USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1033 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 16 HIS : no HD1:sc= 1.21 K(o=1.8,f=-9!) USER MOD Set 1.2: A 54 THR OG1 : rot 6:sc= 0.297 USER MOD Set 1.3: A 110 THR OG1 : rot -10:sc= 0.788 USER MOD Set 1.4: A 113 GLN : amide:sc= -0.54 K(o=1.8,f=-2.3!) USER MOD Set 2.1: A 59 ASN : amide:sc= 0.929 K(o=3,f=-6.2) USER MOD Set 2.2: A 75 LYS NZ :NH3+ 164:sc= 2.05! (180deg=0.493) USER MOD Single : A 3 THR OG1 : rot 180:sc= -1.85! USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0.104 X(o=0.1,f=0) USER MOD Single : A 11 GLN : amide:sc= -1.93! K(o=-1.9!,f=-0.16) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=-0.0079) USER MOD Single : A 17 ASN : amide:sc= 0.0327 K(o=0.033,f=-1.5) USER MOD Single : A 25 LYS NZ :NH3+ 165:sc= -0.0124 (180deg=-0.227) USER MOD Single : A 28 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0305) USER MOD Single : A 29 THR OG1 : rot 76:sc= 1.19 USER MOD Single : A 32 SER OG : rot 12:sc= 0.891 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.173 USER MOD Single : A 47 SER OG : rot 80:sc= 1.23 USER MOD Single : A 51 ASN : amide:sc= -1.62! K(o=-1.6!,f=-0.22) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 74:sc= 1.24 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=-6.6e-05) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= -0.389 K(o=-0.39,f=-3.4!) USER MOD Single : A 82 CYS SG : rot 80:sc= 0.193 USER MOD Single : A 85 THR OG1 : rot 89:sc= 1.16 USER MOD Single : A 87 LYS NZ :NH3+ 165:sc= -2.4! (180deg=-3.42!) USER MOD Single : A 89 ASN : amide:sc= -1.37! X(o=-1.4!,f=-0.97) USER MOD Single : A 90 GLN : amide:sc= 0.141 X(o=0.14,f=-0.09) USER MOD Single : A 91 GLN : amide:sc= 0.404 X(o=0.4,f=0) USER MOD Single : A 94 ASN : amide:sc= -0.118 K(o=-0.12,f=-0.63) USER MOD Single : A 100 MET CE :methyl -110:sc= -2.03 (180deg=-2.57!) USER MOD Single : A 102 THR OG1 : rot 130:sc= 0.133 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= 0.824 K(o=0.82,f=0) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot -95:sc= 1.19 USER MOD Single : A 109 SER OG : rot 180:sc= 0.193 USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= -0.45 X(o=-0.45,f=-0.012) USER MOD Single : A 116 TYR OH : rot 88:sc= 1.02 USER MOD Single : A 123 GLN : amide:sc= -0.0224 X(o=-0.022,f=-0.11) USER MOD Single : A 125 GLN : amide:sc= -0.332 X(o=-0.33,f=-0.33) USER MOD Single : A 129 THR OG1 : rot -100:sc= -1.14 USER MOD Single : A 130 LYS NZ :NH3+ -169:sc= -0.0459 (180deg=-0.234) USER MOD Single : A 134 LYS NZ :NH3+ 150:sc= 0.964 (180deg=0.286) USER MOD Single : A 138 LYS NZ :NH3+ 171:sc= 1.18 (180deg=1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.071 8.344 3.876 1.00 0.00 N ATOM 2 CA PRO A 1 3.854 7.806 2.783 1.00 0.00 C ATOM 3 C PRO A 1 5.242 8.429 2.795 1.00 0.00 C ATOM 4 O PRO A 1 5.467 9.437 3.444 1.00 0.00 O ATOM 5 CB PRO A 1 3.148 8.124 1.479 1.00 0.00 C ATOM 6 CG PRO A 1 1.888 8.801 1.910 1.00 0.00 C ATOM 7 CD PRO A 1 2.120 9.295 3.327 1.00 0.00 C ATOM 0 H2 PRO A 1 3.678 8.800 4.557 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.582 7.595 4.366 1.00 0.00 H new ATOM 0 HA PRO A 1 3.956 6.726 2.889 1.00 0.00 H new ATOM 0 HB2 PRO A 1 3.753 8.772 0.845 1.00 0.00 H new ATOM 0 HB3 PRO A 1 2.940 7.220 0.906 1.00 0.00 H new ATOM 0 HG2 PRO A 1 1.648 9.631 1.245 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.046 8.110 1.874 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.519 10.309 3.336 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.194 9.311 3.901 1.00 0.00 H new ATOM 17 N VAL A 2 6.135 7.848 2.084 1.00 0.00 N ATOM 18 CA VAL A 2 7.482 8.286 2.004 1.00 0.00 C ATOM 19 C VAL A 2 7.681 9.020 0.680 1.00 0.00 C ATOM 20 O VAL A 2 7.343 8.492 -0.390 1.00 0.00 O ATOM 21 CB VAL A 2 8.446 7.065 2.090 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.870 7.470 1.884 1.00 0.00 C ATOM 23 CG2 VAL A 2 8.300 6.348 3.420 1.00 0.00 C ATOM 0 H VAL A 2 5.942 7.021 1.519 1.00 0.00 H new ATOM 0 HA VAL A 2 7.702 8.958 2.834 1.00 0.00 H new ATOM 0 HB VAL A 2 8.167 6.381 1.288 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.512 6.591 1.951 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.980 7.925 0.900 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.158 8.189 2.651 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.984 5.500 3.453 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.535 7.036 4.232 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.276 5.992 3.531 1.00 0.00 H new ATOM 33 N THR A 3 8.186 10.219 0.755 1.00 0.00 N ATOM 34 CA THR A 3 8.433 11.009 -0.411 1.00 0.00 C ATOM 35 C THR A 3 9.927 11.012 -0.705 1.00 0.00 C ATOM 36 O THR A 3 10.714 10.500 0.104 1.00 0.00 O ATOM 37 CB THR A 3 7.869 12.439 -0.242 1.00 0.00 C ATOM 38 OG1 THR A 3 8.391 13.052 0.943 1.00 0.00 O ATOM 39 CG2 THR A 3 6.353 12.396 -0.140 1.00 0.00 C ATOM 0 H THR A 3 8.438 10.675 1.632 1.00 0.00 H new ATOM 0 HA THR A 3 7.915 10.572 -1.265 1.00 0.00 H new ATOM 0 HB THR A 3 8.167 13.022 -1.113 1.00 0.00 H new ATOM 0 HG1 THR A 3 8.024 13.956 1.032 1.00 0.00 H new ATOM 0 HG21 THR A 3 5.967 13.409 -0.021 1.00 0.00 H new ATOM 0 HG22 THR A 3 5.940 11.954 -1.047 1.00 0.00 H new ATOM 0 HG23 THR A 3 6.063 11.794 0.721 1.00 0.00 H new ATOM 47 N GLU A 4 10.340 11.562 -1.816 1.00 0.00 N ATOM 48 CA GLU A 4 11.730 11.487 -2.188 1.00 0.00 C ATOM 49 C GLU A 4 12.308 12.855 -2.565 1.00 0.00 C ATOM 50 O GLU A 4 11.668 13.891 -2.386 1.00 0.00 O ATOM 51 CB GLU A 4 11.984 10.406 -3.278 1.00 0.00 C ATOM 52 CG GLU A 4 11.670 10.778 -4.711 1.00 0.00 C ATOM 53 CD GLU A 4 10.254 11.281 -4.938 1.00 0.00 C ATOM 54 OE1 GLU A 4 10.010 12.491 -4.789 1.00 0.00 O ATOM 55 OE2 GLU A 4 9.360 10.474 -5.267 1.00 0.00 O ATOM 0 H GLU A 4 9.742 12.062 -2.474 1.00 0.00 H new ATOM 0 HA GLU A 4 12.276 11.165 -1.302 1.00 0.00 H new ATOM 0 HB2 GLU A 4 13.033 10.116 -3.227 1.00 0.00 H new ATOM 0 HB3 GLU A 4 11.397 9.524 -3.022 1.00 0.00 H new ATOM 0 HG2 GLU A 4 12.371 11.547 -5.035 1.00 0.00 H new ATOM 0 HG3 GLU A 4 11.838 9.907 -5.344 1.00 0.00 H new ATOM 62 N THR A 5 13.514 12.821 -3.019 1.00 0.00 N ATOM 63 CA THR A 5 14.264 13.973 -3.437 1.00 0.00 C ATOM 64 C THR A 5 15.529 13.394 -4.076 1.00 0.00 C ATOM 65 O THR A 5 15.905 12.295 -3.713 1.00 0.00 O ATOM 66 CB THR A 5 14.557 14.898 -2.203 1.00 0.00 C ATOM 67 OG1 THR A 5 15.266 16.094 -2.578 1.00 0.00 O ATOM 68 CG2 THR A 5 15.328 14.159 -1.134 1.00 0.00 C ATOM 0 H THR A 5 14.036 11.950 -3.117 1.00 0.00 H new ATOM 0 HA THR A 5 13.735 14.609 -4.147 1.00 0.00 H new ATOM 0 HB THR A 5 13.588 15.192 -1.800 1.00 0.00 H new ATOM 0 HG1 THR A 5 15.427 16.642 -1.782 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.515 14.827 -0.293 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.748 13.301 -0.794 1.00 0.00 H new ATOM 0 HG23 THR A 5 16.278 13.815 -1.543 1.00 0.00 H new ATOM 76 N VAL A 6 16.144 14.026 -5.044 1.00 0.00 N ATOM 77 CA VAL A 6 17.350 13.433 -5.632 1.00 0.00 C ATOM 78 C VAL A 6 18.555 14.373 -5.605 1.00 0.00 C ATOM 79 O VAL A 6 18.405 15.597 -5.586 1.00 0.00 O ATOM 80 CB VAL A 6 17.111 12.932 -7.094 1.00 0.00 C ATOM 81 CG1 VAL A 6 16.216 11.701 -7.113 1.00 0.00 C ATOM 82 CG2 VAL A 6 16.484 14.024 -7.942 1.00 0.00 C ATOM 0 H VAL A 6 15.854 14.920 -5.440 1.00 0.00 H new ATOM 0 HA VAL A 6 17.579 12.576 -4.999 1.00 0.00 H new ATOM 0 HB VAL A 6 18.083 12.667 -7.511 1.00 0.00 H new ATOM 0 HG11 VAL A 6 16.067 11.375 -8.142 1.00 0.00 H new ATOM 0 HG12 VAL A 6 16.687 10.900 -6.543 1.00 0.00 H new ATOM 0 HG13 VAL A 6 15.252 11.945 -6.667 1.00 0.00 H new ATOM 0 HG21 VAL A 6 16.327 13.653 -8.955 1.00 0.00 H new ATOM 0 HG22 VAL A 6 15.527 14.316 -7.510 1.00 0.00 H new ATOM 0 HG23 VAL A 6 17.148 14.888 -7.971 1.00 0.00 H new ATOM 92 N ASP A 7 19.742 13.786 -5.563 1.00 0.00 N ATOM 93 CA ASP A 7 20.981 14.532 -5.654 1.00 0.00 C ATOM 94 C ASP A 7 21.563 14.276 -7.035 1.00 0.00 C ATOM 95 O ASP A 7 21.272 13.226 -7.638 1.00 0.00 O ATOM 96 CB ASP A 7 21.969 14.055 -4.584 1.00 0.00 C ATOM 97 CG ASP A 7 23.264 14.852 -4.549 1.00 0.00 C ATOM 98 OD1 ASP A 7 24.202 14.529 -5.303 1.00 0.00 O ATOM 99 OD2 ASP A 7 23.382 15.789 -3.744 1.00 0.00 O ATOM 0 H ASP A 7 19.870 12.779 -5.465 1.00 0.00 H new ATOM 0 HA ASP A 7 20.797 15.595 -5.497 1.00 0.00 H new ATOM 0 HB2 ASP A 7 21.490 14.115 -3.607 1.00 0.00 H new ATOM 0 HB3 ASP A 7 22.203 13.005 -4.761 1.00 0.00 H new ATOM 104 N GLY A 8 22.404 15.184 -7.511 1.00 0.00 N ATOM 105 CA GLY A 8 23.023 15.097 -8.833 1.00 0.00 C ATOM 106 C GLY A 8 23.931 13.886 -9.070 1.00 0.00 C ATOM 107 O GLY A 8 24.548 13.771 -10.132 1.00 0.00 O ATOM 0 H GLY A 8 22.681 16.013 -6.986 1.00 0.00 H new ATOM 0 HA2 GLY A 8 22.232 15.086 -9.583 1.00 0.00 H new ATOM 0 HA3 GLY A 8 23.607 16.002 -8.999 1.00 0.00 H new ATOM 111 N GLN A 9 24.033 12.988 -8.097 1.00 0.00 N ATOM 112 CA GLN A 9 24.800 11.755 -8.296 1.00 0.00 C ATOM 113 C GLN A 9 23.893 10.720 -8.946 1.00 0.00 C ATOM 114 O GLN A 9 24.325 9.615 -9.263 1.00 0.00 O ATOM 115 CB GLN A 9 25.316 11.137 -6.977 1.00 0.00 C ATOM 116 CG GLN A 9 25.984 12.070 -5.985 1.00 0.00 C ATOM 117 CD GLN A 9 27.079 12.908 -6.574 1.00 0.00 C ATOM 118 OE1 GLN A 9 28.235 12.496 -6.629 1.00 0.00 O ATOM 119 NE2 GLN A 9 26.745 14.111 -6.937 1.00 0.00 N ATOM 0 H GLN A 9 23.604 13.083 -7.176 1.00 0.00 H new ATOM 0 HA GLN A 9 25.660 12.017 -8.912 1.00 0.00 H new ATOM 0 HB2 GLN A 9 24.474 10.660 -6.476 1.00 0.00 H new ATOM 0 HB3 GLN A 9 26.025 10.349 -7.229 1.00 0.00 H new ATOM 0 HG2 GLN A 9 25.228 12.728 -5.556 1.00 0.00 H new ATOM 0 HG3 GLN A 9 26.394 11.479 -5.166 1.00 0.00 H new ATOM 0 HE21 GLN A 9 25.772 14.411 -6.874 1.00 0.00 H new ATOM 0 HE22 GLN A 9 27.456 14.755 -7.284 1.00 0.00 H new ATOM 128 N GLY A 10 22.638 11.082 -9.141 1.00 0.00 N ATOM 129 CA GLY A 10 21.673 10.138 -9.634 1.00 0.00 C ATOM 130 C GLY A 10 21.176 9.268 -8.505 1.00 0.00 C ATOM 131 O GLY A 10 20.916 8.078 -8.680 1.00 0.00 O ATOM 0 H GLY A 10 22.273 12.018 -8.965 1.00 0.00 H new ATOM 0 HA2 GLY A 10 20.837 10.666 -10.092 1.00 0.00 H new ATOM 0 HA3 GLY A 10 22.122 9.519 -10.410 1.00 0.00 H new ATOM 135 N GLN A 11 21.051 9.861 -7.341 1.00 0.00 N ATOM 136 CA GLN A 11 20.652 9.132 -6.154 1.00 0.00 C ATOM 137 C GLN A 11 19.463 9.796 -5.498 1.00 0.00 C ATOM 138 O GLN A 11 19.357 11.027 -5.494 1.00 0.00 O ATOM 139 CB GLN A 11 21.787 9.071 -5.154 1.00 0.00 C ATOM 140 CG GLN A 11 22.269 10.442 -4.709 1.00 0.00 C ATOM 141 CD GLN A 11 22.979 10.414 -3.392 1.00 0.00 C ATOM 142 OE1 GLN A 11 23.900 11.200 -3.142 1.00 0.00 O ATOM 143 NE2 GLN A 11 22.515 9.581 -2.507 1.00 0.00 N ATOM 0 H GLN A 11 21.221 10.855 -7.187 1.00 0.00 H new ATOM 0 HA GLN A 11 20.385 8.121 -6.462 1.00 0.00 H new ATOM 0 HB2 GLN A 11 21.462 8.506 -4.280 1.00 0.00 H new ATOM 0 HB3 GLN A 11 22.621 8.525 -5.594 1.00 0.00 H new ATOM 0 HG2 GLN A 11 22.938 10.850 -5.467 1.00 0.00 H new ATOM 0 HG3 GLN A 11 21.415 11.117 -4.641 1.00 0.00 H new ATOM 0 HE21 GLN A 11 21.754 8.948 -2.752 1.00 0.00 H new ATOM 0 HE22 GLN A 11 22.912 9.561 -1.568 1.00 0.00 H new ATOM 152 N ALA A 12 18.607 9.004 -4.928 1.00 0.00 N ATOM 153 CA ALA A 12 17.433 9.495 -4.273 1.00 0.00 C ATOM 154 C ALA A 12 17.552 9.406 -2.749 1.00 0.00 C ATOM 155 O ALA A 12 18.024 8.405 -2.203 1.00 0.00 O ATOM 156 CB ALA A 12 16.209 8.735 -4.744 1.00 0.00 C ATOM 0 H ALA A 12 18.705 7.989 -4.904 1.00 0.00 H new ATOM 0 HA ALA A 12 17.328 10.547 -4.537 1.00 0.00 H new ATOM 0 HB1 ALA A 12 15.324 9.120 -4.237 1.00 0.00 H new ATOM 0 HB2 ALA A 12 16.094 8.862 -5.821 1.00 0.00 H new ATOM 0 HB3 ALA A 12 16.327 7.676 -4.514 1.00 0.00 H new ATOM 162 N TRP A 13 17.139 10.461 -2.094 1.00 0.00 N ATOM 163 CA TRP A 13 17.034 10.527 -0.656 1.00 0.00 C ATOM 164 C TRP A 13 15.555 10.536 -0.360 1.00 0.00 C ATOM 165 O TRP A 13 14.737 10.776 -1.284 1.00 0.00 O ATOM 166 CB TRP A 13 17.694 11.781 -0.088 1.00 0.00 C ATOM 167 CG TRP A 13 19.146 11.914 -0.399 1.00 0.00 C ATOM 168 CD1 TRP A 13 19.698 12.308 -1.578 1.00 0.00 C ATOM 169 CD2 TRP A 13 20.230 11.680 0.498 1.00 0.00 C ATOM 170 NE1 TRP A 13 21.057 12.310 -1.476 1.00 0.00 N ATOM 171 CE2 TRP A 13 21.413 11.937 -0.209 1.00 0.00 C ATOM 172 CE3 TRP A 13 20.315 11.274 1.832 1.00 0.00 C ATOM 173 CZ2 TRP A 13 22.672 11.803 0.370 1.00 0.00 C ATOM 174 CZ3 TRP A 13 21.564 11.143 2.407 1.00 0.00 C ATOM 175 CH2 TRP A 13 22.726 11.407 1.678 1.00 0.00 C ATOM 0 H TRP A 13 16.858 11.324 -2.559 1.00 0.00 H new ATOM 0 HA TRP A 13 17.547 9.684 -0.194 1.00 0.00 H new ATOM 0 HB2 TRP A 13 17.172 12.657 -0.473 1.00 0.00 H new ATOM 0 HB3 TRP A 13 17.566 11.784 0.994 1.00 0.00 H new ATOM 0 HD1 TRP A 13 19.142 12.579 -2.463 1.00 0.00 H new ATOM 0 HE1 TRP A 13 21.706 12.551 -2.225 1.00 0.00 H new ATOM 0 HE3 TRP A 13 19.422 11.067 2.402 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 23.572 12.004 -0.192 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 21.644 10.831 3.438 1.00 0.00 H new ATOM 0 HH2 TRP A 13 23.687 11.296 2.157 1.00 0.00 H new ATOM 186 N ARG A 14 15.178 10.334 0.869 1.00 0.00 N ATOM 187 CA ARG A 14 13.795 10.094 1.164 1.00 0.00 C ATOM 188 C ARG A 14 13.316 10.774 2.447 1.00 0.00 C ATOM 189 O ARG A 14 14.081 11.001 3.376 1.00 0.00 O ATOM 190 CB ARG A 14 13.621 8.603 1.266 1.00 0.00 C ATOM 191 CG ARG A 14 12.651 7.994 0.272 1.00 0.00 C ATOM 192 CD ARG A 14 13.100 8.119 -1.169 1.00 0.00 C ATOM 193 NE ARG A 14 14.377 7.480 -1.412 1.00 0.00 N ATOM 194 CZ ARG A 14 14.604 6.537 -2.324 1.00 0.00 C ATOM 195 NH1 ARG A 14 13.687 6.264 -3.239 1.00 0.00 N ATOM 196 NH2 ARG A 14 15.761 5.910 -2.346 1.00 0.00 N ATOM 0 H ARG A 14 15.801 10.330 1.676 1.00 0.00 H new ATOM 0 HA ARG A 14 13.187 10.524 0.368 1.00 0.00 H new ATOM 0 HB2 ARG A 14 14.594 8.130 1.135 1.00 0.00 H new ATOM 0 HB3 ARG A 14 13.283 8.361 2.274 1.00 0.00 H new ATOM 0 HG2 ARG A 14 12.514 6.939 0.511 1.00 0.00 H new ATOM 0 HG3 ARG A 14 11.679 8.475 0.384 1.00 0.00 H new ATOM 0 HD2 ARG A 14 12.346 7.676 -1.820 1.00 0.00 H new ATOM 0 HD3 ARG A 14 13.170 9.174 -1.434 1.00 0.00 H new ATOM 0 HE ARG A 14 15.166 7.777 -0.838 1.00 0.00 H new ATOM 0 HH11 ARG A 14 12.805 6.776 -3.246 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.862 5.541 -3.937 1.00 0.00 H new ATOM 0 HH21 ARG A 14 16.482 6.147 -1.665 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.936 5.187 -3.044 1.00 0.00 H new ATOM 210 N HIS A 15 12.036 11.071 2.475 1.00 0.00 N ATOM 211 CA HIS A 15 11.366 11.711 3.606 1.00 0.00 C ATOM 212 C HIS A 15 10.320 10.752 4.117 1.00 0.00 C ATOM 213 O HIS A 15 9.554 10.225 3.320 1.00 0.00 O ATOM 214 CB HIS A 15 10.583 12.976 3.147 1.00 0.00 C ATOM 215 CG HIS A 15 11.376 14.113 2.586 1.00 0.00 C ATOM 216 ND1 HIS A 15 11.473 15.335 3.204 1.00 0.00 N ATOM 217 CD2 HIS A 15 12.041 14.237 1.412 1.00 0.00 C ATOM 218 CE1 HIS A 15 12.160 16.157 2.446 1.00 0.00 C ATOM 219 NE2 HIS A 15 12.518 15.523 1.346 1.00 0.00 N ATOM 0 H HIS A 15 11.408 10.873 1.696 1.00 0.00 H new ATOM 0 HA HIS A 15 12.118 11.977 4.349 1.00 0.00 H new ATOM 0 HB2 HIS A 15 9.858 12.668 2.394 1.00 0.00 H new ATOM 0 HB3 HIS A 15 10.017 13.349 4.000 1.00 0.00 H new ATOM 0 HD2 HIS A 15 12.172 13.467 0.666 1.00 0.00 H new ATOM 0 HE1 HIS A 15 12.394 17.184 2.684 1.00 0.00 H new ATOM 0 HE2 HIS A 15 13.058 15.920 0.577 1.00 0.00 H new ATOM 228 N HIS A 16 10.235 10.534 5.402 1.00 0.00 N ATOM 229 CA HIS A 16 9.143 9.740 5.936 1.00 0.00 C ATOM 230 C HIS A 16 8.107 10.739 6.269 1.00 0.00 C ATOM 231 O HIS A 16 8.334 11.591 7.123 1.00 0.00 O ATOM 232 CB HIS A 16 9.552 8.968 7.193 1.00 0.00 C ATOM 233 CG HIS A 16 10.380 7.763 6.937 1.00 0.00 C ATOM 234 ND1 HIS A 16 11.752 7.782 6.777 1.00 0.00 N ATOM 235 CD2 HIS A 16 10.013 6.476 6.815 1.00 0.00 C ATOM 236 CE1 HIS A 16 12.178 6.559 6.566 1.00 0.00 C ATOM 237 NE2 HIS A 16 11.142 5.751 6.584 1.00 0.00 N ATOM 0 H HIS A 16 10.895 10.886 6.096 1.00 0.00 H new ATOM 0 HA HIS A 16 8.809 8.986 5.224 1.00 0.00 H new ATOM 0 HB2 HIS A 16 10.104 9.639 7.852 1.00 0.00 H new ATOM 0 HB3 HIS A 16 8.651 8.667 7.727 1.00 0.00 H new ATOM 0 HD2 HIS A 16 9.008 6.088 6.887 1.00 0.00 H new ATOM 0 HE1 HIS A 16 13.205 6.266 6.405 1.00 0.00 H new ATOM 0 HE2 HIS A 16 11.178 4.741 6.447 1.00 0.00 H new ATOM 246 N ASN A 17 7.004 10.689 5.614 1.00 0.00 N ATOM 247 CA ASN A 17 6.088 11.776 5.700 1.00 0.00 C ATOM 248 C ASN A 17 4.672 11.310 6.025 1.00 0.00 C ATOM 249 O ASN A 17 4.352 10.104 5.940 1.00 0.00 O ATOM 250 CB ASN A 17 6.176 12.470 4.329 1.00 0.00 C ATOM 251 CG ASN A 17 5.531 13.810 4.239 1.00 0.00 C ATOM 252 OD1 ASN A 17 5.407 14.516 5.219 1.00 0.00 O ATOM 253 ND2 ASN A 17 5.171 14.188 3.046 1.00 0.00 N ATOM 0 H ASN A 17 6.712 9.916 