USER MOD reduce.3.24.130724 H: found=0, std=0, add=1043, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1042 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 11 SER OG : rot 50:sc= 0.886 USER MOD Set 1.2: A 130 LYS NZ :NH3+ 161:sc= 1.05 (180deg=0) USER MOD Set 2.1: A 119 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 124 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 113 THR OG1 : rot -59:sc= 1.28 USER MOD Set 3.2: A 128 ASN : amide:sc= 2.05 K(o=3.3,f=-4.1!) USER MOD Set 4.1: A 93 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 95 THR OG1 : rot 180:sc= 0.00785 USER MOD Set 5.1: A 51 MET CE :methyl -166:sc= 0 (180deg=-0.0447) USER MOD Set 5.2: A 94 GLN : amide:sc= 0.958 K(o=0.96,f=-4.7!) USER MOD Set 6.1: A 50 THR OG1 : rot -160:sc= -0.93 USER MOD Set 6.2: A 63 THR OG1 : rot 180:sc= -0.145 USER MOD Set 7.1: A 1 MET CE :methyl -147:sc= 0 (180deg=-1.01) USER MOD Set 7.2: A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 151:sc= 0.608 (180deg=-0.0602) USER MOD Single : A 2 SER OG : rot -71:sc= 0.694 USER MOD Single : A 3 SER OG : rot -27:sc= 0.416 USER MOD Single : A 7 LYS NZ :NH3+ 159:sc= 1.19 (180deg=-0.141!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0.191 USER MOD Single : A 14 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.437 K(o=-0.44,f=-4.6!) USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ -168:sc= 1.92 (180deg=1.65) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 142:sc= 0.82 USER MOD Single : A 31 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 34 ASN : amide:sc= -0.0698 X(o=-0.07,f=-0.49) USER MOD Single : A 35 THR OG1 : rot 119:sc= 1.21 USER MOD Single : A 37 THR OG1 : rot 16:sc= 0.362 USER MOD Single : A 39 THR OG1 : rot 134:sc= 1.08 USER MOD Single : A 41 THR OG1 : rot 115:sc= 0.875 USER MOD Single : A 43 THR OG1 : rot -44:sc= 0.0287 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -160:sc= -0.347 USER MOD Single : A 58 LYS NZ :NH3+ 168:sc= 1.03 (180deg=0.602) USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 SER OG : rot 25:sc= 0.0218 USER MOD Single : A 65 LYS NZ :NH3+ -138:sc= 1.13 (180deg=-1.14!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= -0.0322 USER MOD Single : A 75 SER OG : rot -150:sc= 0 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 LYS NZ :NH3+ -118:sc= 1.23 (180deg=-0.568) USER MOD Single : A 82 SER OG : rot 1:sc= 1.07 USER MOD Single : A 86 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0626) USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 174:sc= 1.17 (180deg=1.06) USER MOD Single : A 96 GLN : amide:sc= 0.655 K(o=0.65,f=0) USER MOD Single : A 100 LYS NZ :NH3+ -154:sc= 1.23 (180deg=1.06) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 102 THR OG1 : rot 66:sc= 0.79 USER MOD Single : A 103 THR OG1 : rot -130:sc= 0.714 USER MOD Single : A 114 MET CE :methyl -164:sc= -0.09 (180deg=-0.863) USER MOD Single : A 115 LYS NZ :NH3+ -171:sc= 2.33 (180deg=2.09) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.0652 USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.0661 USER MOD Single : A 129 TYR OH : rot 30:sc= 0.746 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.677 -13.690 8.488 1.00 0.00 N ATOM 2 CA MET A 1 1.796 -13.858 7.308 1.00 0.00 C ATOM 3 C MET A 1 0.369 -14.379 7.668 1.00 0.00 C ATOM 4 O MET A 1 -0.614 -13.683 7.402 1.00 0.00 O ATOM 5 CB MET A 1 2.476 -14.747 6.238 1.00 0.00 C ATOM 6 CG MET A 1 3.625 -14.088 5.467 1.00 0.00 C ATOM 7 SD MET A 1 4.537 -15.389 4.607 1.00 0.00 S ATOM 8 CE MET A 1 3.744 -15.386 2.991 1.00 