 119 10.689 6.410 -13.131 1.00 0.00 N ATOM 1858 CA GLN A 119 11.550 7.255 -12.312 1.00 0.00 C ATOM 1859 C GLN A 119 11.134 7.195 -10.845 1.00 0.00 C ATOM 1860 O GLN A 119 10.074 6.666 -10.512 1.00 0.00 O ATOM 1861 CB GLN A 119 11.503 8.701 -12.808 1.00 0.00 C ATOM 1862 CG GLN A 119 12.372 8.953 -14.030 1.00 0.00 C ATOM 1863 CD GLN A 119 13.844 9.066 -13.686 1.00 0.00 C ATOM 1864 OE1 GLN A 119 14.343 8.365 -12.805 1.00 0.00 O ATOM 1865 NE2 GLN A 119 14.548 9.951 -14.381 1.00 0.00 N ATOM 0 H GLN A 119 9.846 6.872 -13.473 1.00 0.00 H new ATOM 0 HA GLN A 119 12.571 6.882 -12.398 1.00 0.00 H new ATOM 0 HB2 GLN A 119 10.472 8.962 -13.046 1.00 0.00 H new ATOM 0 HB3 GLN A 119 11.822 9.363 -12.003 1.00 0.00 H new ATOM 0 HG2 GLN A 119 12.231 8.142 -14.745 1.00 0.00 H new ATOM 0 HG3 GLN A 119 12.046 9.870 -14.520 1.00 0.00 H new ATOM 0 HE21 GLN A 119 14.094 10.511 -15.102 1.00 0.00 H new ATOM 0 HE22 GLN A 119 15.543 10.071 -14.194 1.00 0.00 H new ATOM 1874 N ASP A 120 11.977 7.739 -9.974 1.00 0.00 N ATOM 1875 CA ASP A 120 11.697 7.748 -8.543 1.00 0.00 C ATOM 1876 C ASP A 120 10.769 8.903 -8.178 1.00 0.00 C ATOM 1877 O ASP A 120 11.218 10.028 -7.955 1.00 0.00 O ATOM 1878 CB ASP A 120 12.999 7.853 -7.748 1.00 0.00 C ATOM 1879 CG ASP A 120 14.011 6.799 -8.153 1.00 0.00 C ATOM 1880 OD1 ASP A 120 13.791 5.611 -7.835 1.00 0.00 O ATOM 1881 OD2 ASP A 120 15.023 7.162 -8.788 1.00 0.00 O ATOM 0 H ASP A 120 12.860 8.179 -10.234 1.00 0.00 H new ATOM 0 HA ASP A 120 11.200 6.812 -8.289 1.00 0.00 H new ATOM 0 HB2 ASP A 120 13.432 8.843 -7.894 1.00 0.00 H new ATOM 0 HB3 ASP A 120 12.781 7.754 -6.685 1.00 0.00 H new ATOM 1886 N THR A 121 9.472 8.618 -8.120 1.00 0.00 N ATOM 1887 CA THR A 121 8.481 9.632 -7.784 1.00 0.00 C ATOM 1888 C THR A 121 8.832 10.333 -6.477 1.00 0.00 C ATOM 1889 O THR A 121 8.637 11.540 -6.336 1.00 0.00 O ATOM 1890 CB THR A 121 7.071 9.022 -7.663 1.00 0.00 C ATOM 1891 OG1 THR A 121 7.029 8.100 -6.569 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.678 8.310 -8.949 1.00 0.00 C ATOM 0 H THR A 121 9.083 7.693 -8.302 1.00 0.00 H new ATOM 0 HA THR A 121 8.486 10.359 -8.596 1.00 0.00 H new ATOM 0 HB THR A 121 6.363 9.831 -7.483 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.789 7.485 -6.630 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.679 7.887 -8.840 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.683 9.021 -9.775 1.00 0.00 H new ATOM 0 HG23 THR A 121 7.390 7.511 -9.154 1.00 0.00 H new ATOM 1900 N GLY A 122 9.353 9.568 -5.522 1.00 0.00 N ATOM 1901 CA GLY A 122 9.724 10.135 -4.238 1.00 0.00 C ATOM 1902 C GLY A 122 8.665 9.909 -3.177 1.00 0.00 C ATOM 1903 O GLY A 122 8.630 10.611 -2.167 1.00 0.00 O ATOM 0 H GLY A 122 9.525 8.567 -5.614 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.665 9.694 -3.908 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.896 11.205 -4.353 1.00 0.00 H new ATOM 1907 N ALA A 123 7.798 8.928 -3.407 1.00 0.00 N ATOM 1908 CA ALA A 123 6.734 8.612 -2.463 1.00 0.00 C ATOM 1909 C ALA A 123 6.944 7.237 -1.839 1.00 0.00 C ATOM 1910 O ALA A 123 7.209 6.259 -2.539 1.00 0.00 O ATOM 1911 CB ALA A 123 5.379 8.679 -3.153 1.00 0.00 C ATOM 0 H ALA A 123 7.812 8.339 -4.239 1.00 0.00 H new ATOM 0 HA ALA A 123 6.760 9.353 -1.664 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.593 8.441 -2.436 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.220 9.683 -3.545 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.352 