5.016 1.00 0.00 H new ATOM 0 HA ASN A 17 6.339 12.457 6.513 1.00 0.00 H new ATOM 0 HB2 ASN A 17 7.228 12.575 4.063 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.722 11.818 3.583 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.765 15.113 2.905 1.00 0.00 H new ATOM 0 HD22 ASN A 17 5.295 13.559 2.253 1.00 0.00 H new ATOM 260 N GLY A 18 3.842 12.239 6.420 1.00 0.00 N ATOM 261 CA GLY A 18 2.492 11.936 6.761 1.00 0.00 C ATOM 262 C GLY A 18 1.592 12.022 5.560 1.00 0.00 C ATOM 263 O GLY A 18 2.033 12.410 4.467 1.00 0.00 O ATOM 0 H GLY A 18 4.090 13.224 6.512 1.00 0.00 H new ATOM 0 HA2 GLY A 18 2.439 10.934 7.187 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.145 12.628 7.529 1.00 0.00 H new ATOM 267 N PHE A 19 0.355 11.665 5.743 1.00 0.00 N ATOM 268 CA PHE A 19 -0.616 11.693 4.672 1.00 0.00 C ATOM 269 C PHE A 19 -1.135 13.082 4.484 1.00 0.00 C ATOM 270 O PHE A 19 -1.364 13.793 5.468 1.00 0.00 O ATOM 271 CB PHE A 19 -1.820 10.813 5.002 1.00 0.00 C ATOM 272 CG PHE A 19 -1.557 9.353 5.081 1.00 0.00 C ATOM 273 CD1 PHE A 19 -1.424 8.607 3.929 1.00 0.00 C ATOM 274 CD2 PHE A 19 -1.473 8.721 6.302 1.00 0.00 C ATOM 275 CE1 PHE A 19 -1.204 7.258 3.992 1.00 0.00 C ATOM 276 CE2 PHE A 19 -1.260 7.368 6.374 1.00 0.00 C ATOM 277 CZ PHE A 19 -1.127 6.639 5.214 1.00 0.00 C ATOM 0 H PHE A 19 -0.017 11.345 6.637 1.00 0.00 H new ATOM 0 HA PHE A 19 -0.115 11.332 3.774 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.233 11.140 5.956 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.588 10.984 4.247 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -1.494 9.093 2.967 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.576 9.296 7.211 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -1.092 6.683 3.084 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -1.197 6.878 7.334 1.00 0.00 H new ATOM 0 HZ PHE A 19 -0.961 5.573 5.266 1.00 0.00 H new ATOM 287 N ASP A 20 -1.329 13.482 3.259 1.00 0.00 N ATOM 288 CA ASP A 20 -2.008 14.724 2.997 1.00 0.00 C ATOM 289 C ASP A 20 -3.452 14.442 3.209 1.00 0.00 C ATOM 290 O ASP A 20 -3.979 13.459 2.641 1.00 0.00 O ATOM 291 CB ASP A 20 -1.776 15.222 1.563 1.00 0.00 C ATOM 292 CG ASP A 20 -0.382 15.732 1.333 1.00 0.00 C ATOM 293 OD1 ASP A 20 0.526 14.921 1.015 1.00 0.00 O ATOM 294 OD2 ASP A 20 -0.159 16.951 1.468 1.00 0.00 O ATOM 0 H ASP A 20 -1.029 12.971 2.429 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.632 15.509 3.654 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.978 14.409 0.866 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.488 16.017 1.341 1.00 0.00 H new ATOM 299 N PHE A 21 -4.102 15.243 4.021 1.00 0.00 N ATOM 300 CA PHE A 21 -5.469 14.976 4.393 1.00 0.00 C ATOM 301 C PHE A 21 -6.372 14.956 3.181 1.00 0.00 C ATOM 302 O PHE A 21 -7.288 14.193 3.143 1.00 0.00 O ATOM 303 CB PHE A 21 -5.993 15.943 5.453 1.00 0.00 C ATOM 304 CG PHE A 21 -7.326 15.514 6.009 1.00 0.00 C ATOM 305 CD1 PHE A 21 -7.428 14.347 6.752 1.00 0.00 C ATOM 306 CD2 PHE A 21 -8.469 16.261 5.783 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.643 13.935 7.256 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.690 15.851 6.291 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.778 14.688 7.026 1.00 0.00 C ATOM 0 H PHE A 21 -3.704 16.086 4.436 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.479 13.984 4.844 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -5.269 16.016 6.265 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -6.086 16.939 5.019 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.545 13.754 6.938 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -8.408 17.172 5.205 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.708 13.023 7.831 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.575 16.443 6.111 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.731 14.367 7.420 1.00 0.00 H new ATOM 319 N ALA A 22 -6.063 15.779 2.195 1.00 0.00 N ATOM 320 CA ALA A 22 -6.791 15.838 0.929 1.00 0.00 C ATOM 321 C ALA A 22 -6.968 14.448 0.295 1.00 0.00 C ATOM 322 O ALA A 22 -8.081 14.078 -0.094 1.00 0.00 O ATOM 323 CB ALA A 22 -6.065 16.749 -0.034 1.00 0.00 C ATOM 0 H ALA A 22 -5.287 16.439 2.247 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.785 16.231 1.140 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.610 16.791 -0.977 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.999 17.750 0.392 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.061 16.364 -0.212 1.00 0.00 H new ATOM 329 N VAL A 23 -5.888 13.678 0.250 1.00 0.00 N ATOM 330 CA VAL A 23 -5.901 12.344 -0.358 1.00 0.00 C ATOM 331 C VAL A 23 -6.816 11.423 0.434 1.00 0.00 C ATOM 332 O VAL A 23 -7.711 10.762 -0.131 1.00 0.00 O ATOM 333 CB VAL A 23 -4.472 11.732 -0.414 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.483 10.362 -1.077 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.515 12.665 -1.144 1.00 0.00 C ATOM 0 H VAL A 23 -4.982 13.954 0.630 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.271 12.445 -1.378 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.125 11.608 0.612 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.470 9.961 -1.101 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -5.126 9.689 -0.510 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.861 10.454 -2.095 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.521 12.218 -1.172 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.869 12.826 -2.162 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.468 13.620 -0.621 1.00 0.00 H new ATOM 345 N ILE A 24 -6.623 11.424 1.757 1.00 0.00 N ATOM 346 CA ILE A 24 -7.428 10.624 2.689 1.00 0.00 C ATOM 347 C ILE A 24 -8.897 10.989 2.519 1.00 0.00 C ATOM 348 O ILE A 24 -9.760 10.134 2.354 1.00 0.00 O ATOM 349 CB ILE A 24 -7.023 10.929 4.169 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.541 10.623 4.424 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.910 10.179 5.170 1.00 0.00 C ATOM 352 CD1 ILE A 24 -5.160 9.175 4.204 1.00 0.00 C ATOM 0 H ILE A 24 -5.902 11.981 2.214 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.258 9.569 2.474 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.178 11.997 4.323 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.934 11.250 3.771 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -5.296 10.900 5.449 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.595 10.419 6.186 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.949 10.479 5.032 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.817 9.106 5.005 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.097 9.044 4.405 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.738 8.541 4.876 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.371 8.896 3.172 1.00 0.00 H new ATOM 364 N LYS A 25 -9.124 12.274 2.525 1.00 0.00 N ATOM 365 CA LYS A 25 -10.408 12.906 2.438 1.00 0.00 C ATOM 366 C LYS A 25 -11.161 12.458 1.203 1.00 0.00 C ATOM 367 O LYS A 25 -12.311 12.041 1.301 1.00 0.00 O ATOM 368 CB LYS A 25 -10.186 14.420 2.422 1.00 0.00 C ATOM 369 CG LYS A 25 -11.417 15.289 2.407 1.00 0.00 C ATOM 370 CD LYS A 25 -11.018 16.761 2.343 1.00 0.00 C ATOM 371 CE LYS A 25 -10.523 17.175 0.956 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.567 17.061 -0.090 1.00 0.00 N ATOM 0 H LYS A 25 -8.364 12.951 2.596 1.00 0.00 H new ATOM 0 HA LYS A 25 -11.017 12.623 3.296 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.594 14.685 3.298 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.586 14.666 1.546 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.040 15.035 1.550 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.013 15.104 3.301 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.873 17.378 2.619 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.236 16.954 3.077 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.167 18.205 0.996 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.671 16.554 0.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.267 17.583 -0.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.708 16.059 -0.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.459 17.461 0.265 1.00 0.00 H new ATOM 386 N GLU A 26 -10.518 12.503 0.061 1.00 0.00 N ATOM 387 CA GLU A 26 -11.184 12.149 -1.163 1.00 0.00 C ATOM 388 C GLU A 26 -11.353 10.645 -1.348 1.00 0.00 C ATOM 389 O GLU A 26 -12.365 10.210 -1.898 1.00 0.00 O ATOM 390 CB GLU A 26 -10.565 12.845 -2.361 1.00 0.00 C ATOM 391 CG GLU A 26 -10.689 14.351 -2.244 1.00 0.00 C ATOM 392 CD GLU A 26 -10.225 15.099 -3.452 1.00 0.00 C ATOM 393 OE1 GLU A 26 -9.034 15.465 -3.520 1.00 0.00 O ATOM 394 OE2 GLU A 26 -11.066 15.390 -4.332 1.00 0.00 O ATOM 0 H GLU A 26 -9.542 12.779 -0.044 1.00 0.00 H new ATOM 0 HA GLU A 26 -12.203 12.526 -1.083 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.514 12.569 -2.442 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.054 12.507 -3.274 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.731 14.605 -2.051 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -10.115 14.686 -1.380 1.00 0.00 H new ATOM 401 N LEU A 27 -10.390 9.844 -0.883 1.00 0.00 N ATOM 402 CA LEU A 27 -10.557 8.387 -0.943 1.00 0.00 C ATOM 403 C LEU A 27 -11.722 7.990 -0.015 1.00 0.00 C ATOM 404 O LEU A 27 -12.470 7.088 -0.304 1.00 0.00 O ATOM 405 CB LEU A 27 -9.250 7.645 -0.558 1.00 0.00 C ATOM 406 CG LEU A 27 -9.160 6.156 -0.928 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.471 5.955 -2.381 1.00 0.00 C ATOM 408 CD2 LEU A 27 -7.762 5.641 -0.655 1.00 0.00 C ATOM 0 H LEU A 27 -9.513 10.165 -0.473 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.787 8.092 -1.967 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.415 8.163 -1.030 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.114 7.735 0.520 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.885 5.610 -0.324 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.402 4.895 -2.625 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.480 6.311 -2.590 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -8.757 6.513 -2.987 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.705 4.585 -0.919 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.044 6.204 -1.252 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.529 5.763 0.403 1.00 0.00 H new ATOM 420 N LYS A 28 -11.872 8.740 1.080 1.00 0.00 N ATOM 421 CA LYS A 28 -12.966 8.568 2.050 1.00 0.00 C ATOM 422 C LYS A 28 -14.300 9.019 1.422 1.00 0.00 C ATOM 423 O LYS A 28 -15.364 8.433 1.657 1.00 0.00 O ATOM 424 CB LYS A 28 -12.663 9.433 3.282 1.00 0.00 C ATOM 425 CG LYS A 28 -13.651 9.327 4.426 1.00 0.00 C ATOM 426 CD LYS A 28 -13.349 10.362 5.507 1.00 0.00 C ATOM 427 CE LYS A 28 -13.700 11.788 5.066 1.00 0.00 C ATOM 428 NZ LYS A 28 -15.172 12.009 5.012 1.00 0.00 N ATOM 0 H LYS A 28 -11.231 9.495 1.324 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.047 7.519 2.335 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.675 9.165 3.655 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.613 10.475 2.966 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.664 9.472 4.051 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.611 8.326 4.855 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -13.909 10.115 6.409 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.291 10.315 5.766 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -13.251 12.502 5.757 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -13.268 11.980 4.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -15.365 13.007 4.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -15.587 11.405 4.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -15.593 11.769 5.932 1.00 0.00 H new ATOM 442 N THR A 29 -14.228 10.070 0.644 1.00 0.00 N ATOM 443 CA THR A 29 -15.384 10.594 -0.042 1.00 0.00 C ATOM 444 C THR A 29 -15.871 9.582 -1.075 1.00 0.00 C ATOM 445 O THR A 29 -17.048 9.168 -1.047 1.00 0.00 O ATOM 446 CB THR A 29 -15.073 11.953 -0.692 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.612 12.852 0.328 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.305 12.542 -1.349 1.00 0.00 C ATOM 0 H THR A 29 -13.367 10.587 0.468 1.00 0.00 H new ATOM 0 HA THR A 29 -16.180 10.760 0.684 1.00 0.00 H new ATOM 0 HB THR A 29 -14.312 11.809 -1.459 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.689 12.628 0.568 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.053 13.502 -1.799 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.666 11.862 -2.121 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.083 12.686 -0.600 1.00 0.00 H new ATOM 456 N ALA A 30 -14.963 9.149 -1.948 1.00 0.00 N ATOM 457 CA ALA A 30 -15.245 8.147 -2.915 1.00 0.00 C ATOM 458 C ALA A 30 -15.700 6.862 -2.238 1.00 0.00 C ATOM 459 O ALA A 30 -16.570 6.205 -2.726 1.00 0.00 O ATOM 460 CB ALA A 30 -14.035 7.911 -3.790 1.00 0.00 C ATOM 0 H ALA A 30 -14.007 9.502 -1.986 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.060 8.491 -3.552 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.264 7.141 -4.527 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.770 8.836 -4.302 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.198 7.585 -3.173 1.00 0.00 H new ATOM 466 N ALA A 31 -15.075 6.513 -1.149 1.00 0.00 N ATOM 467 CA ALA A 31 -15.469 5.351 -0.332 1.00 0.00 C ATOM 468 C ALA A 31 -16.969 5.336 -0.042 1.00 0.00 C ATOM 469 O ALA A 31 -17.617 4.310 -0.182 1.00 0.00 O ATOM 470 CB ALA A 31 -14.749 5.400 0.980 1.00 0.00 C ATOM 0 H ALA A 31 -14.268 7.018 -0.782 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.211 4.455 -0.897 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.039 4.542 1.586 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.673 5.375 0.806 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.010 6.319 1.504 1.00 0.00 H new ATOM 476 N SER A 32 -17.503 6.470 0.349 1.00 0.00 N ATOM 477 CA SER A 32 -18.898 6.560 0.701 1.00 0.00 C ATOM 478 C SER A 32 -19.811 6.751 -0.519 1.00 0.00 C ATOM 479 O SER A 32 -20.953 6.307 -0.525 1.00 0.00 O ATOM 480 CB SER A 32 -19.077 7.678 1.733 1.00 0.00 C ATOM 481 OG SER A 32 -18.399 8.881 1.324 1.00 0.00 O ATOM 0 H SER A 32 -16.988 7.346 0.431 1.00 0.00 H new ATOM 0 HA SER A 32 -19.206 5.610 1.139 1.00 0.00 H new ATOM 0 HB2 SER A 32 -20.139 7.884 1.868 1.00 0.00 H new ATOM 0 HB3 SER A 32 -18.691 7.350 2.698 1.00 0.00 H new ATOM 0 HG SER A 32 -18.129 8.801 0.385 1.00 0.00 H new ATOM 487 N GLN A 33 -19.299 7.400 -1.544 1.00 0.00 N ATOM 488 CA GLN A 33 -20.067 7.745 -2.727 1.00 0.00 C ATOM 489 C GLN A 33 -19.949 6.692 -3.823 1.00 0.00 C ATOM 490 O GLN A 33 -20.907 6.030 -4.189 1.00 0.00 O ATOM 491 CB GLN A 33 -19.556 9.077 -3.252 1.00 0.00 C ATOM 492 CG GLN A 33 -19.851 10.252 -2.379 1.00 0.00 C ATOM 493 CD GLN A 33 -21.278 10.614 -2.488 1.00 0.00 C ATOM 494 OE1 GLN A 33 -22.127 10.144 -1.723 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.569 11.399 -3.470 1.00 0.00 N ATOM 0 H GLN A 33 -18.327 7.707 -1.582 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.119 7.803 -2.448 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -18.477 9.007 -3.390 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -19.992 9.255 -4.235 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.605 10.018 -1.343 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.229 11.098 -2.671 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -20.828 11.759 -4.072 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.540 11.659 -3.644 1.00 0.00 H new ATOM 504 N TYR A 34 -18.742 6.545 -4.288 1.00 0.00 N ATOM 505 CA TYR A 34 -18.370 5.752 -5.436 1.00 0.00 C ATOM 506 C TYR A 34 -18.252 4.278 -5.083 1.00 0.00 C ATOM 507 O TYR A 34 -18.804 3.419 -5.775 1.00 0.00 O ATOM 508 CB TYR A 34 -17.024 6.319 -5.977 1.00 0.00 C ATOM 509 CG TYR A 34 -17.168 7.657 -6.681 1.00 0.00 C ATOM 510 CD1 TYR A 34 -17.361 8.818 -5.957 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.117 7.753 -8.065 1.00 0.00 C ATOM 512 CE1 TYR A 34 -17.503 10.029 -6.567 1.00 0.00 C ATOM 513 CE2 TYR A 34 -17.255 8.976 -8.693 1.00 0.00 C ATOM 514 CZ TYR A 34 -17.448 10.109 -7.932 1.00 0.00 C ATOM 515 OH TYR A 34 -17.600 11.323 -8.542 1.00 0.00 O ATOM 0 H TYR A 34 -17.940 7.001 -3.853 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.142 5.816 -6.203 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.325 6.428 -5.147 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -16.588 5.599 -6.669 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -17.400 8.765 -4.879 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -16.968 6.862 -8.657 