0.00 C ATOM 0 H1 MET A 1 3.668 -13.829 8.204 1.00 0.00 H new ATOM 0 H2 MET A 1 2.559 -12.732 8.876 1.00 0.00 H new ATOM 0 H3 MET A 1 2.423 -14.391 9.213 1.00 0.00 H new ATOM 0 HA MET A 1 1.646 -12.863 6.888 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.856 -15.645 6.725 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.719 -15.068 5.523 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.238 -13.359 4.755 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.282 -13.549 6.149 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.737 -16.398 2.587 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.719 -15.027 3.089 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.295 -14.730 2.317 1.00 0.00 H new ATOM 19 N SER A 2 0.246 -15.601 8.209 1.00 0.00 N ATOM 20 CA SER A 2 -1.043 -16.338 8.287 1.00 0.00 C ATOM 21 C SER A 2 -2.129 -15.825 9.270 1.00 0.00 C ATOM 22 O SER A 2 -3.310 -15.823 8.900 1.00 0.00 O ATOM 23 CB SER A 2 -0.724 -17.838 8.517 1.00 0.00 C ATOM 24 OG SER A 2 -0.023 -18.078 9.743 1.00 0.00 O ATOM 0 H SER A 2 1.033 -16.114 8.607 1.00 0.00 H new ATOM 0 HA SER A 2 -1.532 -16.153 7.331 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.654 -18.406 8.519 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.126 -18.209 7.684 1.00 0.00 H new ATOM 0 HG SER A 2 0.893 -17.738 9.668 1.00 0.00 H new ATOM 30 N SER A 3 -1.761 -15.327 10.465 1.00 0.00 N ATOM 31 CA SER A 3 -2.700 -14.549 11.318 1.00 0.00 C ATOM 32 C SER A 3 -3.236 -13.185 10.752 1.00 0.00 C ATOM 33 O SER A 3 -4.157 -12.627 11.353 1.00 0.00 O ATOM 34 CB SER A 3 -2.043 -14.324 12.699 1.00 0.00 C ATOM 35 OG SER A 3 -2.997 -13.845 13.650 1.00 0.00 O ATOM 0 H SER A 3 -0.830 -15.444 10.866 1.00 0.00 H new ATOM 0 HA SER A 3 -3.598 -15.165 11.368 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.608 -15.258 13.055 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.227 -13.607 12.605 1.00 0.00 H new ATOM 0 HG SER A 3 -3.713 -13.366 13.182 1.00 0.00 H new ATOM 41 N PHE A 4 -2.690 -12.672 9.638 1.00 0.00 N ATOM 42 CA PHE A 4 -3.156 -11.428 8.984 1.00 0.00 C ATOM 43 C PHE A 4 -3.472 -11.517 7.447 1.00 0.00 C ATOM 44 O PHE A 4 -3.475 -10.488 6.767 1.00 0.00 O ATOM 45 CB PHE A 4 -2.233 -10.251 9.385 1.00 0.00 C ATOM 46 CG PHE A 4 -0.725 -10.371 9.134 1.00 0.00 C ATOM 47 CD1 PHE A 4 -0.164 -9.950 7.923 1.00 0.00 C ATOM 48 CD2 PHE A 4 0.133 -10.809 10.156 1.00 0.00 C ATOM 49 CE1 PHE A 4 1.221 -9.945 7.742 1.00 0.00 C ATOM 50 CE2 PHE A 4 1.516 -10.799 9.979 1.00 0.00 C ATOM 51 CZ PHE A 4 2.057 -10.366 8.772 1.00 0.00 C ATOM 0 H PHE A 4 -1.904 -13.110 9.157 1.00 0.00 H new ATOM 0 HA PHE A 4 -4.155 -11.235 9.374 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -2.585 -9.363 8.859 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -2.376 -10.069 10.450 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -0.809 -9.625 7.120 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -0.283 -11.158 11.090 1.00 0.00 H new ATOM 0 HE1 PHE A 4 1.643 -9.615 6.804 1.00 0.00 H new ATOM 0 HE2 PHE A 4 2.166 -11.127 10.777 1.00 0.00 H new ATOM 0 HZ PHE A 4 3.128 -10.357 8.634 1.00 0.00 H new ATOM 61 N LEU A 5 -3.875 -12.693 6.932 1.00 0.00 N ATOM 62 CA LEU A 5 -4.462 -12.839 5.573 1.00 0.00 C ATOM 63 C LEU A 5 -5.947 -12.306 5.527 1.00 0.00 C ATOM 64 O LEU A 5 -6.777 -12.718 6.346 1.00 0.00 O ATOM 65 CB LEU A 5 -4.425 -14.336 5.159 1.00 0.00 C ATOM 66 CG LEU A 5 -3.016 -14.907 4.861 1.00 0.00 C ATOM 67 CD1 LEU A 5 -3.077 -16.445 4.834 1.00 0.00 C ATOM 68 CD2 LEU A 5 -2.447 -14.416 3.524 1.00 0.00 C ATOM 0 H