7.961 -3.973 1.00 0.00 H new ATOM 1917 N THR A 124 6.825 7.168 -0.516 1.00 0.00 N ATOM 1918 CA THR A 124 7.004 5.913 0.203 1.00 0.00 C ATOM 1919 C THR A 124 5.707 5.473 0.872 1.00 0.00 C ATOM 1920 O THR A 124 5.056 6.258 1.562 1.00 0.00 O ATOM 1921 CB THR A 124 8.106 6.031 1.273 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.698 6.945 2.297 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.412 6.504 0.654 1.00 0.00 C ATOM 0 H THR A 124 6.605 7.967 0.079 1.00 0.00 H new ATOM 0 HA THR A 124 7.301 5.166 -0.533 1.00 0.00 H new ATOM 0 HB THR A 124 8.266 5.045 1.710 1.00 0.00 H new ATOM 0 HG1 THR A 124 6.720 6.962 2.349 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.175 6.580 1.428 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.734 5.791 -0.105 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.264 7.481 0.194 1.00 0.00 H new ATOM 1931 N ILE A 125 5.336 4.214 0.663 1.00 0.00 N ATOM 1932 CA ILE A 125 4.117 3.670 1.247 1.00 0.00 C ATOM 1933 C ILE A 125 4.415 2.430 2.084 1.00 0.00 C ATOM 1934 O ILE A 125 5.099 1.513 1.631 1.00 0.00 O ATOM 1935 CB ILE A 125 3.085 3.308 0.163 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.802 2.778 0.806 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.666 2.282 -0.799 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.558 3.058 -0.009 1.00 0.00 C ATOM 0 H ILE A 125 5.863 3.552 0.093 1.00 0.00 H new ATOM 0 HA ILE A 125 3.700 4.447 1.888 1.00 0.00 H new ATOM 0 HB ILE A 125 2.841 4.208 -0.401 1.00 0.00 H new ATOM 0 HG12 ILE A 125 1.896 1.702 0.953 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.688 3.225 1.793 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.925 2.036 -1.560 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.554 2.694 -1.278 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.935 1.380 -0.250 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.313 2.654 0.507 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.439 4.134 -0.134 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.651 2.587 -0.988 1.00 0.00 H new ATOM 1950 N ASP A 126 3.895 2.409 3.306 1.00 0.00 N ATOM 1951 CA ASP A 126 4.102 1.280 4.206 1.00 0.00 C ATOM 1952 C ASP A 126 2.993 0.245 4.043 1.00 0.00 C ATOM 1953 O ASP A 126 1.808 0.568 4.144 1.00 0.00 O ATOM 1954 CB ASP A 126 4.159 1.761 5.657 1.00 0.00 C ATOM 1955 CG ASP A 126 3.349 3.023 5.881 1.00 0.00 C ATOM 1956 OD1 ASP A 126 3.793 4.100 5.430 1.00 0.00 O ATOM 1957 OD2 ASP A 126 2.272 2.934 6.507 1.00 0.00 O ATOM 0 H ASP A 126 3.327 3.161 3.696 1.00 0.00 H new ATOM 0 HA ASP A 126 5.052 0.811 3.949 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.788 0.973 6.313 1.00 0.00 H new ATOM 0 HB3 ASP A 126 5.197 1.945 5.935 1.00 0.00 H new ATOM 1962 N LEU A 127 3.385 -0.999 3.790 1.00 0.00 N ATOM 1963 CA LEU A 127 2.424 -2.082 3.612 1.00 0.00 C ATOM 1964 C LEU A 127 2.927 -3.367 4.262 1.00 0.00 C ATOM 1965 O LEU A 127 4.132 -3.599 4.353 1.00 0.00 O ATOM 1966 CB LEU A 127 2.161 -2.318 2.124 1.00 0.00 C ATOM 1967 CG LEU A 127 1.770 -1.085 1.308 1.00 0.00 C ATOM 1968 CD1 LEU A 127 2.254 -1.220 -0.128 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.264 -0.875 1.348 1.00 0.00 C ATOM 0 H LEU A 127 4.361 -1.283 3.704 1.00 0.00 H new ATOM 0 HA LEU A 127 1.492 -1.792 4.097 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.057 -2.753 1.682 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.367 -3.059 2.029 1.00 0.00 H new ATOM 0 HG LEU A 127 2.250 -0.212 1.751 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.967 -0.334 -0.694 1.00 0.00 H new ATOM 0 HD12 LEU A 127 3.339 -1.321 -0.138 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.803 -2.102 -0.582 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.004 0.007 0.762 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.236 -1.749 0.931 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -0.056 -0.732 2.380 1.00 0.00 H new ATOM 1981 N VAL A 128 1.994 -4.202 4.709 1.00 0.00 N ATOM 1982 CA VAL A 128 2.342 -5.467 5.347 1.00 0.00 C ATOM 1983 C VAL A 128 1.548 -6.621 4.746 1.00 0.00 C ATOM 1984 O VAL A 128 0.369 -6.802 5.051 1.00 0.00 O ATOM 1985 CB VAL A 128 2.088 -5.418 6.865 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.561 -6.703 7.527 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.774 -4.208 7.481 1.00 0.00 C ATOM 0 H VAL A 128 0.992 -4.026 4.641 1.00 0.00 H new ATOM 0 HA VAL A 128 3.405 -5.630 5.170 1.00 0.00 H new ATOM 0 HB VAL A 128 1.015 -5.324 7.034 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.373 -6.650 8.599 1.00 0.00 H new ATOM 0 HG12 VAL A 128 2.020 -7.550 7.105 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.629 -6.831 7.351 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.584 -4.189 8.554 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.848 -4.269 7.304 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.383 -3.298 7.027 1.00 0.00 H new ATOM 1997 N ILE A 129 2.203 -7.401 3.892 1.00 0.00 N ATOM 1998 CA ILE A 129 1.559 -8.540 3.250 1.00 0.00 C ATOM 1999 C ILE A 129 1.847 -9.833 4.006 1.00 0.00 C ATOM 2000 O ILE A 129 2.913 -9.993 4.598 1.00 0.00 O ATOM 2001 CB ILE A 129 2.020 -8.698 1.789 1.00 0.00 C ATOM 2002 CG1 ILE A 129 2.052 -7.337 1.091 1.00 0.00 C ATOM 2003 CG2 ILE A 129 1.105 -9.660 1.046 1.00 0.00 C ATOM 2004 CD1 ILE A 129 3.050 -7.263 -0.043 1.00 0.00 C ATOM 0 H ILE A 129 3.179 -7.265 3.629 1.00 0.00 H new ATOM 0 HA ILE A 129 0.487 -8.345 3.264 1.00 0.00 H new ATOM 0 HB ILE A 129 3.029 -9.111 1.784 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.058 -7.112 0.705 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.290 -6.567 1.825 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.444 -9.761 0.015 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.129 -10.635 1.533 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.086 -9.274 1.057 1.00 0.00 H new ATOM 0 HD11 ILE A 129 3.018 -6.270 -0.492 1.00 0.00 H new ATOM 0 HD12 ILE A 129 4.052 -7.456 0.341 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.800 -8.010 -0.797 1.00 0.00 H new ATOM 2016 N GLY A 130 0.889 -10.754 3.979 1.00 0.00 N ATOM 2017 CA GLY A 130 1.060 -12.022 4.664 1.00 0.00 C ATOM 2018 C GLY A 130 0.502 -13.188 3.872 1.00 0.00 C ATOM 2019 O GLY A 130 -0.659 -13.170 3.462 1.00 0.00 O ATOM 0 H GLY A 130 -0.002 -10.645 3.495 1.00 0.00 H new ATOM 0 HA2 GLY A 130 2.120 -12.189 4.853 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.566 -11.977 5.635 1.00 0.00 H new ATOM 2023 N TYR A 131 1.330 -14.204 3.655 1.00 0.00 N ATOM 2024 CA TYR A 131 0.914 -15.382 2.903 1.00 0.00 C ATOM 2025 C TYR A 131 0.525 -16.519 3.844 1.00 0.00 C ATOM 2026 O TYR A 131 1.043 -16.624 4.956 1.00 0.00 O ATOM 2027 CB TYR A 131 2.035 -15.839 1.969 1.00 0.00 C ATOM 2028 CG TYR A 131 1.902 -17.277 1.521 1.00 0.00 C ATOM 2029 CD1 TYR A 131 0.878 -17.668 