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -17.658 10.920 -5.976 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -17.212 9.044 -9.770 1.00 0.00 H new ATOM 0 HH TYR A 34 -17.535 11.211 -9.513 1.00 0.00 H new ATOM 525 N GLY A 35 -17.604 3.995 -3.979 1.00 0.00 N ATOM 526 CA GLY A 35 -17.393 2.635 -3.574 1.00 0.00 C ATOM 527 C GLY A 35 -16.195 2.021 -4.242 1.00 0.00 C ATOM 528 O GLY A 35 -15.845 2.394 -5.367 1.00 0.00 O ATOM 0 H GLY A 35 -17.214 4.694 -3.346 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.263 2.596 -2.492 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.279 2.046 -3.810 1.00 0.00 H new ATOM 532 N ALA A 36 -15.633 1.005 -3.623 1.00 0.00 N ATOM 533 CA ALA A 36 -14.401 0.429 -4.107 1.00 0.00 C ATOM 534 C ALA A 36 -14.705 -0.629 -5.146 1.00 0.00 C ATOM 535 O ALA A 36 -14.843 -1.805 -4.853 1.00 0.00 O ATOM 536 CB ALA A 36 -13.537 -0.087 -2.983 1.00 0.00 C ATOM 0 H ALA A 36 -16.010 0.563 -2.785 1.00 0.00 H new ATOM 0 HA ALA A 36 -13.814 1.212 -4.587 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -12.621 -0.511 -3.394 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.287 0.733 -2.310 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.078 -0.856 -2.432 1.00 0.00 H new ATOM 542 N THR A 37 -14.793 -0.157 -6.363 1.00 0.00 N ATOM 543 CA THR A 37 -15.246 -0.887 -7.540 1.00 0.00 C ATOM 544 C THR A 37 -15.422 0.124 -8.657 1.00 0.00 C ATOM 545 O THR A 37 -15.226 -0.176 -9.839 1.00 0.00 O ATOM 546 CB THR A 37 -16.579 -1.709 -7.298 1.00 0.00 C ATOM 547 OG1 THR A 37 -17.108 -2.241 -8.526 1.00 0.00 O ATOM 548 CG2 THR A 37 -17.628 -0.896 -6.578 1.00 0.00 C ATOM 0 H THR A 37 -14.537 0.806 -6.582 1.00 0.00 H new ATOM 0 HA THR A 37 -14.499 -1.637 -7.799 1.00 0.00 H new ATOM 0 HB THR A 37 -16.310 -2.546 -6.654 1.00 0.00 H new ATOM 0 HG1 THR A 37 -17.929 -2.743 -8.338 1.00 0.00 H new ATOM 0 HG21 THR A 37 -18.523 -1.502 -6.435 1.00 0.00 H new ATOM 0 HG22 THR A 37 -17.243 -0.583 -5.608 1.00 0.00 H new ATOM 0 HG23 THR A 37 -17.876 -0.016 -7.171 1.00 0.00 H new ATOM 556 N ALA A 38 -15.781 1.342 -8.274 1.00 0.00 N ATOM 557 CA ALA A 38 -15.851 2.431 -9.207 1.00 0.00 C ATOM 558 C ALA A 38 -14.433 2.896 -9.495 1.00 0.00 C ATOM 559 O ALA A 38 -13.684 3.185 -8.543 1.00 0.00 O ATOM 560 CB ALA A 38 -16.684 3.563 -8.630 1.00 0.00 C ATOM 0 H ALA A 38 -16.027 1.590 -7.316 1.00 0.00 H new ATOM 0 HA ALA A 38 -16.328 2.109 -10.132 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -16.730 4.383 -9.347 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -17.692 3.204 -8.424 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.228 3.915 -7.705 1.00 0.00 H new ATOM 566 N PRO A 39 -14.043 2.944 -10.798 1.00 0.00 N ATOM 567 CA PRO A 39 -12.679 3.299 -11.270 1.00 0.00 C ATOM 568 C PRO A 39 -12.006 4.431 -10.487 1.00 0.00 C ATOM 569 O PRO A 39 -10.817 4.342 -10.167 1.00 0.00 O ATOM 570 CB PRO A 39 -12.937 3.727 -12.708 1.00 0.00 C ATOM 571 CG PRO A 39 -14.027 2.831 -13.148 1.00 0.00 C ATOM 572 CD PRO A 39 -14.923 2.634 -11.951 1.00 0.00 C ATOM 0 HA PRO A 39 -11.988 2.465 -11.146 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -13.231 4.775 -12.768 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -12.047 3.610 -13.327 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -14.579 3.270 -13.979 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -13.630 1.878 -13.497 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -15.787 3.297 -11.985 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -15.305 1.614 -11.900 1.00 0.00 H new ATOM 580 N TYR A 40 -12.792 5.449 -10.146 1.00 0.00 N ATOM 581 CA TYR A 40 -12.321 6.629 -9.441 1.00 0.00 C ATOM 582 C TYR A 40 -11.508 6.258 -8.184 1.00 0.00 C ATOM 583 O TYR A 40 -10.296 6.508 -8.118 1.00 0.00 O ATOM 584 CB TYR A 40 -13.519 7.535 -9.052 1.00 0.00 C ATOM 585 CG TYR A 40 -13.125 8.877 -8.481 1.00 0.00 C ATOM 586 CD1 TYR A 40 -12.885 9.955 -9.317 1.00 0.00 C ATOM 587 CD2 TYR A 40 -12.974 9.062 -7.115 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.495 11.172 -8.814 1.00 0.00 C ATOM 589 CE2 TYR A 40 -12.589 10.282 -6.605 1.00 0.00 C ATOM 590 CZ TYR A 40 -12.348 11.331 -7.458 1.00 0.00 C ATOM 591 OH TYR A 40 -11.929 12.543 -6.949 1.00 0.00 O ATOM 0 H TYR A 40 -13.790 5.474 -10.357 1.00 0.00 H new ATOM 0 HA TYR A 40 -11.660 7.173 -10.115 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.138 7.697 -9.934 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.135 7.009 -8.322 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.007 9.836 -10.384 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -13.161 8.238 -6.442 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.305 12.000 -9.481 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -12.477 10.413 -5.539 1.00 0.00 H new ATOM 0 HH TYR A 40 -11.878 12.487 -5.972 1.00 0.00 H new ATOM 601 N THR A 41 -12.154 5.615 -7.207 1.00 0.00 N ATOM 602 CA THR A 41 -11.554 5.346 -5.925 1.00 0.00 C ATOM 603 C THR A 41 -10.345 4.408 -6.007 1.00 0.00 C ATOM 604 O THR A 41 -9.356 4.629 -5.323 1.00 0.00 O ATOM 605 CB THR A 41 -12.607 4.833 -4.907 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.073 4.769 -3.595 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.104 3.477 -5.283 1.00 0.00 C ATOM 0 H THR A 41 -13.110 5.271 -7.297 1.00 0.00 H new ATOM 0 HA THR A 41 -11.168 6.299 -5.563 1.00 0.00 H new ATOM 0 HB THR A 41 -13.432 5.545 -4.927 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.761 4.444 -2.977 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.840 3.144 -4.552 1.00 0.00 H new ATOM 0 HG22 THR A 41 -13.566 3.519 -6.269 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.269 2.776 -5.303 1.00 0.00 H new ATOM 615 N LEU A 42 -10.388 3.392 -6.849 1.00 0.00 N ATOM 616 CA LEU A 42 -9.246 2.510 -6.911 1.00 0.00 C ATOM 617 C LEU A 42 -8.100 3.072 -7.699 1.00 0.00 C ATOM 618 O LEU A 42 -6.972 2.684 -7.484 1.00 0.00 O ATOM 619 CB LEU A 42 -9.505 0.986 -7.122 1.00 0.00 C ATOM 620 CG LEU A 42 -10.510 0.513 -8.185 1.00 0.00 C ATOM 621 CD1 LEU A 42 -11.923 0.724 -7.714 1.00 0.00 C ATOM 622 CD2 LEU A 42 -10.275 1.162 -9.543 1.00 0.00 C ATOM 0 H LEU A 42 -11.164 3.166 -7.471 1.00 0.00 H new ATOM 0 HA LEU A 42 -8.921 2.496 -5.871 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.546 0.524 -7.356 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -9.830 0.578 -6.165 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.349 -0.556 -8.323 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -12.617 0.382 -8.482 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.089 0.159 -6.797 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.088 1.784 -7.522 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.012 0.792 -10.255 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -10.370 2.244 -9.451 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -9.274 0.915 -9.896 1.00 0.00 H new ATOM 634 N ALA A 43 -8.384 4.025 -8.588 1.00 0.00 N ATOM 635 CA ALA A 43 -7.320 4.749 -9.269 1.00 0.00 C ATOM 636 C ALA A 43 -6.527 5.512 -8.235 1.00 0.00 C ATOM 637 O ALA A 43 -5.302 5.617 -8.308 1.00 0.00 O ATOM 638 CB ALA A 43 -7.863 5.690 -10.332 1.00 0.00 C ATOM 0 H ALA A 43 -9.329 4.308 -8.848 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.679 4.035 -9.785 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.035 6.210 -10.815 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.416 5.117 -11.077 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -8.528 6.419 -9.868 1.00 0.00 H new ATOM 644 N ILE A 44 -7.237 5.979 -7.234 1.00 0.00 N ATOM 645 CA ILE A 44 -6.633 6.654 -6.115 1.00 0.00 C ATOM 646 C ILE A 44 -5.845 5.632 -5.276 1.00 0.00 C ATOM 647 O ILE A 44 -4.730 5.904 -4.875 1.00 0.00 O ATOM 648 CB ILE A 44 -7.698 7.347 -5.255 1.00 0.00 C ATOM 649 CG1 ILE A 44 -8.528 8.275 -6.131 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.037 8.137 -4.119 1.00 0.00 C ATOM 651 CD1 ILE A 44 -9.765 8.785 -5.470 1.00 0.00 C ATOM 0 H ILE A 44 -8.252 5.900 -7.175 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.954 7.422 -6.485 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.348 6.592 -4.812 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.912 9.123 -6.431 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -8.807 7.746 -7.042 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -7.806 8.623 -3.518 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.461 7.458 -3.491 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.374 8.893 -4.539 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.302 9.439 -6.157 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -10.403 7.945 -5.195 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -9.495 9.344 -4.574 1.00 0.00 H new ATOM 663 N VAL A 45 -6.421 4.431 -5.077 1.00 0.00 N ATOM 664 CA VAL A 45 -5.748 3.332 -4.349 1.00 0.00 C ATOM 665 C VAL A 45 -4.390 3.023 -5.009 1.00 0.00 C ATOM 666 O VAL A 45 -3.350 2.953 -4.331 1.00 0.00 O ATOM 667 CB VAL A 45 -6.643 2.023 -4.286 1.00 0.00 C ATOM 668 CG1 VAL A 45 -5.890 0.835 -3.695 1.00 0.00 C ATOM 669 CG2 VAL A 45 -7.910 2.250 -3.471 1.00 0.00 C ATOM 0 H VAL A 45 -7.355 4.194 -5.411 1.00 0.00 H new ATOM 0 HA VAL A 45 -5.588 3.662 -3.323 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.907 1.795 -5.319 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.545 -0.036 -3.673 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.016 0.617 -4.308 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.571 1.075 -2.681 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.498 1.333 -3.450 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.642 2.533 -2.453 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.498 3.047 -3.926 1.00 0.00 H new ATOM 679 N GLU A 46 -4.398 2.921 -6.334 1.00 0.00 N ATOM 680 CA GLU A 46 -3.190 2.643 -7.099 1.00 0.00 C ATOM 681 C GLU A 46 -2.199 3.807 -6.998 1.00 0.00 C ATOM 682 O GLU A 46 -0.991 3.602 -6.991 1.00 0.00 O ATOM 683 CB GLU A 46 -3.519 2.362 -8.572 1.00 0.00 C ATOM 684 CG GLU A 46 -4.575 1.291 -8.772 1.00 0.00 C ATOM 685 CD GLU A 46 -4.656 0.787 -10.196 1.00 0.00 C ATOM 686 OE1 GLU A 46 -5.259 1.456 -11.056 1.00 0.00 O ATOM 687 OE2 GLU A 46 -4.117 -0.304 -10.490 1.00 0.00 O ATOM 0 H GLU A 46 -5.237 3.028 -6.904 1.00 0.00 H new ATOM 0 HA GLU A 46 -2.730 1.752 -6.672 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -3.859 3.286 -9.041 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -2.607 2.060 -9.087 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.362 0.452 -8.109 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.546 1.690 -8.479 1.00 0.00 H new ATOM 694 N SER A 47 -2.728 5.011 -6.876 1.00 0.00 N ATOM 695 CA SER A 47 -1.922 6.212 -6.783 1.00 0.00 C ATOM 696 C SER A 47 -1.302 6.380 -5.387 1.00 0.00 C ATOM 697 O SER A 47 -0.194 6.883 -5.254 1.00 0.00 O ATOM 698 CB SER A 47 -2.753 7.428 -7.178 1.00 0.00 C ATOM 699 OG SER A 47 -3.243 7.283 -8.515 1.00 0.00 O ATOM 0 H SER A 47 -3.733 5.183 -6.839 1.00 0.00 H new ATOM 0 HA SER A 47 -1.090 6.119 -7.481 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.589 7.545 -6.488 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.147 8.331 -7.102 1.00 0.00 H new ATOM 0 HG SER A 47 -4.030 6.699 -8.513 1.00 0.00 H new ATOM 705 N VAL A 48 -1.996 5.934 -4.355 1.00 0.00 N ATOM 706 CA VAL A 48 -1.448 5.986 -3.012 1.00 0.00 C ATOM 707 C VAL A 48 -0.369 4.917 -2.879 1.00 0.00 C ATOM 708 O VAL A 48 0.688 5.150 -2.300 1.00 0.00 O ATOM 709 CB VAL A 48 -2.523 5.789 -1.908 1.00 0.00 C ATOM 710 CG1 VAL A 48 -1.900 5.915 -0.529 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.657 6.790 -2.057 1.00 0.00 C ATOM 0 H VAL A 48 -2.932 5.535 -4.420 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.031 6.982 -2.865 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.934 4.786 -2.023 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.668 5.774 0.231 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.127 5.156 -0.408 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.458 6.905 -0.419 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.393 6.626 -1.270 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.261 7.803 -1.979 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.131 6.660 -3.030 1.00 0.00 H new ATOM 721 N ALA A 49 -0.612 3.758 -3.497 1.00 0.00 N ATOM 722 CA ALA A 49 0.359 2.666 -3.483 1.00 0.00 C ATOM 723 C ALA A 49 1.513 2.971 -4.411 1.00 0.00 C ATOM 724 O ALA A 49 2.515 2.300 -4.399 1.00 0.00 O ATOM 725 CB ALA A 49 -0.299 1.338 -3.835 1.00 0.00 C ATOM 0 H ALA A 49 -1.469 3.554 -4.011 1.00 0.00 H new ATOM 0 HA ALA A 49 0.754 2.575 -2.471 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.449 0.545 -3.816 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.081 1.116 -3.109 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.736 1.401 -4.832 1.00 0.00 H new ATOM 731 N ASP A 50 1.365 4.041 -5.164 1.00 0.00 N ATOM 732 CA ASP A 50 2.374 4.491 -6.107 1.00 0.00 C ATOM 733 C ASP A 50 3.442 5.261 -5.344 1.00 0.00 C ATOM 734 O ASP A 50 4.465 5.666 -5.884 1.00 0.00 O ATOM 735 CB ASP A 50 1.711 5.359 -7.187 1.00 0.00 C ATOM 736 CG ASP A 50 2.642 5.835 -8.269 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.994 5.030 -9.155 1.00 0.00 O ATOM 738 OD2 ASP A 50 2.974 7.046 -8.302 1.00 0.00 O ATOM 0 H ASP A 50 0.533 4.631 -5.140 1.00 0.00 H new ATOM 0 HA ASP A 50 2.846 3.644 -6.605 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.903 4.790 -7.646 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.258 6.227 -6.709 1.00 0.00 H new ATOM 743 N ASN A 51 3.199 5.443 -4.063 1.00 0.00 N ATOM 744 CA ASN A 51 4.147 6.078 -3.187 1.00 0.00 C ATOM 745 C ASN A 51 4.877 4.968 -2.486 1.00 0.00 C ATOM 746 O ASN A 51 4.463 3.819 -2.552 1.00 0.00 O ATOM 747 CB ASN A 51 3.473 6.931 -2.073 1.00 0.00 C ATOM 748 CG ASN A 51 2.609 8.119 -2.507 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.586 9.152 -1.835 1.00 0.00 O ATOM 750 ND2 ASN A 51 1.854 7.977 -3.543 1.00 0.00 N ATOM 0 H ASN A 51 2.336 5.153 -3.604 1.00 0.00 H new ATOM 0 HA ASN A 51 4.778 6.736 -3.784 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.852 6.267 -1.472 1.00 0.00 H new ATOM 0 HB3 ASN A 51 4.259 7.310 -1.419 1.00 0.00 H new ATOM 0 HD21 ASN A 51 1.222 8.728 -3.820 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.889 7.114 -4.085 1.00 0.00 H new ATOM 757 N TRP A 52 5.932 5.284 -1.820 1.00 0.00 N ATOM 758 CA TRP A 52 6.576 4.306 -0.999 1.00 0.00 C ATOM 759 C TRP A 52 5.977 4.459 0.363 1.00 0.00 C ATOM 760 O TRP A 52 5.951 5.546 0.886 1.00 0.00 O ATOM 761 CB TRP A 52 8.089 4.525 -0.969 1.00 0.00 C ATOM 762 CG TRP A 52 8.692 4.436 -2.330 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.956 3.305 -3.022 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.094 5.523 -3.169 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.483 3.614 -4.248 1.00 0.00 N ATOM 766 CE2 TRP A 52 9.587 4.966 -4.360 1.00 0.00 C ATOM 767 CE3 TRP A 52 9.083 6.906 -3.030 1.00 0.00 C ATOM 768 CZ2 TRP A 52 10.065 5.742 -5.405 1.00 0.00 C ATOM 769 CZ3 TRP A 52 9.557 7.672 -4.063 1.00 0.00 C ATOM 770 CH2 TRP A 52 10.042 7.091 -5.239 1.00 0.00 C ATOM 0 H TRP A 52 6.370 6.205 -1.824 1.00 0.00 H new ATOM 0 HA TRP A 52 6.426 3.298 -1.385 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.306 5.503 -0.539 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.550 3.782 -0.318 1.00 0.00 H new ATOM 0 HD1 TRP A 52 8.777 2.303 -2.661 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.754 2.939 -4.963 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.709 7.367 -2.128 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 10.440 5.293 -6.313 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 9.556 8.748 -3.967 1.00 0.00 H new ATOM 0 HH2 TRP A 52 10.406 7.727 -6.032 1.00 0.00 H new ATOM 781 N LEU A 53 5.405 3.430 0.876 1.00 0.00 N ATOM 782 CA LEU A 53 4.773 3.545 2.164 1.00 0.00 C ATOM 783 C LEU A 53 4.916 2.320 3.028 1.00 0.00 C ATOM 784 O LEU A 53 4.812 1.187 2.563 1.00 0.00 O ATOM 785 CB LEU A 53 3.319 4.125 2.099 1.00 0.00 C ATOM 786 CG LEU A 53 2.190 3.362 1.365 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.930 4.211 1.374 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.545 3.010 -0.075 1.00 0.00 C ATOM 0 H LEU A 53 5.355 2.508 0.442 1.00 0.00 H new ATOM 0 HA LEU A 53 5.347 4.307 2.692 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.988 4.274 3.127 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.389 5.111 1.640 1.00 0.00 H new ATOM 0 HG LEU A 53 2.038 2.423 1.897 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.130 3.680 0.858 