LEU A 5 -3.806 -13.574 7.441 1.00 0.00 H new ATOM 0 HA LEU A 5 -3.873 -12.244 4.876 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -4.877 -14.927 5.955 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -5.046 -14.466 4.273 1.00 0.00 H new ATOM 0 HG LEU A 5 -2.358 -14.554 5.655 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -2.085 -16.845 4.624 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -3.419 -16.813 5.801 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -3.770 -16.768 4.057 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.459 -14.848 3.369 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -3.108 -14.721 2.713 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -2.369 -13.329 3.539 1.00 0.00 H new ATOM 80 N GLY A 6 -6.242 -11.401 4.589 1.00 0.00 N ATOM 81 CA GLY A 6 -7.549 -10.713 4.471 1.00 0.00 C ATOM 82 C GLY A 6 -7.463 -9.173 4.365 1.00 0.00 C ATOM 83 O GLY A 6 -6.394 -8.576 4.533 1.00 0.00 O ATOM 0 H GLY A 6 -5.573 -11.115 3.874 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -8.067 -11.095 3.592 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -8.159 -10.970 5.337 1.00 0.00 H new ATOM 87 N LYS A 7 -8.603 -8.511 4.097 1.00 0.00 N ATOM 88 CA LYS A 7 -8.714 -7.027 4.216 1.00 0.00 C ATOM 89 C LYS A 7 -9.167 -6.506 5.606 1.00 0.00 C ATOM 90 O LYS A 7 -9.384 -7.263 6.557 1.00 0.00 O ATOM 91 CB LYS A 7 -9.534 -6.472 3.030 1.00 0.00 C ATOM 92 CG LYS A 7 -11.032 -6.775 3.003 1.00 0.00 C ATOM 93 CD LYS A 7 -11.735 -6.385 1.697 1.00 0.00 C ATOM 94 CE LYS A 7 -11.193 -7.110 0.462 1.00 0.00 C ATOM 95 NZ LYS A 7 -12.102 -6.822 -0.661 1.00 0.00 N ATOM 0 H LYS A 7 -9.463 -8.969 3.797 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.704 -6.623 4.151 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -9.410 -5.389 3.013 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -9.096 -6.858 2.109 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -11.178 -7.841 3.175 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -11.511 -6.251 3.830 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -12.800 -6.596 1.792 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -11.635 -5.310 1.549 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -10.183 -6.772 0.233 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -11.136 -8.183 0.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.605 -6.983 -1.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -12.930 -7.448 -0.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -12.413 -5.831 -0.610 1.00 0.00 H new ATOM 109 N TRP A 8 -9.211 -5.172 5.733 1.00 0.00 N ATOM 110 CA TRP A 8 -9.118 -4.490 7.036 1.00 0.00 C ATOM 111 C TRP A 8 -9.962 -3.182 6.993 1.00 0.00 C ATOM 112 O TRP A 8 -9.820 -2.393 6.052 1.00 0.00 O ATOM 113 CB TRP A 8 -7.633 -4.122 7.292 1.00 0.00 C ATOM 114 CG TRP A 8 -6.660 -5.325 7.473 1.00 0.00 C ATOM 115 CD1 TRP A 8 -5.756 -5.793 6.495 1.00 0.00 C ATOM 116 CD2 TRP A 8 -6.585 -6.263 8.503 1.00 0.00 C ATOM 117 NE1 TRP A 8 -5.117 -6.981 6.879 1.00 0.00 N ATOM 118 CE2 TRP A 8 -5.660 -7.265 8.113 1.00 0.00 C ATOM 119 CE3 TRP A 8 -7.311 -6.399 9.717 1.00 0.00 C ATOM 120 CZ2 TRP A 8 -5.478 -8.414 8.927 1.00 0.00 C ATOM 121 CZ3 TRP A 8 -7.075 -7.509 10.523 1.00 0.00 C ATOM 122 CH2 TRP A 8 -6.173 -8.514 10.129 1.00 0.00 C ATOM 0 H TRP A 8 -9.311 -4.537 4.941 1.00 0.00 H new ATOM 0 HA TRP A 8 -9.491 -5.141 7.827 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -7.280 -3.515 6.459 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -7.581 -3.499 8.185 