0.668 1.00 0.00 C ATOM 2030 CD2 TYR A 131 2.800 -18.246 1.953 1.00 0.00 C ATOM 2031 CE1 TYR A 131 0.752 -18.981 0.257 1.00 0.00 C ATOM 2032 CE2 TYR A 131 2.683 -19.560 1.546 1.00 0.00 C ATOM 2033 CZ TYR A 131 1.657 -19.923 0.698 1.00 0.00 C ATOM 2034 OH TYR A 131 1.536 -21.232 0.292 1.00 0.00 O ATOM 0 H TYR A 131 2.293 -14.235 3.989 1.00 0.00 H new ATOM 0 HA TYR A 131 0.042 -15.112 2.307 1.00 0.00 H new ATOM 0 HB2 TYR A 131 2.050 -15.194 1.091 1.00 0.00 H new ATOM 0 HB3 TYR A 131 2.992 -15.712 2.475 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.168 -16.933 0.320 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.603 -17.966 2.619 1.00 0.00 H new ATOM 0 HE1 TYR A 131 -0.051 -19.268 -0.406 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.391 -20.300 1.890 1.00 0.00 H new ATOM 0 HH TYR A 131 2.254 -21.766 0.692 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.389 -17.368 3.388 1.00 0.00 N ATOM 2045 CA ASP A 132 -0.847 -18.499 4.187 1.00 0.00 C ATOM 2046 C ASP A 132 -1.015 -19.743 3.320 1.00 0.00 C ATOM 2047 O ASP A 132 -1.784 -19.761 2.359 1.00 0.00 O ATOM 2048 CB ASP A 132 -2.170 -18.161 4.877 1.00 0.00 C ATOM 2049 CG ASP A 132 -2.651 -19.276 5.784 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -1.801 -19.917 6.438 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -3.877 -19.510 5.840 1.00 0.00 O ATOM 0 H ASP A 132 -0.827 -17.295 2.470 1.00 0.00 H new ATOM 0 HA ASP A 132 -0.093 -18.706 4.946 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.049 -17.248 5.461 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -2.929 -17.958 4.121 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.278 -20.809 3.666 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.327 -22.077 2.932 1.00 0.00 C ATOM 2058 C PRO A 133 -1.652 -22.808 3.125 1.00 0.00 C ATOM 2059 O PRO A 133 -2.106 -23.033 4.247 1.00 0.00 O ATOM 2060 CB PRO A 133 0.822 -22.884 3.541 1.00 0.00 C ATOM 2061 CG PRO A 133 0.999 -22.320 4.908 1.00 0.00 C ATOM 2062 CD PRO A 133 0.660 -20.859 4.800 1.00 0.00 C ATOM 0 HA PRO A 133 -0.238 -21.928 1.856 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.582 -23.947 3.579 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.733 -22.784 2.950 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.347 -22.820 5.624 1.00 0.00 H new ATOM 0 HG3 PRO A 133 2.022 -22.458 5.258 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.203 -20.484 5.716 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.547 -20.253 4.615 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.288 -23.187 2.007 1.00 0.00 N ATOM 2071 CA PRO A 134 -3.569 -23.899 2.028 1.00 0.00 C ATOM 2072 C PRO A 134 -3.432 -25.325 2.551 1.00 0.00 C ATOM 2073 O PRO A 134 -2.375 -25.944 2.423 1.00 0.00 O ATOM 2074 CB PRO A 134 -3.994 -23.908 0.557 1.00 0.00 C ATOM 2075 CG PRO A 134 -2.720 -23.797 -0.206 1.00 0.00 C ATOM 2076 CD PRO A 134 -1.805 -22.951 0.636 1.00 0.00 C ATOM 0 HA PRO A 134 -4.290 -23.421 2.692 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -4.528 -24.824 0.305 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -4.663 -23.077 0.333 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.286 -24.781 -0.386 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -2.888 -23.339 -1.181 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -0.763 -23.249 0.520 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -1.868 -21.897 0.364 1.00 0.00 H new