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.631 4.407 2.404 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.124 5.156 0.866 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.713 2.476 -0.535 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.744 3.924 -0.635 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.433 2.377 -0.087 1.00 0.00 H new ATOM 800 N THR A 54 5.202 2.580 4.286 1.00 0.00 N ATOM 801 CA THR A 54 5.466 1.589 5.276 1.00 0.00 C ATOM 802 C THR A 54 4.137 0.892 5.657 1.00 0.00 C ATOM 803 O THR A 54 3.103 1.543 5.670 1.00 0.00 O ATOM 804 CB THR A 54 6.081 2.330 6.493 1.00 0.00 C ATOM 805 OG1 THR A 54 7.145 3.179 6.019 1.00 0.00 O ATOM 806 CG2 THR A 54 6.652 1.373 7.532 1.00 0.00 C ATOM 0 H THR A 54 5.256 3.531 4.650 1.00 0.00 H new ATOM 0 HA THR A 54 6.153 0.822 4.919 1.00 0.00 H new ATOM 0 HB THR A 54 5.286 2.903 6.971 1.00 0.00 H new ATOM 0 HG1 THR A 54 7.170 3.156 5.040 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.069 1.944 8.362 1.00 0.00 H new ATOM 0 HG22 THR A 54 5.860 0.722 7.902 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.436 0.768 7.077 1.00 0.00 H new ATOM 814 N PRO A 55 4.147 -0.431 5.930 1.00 0.00 N ATOM 815 CA PRO A 55 2.935 -1.210 6.287 1.00 0.00 C ATOM 816 C PRO A 55 2.056 -0.571 7.378 1.00 0.00 C ATOM 817 O PRO A 55 0.825 -0.620 7.294 1.00 0.00 O ATOM 818 CB PRO A 55 3.502 -2.527 6.761 1.00 0.00 C ATOM 819 CG PRO A 55 4.750 -2.678 5.976 1.00 0.00 C ATOM 820 CD PRO A 55 5.334 -1.308 5.850 1.00 0.00 C ATOM 0 HA PRO A 55 2.259 -1.284 5.436 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.702 -2.514 7.832 1.00 0.00 H new ATOM 0 HB3 PRO A 55 2.811 -3.350 6.576 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.445 -3.352 6.476 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.543 -3.104 4.994 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.045 -1.098 6.649 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.866 -1.181 4.907 1.00 0.00 H new ATOM 828 N THR A 56 2.674 0.021 8.391 1.00 0.00 N ATOM 829 CA THR A 56 1.921 0.687 9.446 1.00 0.00 C ATOM 830 C THR A 56 1.165 1.932 8.888 1.00 0.00 C ATOM 831 O THR A 56 0.013 2.217 9.265 1.00 0.00 O ATOM 832 CB THR A 56 2.840 1.057 10.665 1.00 0.00 C ATOM 833 OG1 THR A 56 2.049 1.563 11.752 1.00 0.00 O ATOM 834 CG2 THR A 56 3.910 2.082 10.289 1.00 0.00 C ATOM 0 H THR A 56 3.687 0.054 8.505 1.00 0.00 H new ATOM 0 HA THR A 56 1.172 -0.013 9.817 1.00 0.00 H new ATOM 0 HB THR A 56 3.346 0.142 10.973 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.634 1.788 12.505 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.521 2.307 11.163 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.542 1.675 9.499 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.431 2.995 9.936 1.00 0.00 H new ATOM 842 N ASP A 57 1.769 2.582 7.896 1.00 0.00 N ATOM 843 CA ASP A 57 1.220 3.764 7.238 1.00 0.00 C ATOM 844 C ASP A 57 0.103 3.294 6.326 1.00 0.00 C ATOM 845 O ASP A 57 -1.001 3.828 6.338 1.00 0.00 O ATOM 846 CB ASP A 57 2.362 4.442 6.443 1.00 0.00 C ATOM 847 CG ASP A 57 2.085 5.856 5.965 1.00 0.00 C ATOM 848 OD1 ASP A 57 2.102 6.788 6.803 1.00 0.00 O ATOM 849 OD2 ASP A 57 1.984 6.080 4.753 1.00 0.00 O ATOM 0 H ASP A 57 2.673 2.295 7.520 1.00 0.00 H new ATOM 0 HA ASP A 57 0.818 4.490 7.945 1.00 0.00 H new ATOM 0 HB2 ASP A 57 3.255 4.458 7.068 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.592 3.824 5.575 1.00 0.00 H new ATOM 854 N TRP A 58 0.396 2.214 5.610 1.00 0.00 N ATOM 855 CA TRP A 58 -0.547 1.514 4.754 1.00 0.00 C ATOM 856 C TRP A 58 -1.825 1.179 5.538 1.00 0.00 C ATOM 857 O TRP A 58 -2.928 1.533 5.128 1.00 0.00 O ATOM 858 CB TRP A 58 0.085 0.205 4.271 1.00 0.00 C ATOM 859 CG TRP A 58 0.357 0.092 2.801 1.00 0.00 C ATOM 860 CD1 TRP A 58 -0.100 0.895 1.792 1.00 0.00 C ATOM 861 CD2 TRP A 58 1.112 -0.941 2.165 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.362 0.427 0.585 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.093 -0.685 0.788 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.816 -2.056 2.626 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.735 -1.486 -0.126 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.450 -2.860 1.703 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.399 -2.564 0.340 1.00 0.00 C ATOM 0 H TRP A 58 1.324 1.791 5.611 1.00 0.00 H new ATOM 0 HA TRP A 58 -0.795 2.153 3.906 1.00 0.00 H new ATOM 0 HB2 TRP A 58 1.026 0.065 4.803 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -0.570 -0.617 4.560 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.728 1.764 1.924 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.179 0.855 -0.323 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.862 -2.283 3.681 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 1.709 -1.260 -1.182 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.993 -3.731 2.039 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.904 -3.214 -0.359 1.00 0.00 H new ATOM 878 N ASN A 59 -1.669 0.502 6.673 1.00 0.00 N ATOM 879 CA ASN A 59 -2.816 0.134 7.508 1.00 0.00 C ATOM 880 C ASN A 59 -3.624 1.330 7.932 1.00 0.00 C ATOM 881 O ASN A 59 -4.841 1.264 7.950 1.00 0.00 O ATOM 882 CB ASN A 59 -2.434 -0.730 8.715 1.00 0.00 C ATOM 883 CG ASN A 59 -2.350 -2.214 8.388 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.021 -2.617 7.252 1.00 0.00 O ATOM 885 ND2 ASN A 59 -2.694 -3.034 9.348 1.00 0.00 N ATOM 0 H ASN A 59 -0.766 0.197 7.037 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.448 -0.483 6.869 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.472 -0.395 9.103 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.167 -0.580 9.507 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.700 -4.040 9.182 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -2.956 -2.667 10.263 1.00 0.00 H new ATOM 892 N THR A 60 -2.949 2.437 8.188 1.00 0.00 N ATOM 893 CA THR A 60 -3.615 3.663 8.585 1.00 0.00 C ATOM 894 C THR A 60 -4.530 4.163 7.431 1.00 0.00 C ATOM 895 O THR A 60 -5.708 4.525 7.650 1.00 0.00 O ATOM 896 CB THR A 60 -2.571 4.750 8.954 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.668 4.232 9.962 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.256 6.004 9.489 1.00 0.00 C ATOM 0 H THR A 60 -1.933 2.511 8.127 1.00 0.00 H new ATOM 0 HA THR A 60 -4.229 3.463 9.463 1.00 0.00 H new ATOM 0 HB THR A 60 -2.016 5.013 8.054 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.050 3.593 9.550 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.503 6.751 9.740 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.925 6.406 8.728 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.830 5.753 10.381 1.00 0.00 H new ATOM 906 N LEU A 61 -3.997 4.075 6.207 1.00 0.00 N ATOM 907 CA LEU A 61 -4.671 4.513 4.992 1.00 0.00 C ATOM 908 C LEU A 61 -6.016 3.796 4.861 1.00 0.00 C ATOM 909 O LEU A 61 -7.065 4.423 4.993 1.00 0.00 O ATOM 910 CB LEU A 61 -3.735 4.230 3.768 1.00 0.00 C ATOM 911 CG LEU A 61 -4.113 4.763 2.349 1.00 0.00 C ATOM 912 CD1 LEU A 61 -5.348 4.105 1.747 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.260 6.270 2.354 1.00 0.00 C ATOM 0 H LEU A 61 -3.068 3.690 6.036 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.875 5.583 5.029 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.752 4.633 4.013 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.626 3.148 3.688 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.280 4.485 1.703 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.543 4.530 0.762 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.179 3.032 1.652 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.207 4.281 2.395 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.523 6.613 1.354 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.045 6.557 3.054 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -3.318 6.726 2.658 1.00 0.00 H new ATOM 925 N VAL A 62 -5.956 2.479 4.688 1.00 0.00 N ATOM 926 CA VAL A 62 -7.146 1.634 4.461 1.00 0.00 C ATOM 927 C VAL A 62 -8.217 1.810 5.539 1.00 0.00 C ATOM 928 O VAL A 62 -9.376 2.126 5.241 1.00 0.00 O ATOM 929 CB VAL A 62 -6.762 0.112 4.300 1.00 0.00 C ATOM 930 CG1 VAL A 62 -5.826 -0.368 5.399 1.00 0.00 C ATOM 931 CG2 VAL A 62 -7.997 -0.763 4.275 1.00 0.00 C ATOM 0 H VAL A 62 -5.080 1.956 4.700 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.579 1.978 3.522 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.239 0.028 3.348 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.592 -1.421 5.243 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.906 0.216 5.374 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.309 -0.243 6.368 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.702 -1.806 4.163 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.549 -0.640 5.207 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.631 -0.474 3.437 1.00 0.00 H new ATOM 941 N ARG A 63 -7.798 1.669 6.767 1.00 0.00 N ATOM 942 CA ARG A 63 -8.715 1.678 7.925 1.00 0.00 C ATOM 943 C ARG A 63 -9.391 3.025 8.151 1.00 0.00 C ATOM 944 O ARG A 63 -10.402 3.105 8.852 1.00 0.00 O ATOM 945 CB ARG A 63 -8.036 1.191 9.200 1.00 0.00 C ATOM 946 CG ARG A 63 -7.017 2.144 9.779 1.00 0.00 C ATOM 947 CD ARG A 63 -6.232 1.477 10.876 1.00 0.00 C ATOM 948 NE ARG A 63 -5.253 2.388 11.481 1.00 0.00 N ATOM 949 CZ ARG A 63 -4.024 2.037 11.911 1.00 0.00 C ATOM 950 NH1 ARG A 63 -3.652 0.757 11.943 1.00 0.00 N ATOM 951 NH2 ARG A 63 -3.182 2.970 12.340 1.00 0.00 N ATOM 0 H ARG A 63 -6.817 1.543 7.016 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.504 0.970 7.671 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -8.801 0.999 9.952 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.546 0.239 8.993 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.340 2.482 8.994 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.519 3.029 10.170 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.916 1.117 11.644 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.716 0.605 10.474 1.00 0.00 H new ATOM 0 HE ARG A 63 -5.524 3.366 11.585 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.300 0.030 11.640 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.719 0.505 12.270 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.465 3.950 12.344 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -2.252 2.707 12.666 1.00 0.00 H new ATOM 965 N ALA A 64 -8.835 4.077 7.614 1.00 0.00 N ATOM 966 CA ALA A 64 -9.466 5.370 7.750 1.00 0.00 C ATOM 967 C ALA A 64 -10.343 5.687 6.533 1.00 0.00 C ATOM 968 O ALA A 64 -11.529 5.990 6.677 1.00 0.00 O ATOM 969 CB ALA A 64 -8.421 6.455 7.962 1.00 0.00 C ATOM 0 H ALA A 64 -7.962 4.071 7.086 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.112 5.340 8.627 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -8.915 7.421 8.062 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.854 6.242 8.868 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.744 6.480 7.108 1.00 0.00 H new ATOM 975 N VAL A 65 -9.729 5.645 5.385 1.00 0.00 N ATOM 976 CA VAL A 65 -10.414 5.992 4.119 1.00 0.00 C ATOM 977 C VAL A 65 -11.727 5.204 3.873 1.00 0.00 C ATOM 978 O VAL A 65 -12.758 5.798 3.555 1.00 0.00 O ATOM 979 CB VAL A 65 -9.488 5.928 2.875 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.310 6.874 3.047 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.009 4.509 2.594 1.00 0.00 C ATOM 0 H VAL A 65 -8.751 5.376 5.273 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.697 7.035 4.259 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.071 6.245 2.010 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.668 6.820 2.168 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.677 7.894 3.166 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.740 6.588 3.931 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.364 4.510 1.715 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.451 4.136 3.453 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.869 3.864 2.412 1.00 0.00 H new ATOM 991 N LEU A 66 -11.716 3.905 4.091 1.00 0.00 N ATOM 992 CA LEU A 66 -12.895 3.091 3.864 1.00 0.00 C ATOM 993 C LEU A 66 -13.442 2.651 5.187 1.00 0.00 C ATOM 994 O LEU A 66 -12.755 2.741 6.217 1.00 0.00 O ATOM 995 CB LEU A 66 -12.590 1.851 2.991 1.00 0.00 C ATOM 996 CG LEU A 66 -12.888 1.914 1.477 1.00 0.00 C ATOM 997 CD1 LEU A 66 -14.383 1.965 1.202 1.00 0.00 C ATOM 998 CD2 LEU A 66 -12.172 3.075 0.833 1.00 0.00 C ATOM 0 H LEU A 66 -10.903 3.388 4.426 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.625 3.696 3.326 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.532 1.616 3.109 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.151 1.012 3.403 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.508 0.996 1.028 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.554 2.009 0.126 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -14.858 1.073 1.609 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -14.810 2.850 1.673 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.399 3.096 -0.233 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.502 4.006 1.293 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.097 2.962 0.973 1.00 0.00 H new ATOM 1010 N SER A 67 -14.655 2.201 5.187 1.00 0.00 N ATOM 1011 CA SER A 67 -15.244 1.729 6.393 1.00 0.00 C ATOM 1012 C SER A 67 -15.998 0.436 6.130 1.00 0.00 C ATOM 1013 O SER A 67 -16.972 0.410 5.358 1.00 0.00 O ATOM 1014 CB SER A 67 -16.188 2.799 6.962 1.00 0.00 C ATOM 1015 OG SER A 67 -15.506 4.049 7.134 1.00 0.00 O ATOM 0 H SER A 67 -15.256 2.151 4.364 1.00 0.00 H new ATOM 0 HA SER A 67 -14.461 1.529 7.124 1.00 0.00 H new ATOM 0 HB2 SER A 67 -17.037 2.933 6.292 1.00 0.00 H new ATOM 0 HB3 SER A 67 -16.588 2.464 7.919 1.00 0.00 H new ATOM 0 HG SER A 67 -16.128 4.714 7.496 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.533 -0.622 6.723 1.00 0.00 N ATOM 1022 CA GLY A 68 -16.225 -1.868 6.654 1.00 0.00 C ATOM 1023 C GLY A 68 -15.644 -2.820 5.638 1.00 0.00 C ATOM 1024 O GLY A 68 -14.822 -3.677 5.982 1.00 0.00 O ATOM 0 H GLY A 68 -14.669 -0.644 7.264 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -16.206 -2.340 7.636 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.271 -1.681 6.410 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.046 -2.641 4.391 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.685 -3.551 3.311 1.00 0.00 C ATOM 1030 C GLY A 69 -14.194 -3.659 3.049 1.00 0.00 C ATOM 1031 O GLY A 69 -13.716 -4.701 2.586 1.00 0.00 O ATOM 0 H GLY A 69 -16.633 -1.860 4.096 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.073 -4.543 3.544 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.179 -3.223 2.396 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.474 -2.592 3.330 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.037 -2.523 3.137 1.00 0.00 C ATOM 1037 C ASP A 70 -11.297 -3.687 3.758 1.00 0.00 C ATOM 1038 O ASP A 70 -10.623 -4.427 3.055 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.482 -1.211 3.689 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.879 -0.938 5.132 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.028 -0.549 5.364 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -11.067 -1.149 6.053 1.00 0.00 O ATOM 0 H ASP A 70 -13.876 -1.733 3.705 1.00 0.00 H new ATOM 0 HA ASP A 70 -11.873 -2.573 2.060 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.394 -1.228 3.618 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -11.829 -0.388 3.064 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.474 -3.883 5.051 1.00 0.00 N ATOM 1048 CA HIS A 71 -10.707 -4.859 5.781 1.00 0.00 C ATOM 1049 C HIS A 71 -10.886 -6.245 5.195 1.00 0.00 C ATOM 1050 O HIS A 71 -9.908 -6.892 4.835 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.045 -4.845 7.271 1.00 0.00 C ATOM 1052 CG HIS A 71 -9.980 -5.479 8.129 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -9.097 -4.745 8.883 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.655 -6.778 8.343 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -8.281 -5.555 9.521 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -8.596 -6.795 9.208 1.00 0.00 N ATOM 0 H HIS A 71 -12.151 -3.371 5.617 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.657 -4.585 5.683 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -11.196 -3.815 7.593 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -11.988 -5.369 7.428 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -10.142 -7.639 7.910 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -7.487 -5.254 10.189 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -8.127 -7.632 9.554 