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -5.576 -5.292 5.555 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -4.414 -7.511 6.364 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -8.035 -5.653 10.010 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -4.808 -9.202 8.617 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -7.593 -7.600 11.466 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -6.018 -9.372 10.766 1.00 0.00 H new ATOM 133 N LYS A 9 -10.796 -2.922 8.016 1.00 0.00 N ATOM 134 CA LYS A 9 -11.472 -1.600 8.160 1.00 0.00 C ATOM 135 C LYS A 9 -11.384 -1.040 9.616 1.00 0.00 C ATOM 136 O LYS A 9 -11.451 -1.786 10.599 1.00 0.00 O ATOM 137 CB LYS A 9 -12.895 -1.610 7.564 1.00 0.00 C ATOM 138 CG LYS A 9 -13.985 -2.378 8.327 1.00 0.00 C ATOM 139 CD LYS A 9 -15.328 -2.275 7.571 1.00 0.00 C ATOM 140 CE LYS A 9 -16.456 -3.015 8.303 1.00 0.00 C ATOM 141 NZ LYS A 9 -17.726 -2.877 7.536 1.00 0.00 N ATOM 0 H LYS A 9 -11.022 -3.593 8.750 1.00 0.00 H new ATOM 0 HA LYS A 9 -10.917 -0.882 7.556 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -13.223 -0.575 7.462 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.834 -2.025 6.558 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -13.698 -3.424 8.434 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -14.092 -1.972 9.333 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -15.599 -1.226 7.454 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -15.213 -2.689 6.569 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -16.200 -4.069 8.415 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -16.580 -2.608 9.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -18.489 -3.379 8.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -17.972 -1.870 7.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -17.605 -3.285 6.587 1.00 0.00 H new ATOM 155 N LEU A 10 -11.193 0.281 9.716 1.00 0.00 N ATOM 156 CA LEU A 10 -10.693 0.975 10.929 1.00 0.00 C ATOM 157 C LEU A 10 -11.613 0.929 12.180 1.00 0.00 C ATOM 158 O LEU A 10 -12.798 1.265 12.126 1.00 0.00 O ATOM 159 CB LEU A 10 -10.370 2.434 10.490 1.00 0.00 C ATOM 160 CG LEU A 10 -9.449 3.229 11.444 1.00 0.00 C ATOM 161 CD1 LEU A 10 -7.985 2.768 11.393 1.00 0.00 C ATOM 162 CD2 LEU A 10 -9.503 4.723 11.079 1.00 0.00 C ATOM 0 H LEU A 10 -11.383 0.919 8.944 1.00 0.00 H new ATOM 0 HA LEU A 10 -9.814 0.439 11.287 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -9.904 2.404 9.505 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -11.308 2.978 10.382 1.00 0.00 H new ATOM 0 HG LEU A 10 -9.816 3.051 12.455 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -7.391 3.365 12.085 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -7.924 1.717 11.676 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -7.599 2.894 10.381 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -8.854 5.285 11.751 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -9.166 4.859 10.051 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -10.527 5.085 11.176 1.00 0.00 H new ATOM 174 N SER A 11 -11.013 0.541 13.311 1.00 0.00 N ATOM 175 CA SER A 11 -11.630 0.628 14.649 1.00 0.00 C ATOM 176 C SER A 11 -11.291 1.931 15.447 1.00 0.00 C ATOM 177 O SER A 11 -12.177 2.455 16.121 1.00 0.00 O ATOM 178 CB SER A 11 -11.201 -0.623 15.457 1.00 0.00 C ATOM 179 OG SER A 11 -12.020 -0.797 16.615 1.00 0.00 O ATOM 0 H SER A 11 -10.071 0.151 13.328 1.00 0.00 H new ATOM 0 HA SER A 11 -12.709 0.668 14.501 1.00 0.00 H new ATOM 0 HB2 SER A 11 -11.268 -1.508 14.825 1.00 0.00 H new ATOM 0 HB3 SER A 11 -10.158 -0.525 15.758 1.00 