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.117 -6.685 5.054 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.345 -8.001 4.525 1.00 0.00 C ATOM 1067 C LEU A 72 -11.828 -8.232 3.098 1.00 0.00 C ATOM 1068 O LEU A 72 -11.041 -9.156 2.887 1.00 0.00 O ATOM 1069 CB LEU A 72 -13.744 -8.615 4.852 1.00 0.00 C ATOM 1070 CG LEU A 72 -14.996 -7.708 4.862 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.332 -7.158 3.500 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.180 -8.476 5.417 1.00 0.00 C ATOM 0 H LEU A 72 -12.957 -6.159 5.294 1.00 0.00 H new ATOM 0 HA LEU A 72 -11.674 -8.626 5.115 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -13.926 -9.413 4.132 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -13.673 -9.082 5.834 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.769 -6.854 5.500 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.220 -6.529 3.570 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.495 -6.565 3.131 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.524 -7.982 2.812 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.060 -7.833 5.422 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.372 -9.349 4.793 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -15.960 -8.798 6.435 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.152 -7.376 2.151 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.669 -7.630 0.795 1.00 0.00 C ATOM 1086 C LEU A 73 -10.254 -7.134 0.552 1.00 0.00 C ATOM 1087 O LEU A 73 -9.355 -7.961 0.310 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.593 -7.068 -0.263 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.767 -7.937 -0.733 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.321 -9.347 -1.047 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.895 -7.943 0.253 1.00 0.00 C ATOM 0 H LEU A 73 -12.718 -6.537 2.275 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.657 -8.717 0.710 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.002 -6.131 0.115 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -11.989 -6.822 -1.137 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.140 -7.487 -1.653 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -14.178 -9.935 -1.377 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.571 -9.324 -1.838 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.892 -9.801 -0.153 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.703 -8.571 -0.122 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.543 -8.336 1.207 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.261 -6.926 0.393 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.037 -5.808 0.662 1.00 0.00 N ATOM 1104 CA TRP A 74 -8.725 -5.217 0.508 1.00 0.00 C ATOM 1105 C TRP A 74 -7.698 -5.912 1.391 1.00 0.00 C ATOM 1106 O TRP A 74 -6.633 -6.271 0.974 1.00 0.00 O ATOM 1107 CB TRP A 74 -8.715 -3.726 0.912 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.440 -2.668 0.062 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.339 -2.796 -0.968 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.182 -1.281 0.180 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -10.743 -1.520 -1.401 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.035 -0.578 -0.684 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.327 -0.601 0.974 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.044 0.826 -0.748 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.300 0.797 0.929 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.171 1.506 0.081 1.00 0.00 C ATOM 0 H TRP A 74 -10.775 -5.132 0.860 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.474 -5.329 -0.547 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.130 -3.665 1.918 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -7.671 -3.421 0.979 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -10.683 -3.732 -1.382 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.439 -1.325 -2.121 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.666 -1.135 1.641 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.707 1.353 -1.418 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.603 1.338 1.552 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.157 2.586 0.078 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.034 -6.092 2.600 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.068 -6.537 3.561 1.00 0.00 C ATOM 1129 C LYS A 75 -6.853 -8.016 3.703 1.00 0.00 C ATOM 1130 O LYS A 75 -5.689 -8.430 3.835 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.120 -5.756 4.840 1.00 0.00 C ATOM 1132 CG LYS A 75 -6.942 -4.279 4.561 1.00 0.00 C ATOM 1133 CD LYS A 75 -5.528 -3.940 4.069 1.00 0.00 C ATOM 1134 CE LYS A 75 -4.553 -3.929 5.263 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.185 -3.465 4.944 1.00 0.00 N ATOM 0 H LYS A 75 -8.973 -5.942 2.969 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.117 -6.278 3.095 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.074 -5.926 5.340 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.339 -6.102 5.517 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.669 -3.964 3.813 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.153 -3.713 5.468 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.204 -4.672 3.329 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.527 -2.967 3.577 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -4.965 -3.290 6.044 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.493 -4.937 5.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.683 -3.232 5.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.672 -4.217 4.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.237 -2.619 4.341 1.00 0.00 H new ATOM 1149 N SER A 76 -7.909 -8.843 3.648 1.00 0.00 N ATOM 1150 CA SER A 76 -7.670 -10.272 3.744 1.00 0.00 C ATOM 1151 C SER A 76 -6.843 -10.687 2.531 1.00 0.00 C ATOM 1152 O SER A 76 -5.892 -11.479 2.630 1.00 0.00 O ATOM 1153 CB SER A 76 -8.980 -11.072 3.839 1.00 0.00 C ATOM 1154 OG SER A 76 -8.743 -12.462 4.064 1.00 0.00 O ATOM 0 H SER A 76 -8.883 -8.558 3.543 1.00 0.00 H new ATOM 0 HA SER A 76 -7.125 -10.492 4.662 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.591 -10.673 4.649 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.549 -10.946 2.918 1.00 0.00 H new ATOM 0 HG SER A 76 -9.599 -12.935 4.120 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.131 -10.050 1.409 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.400 -10.293 0.214 1.00 0.00 C ATOM 1162 C GLU A 77 -5.049 -9.620 0.212 1.00 0.00 C ATOM 1163 O GLU A 77 -4.188 -10.008 -0.557 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.214 -9.910 -0.978 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.250 -10.940 -1.326 1.00 0.00 C ATOM 1166 CD GLU A 77 -7.637 -12.101 -2.045 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -7.322 -11.938 -3.228 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -7.494 -13.181 -1.472 1.00 0.00 O ATOM 0 H GLU A 77 -7.875 -9.358 1.318 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.199 -11.363 0.164 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.706 -8.956 -0.786 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.553 -9.762 -1.832 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.740 -11.289 -0.417 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.021 -10.488 -1.950 1.00 0.00 H new ATOM 1175 N PHE A 78 -4.854 -8.604 1.049 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.549 -7.986 1.169 1.00 0.00 C ATOM 1177 C PHE A 78 -2.569 -9.018 1.638 1.00 0.00 C ATOM 1178 O PHE A 78 -1.499 -9.173 1.063 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.585 -6.781 2.128 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.227 -6.259 2.513 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.462 -5.537 1.619 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -1.717 -6.504 3.781 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.214 -5.072 1.978 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.471 -6.040 4.145 1.00 0.00 C ATOM 1185 CZ PHE A 78 0.282 -5.324 3.243 1.00 0.00 C ATOM 0 H PHE A 78 -5.577 -8.200 1.644 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.241 -7.606 0.195 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.152 -5.976 1.661 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.122 -7.067 3.032 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -1.844 -5.334 0.629 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.305 -7.066 4.492 1.00 0.00 H new ATOM 0 HE1 PHE A 78 0.376 -4.510 1.269 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.087 -6.238 5.135 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.259 -4.959 3.523 1.00 0.00 H new ATOM 1195 N PHE A 79 -2.963 -9.744 2.642 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.125 -10.773 3.193 1.00 0.00 C ATOM 1197 C PHE A 79 -1.946 -11.915 2.210 1.00 0.00 C ATOM 1198 O PHE A 79 -0.809 -12.328 1.915 1.00 0.00 O ATOM 1199 CB PHE A 79 -2.697 -11.270 4.514 1.00 0.00 C ATOM 1200 CG PHE A 79 -2.653 -10.234 5.600 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -1.478 -9.975 6.285 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -3.782 -9.504 5.923 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -1.431 -9.008 7.269 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -3.746 -8.538 6.904 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.568 -8.287 7.578 1.00 0.00 C ATOM 0 H PHE A 79 -3.868 -9.643 3.101 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.140 -10.348 3.385 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.729 -11.584 4.361 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.140 -12.150 4.836 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.587 -10.537 6.046 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.706 -9.694 5.398 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.508 -8.816 7.796 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -4.637 -7.978 7.145 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.535 -7.528 8.346 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.053 -12.383 1.658 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.024 -13.503 0.747 1.00 0.00 C ATOM 1217 C GLU A 80 -2.188 -13.224 -0.489 1.00 0.00 C ATOM 1218 O GLU A 80 -1.384 -14.067 -0.871 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.423 -13.989 0.389 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.225 -14.429 1.603 1.00 0.00 C ATOM 1221 CD GLU A 80 -4.459 -15.382 2.491 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -4.339 -16.578 2.161 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -3.957 -14.949 3.551 1.00 0.00 O ATOM 0 H GLU A 80 -3.983 -12.000 1.829 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.531 -14.317 1.279 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.959 -13.191 -0.125 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.345 -14.822 -0.310 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.513 -13.551 2.181 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.146 -14.908 1.271 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.346 -12.037 -1.094 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.530 -11.656 -2.265 1.00 0.00 C ATOM 1232 C ASN A 81 -0.067 -11.630 -1.943 1.00 0.00 C ATOM 1233 O ASN A 81 0.735 -12.212 -2.679 1.00 0.00 O ATOM 1234 CB ASN A 81 -1.909 -10.295 -2.900 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.114 -10.339 -3.813 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -2.988 -10.678 -4.982 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.245 -9.906 -3.340 1.00 0.00 N ATOM 0 H ASN A 81 -3.020 -11.331 -0.800 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.749 -12.435 -2.995 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.100 -9.578 -2.102 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.055 -9.922 -3.465 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.061 -9.841 -3.949 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.316 -9.631 -2.360 1.00 0.00 H new ATOM 1244 N CYS A 82 0.287 -10.986 -0.834 1.00 0.00 N ATOM 1245 CA CYS A 82 1.680 -10.847 -0.448 1.00 0.00 C ATOM 1246 C CYS A 82 2.357 -12.196 -0.254 1.00 0.00 C ATOM 1247 O CYS A 82 3.344 -12.483 -0.904 1.00 0.00 O ATOM 1248 CB CYS A 82 1.827 -9.991 0.801 1.00 0.00 C ATOM 1249 SG CYS A 82 1.244 -8.294 0.613 1.00 0.00 S ATOM 0 H CYS A 82 -0.375 -10.554 -0.190 1.00 0.00 H new ATOM 0 HA CYS A 82 2.184 -10.341 -1.271 1.00 0.00 H new ATOM 0 HB2 CYS A 82 1.279 -10.463 1.617 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.877 -9.972 1.092 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.050 -8.264 0.734 1.00 0.00 H new ATOM 1255 N ARG A 83 1.784 -13.057 0.567 1.00 0.00 N ATOM 1256 CA ARG A 83 2.423 -14.341 0.840 1.00 0.00 C ATOM 1257 C ARG A 83 2.316 -15.311 -0.335 1.00 0.00 C ATOM 1258 O ARG A 83 3.107 -16.227 -0.466 1.00 0.00 O ATOM 1259 CB ARG A 83 2.018 -14.986 2.181 1.00 0.00 C ATOM 1260 CG ARG A 83 2.494 -14.200 3.411 1.00 0.00 C ATOM 1261 CD ARG A 83 1.565 -13.047 3.725 1.00 0.00 C ATOM 1262 NE ARG A 83 2.115 -12.074 4.680 1.00 0.00 N ATOM 1263 CZ ARG A 83 1.658 -11.915 5.950 1.00 0.00 C ATOM 1264 NH1 ARG A 83 0.960 -12.882 6.540 1.00 0.00 N ATOM 1265 NH2 ARG A 83 1.939 -10.810 6.626 1.00 0.00 N ATOM 0 H ARG A 83 0.898 -12.901 1.049 1.00 0.00 H new ATOM 0 HA ARG A 83 3.480 -14.103 0.959 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.932 -15.078 2.217 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.425 -15.996 2.226 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.551 -14.867 4.271 1.00 0.00 H new ATOM 0 HG3 ARG A 83 3.500 -13.820 3.235 1.00 0.00 H new ATOM 0 HD2 ARG A 83 1.319 -12.530 2.797 1.00 0.00 H new ATOM 0 HD3 ARG A 83 0.632 -13.445 4.125 1.00 0.00 H new ATOM 0 HE ARG A 83 2.886 -11.482 4.371 1.00 0.00 H new ATOM 0 HH11 ARG A 83 0.765 -13.749 6.039 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.620 -12.756 7.493 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.500 -10.076 6.193 1.00 0.00 H new ATOM 0 HH22 ARG A 83 1.595 -10.694 7.579 1.00 0.00 H new ATOM 1279 N ASP A 84 1.334 -15.111 -1.188 1.00 0.00 N ATOM 1280 CA ASP A 84 1.168 -15.941 -2.390 1.00 0.00 C ATOM 1281 C ASP A 84 2.299 -15.691 -3.323 1.00 0.00 C ATOM 1282 O ASP A 84 2.966 -16.606 -3.812 1.00 0.00 O ATOM 1283 CB ASP A 84 -0.082 -15.570 -3.110 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.413 -16.570 -4.156 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.964 -17.629 -3.815 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -0.119 -16.325 -5.330 1.00 0.00 O ATOM 0 H ASP A 84 0.630 -14.381 -1.082 1.00 0.00 H new ATOM 0 HA ASP A 84 1.132 -16.985 -2.078 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.906 -15.495 -2.400 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.036 -14.587 -3.566 1.00 0.00 H new ATOM 1291 N THR A 85 2.517 -14.443 -3.538 1.00 0.00 N ATOM 1292 CA THR A 85 3.551 -13.945 -4.363 1.00 0.00 C ATOM 1293 C THR A 85 4.926 -14.207 -3.682 1.00 0.00 C ATOM 1294 O THR A 85 5.958 -14.335 -4.344 1.00 0.00 O ATOM 1295 CB THR A 85 3.264 -12.454 -4.563 1.00 0.00 C ATOM 1296 OG1 THR A 85 1.937 -12.320 -5.123 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.282 -11.775 -5.460 1.00 0.00 C ATOM 0 H THR A 85 1.948 -13.707 -3.120 1.00 0.00 H new ATOM 0 HA THR A 85 3.590 -14.439 -5.334 1.00 0.00 H new ATOM 0 HB THR A 85 3.331 -11.959 -3.594 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.280 -12.260 -4.398 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.028 -10.720 -5.566 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.274 -11.867 -5.019 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.276 -12.250 -6.441 1.00 0.00 H new ATOM 1305 N ALA A 86 4.887 -14.359 -2.377 1.00 0.00 N ATOM 1306 CA ALA A 86 6.062 -14.710 -1.630 1.00 0.00 C ATOM 1307 C ALA A 86 6.449 -16.124 -1.954 1.00 0.00 C ATOM 1308 O ALA A 86 7.618 -16.398 -2.191 1.00 0.00 O ATOM 1309 CB ALA A 86 5.832 -14.558 -0.162 1.00 0.00 C ATOM 0 H ALA A 86 4.045 -14.243 -1.813 1.00 0.00 H new ATOM 0 HA ALA A 86 6.871 -14.035 -1.910 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.738 -14.831 0.378 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.574 -13.523 0.061 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.015 -15.210 0.148 1.00 0.00 H new ATOM 1315 N LYS A 87 5.445 -17.022 -1.992 1.00 0.00 N ATOM 1316 CA LYS A 87 5.651 -18.420 -2.391 1.00 0.00 C ATOM 1317 C LYS A 87 6.311 -18.466 -3.761 1.00 0.00 C ATOM 1318 O LYS A 87 7.174 -19.304 -4.027 1.00 0.00 O ATOM 1319 CB LYS A 87 4.328 -19.221 -2.437 1.00 0.00 C ATOM 1320 CG LYS A 87 3.600 -19.333 -1.107 1.00 0.00 C ATOM 1321 CD LYS A 87 2.469 -20.367 -1.159 1.00 0.00 C ATOM 1322 CE LYS A 87 1.271 -19.903 -1.983 1.00 0.00 C ATOM 1323 NZ LYS A 87 0.451 -18.906 -1.262 1.00 0.00 N ATOM 0 H LYS A 87 4.480 -16.798 -1.749 1.00 0.00 H new ATOM 0 HA LYS A 87 6.292 -18.881 -1.640 1.00 0.00 H new ATOM 0 HB2 LYS A 87 3.662 -18.752 -3.161 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.541 -20.225 -2.804 1.00 0.00 H new ATOM 0 HG2 LYS A 87 4.309 -19.610 -0.327 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.190 -18.360 -0.834 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.853 -21.296 -1.579 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.140 -20.588 -0.144 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.622 -19.473 -2.921 1.00 0.00 H new ATOM 0 HE3 LYS A 87 0.653 -20.763 -2.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -0.190 -18.434 -1.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -0.107 -19.383 -0.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 1.073 -18.199 -0.821 1.00 0.00 H new ATOM 1337 N ARG A 88 5.910 -17.540 -4.615 1.00 0.00 N ATOM 1338 CA ARG A 88 6.486 -17.403 -5.941 1.00 0.00 C ATOM 1339 C ARG A 88 7.954 -16.986 -5.882 1.00 0.00 C ATOM 1340 O ARG A 88 8.801 -17.608 -6.534 1.00 0.00 O ATOM 1341 CB ARG A 88 5.680 -16.439 -6.827 1.00 0.00 C ATOM 1342 CG ARG A 88 4.599 -17.103 -7.672 1.00 0.00 C ATOM 1343 CD ARG A 88 3.540 -17.826 -6.857 1.00 0.00 C ATOM 1344 NE ARG A 88 2.713 -18.661 -7.734 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.528 -19.192 -7.443 1.00 0.00 C ATOM 1346 NH1 ARG A 88 0.781 -18.699 -6.468 1.00 0.00 N ATOM 1347 NH2 ARG A 88 1.042 -20.136 -8.222 1.00 0.00 N ATOM 0 H ARG A 88 5.176 -16.862 -4.408 1.00 0.00 H new ATOM 0 HA ARG A 88 6.437 -18.390 -6.401 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.214 -15.687 -6.191 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.369 -15.914 -7.489 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.115 -16.344 -8.287 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.068 -17.814 -8.352 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.015 -18.444 -6.095 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.914 -17.102 -6.335 1.00 0.00 H new ATOM 0 HE ARG A 88 3.085 -18.855 -8.664 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.111 -17.900 -5.927 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.125 -19.118 -6.258 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.573 -20.450 -9.035 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.135 -20.553 -8.013 1.00 0.00 H new ATOM 1361 N ASN A 89 8.260 -15.976 -5.077 1.00 0.00 N ATOM 1362 CA ASN A 89 9.629 -15.466 -4.967 1.00 0.00 C ATOM 1363 C ASN A 89 10.546 -16.442 -4.256 1.00 0.00 C ATOM 1364 O ASN A 89 11.743 -16.471 -4.533 1.00 0.00 O ATOM 1365 CB ASN A 89 9.691 -14.064 -4.301 1.00 0.00 C ATOM 1366 CG ASN A 89 9.217 -12.936 -5.218 1.00 0.00 C ATOM 1367 OD1 ASN A 89 8.401 -13.130 -6.090 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.746 -11.749 -5.023 1.00 0.00 N ATOM 0 H ASN A 89 7.582 -15.491 -4.489 1.00 0.00 H new ATOM 0 HA ASN A 89 9.989 -15.355 -5.990 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.079 -14.071 -3.399 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.716 -13.863 -3.989 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.471 -10.965 -5.614 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.432 -11.612 -4.281 1.00 0.00 H new ATOM 1375 N GLN A 90 9.994 -17.265 -3.363 1.00 0.00 N ATOM 1376 CA GLN A 90 10.824 -18.221 -2.633 1.00 0.00 C ATOM 1377 C GLN A 90 11.197 -19.395 -3.517 1.00 0.00 C ATOM 1378 O GLN A 90 12.349 -19.826 -3.506 1.00 0.00 O ATOM 1379 CB GLN A 90 10.196 -18.721 -1.306 1.00 0.00 C ATOM 1380 CG GLN A 90 9.755 -17.628 -0.326 1.00 0.00 C ATOM 1381 CD GLN A 90 10.778 -16.524 -0.158 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.675 -16.597 0.680 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.614 -15.474 -0.923 1.00 0.00 N ATOM 0 H GLN A 90 9.001 -17.290 -3.132 1.00 0.00 H new ATOM 0 HA GLN A 90 11.724 -17.673 -2.352 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.331 -19.339 -1.545 1.00 0.00 H new ATOM 0 HB3 GLN A 90 10.918 -19.364 -0.803 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.817 -17.195 -0.674 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.556 -18.080 0.646 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.857 -15.454 -1.606 1.00 0.00 H new ATOM 0 HE22 GLN A 90 11.244 -14.676 -0.836 1.00 0.00 H new ATOM 1392 N GLN A 91 10.244 -19.914 -4.297 1.00 0.00 N ATOM 1393 CA GLN A 91 10.555 -21.019 -5.208 1.00 0.00 C ATOM 1394 C GLN A 91 11.453 -20.555 -6.353 1.00 0.00 C ATOM 1395 O GLN A 91 12.299 -21.299 -6.829 1.00 0.00 O ATOM 1396 CB GLN A 91 9.277 -21.716 -5.715 1.00 0.00 C ATOM 1397 CG GLN A 91 8.329 -20.841 -6.504 1.00 0.00 C ATOM 1398 CD GLN A 91 7.016 -21.534 -6.784 1.00 0.00 C ATOM 1399 OE1 GLN A 91 6.847 -22.203 -7.796 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.085 -21.388 -5.888 1.00 0.00 N ATOM 0 H GLN A 91 9.275 -19.597 -4.317 1.00 0.00 H new ATOM 0 HA GLN A 91 11.114 -21.766 -4.644 1.00 0.00 H new ATOM 0 HB2 GLN A 91 9.568 -22.561 -6.339 1.00 0.00 H new ATOM 0 HB3 GLN A 91 8.741 -22.122 -4.857 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.142 -19.920 -5.952 1.00 0.00 H new ATOM 0 HG3 GLN A 91 8.797 -20.558 -7.447 1.00 0.00 H new ATOM 0 HE21 GLN A 91 6.261 -20.823 -5.057 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.179 -21.838 -6.016 1.00 0.00 H new ATOM 1409 N ALA A 92 11.297 -19.293 -6.757 1.00 0.00 N ATOM 1410 CA ALA A 92 12.146 -18.712 -7.795 1.00 0.00 C ATOM 1411 C ALA A 92 13.529 -18.416 -7.239 1.00 0.00 C ATOM 1412 O ALA A 92 14.504 -18.295 -7.991 1.00 0.00 O ATOM 1413 CB ALA A 92 11.532 -17.435 -8.340 1.00 0.00 C ATOM 0 H ALA A 92 10.593 -18.657 -6.382 1.00 0.00 H new ATOM 0 HA ALA A 92 12.231 -19.435 -8.607 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.181 -17.020 -9.111 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.554 -17.655 -8.768 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.420 -16.712 -7.532 1.00 0.00 H new ATOM 1419 N GLY A 93 13.596 -18.301 -5.927 1.00 0.00 N ATOM 1420 CA GLY A 93 14.827 -17.999 -5.252 1.00 0.00 C ATOM 1421 C GLY A 93 15.292 -16.612 -5.566 1.00 0.00 C ATOM 1422 O GLY A 93 16.436 -16.402 -5.973 1.00 0.00 O ATOM 0 H GLY A 93 12.795 -18.416 -5.306 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.690 -18.104 -4.176 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.592 -18.717 -5.547 1.00 0.00 H new ATOM 1426 N ASN A 94 14.388 -15.668 -5.412 1.00 0.00 N ATOM 1427 CA ASN A 94 14.693 -14.272 -5.658 1.00 0.00 C ATOM 1428 C ASN A 94 15.227 -13.663 -4.385 1.00 0.00 C ATOM 1429 O ASN A 94 15.055 -14.242 -3.313 1.00 0.00 O ATOM 1430 CB ASN A 94 13.448 -13.484 -6.142 1.00 0.00 C ATOM 1431 CG ASN A 94 12.899 -13.963 -7.484 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.625 -14.506 -8.310 1.00 0.00 O ATOM 1433 ND2 ASN A 94 11.624 -13.738 -7.725 1.00 0.00 N ATOM 0 H ASN A 94 13.428 -15.843 -5.115 1.00 0.00 H new ATOM 0 HA ASN A 94 15.439 -14.214 -6.451 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.664 -13.564 -5.390 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.706 -12.428 -6.222 1.00 0.00 H new ATOM 0 HD21 ASN A 94 11.217 -14.017 -8.617 1.00 0.00 H new ATOM 0 HD22 ASN A 94 11.044 -13.284 -7.019 1.00 0.00 H new ATOM 1440 N GLY A 95 15.820 -12.498 -4.475 1.00 0.00 N ATOM 1441 CA GLY A 95 16.405 -11.844 -3.310 1.00 0.00 C ATOM 1442 C GLY A 95 15.379 -11.101 -2.476 1.00 0.00 C ATOM 1443 O GLY A 95 15.686 -10.086 -1.850 1.00 0.00 O ATOM 0 H GLY A 95 15.915 -11.973 -5.345 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.899 -12.592 -2.689 1.00 0.00 H new ATOM 0 HA3 GLY A 95 17.174 -11.145 -3.639 1.00 0.00 H new ATOM 1447 N TRP A 96 14.173 -11.620 -2.443 1.00 0.00 N ATOM 1448 CA TRP A 96 13.091 -11.031 -1.718 1.00 0.00 C ATOM 1449 C TRP A 96 12.404 -12.082 -0.918 1.00 0.00 C ATOM 1450 O TRP A 96 12.441 -13.269 -1.271 1.00 0.00 O ATOM 1451 CB TRP A 96 12.137 -10.240 -2.624 1.00 0.00 C ATOM 1452 CG TRP A 96 12.816 -9.033 -3.185 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.183 -7.929 -2.485 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.238 -8.813 -4.533 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.814 -7.038 -3.302 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.863 -7.550 -4.567 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.156 -9.557 -5.712 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 14.401 -7.017 -5.730 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.689 -9.025 -6.869 1.00 0.00 C ATOM 1460 CH2 TRP A 96 14.306 -7.769 -6.870 1.00 0.00 C ATOM 0 H TRP A 96 13.921 -12.479 -2.931 1.00 0.00 H new ATOM 0 HA TRP A 96 13.492 -10.289 -1.028 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.788 -10.877 -3.437 1.00 0.00 H new ATOM 0 HB3 TRP A 96 11.257 -9.937 -2.057 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.001 -7.778 -1.431 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.189 -6.134 -3.014 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.685 -10.529 -5.718 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 14.876 -6.047 -5.735 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.629 -9.588 -7.789 1.00 0.00 H new ATOM 0 HH2 TRP A 96 14.717 -7.384 -7.792 1.00 0.00 H new ATOM 1471 N ASP A 97 11.732 -11.666 0.092 1.00 0.00 N ATOM 1472 CA ASP A 97 11.280 -12.594 1.126 1.00 0.00 C ATOM 1473 C ASP A 97 9.882 -12.222 1.558 1.00 0.00 C ATOM 1474 O ASP A 97 9.458 -11.114 1.285 1.00 0.00 O ATOM 1475 CB ASP A 97 12.258 -12.482 2.304 1.00 0.00 C ATOM 1476 CG ASP A 97 12.062 -13.509 3.384 1.00 0.00 C ATOM 1477 OD1 ASP A 97 11.164 -13.340 4.221 1.00 0.00 O ATOM 1478 OD2 ASP A 97 12.846 -14.487 3.431 1.00 0.00 O ATOM 0 H ASP A 97 11.470 -10.693 0.247 1.00 0.00 H new ATOM 0 HA ASP A 97 11.258 -13.619 0.755 1.00 0.00 H new ATOM 0 HB2 ASP A 97 13.276 -12.566 1.923 1.00 0.00 H new ATOM 0 HB3 ASP A 97 12.163 -11.489 2.744 1.00 0.00 H new ATOM 1483 N PHE A 98 9.183 -13.115 2.250 1.00 0.00 N ATOM 1484 CA PHE A 98 7.807 -12.868 2.628 1.00 0.00 C ATOM 1485 C PHE A 98 7.714 -11.897 3.804 1.00 0.00 C ATOM 1486 O PHE A 98 6.697 -11.291 4.008 1.00 0.00 O ATOM 1487 CB PHE A 98 7.045 -14.183 2.893 1.00 0.00 C ATOM 1488 CG PHE A 98 7.010 -14.661 4.299 1.00 0.00 C ATOM 1489 CD1 PHE A 98 8.103 -15.250 4.888 1.00 0.00 C ATOM 1490 CD2 PHE A 98 5.846 -14.530 5.020 1.00 0.00 C ATOM 1491 CE1 PHE A 98 8.038 -15.694 6.191 1.00 0.00 C ATOM 1492 CE2 PHE A 98 5.761 -14.963 6.312 1.00 0.00 C ATOM 1493 CZ PHE A 98 6.859 -15.553 6.911 1.00 0.00 C ATOM 0 H PHE A 98 9.552 -14.015 2.558 1.00 0.00 H new ATOM 0 HA PHE A 98 7.316 -12.387 1.782 1.00 0.00 H new ATOM 0 HB2 PHE A 98 6.018 -14.056 2.551 1.00 0.00 H new ATOM 0 HB3 PHE A 98 7.491 -14.965 2.279 1.00 0.00 H new ATOM 0 HD1 PHE A 98 9.018 -15.366 4.326 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.983 -14.076 4.555 1.00 0.00 H new ATOM 0 HE1 PHE A 98 8.902 -16.151 6.651 1.00 0.00 H new ATOM 0 HE2 PHE A 98 4.840 -14.845 6.864 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.800 -15.902 7.931 1.00 0.00 H new ATOM 1503 N ASP A 99 8.793 -11.770 4.567 1.00 0.00 N ATOM 1504 CA ASP A 99 8.878 -10.802 5.689 1.00 0.00 C ATOM 1505 C ASP A 99 8.754 -9.422 5.094 1.00 0.00 C ATOM 1506 O ASP A 99 7.891 -8.623 5.463 1.00 0.00 O ATOM 1507 CB ASP A 99 10.273 -10.935 6.329 1.00 0.00 C ATOM 1508 CG ASP A 99 10.404 -10.356 7.717 1.00 0.00 C ATOM 1509 OD1 ASP A 99 10.360 -9.121 7.900 1.00 0.00 O ATOM 1510 OD2 ASP A 99 10.569 -11.144 8.669 1.00 0.00 O ATOM 0 H ASP A 99 9.638 -12.326 4.438 1.00 0.00 H new ATOM 0 HA ASP A 99 8.102 -10.981 6.433 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.538 -11.992 6.368 1.00 0.00 H new ATOM 0 HB3 ASP A 99 11.000 -10.448 5.680 1.00 0.00 H new ATOM 1515 N MET A 100 9.585 -9.177 4.111 1.00 0.00 N ATOM 1516 CA MET A 100 9.642 -7.900 3.451 1.00 0.00 C ATOM 1517 C MET A 100 8.475 -7.733 2.457 1.00 0.00 C ATOM 1518 O MET A 100 7.932 -6.644 2.311 1.00 0.00 O ATOM 1519 CB MET A 100 11.034 -7.704 2.805 1.00 0.00 C ATOM 1520 CG MET A 100 11.359 -8.659 1.673 1.00 0.00 C ATOM 1521 SD MET A 100 13.132 -8.872 1.387 1.00 0.00 S ATOM 1522 CE MET A 100 13.708 -7.185 1.182 1.00 0.00 C ATOM 0 H MET A 100 10.244 -9.864 3.745 1.00 0.00 H new ATOM 0 HA MET A 100 9.516 -7.105 4.186 1.00 0.00 H new ATOM 0 HB2 MET A 100 11.102 -6.683 2.429 1.00 0.00 H new ATOM 0 HB3 MET A 100 11.794 -7.810 3.579 1.00 0.00 H new ATOM 0 HG2 MET A 100 10.916 -9.631 1.891 1.00 0.00 H new ATOM 0 HG3 MET A 100 10.894 -8.295 0.757 1.00 0.00 H new ATOM 0 HE1 MET A 100 13.992 -7.021 0.142 1.00 0.00 H new ATOM 0 HE2 MET A 100 12.911 -6.493 1.454 1.00 0.00 H new ATOM 0 HE3 MET A 100 14.572 -7.015 1.825 1.00 0.00 H new ATOM 1532 N LEU A 101 8.047 -8.825 1.826 1.00 0.00 N ATOM 1533 CA LEU A 101 6.925 -8.769 0.902 1.00 0.00 C ATOM 1534 C LEU A 101 5.629 -8.995 1.657 1.00 0.00 C ATOM 1535 O LEU A 101 5.132 -10.122 1.759 1.00 0.00 O ATOM 1536 CB LEU A 101 7.074 -9.814 -0.208 1.00 0.00 C ATOM 1537 CG LEU A 101 5.952 -9.882 -1.240 1.00 0.00 C ATOM 1538 CD1 LEU A 101 5.953 -8.687 -2.162 1.00 0.00 C ATOM 1539 CD2 LEU A 101 6.030 -11.159 -2.007 1.00 0.00 C ATOM 0 H LEU A 101 8.459 -9.751 1.939 1.00 0.00 H new ATOM 0 HA LEU A 101 6.909 -7.782 0.439 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.009 -9.621 -0.734 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.167 -10.795 0.258 1.00 0.00 H new ATOM 0 HG LEU A 101 5.005 -9.858 -0.701 1.00 0.00 H new ATOM 0 HD11 LEU A 101 5.137 -8.780 -2.879 1.00 0.00 H new ATOM 0 HD12 LEU A 101 5.821 -7.776 -1.578 1.00 0.00 H new ATOM 0 HD13 LEU A 101 6.902 -8.640 -2.696 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.223 -11.193 -2.739 1.00 0.00 H new ATOM 0 HD22 LEU A 101 6.990 -11.217 -2.521 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.934 -12.001 -1.322 1.00 0.00 H new ATOM 1551 N THR A 102 5.149 -7.906 2.213 1.00 0.00 N ATOM 1552 CA THR A 102 3.929 -7.767 3.002 1.00 0.00 C ATOM 1553 C THR A 102 4.249 -6.705 4.034 1.00 0.00 C ATOM 1554 O THR A 102 3.401 -5.911 4.431 1.00 0.00 O ATOM 1555 CB THR A 102 3.446 -9.087 3.758 1.00 0.00 C ATOM 1556 OG1 THR A 102 2.180 -8.874 4.382 1.00 0.00 O ATOM 1557 CG2 THR A 102 4.422 -9.551 4.832 1.00 0.00 C ATOM 0 H THR A 102 5.638 -7.015 2.122 1.00 0.00 H new ATOM 0 HA THR A 102 3.110 -7.523 2.326 1.00 0.00 H new ATOM 0 HB THR A 102 3.381 -9.858 2.991 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.569 -9.600 4.138 1.00 0.00 H new ATOM 0 HG21 THR A 102 4.037 -10.452 5.309 1.00 0.00 H new ATOM 0 HG22 THR A 102 5.389 -9.766 4.377 1.00 0.00 H new ATOM 0 HG23 THR A 102 4.540 -8.767 5.580 1.00 0.00 H new ATOM 1565 N GLY A 103 5.518 -6.710 4.433 1.00 0.00 N ATOM 1566 CA GLY A 103 6.006 -5.800 5.411 1.00 0.00 C ATOM 1567 C GLY A 103 5.655 -6.272 6.800 1.00 0.00 C ATOM 1568 O GLY A 103 5.180 -5.492 7.640 1.00 0.00 O ATOM 0 H GLY A 103 6.222 -7.355 4.074 1.00 0.00 H new ATOM 0 HA2 GLY A 103 7.088 -5.703 5.317 1.00 0.00 H new ATOM 0 HA3 GLY A 103 5.581 -4.811 5.239 1.00 0.00 H new ATOM 1572 N SER A 104 5.899 -7.542 7.056 1.00 0.00 N ATOM 1573 CA SER A 104 5.521 -8.122 8.303 1.00 0.00 C ATOM 1574 C SER A 104 6.443 -9.258 8.687 1.00 0.00 C ATOM 1575 O SER A 104 6.556 -10.274 7.986 1.00 0.00 O ATOM 1576 CB SER A 104 4.045 -8.539 8.270 1.00 0.00 C ATOM 1577 OG SER A 104 3.558 -8.915 9.538 1.00 0.00 O ATOM 0 H SER A 104 6.358 -8.182 6.408 1.00 0.00 H new ATOM 0 HA SER A 104 5.628 -7.371 9.086 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.447 -7.713 7.886 1.00 0.00 H new ATOM 0 HB3 SER A 104 3.922 -9.371 7.577 1.00 0.00 H new ATOM 0 HG SER A 104 2.615 -9.170 9.464 1.00 0.00 H new ATOM 1583 N GLY A 105 7.113 -9.067 9.794 1.00 0.00 N ATOM 1584 CA GLY A 105 7.993 -10.041 10.292 1.00 0.00 C ATOM 1585 C GLY A 105 9.030 -9.463 11.211 1.00 0.00 C ATOM 1586 O GLY A 105 8.710 -8.774 12.193 1.00 0.00 O ATOM 0 H GLY A 105 7.050 -8.222 10.363 1.00 0.00 H new ATOM 0 HA2 GLY A 105 7.423 -10.802 10.825 1.00 0.00 H new ATOM 0 HA3 GLY A 105 8.488 -10.539 9.458 1.00 0.00 H new ATOM 1590 N ASN A 106 10.247 -9.678 10.850 1.00 0.00 N ATOM 1591 CA ASN A 106 11.387 -9.379 11.672 1.00 0.00 C ATOM 1592 C ASN A 106 12.160 -8.182 11.154 1.00 0.00 C ATOM 1593 O ASN A 106 12.499 -7.277 11.922 1.00 0.00 O ATOM 1594 CB ASN A 106 12.333 -10.593 11.663 1.00 0.00 C ATOM 1595 CG ASN A 106 11.659 -11.900 12.054 1.00 0.00 C ATOM 1596 OD1 ASN