0.00 H new ATOM 0 HG SER A 11 -12.964 -0.746 16.358 1.00 0.00 H new ATOM 185 N GLU A 12 -10.025 2.391 15.422 1.00 0.00 N ATOM 186 CA GLU A 12 -9.548 3.554 16.212 1.00 0.00 C ATOM 187 C GLU A 12 -8.422 4.347 15.460 1.00 0.00 C ATOM 188 O GLU A 12 -7.567 3.773 14.775 1.00 0.00 O ATOM 189 CB GLU A 12 -9.101 3.168 17.658 1.00 0.00 C ATOM 190 CG GLU A 12 -8.086 2.024 17.738 1.00 0.00 C ATOM 191 CD GLU A 12 -7.431 1.715 19.063 1.00 0.00 C ATOM 192 OE1 GLU A 12 -7.086 2.640 19.826 1.00 0.00 O ATOM 193 OE2 GLU A 12 -7.201 0.508 19.313 1.00 0.00 O ATOM 0 H GLU A 12 -9.295 1.966 14.850 1.00 0.00 H new ATOM 0 HA GLU A 12 -10.408 4.215 16.320 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -8.672 4.048 18.137 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -9.984 2.891 18.233 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -8.586 1.117 17.399 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -7.293 2.238 17.021 1.00 0.00 H new ATOM 200 N SER A 13 -8.445 5.675 15.641 1.00 0.00 N ATOM 201 CA SER A 13 -7.354 6.583 15.225 1.00 0.00 C ATOM 202 C SER A 13 -6.896 7.428 16.453 1.00 0.00 C ATOM 203 O SER A 13 -7.676 8.190 17.031 1.00 0.00 O ATOM 204 CB SER A 13 -7.866 7.512 14.099 1.00 0.00 C ATOM 205 OG SER A 13 -6.835 8.397 13.658 1.00 0.00 O ATOM 0 H SER A 13 -9.226 6.159 16.084 1.00 0.00 H new ATOM 0 HA SER A 13 -6.508 6.006 14.853 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.219 6.912 13.260 1.00 0.00 H new ATOM 0 HB3 SER A 13 -8.717 8.090 14.458 1.00 0.00 H new ATOM 0 HG SER A 13 -7.181 8.973 12.945 1.00 0.00 H new ATOM 211 N HIS A 14 -5.609 7.318 16.803 1.00 0.00 N ATOM 212 CA HIS A 14 -4.956 8.274 17.750 1.00 0.00 C ATOM 213 C HIS A 14 -4.539 9.600 17.053 1.00 0.00 C ATOM 214 O HIS A 14 -4.978 10.667 17.482 1.00 0.00 O ATOM 215 CB HIS A 14 -3.798 7.544 18.461 1.00 0.00 C ATOM 216 CG HIS A 14 -2.991 8.365 19.481 1.00 0.00 C ATOM 217 ND1 HIS A 14 -3.404 8.551 20.790 1.00 0.00 N ATOM 218 CD2 HIS A 14 -1.762 9.042 19.271 1.00 0.00 C ATOM 219 CE1 HIS A 14 -2.390 9.336 21.274 1.00 0.00 C ATOM 220 NE2 HIS A 14 -1.364 9.677 20.434 1.00 0.00 N ATOM 0 H HIS A 14 -4.989 6.586 16.455 1.00 0.00 H new ATOM 0 HA HIS A 14 -5.669 8.592 18.510 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -4.207 6.672 18.972 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -3.110 7.174 17.701 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -1.217 9.059 18.339 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -2.400 9.679 22.298 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -0.535 10.243 20.616 1.00 0.00 H new ATOM 229 N ASN A 15 -3.670 9.529 16.029 1.00 0.00 N ATOM 230 CA ASN A 15 -3.356 10.707 15.184 1.00 0.00 C ATOM 231 C ASN A 15 -3.084 10.298 13.707 1.00 0.00 C ATOM 232 O ASN A 15 -2.060 10.681 13.128 1.00 0.00 O ATOM 233 CB ASN A 15 -2.191 11.483 15.862 1.00 0.00 C ATOM 234 CG ASN A 15 -1.963 12.875 15.286 1.00 0.00 C ATOM 235 OD1 ASN A 15 -1.041 13.105 14.512 1.00 0.00 O ATOM 236 ND2 ASN A 15 -2.818 13.824 15.595 1.00 0.00 N ATOM 0 H ASN A 15 -3.174 8.678 15.764 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.212 11.378 15.116 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -2.397 11.571 16.929 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -1.273 10.903 15.761 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -2.715 14.755 15.190 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -3.584 13.630 16.239 1.00 0.00 H new ATOM 243 N PHE A 16 -4.014 9.570 13.049 1.00 0.00 N ATOM 244 CA PHE A 16 -3.922 9.354 11.574 1.00 0.00 C ATOM 245 C