A 106 11.652 -12.301 13.221 1.00 0.00 O ATOM 1597 ND2 ASN A 106 11.069 -12.567 11.086 1.00 0.00 N ATOM 0 H ASN A 106 10.494 -10.080 9.946 1.00 0.00 H new ATOM 0 HA ASN A 106 11.026 -9.153 12.675 1.00 0.00 H new ATOM 0 HB2 ASN A 106 12.762 -10.700 10.667 1.00 0.00 H new ATOM 0 HB3 ASN A 106 13.160 -10.403 12.347 1.00 0.00 H new ATOM 0 HD21 ASN A 106 10.588 -13.443 11.290 1.00 0.00 H new ATOM 0 HD22 ASN A 106 11.093 -12.208 10.131 1.00 0.00 H new ATOM 1604 N TYR A 107 12.401 -8.135 9.859 1.00 0.00 N ATOM 1605 CA TYR A 107 13.297 -7.117 9.317 1.00 0.00 C ATOM 1606 C TYR A 107 12.657 -6.313 8.203 1.00 0.00 C ATOM 1607 O TYR A 107 13.334 -5.575 7.487 1.00 0.00 O ATOM 1608 CB TYR A 107 14.626 -7.750 8.852 1.00 0.00 C ATOM 1609 CG TYR A 107 14.512 -8.774 7.734 1.00 0.00 C ATOM 1610 CD1 TYR A 107 14.544 -8.381 6.403 1.00 0.00 C ATOM 1611 CD2 TYR A 107 14.398 -10.129 8.012 1.00 0.00 C ATOM 1612 CE1 TYR A 107 14.469 -9.302 5.390 1.00 0.00 C ATOM 1613 CE2 TYR A 107 14.317 -11.061 6.998 1.00 0.00 C ATOM 1614 CZ TYR A 107 14.354 -10.638 5.688 1.00 0.00 C ATOM 1615 OH TYR A 107 14.303 -11.555 4.670 1.00 0.00 O ATOM 0 H TYR A 107 12.002 -8.772 9.170 1.00 0.00 H new ATOM 0 HA TYR A 107 13.509 -6.417 10.125 1.00 0.00 H new ATOM 0 HB2 TYR A 107 15.292 -6.952 8.523 1.00 0.00 H new ATOM 0 HB3 TYR A 107 15.100 -8.227 9.710 1.00 0.00 H new ATOM 0 HD1 TYR A 107 14.629 -7.332 6.161 1.00 0.00 H new ATOM 0 HD2 TYR A 107 14.372 -10.460 9.040 1.00 0.00 H new ATOM 0 HE1 TYR A 107 14.500 -8.978 4.360 1.00 0.00 H new ATOM 0 HE2 TYR A 107 14.225 -12.112 7.229 1.00 0.00 H new ATOM 0 HH TYR A 107 14.223 -12.457 5.046 1.00 0.00 H new ATOM 1625 N SER A 108 11.378 -6.439 8.078 1.00 0.00 N ATOM 1626 CA SER A 108 10.635 -5.718 7.086 1.00 0.00 C ATOM 1627 C SER A 108 10.577 -4.231 7.425 1.00 0.00 C ATOM 1628 O SER A 108 11.380 -3.443 6.907 1.00 0.00 O ATOM 1629 CB SER A 108 9.270 -6.328 6.994 1.00 0.00 C ATOM 1630 OG SER A 108 8.908 -6.874 8.263 1.00 0.00 O ATOM 0 H SER A 108 10.809 -7.050 8.664 1.00 0.00 H new ATOM 0 HA SER A 108 11.126 -5.791 6.115 1.00 0.00 H new ATOM 0 HB2 SER A 108 8.543 -5.575 6.689 1.00 0.00 H new ATOM 0 HB3 SER A 108 9.259 -7.109 6.233 1.00 0.00 H new ATOM 0 HG SER A 108 9.129 -7.828 8.284 1.00 0.00 H new ATOM 1636 N SER A 109 9.691 -3.888 8.364 1.00 0.00 N ATOM 1637 CA SER A 109 9.497 -2.531 8.892 1.00 0.00 C ATOM 1638 C SER A 109 9.547 -1.453 7.777 1.00 0.00 C ATOM 1639 O SER A 109 9.071 -1.669 6.655 1.00 0.00 O ATOM 1640 CB SER A 109 10.577 -2.277 9.967 1.00 0.00 C ATOM 1641 OG SER A 109 11.899 -2.324 9.418 1.00 0.00 O ATOM 0 H SER A 109 9.066 -4.570 8.794 1.00 0.00 H new ATOM 0 HA SER A 109 8.503 -2.457 9.332 1.00 0.00 H new ATOM 0 HB2 SER A 109 10.409 -1.303 10.427 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.485 -3.022 10.757 1.00 0.00 H new ATOM 0 HG SER A 109 12.554 -2.157 10.128 1.00 0.00 H new ATOM 1647 N THR A 110 10.079 -0.298 8.109 1.00 0.00 N ATOM 1648 CA THR A 110 10.336 0.731 7.145 1.00 0.00 C ATOM 1649 C THR A 110 11.627 0.413 6.375 1.00 0.00 C ATOM 1650 O THR A 110 11.833 0.911 5.266 1.00 0.00 O ATOM 1651 CB THR A 110 10.467 2.140 7.824 1.00 0.00 C ATOM 1652 OG1 THR A 110 10.892 3.121 6.860 1.00 0.00 O ATOM 1653 CG2 THR A 110 11.463 2.123 8.981 1.00 0.00 C ATOM 0 H THR A 110 10.345 -0.052 9.063 1.00 0.00 H new ATOM 0 HA THR A 110 9.490 0.762 6.458 1.00 0.00 H new ATOM 0 HB THR A 110 9.483 2.399 8.216 1.00 0.00 H new ATOM 0 HG1 THR A 110 11.159 2.671 6.031 1.00 0.00 H new ATOM 0 HG21 THR A 110 11.524 3.117 9.423 1.00 0.00 H new ATOM 0 HG22 THR A 110 11.132 1.410 9.736 1.00 0.00 H new ATOM 0 HG23 THR A 110 12.445 1.830 8.611 1.00 0.00 H new ATOM 1661 N ASP A 111 12.463 -0.445 6.945 1.00 0.00 N ATOM 1662 CA ASP A 111 13.797 -0.714 6.396 1.00 0.00 C ATOM 1663 C ASP A 111 13.746 -1.324 5.010 1.00 0.00 C ATOM 1664 O ASP A 111 14.329 -0.780 4.065 1.00 0.00 O ATOM 1665 CB ASP A 111 14.618 -1.595 7.325 1.00 0.00 C ATOM 1666 CG ASP A 111 16.043 -1.741 6.848 1.00 0.00 C ATOM 1667 OD1 ASP A 111 16.841 -0.815 7.081 1.00 0.00 O ATOM 1668 OD2 ASP A 111 16.395 -2.779 6.250 1.00 0.00 O ATOM 0 H ASP A 111 12.245 -0.971 7.791 1.00 0.00 H new ATOM 0 HA ASP A 111 14.287 0.256 6.311 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.613 -1.169 8.328 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.156 -2.580 7.394 1.00 0.00 H new ATOM 1673 N ALA A 112 13.014 -2.396 4.872 1.00 0.00 N ATOM 1674 CA ALA A 112 12.928 -3.104 3.594 1.00 0.00 C ATOM 1675 C ALA A 112 12.152 -2.297 2.567 1.00 0.00 C ATOM 1676 O ALA A 112 12.266 -2.510 1.388 1.00 0.00 O ATOM 1677 CB ALA A 112 12.298 -4.470 3.789 1.00 0.00 C ATOM 0 H ALA A 112 12.462 -2.810 5.623 1.00 0.00 H new ATOM 0 HA ALA A 112 13.941 -3.238 3.214 1.00 0.00 H new ATOM 0 HB1 ALA A 112 12.241 -4.985 2.830 1.00 0.00 H new ATOM 0 HB2 ALA A 112 12.905 -5.056 4.479 1.00 0.00 H new ATOM 0 HB3 ALA A 112 11.295 -4.353 4.198 1.00 0.00 H new ATOM 1683 N GLN A 113 11.375 -1.363 3.047 1.00 0.00 N ATOM 1684 CA GLN A 113 10.597 -0.491 2.201 1.00 0.00 C ATOM 1685 C GLN A 113 11.418 0.715 1.738 1.00 0.00 C ATOM 1686 O GLN A 113 11.184 1.254 0.681 1.00 0.00 O ATOM 1687 CB GLN A 113 9.308 -0.100 2.931 1.00 0.00 C ATOM 1688 CG GLN A 113 8.546 1.101 2.372 1.00 0.00 C ATOM 1689 CD GLN A 113 8.735 2.370 3.207 1.00 0.00 C ATOM 1690 OE1 GLN A 113 7.869 3.213 3.259 1.00 0.00 O ATOM 1691 NE2 GLN A 113 9.838 2.495 3.902 1.00 0.00 N ATOM 0 H GLN A 113 11.262 -1.183 4.044 1.00 0.00 H new ATOM 0 HA GLN A 113 10.316 -1.017 1.289 1.00 0.00 H new ATOM 0 HB2 GLN A 113 8.639 -0.961 2.927 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.555 0.107 3.972 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.877 1.292 1.351 1.00 0.00 H new ATOM 0 HG3 GLN A 113 7.484 0.860 2.323 1.00 0.00 H new ATOM 0 HE21 GLN A 113 10.559 1.776 3.848 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.976 3.312 4.497 1.00 0.00 H new ATOM 1700 N MET A 114 12.365 1.160 2.546 1.00 0.00 N ATOM 1701 CA MET A 114 13.220 2.251 2.132 1.00 0.00 C ATOM 1702 C MET A 114 14.232 1.729 1.126 1.00 0.00 C ATOM 1703 O MET A 114 14.686 2.447 0.244 1.00 0.00 O ATOM 1704 CB MET A 114 13.899 2.890 3.336 1.00 0.00 C ATOM 1705 CG MET A 114 14.656 4.161 3.010 1.00 0.00 C ATOM 1706 SD MET A 114 15.266 4.986 4.487 1.00 0.00 S ATOM 1707 CE MET A 114 15.971 6.454 3.752 1.00 0.00 C ATOM 0 H MET A 114 12.557 0.788 3.476 1.00 0.00 H new ATOM 0 HA MET A 114 12.623 3.029 1.656 1.00 0.00 H new ATOM 0 HB2 MET A 114 13.145 3.111 4.091 1.00 0.00 H new ATOM 0 HB3 MET A 114 14.589 2.170 3.776 1.00 0.00 H new ATOM 0 HG2 MET A 114 15.495 3.925 2.355 1.00 0.00 H new ATOM 0 HG3 MET A 114 14.004 4.839 2.460 1.00 0.00 H new ATOM 0 HE1 MET A 114 16.397 7.083 4.533 1.00 0.00 H new ATOM 0 HE2 MET A 114 16.753 6.169 3.049 1.00 0.00 H new ATOM 0 HE3 MET A 114 15.193 7.007 3.225 1.00 0.00 H new ATOM 1717 N GLN A 115 14.545 0.459 1.264 1.00 0.00 N ATOM 1718 CA GLN A 115 15.356 -0.271 0.316 1.00 0.00 C ATOM 1719 C GLN A 115 14.441 -1.199 -0.471 1.00 0.00 C ATOM 1720 O GLN A 115 14.747 -2.366 -0.715 1.00 0.00 O ATOM 1721 CB GLN A 115 16.507 -1.034 0.997 1.00 0.00 C ATOM 1722 CG GLN A 115 17.714 -0.155 1.333 1.00 0.00 C ATOM 1723 CD GLN A 115 17.509 0.836 2.466 1.00 0.00 C ATOM 1724 OE1 GLN A 115 18.075 1.921 2.454 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.764 0.468 3.466 1.00 0.00 N ATOM 0 H GLN A 115 14.236 -0.106 2.055 1.00 0.00 H new ATOM 0 HA GLN A 115 15.841 0.430 -0.363 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.135 -1.491 1.914 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.830 -1.845 0.344 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.553 -0.803 1.588 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.999 0.398 0.438 1.00 0.00 H new ATOM 0 HE21 GLN A 115 16.303 -0.442 3.451 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.640 1.089 4.265 1.00 0.00 H new ATOM 1734 N TYR A 116 13.305 -0.619 -0.849 1.00 0.00 N ATOM 1735 CA TYR A 116 12.217 -1.246 -1.566 1.00 0.00 C ATOM 1736 C TYR A 116 12.664 -2.010 -2.805 1.00 0.00 C ATOM 1737 O TYR A 116 12.126 -3.021 -3.105 1.00 0.00 O ATOM 1738 CB TYR A 116 11.178 -0.174 -1.970 1.00 0.00 C ATOM 1739 CG TYR A 116 11.749 1.005 -2.778 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.828 0.970 -4.169 1.00 0.00 C ATOM 1741 CD2 TYR A 116 12.209 2.151 -2.138 1.00 0.00 C ATOM 1742 CE1 TYR A 116 12.347 2.026 -4.882 1.00 0.00 C ATOM 1743 CE2 TYR A 116 12.726 3.209 -2.848 1.00 0.00 C ATOM 1744 CZ TYR A 116 12.796 3.138 -4.222 1.00 0.00 C ATOM 1745 OH TYR A 116 13.309 4.200 -4.941 1.00 0.00 O ATOM 0 H TYR A 116 13.116 0.363 -0.646 1.00 0.00 H new ATOM 0 HA TYR A 116 11.779 -1.978 -0.888 1.00 0.00 H new ATOM 0 HB2 TYR A 116 10.393 -0.652 -2.556 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.709 0.216 -1.067 1.00 0.00 H new ATOM 0 HD1 TYR A 116 11.475 0.097 -4.698 1.00 0.00 H new ATOM 0 HD2 TYR A 116 12.159 2.211 -1.061 1.00 0.00 H new ATOM 0 HE1 TYR A 116 12.400 1.978 -5.960 1.00 0.00 H new ATOM 0 HE2 TYR A 116 13.075 4.091 -2.331 1.00 0.00 H new ATOM 0 HH TYR A 116 12.582 4.810 -5.188 1.00 0.00 H new ATOM 1755 N ASP A 117 13.645 -1.497 -3.509 1.00 0.00 N ATOM 1756 CA ASP A 117 14.133 -2.076 -4.777 1.00 0.00 C ATOM 1757 C ASP A 117 13.049 -2.179 -5.866 1.00 0.00 C ATOM 1758 O ASP A 117 11.857 -2.134 -5.589 1.00 0.00 O ATOM 1759 CB ASP A 117 14.819 -3.436 -4.560 1.00 0.00 C ATOM 1760 CG ASP A 117 16.175 -3.306 -3.930 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.733 -2.197 -3.913 1.00 0.00 O ATOM 1762 OD2 ASP A 117 16.718 -4.332 -3.457 1.00 0.00 O ATOM 0 H ASP A 117 14.146 -0.654 -3.229 1.00 0.00 H new ATOM 0 HA ASP A 117 14.877 -1.370 -5.147 1.00 0.00 H new ATOM 0 HB2 ASP A 117 14.187 -4.060 -3.928 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.915 -3.947 -5.518 1.00 0.00 H new ATOM 1767 N PRO A 118 13.442 -2.303 -7.141 1.00 0.00 N ATOM 1768 CA PRO A 118 12.477 -2.466 -8.241 1.00 0.00 C ATOM 1769 C PRO A 118 11.594 -3.720 -8.088 1.00 0.00 C ATOM 1770 O PRO A 118 10.440 -3.732 -8.509 1.00 0.00 O ATOM 1771 CB PRO A 118 13.369 -2.613 -9.477 1.00 0.00 C ATOM 1772 CG PRO A 118 14.654 -1.966 -9.109 1.00 0.00 C ATOM 1773 CD PRO A 118 14.837 -2.212 -7.645 1.00 0.00 C ATOM 0 HA PRO A 118 11.780 -1.629 -8.282 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.516 -3.662 -9.734 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.920 -2.132 -10.346 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.481 -2.387 -9.681 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.629 -0.898 -9.325 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.394 -3.130 -7.457 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.387 -1.402 -7.166 1.00 0.00 H new ATOM 1781 N GLY A 119 12.090 -4.727 -7.378 1.00 0.00 N ATOM 1782 CA GLY A 119 11.399 -6.006 -7.347 1.00 0.00 C ATOM 1783 C GLY A 119 10.452 -6.112 -6.182 1.00 0.00 C ATOM 1784 O GLY A 119 9.326 -6.581 -6.331 1.00 0.00 O ATOM 0 H GLY A 119 12.948 -4.684 -6.829 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.846 -6.141 -8.276 1.00 0.00 H new ATOM 0 HA3 GLY A 119 12.131 -6.812 -7.292 1.00 0.00 H new ATOM 1788 N LEU A 120 10.892 -5.648 -5.041 1.00 0.00 N ATOM 1789 CA LEU A 120 10.042 -5.720 -3.880 1.00 0.00 C ATOM 1790 C LEU A 120 8.920 -4.702 -4.059 1.00 0.00 C ATOM 1791 O LEU A 120 7.760 -5.027 -3.884 1.00 0.00 O ATOM 1792 CB LEU A 120 10.805 -5.408 -2.600 1.00 0.00 C ATOM 1793 CG LEU A 120 9.999 -5.458 -1.305 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.374 -6.828 -1.111 1.00 0.00 C ATOM 1795 CD2 LEU A 120 10.874 -5.108 -0.130 1.00 0.00 C ATOM 0 H LEU A 120 11.809 -5.227 -4.891 1.00 0.00 H new ATOM 0 HA LEU A 120 9.651 -6.733 -3.789 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.633 -6.111 -2.515 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.240 -4.413 -2.694 1.00 0.00 H new ATOM 0 HG LEU A 120 9.196 -4.724 -1.373 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.805 -6.840 -0.182 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.709 -7.046 -1.947 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.159 -7.583 -1.065 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.285 -5.148 0.787 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.697 -5.820 -0.064 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.274 -4.103 -0.261 1.00 0.00 H new ATOM 1807 N PHE A 121 9.291 -3.474 -4.470 1.00 0.00 N ATOM 1808 CA PHE A 121 8.336 -2.382 -4.673 1.00 0.00 C ATOM 1809 C PHE A 121 7.275 -2.716 -5.709 1.00 0.00 C ATOM 1810 O PHE A 121 6.083 -2.533 -5.446 1.00 0.00 O ATOM 1811 CB PHE A 121 9.032 -1.068 -5.043 1.00 0.00 C ATOM 1812 CG PHE A 121 8.099 0.114 -5.175 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.229 0.445 -4.148 1.00 0.00 C ATOM 1814 CD2 PHE A 121 8.080 0.877 -6.331 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.361 1.515 -4.270 1.00 0.00 C ATOM 1816 CE2 PHE A 121 7.215 1.946 -6.461 1.00 0.00 C ATOM 1817 CZ PHE A 121 6.354 2.267 -5.429 1.00 0.00 C ATOM 0 H PHE A 121 10.258 -3.218 -4.668 1.00 0.00 H new ATOM 0 HA PHE A 121 7.837 -2.250 -3.713 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.782 -0.841 -4.285 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.563 -1.204 -5.985 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.229 -0.140 -3.240 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.751 0.633 -7.142 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.690 1.762 -3.461 1.00 0.00 H new ATOM 0 HE2 PHE A 121 7.212 2.531 -7.369 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.678 3.103 -5.528 1.00 0.00 H new ATOM 1827 N ALA A 122 7.687 -3.209 -6.880 1.00 0.00 N ATOM 1828 CA ALA A 122 6.713 -3.522 -7.914 1.00 0.00 C ATOM 1829 C ALA A 122 5.755 -4.606 -7.447 1.00 0.00 C ATOM 1830 O ALA A 122 4.541 -4.528 -7.684 1.00 0.00 O ATOM 1831 CB ALA A 122 7.389 -3.921 -9.207 1.00 0.00 C ATOM 0 H ALA A 122 8.659 -3.394 -7.126 1.00 0.00 H new ATOM 0 HA ALA A 122 6.136 -2.618 -8.108 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.632 -4.148 -9.958 1.00 0.00 H new ATOM 0 HB2 ALA A 122 8.015 -3.101 -9.559 1.00 0.00 H new ATOM 0 HB3 ALA A 122 8.008 -4.802 -9.037 1.00 0.00 H new ATOM 1837 N GLN A 123 6.281 -5.589 -6.747 1.00 0.00 N ATOM 1838 CA GLN A 123 5.473 -6.676 -6.253 1.00 0.00 C ATOM 1839 C GLN A 123 4.533 -6.230 -5.128 1.00 0.00 C ATOM 1840 O GLN A 123 3.347 -6.551 -5.163 1.00 0.00 O ATOM 1841 CB GLN A 123 6.348 -7.858 -5.834 1.00 0.00 C ATOM 1842 CG GLN A 123 6.385 -9.014 -6.846 1.00 0.00 C ATOM 1843 CD GLN A 123 6.735 -8.616 -8.279 1.00 0.00 C ATOM 1844 OE1 GLN A 123 7.464 -7.658 -8.532 1.00 0.00 O ATOM 1845 NE2 GLN A 123 6.204 -9.353 -9.224 1.00 0.00 N ATOM 0 H GLN A 123 7.270 -5.654 -6.508 1.00 0.00 H new ATOM 0 HA GLN A 123 4.835 -7.010 -7.071 1.00 0.00 H new ATOM 0 HB2 GLN A 123 7.365 -7.501 -5.672 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.988 -8.240 -4.879 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.111 -9.752 -6.504 1.00 0.00 H new ATOM 0 HG3 GLN A 123 5.411 -9.503 -6.850 1.00 0.00 H new ATOM 0 HE21 GLN A 123 5.604 -10.141 -8.980 1.00 0.00 H new ATOM 0 HE22 GLN A 123 6.391 -9.139 -10.204 1.00 0.00 H new ATOM 1854 N ILE A 124 5.043 -5.464 -4.158 1.00 0.00 N ATOM 1855 CA ILE A 124 4.206 -4.994 -3.048 1.00 0.00 C ATOM 1856 C ILE A 124 3.113 -4.054 -3.521 1.00 0.00 C ATOM 1857 O ILE A 124 1.986 -4.137 -3.039 1.00 0.00 O ATOM 1858 CB ILE A 124 4.987 -4.329 -1.859 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.849 -3.141 -2.307 1.00 0.00 C ATOM 1860 CG2 ILE A 124 5.801 -5.342 -1.077 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.623 -2.462 -1.182 1.00 0.00 C ATOM 0 H ILE A 124 6.016 -5.160 -4.117 1.00 0.00 H new ATOM 0 HA ILE A 124 3.766 -5.910 -2.654 1.00 0.00 H new ATOM 0 HB ILE A 124 4.229 -3.929 -1.186 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.556 -3.486 -3.061 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.207 -2.402 -2.786 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.325 -4.839 -0.264 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.137 -6.102 -0.665 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.527 -5.814 -1.739 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.204 -1.634 -1.588 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.924 -2.083 -0.437 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.295 -3.183 -0.716 1.00 0.00 H new ATOM 1873 N GLN A 125 3.430 -3.192 -4.488 1.00 0.00 N ATOM 1874 CA GLN A 125 2.460 -2.236 -4.985 1.00 0.00 C ATOM 1875 C GLN A 125 1.300 -2.963 -5.637 1.00 0.00 C ATOM 1876 O GLN A 125 0.129 -2.663 -5.365 1.00 