PHE A 16 -4.425 10.589 10.747 1.00 0.00 C ATOM 246 O PHE A 16 -5.490 10.567 10.127 1.00 0.00 O ATOM 247 CB PHE A 16 -4.581 7.999 11.218 1.00 0.00 C ATOM 248 CG PHE A 16 -4.226 7.486 9.805 1.00 0.00 C ATOM 249 CD1 PHE A 16 -2.890 7.211 9.463 1.00 0.00 C ATOM 250 CD2 PHE A 16 -5.217 7.311 8.829 1.00 0.00 C ATOM 251 CE1 PHE A 16 -2.549 6.826 8.164 1.00 0.00 C ATOM 252 CE2 PHE A 16 -4.879 6.889 7.540 1.00 0.00 C ATOM 253 CZ PHE A 16 -3.547 6.660 7.206 1.00 0.00 C ATOM 0 H PHE A 16 -4.819 9.130 13.495 1.00 0.00 H new ATOM 0 HA PHE A 16 -2.876 9.281 11.275 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -4.276 7.253 11.952 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -5.663 8.100 11.296 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -2.118 7.298 10.213 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.251 7.504 9.075 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -1.515 6.658 7.903 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.653 6.740 6.802 1.00 0.00 H new ATOM 0 HZ PHE A 16 -3.287 6.353 6.204 1.00 0.00 H new ATOM 263 N ASP A 17 -3.605 11.654 10.768 1.00 0.00 N ATOM 264 CA ASP A 17 -3.976 13.002 10.272 1.00 0.00 C ATOM 265 C ASP A 17 -2.676 13.849 10.037 1.00 0.00 C ATOM 266 O ASP A 17 -2.307 14.115 8.886 1.00 0.00 O ATOM 267 CB ASP A 17 -5.056 13.694 11.142 1.00 0.00 C ATOM 268 CG ASP A 17 -4.805 13.778 12.645 1.00 0.00 C ATOM 269 OD1 ASP A 17 -4.091 14.703 13.090 1.00 0.00 O ATOM 270 OD2 ASP A 17 -5.286 12.897 13.388 1.00 0.00 O ATOM 0 H ASP A 17 -2.654 11.608 11.133 1.00 0.00 H new ATOM 0 HA ASP A 17 -4.470 12.902 9.306 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -5.191 14.708 10.767 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.999 13.169 10.988 1.00 0.00 H new ATOM 275 N ALA A 18 -1.958 14.208 11.116 1.00 0.00 N ATOM 276 CA ALA A 18 -0.660 14.919 11.036 1.00 0.00 C ATOM 277 C ALA A 18 0.574 14.035 10.685 1.00 0.00 C ATOM 278 O ALA A 18 1.515 14.530 10.071 1.00 0.00 O ATOM 279 CB ALA A 18 -0.417 15.648 12.366 1.00 0.00 C ATOM 0 H ALA A 18 -2.258 14.015 12.072 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.750 15.610 10.198 1.00 0.00 H new ATOM 0 HB1 ALA A 18 0.535 16.176 12.323 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -1.221 16.363 12.541 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -0.393 14.923 13.179 1.00 0.00 H new ATOM 285 N VAL A 19 0.530 12.737 11.014 1.00 0.00 N ATOM 286 CA VAL A 19 1.431 11.693 10.447 1.00 0.00 C ATOM 287 C VAL A 19 1.659 11.722 8.904 1.00 0.00 C ATOM 288 O VAL A 19 2.792 11.613 8.431 1.00 0.00 O ATOM 289 CB VAL A 19 0.923 10.312 10.976 1.00 0.00 C ATOM 290 CG1 VAL A 19 -0.316 9.729 10.293 1.00 0.00 C ATOM 291 CG2 VAL A 19 2.039 9.270 11.012 1.00 0.00 C ATOM 0 H VAL A 19 -0.137 12.365 11.690 1.00 0.00 H new ATOM 0 HA VAL A 19 2.442 11.905 10.796 1.00 0.00 H new ATOM 0 HB VAL A 19 0.596 10.551 11.988 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.567 8.772 10.750 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -1.153 10.417 10.410 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -0.112 9.583 9.232 1.00 0.00 H new ATOM 0 HG21 VAL A 19 1.643 8.326 11.386 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.434 9.125 10.007 1.00 0.00 H new ATOM 0 HG23 VAL A 19 2.837 9.614 11.670 1.00 0.00 H new ATOM 301 N MET A 20 0.560 11.907 8.161 1.00 0.00 N ATOM 302 CA MET A 20 0.574 12.113 6.706 1.00 0.00 C ATOM 303 C MET A 20 1.006 13.557 6.323 1.00 0.00 C ATOM 304 O MET A 20 1.956 13.707 5.555 1.00 0.00 O ATOM 305 CB MET A 20 -0.818 11.735 6.144 1.00 0.00 C ATOM 306 CG MET A 20 -1.147 10.233 6.147 1.00 0.00 C ATOM 307 SD MET A 20 0.022 9.309 5.128 1.00 0.00 S ATOM 308 CE MET A 20 1.009 8.460 6.377 1.00 0.00 C ATOM 0 H MET A 20 -0.379 11.918 8.560 1.00 0.00 H new ATOM 0 HA MET A 20 1.325 11.466 6.253 1.00 0.00 H new ATOM 0 HB2 MET A 20 -1.579 12.257 6.724 1.00 0.00 H new ATOM 0 HB3 MET A 20 -0.890 12.103 5.120 1.00 0.00 H new ATOM 0 HG2 MET A 20 -1.122 9.854 7.169 1.00 0.00 H new ATOM 0 HG3 MET A 20 -2.160 10.079 5.775 1.00 0.00 H new ATOM 0 HE1 MET A 20 1.770 7.852 5.888 1.00 0.00 H new ATOM 0 HE2 MET A 20 1.490 9.195 7.022 1.00 0.00 H new ATOM 0 HE3 MET A 20 0.363 7.819 6.977 1.00 0.00 H new ATOM 318 N SER A 21 0.384 14.614 6.877 1.00 0.00 N ATOM 319 CA SER A 21 0.812 16.010 6.608 1.00 0.00 C ATOM 320 C SER A 21 2.288 16.389 6.938 1.00 0.00 C ATOM 321 O SER A 21 2.882 17.146 6.168 1.00 0.00 O ATOM 322 CB SER A 21 -0.122 16.998 7.338 1.00 0.00 C ATOM 323 OG SER A 21 -0.012 18.308 6.783 1.00 0.00 O ATOM 0 H SER A 21 -0.412 14.535 7.510 1.00 0.00 H new ATOM 0 HA SER A 21 0.745 16.081 5.522 1.00 0.00 H new ATOM 0 HB2 SER A 21 -1.153 16.653 7.263 1.00 0.00 H new ATOM 0 HB3 SER A 21 0.129 17.026 8.398 1.00 0.00 H new ATOM 0 HG SER A 21 -0.614 18.917 7.260 1.00 0.00 H new ATOM 329 N LYS A 22 2.872 15.861 8.027 1.00 0.00 N ATOM 330 CA LYS A 22 4.332 15.954 8.276 1.00 0.00 C ATOM 331 C LYS A 22 5.249 15.257 7.232 1.00 0.00 C ATOM 332 O LYS A 22 6.355 15.743 6.983 1.00 0.00 O ATOM 333 CB LYS A 22 4.633 15.613 9.758 1.00 0.00 C ATOM 334 CG LYS A 22 5.011 14.168 10.120 1.00 0.00 C ATOM 335 CD LYS A 22 5.794 14.038 11.440 1.00 0.00 C ATOM 336 CE LYS A 22 7.239 14.560 11.371 1.00 0.00 C ATOM 337 NZ LYS A 22 8.005 14.062 12.542 1.00 0.00 N ATOM 0 H LYS A 22 2.359 15.363 8.754 1.00 0.00 H new ATOM 0 HA LYS A 22 4.616 16.993 8.110 1.00 0.00 H new ATOM 0 HB2 LYS A 22 5.446 16.260 10.088 1.00 0.00 H new ATOM 0 HB3 LYS A 22 3.754 15.882 10.344 1.00 0.00 H new ATOM 0 HG2 LYS A 22 4.101 13.572 10.189 1.00 0.00 H new ATOM 0 HG3 LYS A 22 5.608 13.746 9.312 1.00 0.00 H new ATOM 0 HD2 LYS A 22 5.261 14.581 12.221 1.00 0.00 H new ATOM 0 HD3 LYS A 22 5.812 12.989 11.737 1.00 0.00 H new ATOM 0 HE2 LYS A 22 7.712 14.229 10.447 1.00 0.00 H new ATOM 0 HE3 LYS A 22 7.242 15.650 11.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 8.910 14.571 12.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 7.455 14.222 13.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 8.188 13.044 12.430 1.00 0.00 H new ATOM 351 N LEU A 23 4.788 14.155 6.607 1.00 0.00 N ATOM 352 CA LEU A 23 5.421 13.620 5.385 1.00 0.00 C ATOM 353 C LEU A 23 5.245 14.547 4.131 1.00 0.00 C ATOM 354 O LEU A 23 6.248 14.897 3.500 1.00 0.00 O ATOM 355 CB LEU A 23 4.922 12.171 5.149 1.00 0.00 C ATOM 356 CG LEU A 23 5.987 11.270 4.477 1.00 0.00 C ATOM 357 CD1 LEU A 23 6.930 10.661 5.528 1.00 0.00 C ATOM 358 CD2 LEU A 23 5.316 10.138 3.689 1.00 0.00 C ATOM 0 H LEU A 23 3.981 13.619 6.928 1.00 0.00 H new ATOM 0 HA LEU A 23 6.500 13.597 5.540 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.632 11.732 6.103 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.029 12.197 4.525 1.00 0.00 H new ATOM 0 HG LEU A 23 6.565 11.894 3.795 1.00 0.00 H new ATOM 0 HD11 LEU A 23 7.669 10.032 5.032 1.00 0.00 H new ATOM 0 HD12 LEU A 23 7.437 11.460 6.068 1.00 0.00 H new ATOM 0 HD13 LEU A 23 6.353 10.058 6.229 1.00 0.00 H new ATOM 0 HD21 LEU A 23 6.080 9.516 3.224 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.715 9.530 4.366 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.675 10.563 2.917 