0.00 O ATOM 1877 CB GLN A 125 3.079 -1.257 -5.981 1.00 0.00 C ATOM 1878 CG GLN A 125 2.174 -0.075 -6.230 1.00 0.00 C ATOM 1879 CD GLN A 125 2.695 0.927 -7.231 1.00 0.00 C ATOM 1880 OE1 GLN A 125 3.902 1.079 -7.435 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.794 1.670 -7.815 1.00 0.00 N ATOM 0 H GLN A 125 4.345 -3.142 -4.935 1.00 0.00 H new ATOM 0 HA GLN A 125 2.103 -1.661 -4.131 1.00 0.00 H new ATOM 0 HB2 GLN A 125 4.039 -0.908 -5.601 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.276 -1.770 -6.922 1.00 0.00 H new ATOM 0 HG2 GLN A 125 1.208 -0.443 -6.576 1.00 0.00 H new ATOM 0 HG3 GLN A 125 2.000 0.436 -5.283 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.804 1.517 -7.623 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.080 2.404 -8.463 1.00 0.00 H new ATOM 1890 N ALA A 126 1.635 -3.955 -6.451 1.00 0.00 N ATOM 1891 CA ALA A 126 0.648 -4.739 -7.163 1.00 0.00 C ATOM 1892 C ALA A 126 -0.177 -5.576 -6.199 1.00 0.00 C ATOM 1893 O ALA A 126 -1.409 -5.644 -6.319 1.00 0.00 O ATOM 1894 CB ALA A 126 1.318 -5.630 -8.196 1.00 0.00 C ATOM 0 H ALA A 126 2.599 -4.235 -6.633 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.022 -4.051 -7.679 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.560 -6.212 -8.721 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.862 -5.013 -8.911 1.00 0.00 H new ATOM 0 HB3 ALA A 126 2.013 -6.306 -7.698 1.00 0.00 H new ATOM 1900 N ALA A 127 0.496 -6.165 -5.206 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.163 -7.031 -4.244 1.00 0.00 C ATOM 1902 C ALA A 127 -1.146 -6.233 -3.436 1.00 0.00 C ATOM 1903 O ALA A 127 -2.298 -6.666 -3.216 1.00 0.00 O ATOM 1904 CB ALA A 127 0.860 -7.695 -3.326 1.00 0.00 C ATOM 0 H ALA A 127 1.498 -6.053 -5.053 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.694 -7.815 -4.784 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.345 -8.339 -2.613 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.550 -8.292 -3.922 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.416 -6.928 -2.786 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.705 -5.054 -3.031 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.504 -4.193 -2.235 1.00 0.00 C ATOM 1912 C ALA A 128 -2.719 -3.713 -2.965 1.00 0.00 C ATOM 1913 O ALA A 128 -3.757 -4.037 -2.572 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.706 -3.023 -1.728 1.00 0.00 C ATOM 0 H ALA A 128 0.219 -4.684 -3.255 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.842 -4.782 -1.382 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.346 -2.382 -1.122 1.00 0.00 H new ATOM 0 HB2 ALA A 128 0.125 -3.384 -1.122 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.318 -2.454 -2.573 1.00 0.00 H new ATOM 1920 N THR A 129 -2.581 -2.985 -4.046 1.00 0.00 N ATOM 1921 CA THR A 129 -3.798 -2.443 -4.705 1.00 0.00 C ATOM 1922 C THR A 129 -4.819 -3.542 -5.148 1.00 0.00 C ATOM 1923 O THR A 129 -6.069 -3.321 -5.100 1.00 0.00 O ATOM 1924 CB THR A 129 -3.487 -1.443 -5.863 1.00 0.00 C ATOM 1925 OG1 THR A 129 -4.703 -1.005 -6.488 1.00 0.00 O ATOM 1926 CG2 THR A 129 -2.572 -2.047 -6.909 1.00 0.00 C ATOM 0 H THR A 129 -1.694 -2.749 -4.490 1.00 0.00 H new ATOM 0 HA THR A 129 -4.290 -1.868 -3.921 1.00 0.00 H new ATOM 0 HB THR A 129 -2.974 -0.591 -5.417 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.843 -1.507 -7.318 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.384 -1.315 -7.694 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.628 -2.333 -6.445 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.045 -2.929 -7.341 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.304 -4.736 -5.446 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.139 -5.819 -5.943 1.00 0.00 C ATOM 1936 C LYS A 130 -6.082 -6.192 -4.845 1.00 0.00 C ATOM 1937 O LYS A 130 -7.294 -6.304 -5.037 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.269 -6.999 -6.355 1.00 0.00 C ATOM 1939 CG LYS A 130 -5.030 -8.121 -7.020 1.00 0.00 C ATOM 1940 CD LYS A 130 -4.093 -9.176 -7.586 1.00 0.00 C ATOM 1941 CE LYS A 130 -3.198 -8.616 -8.687 1.00 0.00 C ATOM 1942 NZ LYS A 130 -3.982 -8.031 -9.806 1.00 0.00 N ATOM 0 H LYS A 130 -3.316 -4.972 -5.351 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.702 -5.512 -6.825 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.494 -6.646 -7.036 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.763 -7.390 -5.472 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.704 -8.582 -6.298 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.649 -7.717 -7.821 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -3.473 -9.577 -6.784 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -4.679 -10.006 -7.982 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -2.543 -7.853 -8.267 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -2.557 -9.410 -9.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -3.349 -7.834 -10.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -4.718 -8.703 -10.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -4.428 -7.146 -9.492 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.491 -6.378 -3.703 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.156 -6.498 -2.466 1.00 0.00 C ATOM 1958 C ALA A 131 -7.053 -5.282 -2.248 1.00 0.00 C ATOM 1959 O ALA A 131 -8.283 -5.414 -2.300 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.073 -6.570 -1.441 1.00 0.00 C ATOM 0 H ALA A 131 -4.477 -6.452 -3.618 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.799 -7.377 -2.415 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.516 -6.665 -0.450 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.441 -7.435 -1.640 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.470 -5.663 -1.484 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.435 -4.096 -2.181 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.073 -2.835 -1.805 1.00 0.00 C ATOM 1968 C TRP A 132 -8.041 -2.268 -2.866 1.00 0.00 C ATOM 1969 O TRP A 132 -8.243 -1.074 -2.961 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.073 -1.730 -1.401 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.174 -2.075 -0.261 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -4.694 -3.274 -0.013 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.644 -1.224 0.773 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -3.837 -3.265 0.977 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -3.778 -2.029 1.510 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -4.771 0.129 1.144 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.046 -1.555 2.560 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.045 0.572 2.200 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.189 -0.270 2.881 1.00 0.00 C ATOM 0 H TRP A 132 -5.444 -3.988 -2.395 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.659 -3.118 -0.930 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.458 -1.484 -2.267 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.633 -0.832 -1.142 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -4.974 -4.161 -0.561 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.297 -4.070 1.296 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.428 0.794 0.603 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.375 -2.198 3.110 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.138 1.601 2.514 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.614 0.128 3.704 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.581 -3.095 -3.676 1.00 0.00 N ATOM 1991 CA ARG A 133 -9.661 -2.706 -4.527 1.00 0.00 C ATOM 1992 C ARG A 133 -11.005 -3.433 -4.301 1.00 0.00 C ATOM 1993 O ARG A 133 -12.050 -2.809 -4.202 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.215 -2.692 -5.997 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.315 -2.584 -7.075 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.086 -3.876 -7.268 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.571 -3.734 -7.006 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.540 -4.228 -7.781 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -13.273 -4.600 -9.031 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.794 -4.320 -7.312 1.00 0.00 N ATOM 0 H ARG A 133 -8.293 -4.068 -3.776 1.00 0.00 H new ATOM 0 HA ARG A 133 -9.906 -1.687 -4.228 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -8.528 -1.856 -6.132 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -8.648 -3.604 -6.185 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.010 -1.791 -6.799 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -9.860 -2.294 -8.022 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -10.937 -4.231 -8.288 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -10.678 -4.637 -6.603 1.00 0.00 H new ATOM 0 HE ARG A 133 -12.853 -3.220 -6.171 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -12.326 -4.508 -9.399 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -14.015 -4.977 -9.620 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.007 -4.013 -6.363 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -15.534 -4.697 -7.904 1.00 0.00 H new ATOM 2014 N LYS A 134 -10.924 -4.735 -4.244 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.028 -5.700 -4.595 1.00 0.00 C ATOM 2016 C LYS A 134 -13.349 -5.722 -3.786 1.00 0.00 C ATOM 2017 O LYS A 134 -13.945 -6.785 -3.624 1.00 0.00 O ATOM 2018 CB LYS A 134 -11.444 -7.060 -4.632 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.021 -7.520 -3.283 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.301 -8.793 -3.359 1.00 0.00 C ATOM 2021 CE LYS A 134 -8.935 -8.564 -3.915 1.00 0.00 C ATOM 2022 NZ LYS A 134 -8.339 -9.787 -4.501 1.00 0.00 N ATOM 0 H LYS A 134 -10.072 -5.209 -3.945 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.387 -5.317 -5.550 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -12.175 -7.758 -5.040 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -10.586 -7.068 -5.304 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -10.383 -6.766 -2.822 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -11.896 -7.632 -2.643 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.231 -9.242 -2.368 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.848 -9.495 -3.989 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.984 -7.788 -4.679 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -8.284 -8.192 -3.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.696 -9.523 -5.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -7.808 -10.299 -3.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.095 -10.398 -4.872 1.00 0.00 H new ATOM 2036 N LEU A 135 -13.842 -4.621 -3.387 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.117 -4.598 -2.682 1.00 0.00 C ATOM 2038 C LEU A 135 -16.279 -4.785 -3.654 1.00 0.00 C ATOM 2039 O LEU A 135 -16.250 -4.259 -4.780 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.273 -3.301 -1.892 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.654 -3.257 -0.476 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.282 -3.814 -0.488 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.552 -1.836 -0.007 1.00 0.00 C ATOM 0 H LEU A 135 -13.406 -3.708 -3.521 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.131 -5.429 -1.977 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -14.834 -2.494 -2.478 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.338 -3.086 -1.802 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.295 -3.842 0.183 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -12.864 -3.774 0.518 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.313 -4.849 -0.827 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.658 -3.229 -1.164 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.115 -1.813 0.991 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.921 -1.271 -0.693 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.546 -1.390 0.022 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.270 -5.605 -3.280 1.00 0.00 N ATOM 2056 CA PRO A 136 -18.466 -5.770 -4.074 1.00 0.00 C ATOM 2057 C PRO A 136 -19.393 -4.576 -3.863 1.00 0.00 C ATOM 2058 O PRO A 136 -19.305 -3.922 -2.829 1.00 0.00 O ATOM 2059 CB PRO A 136 -19.097 -7.052 -3.518 1.00 0.00 C ATOM 2060 CG PRO A 136 -18.639 -7.113 -2.097 1.00 0.00 C ATOM 2061 CD PRO A 136 -17.286 -6.455 -2.064 1.00 0.00 C ATOM 0 HA PRO A 136 -18.271 -5.832 -5.145 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.185 -7.019 -3.583 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -18.771 -7.929 -4.077 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -19.339 -6.597 -1.440 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -18.579 -8.145 -1.751 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.153 -5.861 -1.160 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -16.483 -7.192 -2.082 1.00 0.00 H new ATOM 2069 N VAL A 137 -20.339 -4.398 -4.791 1.00 0.00 N ATOM 2070 CA VAL A 137 -21.306 -3.250 -4.934 1.00 0.00 C ATOM 2071 C VAL A 137 -20.789 -1.794 -4.665 1.00 0.00 C ATOM 2072 O VAL A 137 -21.083 -0.880 -5.441 1.00 0.00 O ATOM 2073 CB VAL A 137 -22.668 -3.499 -4.220 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -23.331 -4.750 -4.774 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -22.525 -3.599 -2.705 1.00 0.00 C ATOM 0 H VAL A 137 -20.478 -5.091 -5.527 1.00 0.00 H new ATOM 0 HA VAL A 137 -21.450 -3.261 -6.014 1.00 0.00 H new ATOM 0 HB VAL A 137 -23.300 -2.634 -4.423 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -24.282 -4.913 -4.267 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -23.506 -4.626 -5.843 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -22.681 -5.609 -4.610 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -23.504 -3.773 -2.258 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -21.860 -4.426 -2.456 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -22.109 -2.670 -2.317 1.00 0.00 H new ATOM 2085 N LYS A 138 -20.037 -1.613 -3.601 1.00 0.00 N ATOM 2086 CA LYS A 138 -19.543 -0.336 -3.113 1.00 0.00 C ATOM 2087 C LYS A 138 -18.588 -0.692 -1.968 1.00 0.00 C ATOM 2088 O LYS A 138 -17.471 -0.198 -1.879 1.00 0.00 O ATOM 2089 CB LYS A 138 -20.760 0.491 -2.596 1.00 0.00 C ATOM 2090 CG LYS A 138 -20.568 1.988 -2.249 1.00 0.00 C ATOM 2091 CD LYS A 138 -19.703 2.264 -1.018 1.00 0.00 C ATOM 2092 CE LYS A 138 -20.230 1.618 0.263 1.00 0.00 C ATOM 2093 NZ LYS A 138 -21.612 2.035 0.626 1.00 0.00 N ATOM 0 H LYS A 138 -19.735 -2.394 -3.018 1.00 0.00 H new ATOM 0 HA LYS A 138 -19.034 0.258 -3.873 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -21.543 0.428 -3.351 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -21.138 -0.006 -1.703 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -20.121 2.489 -3.107 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -21.549 2.437 -2.093 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -18.692 1.902 -1.207 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -19.633 3.341 -0.869 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -20.207 0.534 0.148 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -19.559 1.865 1.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -21.957 1.447 1.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -21.608 3.034 0.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -22.238 1.916 -0.196 1.00 0.00 H new ATOM 2107 N GLY A 139 -19.057 -1.587 -1.126 1.00 0.00 N ATOM 2108 CA GLY A 139 -18.303 -2.104 -0.012 1.00 0.00 C ATOM 2109 C GLY A 139 -19.263 -2.615 1.003 1.00 0.00 C ATOM 2110 O GLY A 139 -19.574 -3.805 1.038 1.00 0.00 O ATOM 0 H GLY A 139 -19.994 -1.982 -1.201 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -17.638 -2.902 -0.341 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -17.676 -1.323 0.418 1.00 0.00 H new ATOM 2114 N ASP A 140 -19.760 -1.705 1.781 1.00 0.00 N ATOM 2115 CA ASP A 140 -20.818 -1.902 2.741 1.00 0.00 C ATOM 2116 C ASP A 140 -21.341 -0.540 3.056 1.00 0.00 C ATOM 2117 O ASP A 140 -22.184 -0.047 2.301 1.00 0.00 O ATOM 2118 CB ASP A 140 -20.396 -2.628 4.043 1.00 0.00 C ATOM 2119 CG ASP A 140 -20.592 -4.129 4.001 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -21.752 -4.591 3.788 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -19.625 -4.883 4.242 1.00 0.00 O ATOM 2122 OXT ASP A 140 -20.819 0.100 3.973 1.00 0.00 O ATOM 0 H ASP A 140 -19.422 -0.743 1.767 1.00 0.00 H new ATOM 0 HA ASP A 140 -21.565 -2.563 2.302 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -19.346 -2.414 4.242 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -20.968 -2.220 4.876 1.00 0.00 H new TER 2127 ASP A 140