1.00 0.00 H new ATOM 370 N GLY A 24 3.999 14.961 3.831 1.00 0.00 N ATOM 371 CA GLY A 24 3.698 15.967 2.790 1.00 0.00 C ATOM 372 C GLY A 24 2.523 15.581 1.876 1.00 0.00 C ATOM 373 O GLY A 24 2.729 15.358 0.678 1.00 0.00 O ATOM 0 H GLY A 24 3.168 14.607 4.305 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.474 16.919 3.272 1.00 0.00 H new ATOM 0 HA3 GLY A 24 4.587 16.121 2.178 1.00 0.00 H new ATOM 377 N VAL A 25 1.307 15.504 2.447 1.00 0.00 N ATOM 378 CA VAL A 25 0.155 14.823 1.781 1.00 0.00 C ATOM 379 C VAL A 25 -0.972 15.854 1.448 1.00 0.00 C ATOM 380 O VAL A 25 -1.315 16.730 2.251 1.00 0.00 O ATOM 381 CB VAL A 25 -0.321 13.631 2.676 1.00 0.00 C ATOM 382 CG1 VAL A 25 -1.510 12.842 2.096 1.00 0.00 C ATOM 383 CG2 VAL A 25 0.811 12.574 2.836 1.00 0.00 C ATOM 0 H VAL A 25 1.086 15.898 3.361 1.00 0.00 H new ATOM 0 HA VAL A 25 0.458 14.402 0.822 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.608 14.107 3.614 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -1.777 12.034 2.777 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.363 13.509 1.972 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -1.232 12.424 1.128 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.458 11.755 3.462 1.00 0.00 H new ATOM 0 HG22 VAL A 25 1.089 12.188 1.855 1.00 0.00 H new ATOM 0 HG23 VAL A 25 1.679 13.039 3.303 1.00 0.00 H new ATOM 393 N SER A 26 -1.544 15.698 0.251 1.00 0.00 N ATOM 394 CA SER A 26 -2.454 16.668 -0.394 1.00 0.00 C ATOM 395 C SER A 26 -3.763 17.012 0.359 1.00 0.00 C ATOM 396 O SER A 26 -4.335 16.175 1.065 1.00 0.00 O ATOM 397 CB SER A 26 -2.817 16.076 -1.791 1.00 0.00 C ATOM 398 OG SER A 26 -3.438 17.056 -2.621 1.00 0.00 O ATOM 0 H SER A 26 -1.386 14.868 -0.320 1.00 0.00 H new ATOM 0 HA SER A 26 -1.916 17.615 -0.426 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.915 15.703 -2.276 1.00 0.00 H new ATOM 0 HB3 SER A 26 -3.486 15.225 -1.665 1.00 0.00 H new ATOM 0 HG SER A 26 -3.653 16.659 -3.491 1.00 0.00 H new ATOM 404 N TRP A 27 -4.308 18.215 0.108 1.00 0.00 N ATOM 405 CA TRP A 27 -5.693 18.566 0.544 1.00 0.00 C ATOM 406 C TRP A 27 -6.835 17.974 -0.380 1.00 0.00 C ATOM 407 O TRP A 27 -7.698 18.667 -0.920 1.00 0.00 O ATOM 408 CB TRP A 27 -5.805 20.097 0.681 1.00 0.00 C ATOM 409 CG TRP A 27 -5.046 20.699 1.900 1.00 0.00 C ATOM 410 CD1 TRP A 27 -3.778 21.338 1.897 1.00 0.00 C ATOM 411 CD2 TRP A 27 -5.490 20.792 3.217 1.00 0.00 C ATOM 412 NE1 TRP A 27 -3.418 21.805 3.176 1.00 0.00 N ATOM 413 CE2 TRP A 27 -4.505 21.487 3.967 1.00 0.00 C ATOM 414 CE3 TRP A 27 -6.692 20.353 3.848 1.00 0.00 C ATOM 415 CZ2 TRP A 27 -4.722 21.750 5.350 1.00 0.00 C ATOM 416 CZ3 TRP A 27 -6.868 20.603 5.204 1.00 0.00 C ATOM 417 CH2 TRP A 27 -5.898 21.299 5.948 1.00 0.00 C ATOM 0 H TRP A 27 -3.824 18.963 -0.390 1.00 0.00 H new ATOM 0 HA TRP A 27 -5.857 18.093 1.512 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -5.425 20.558 -0.230 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -6.859 20.365 0.758 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -3.162 21.452 1.017 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -2.554 22.271 3.454 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -7.452 19.835 3.282 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -3.986 22.291 5.927 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -7.765 20.257 5.695 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -6.067 21.487 6.998 1.00 0.00 H new ATOM 428 N ALA A 28 -6.806 16.648 -0.460 1.00 0.00 N ATOM 429 CA ALA A 28 -7.838 15.781 -1.062 1.00 0.00 C ATOM 430 C ALA A 28 -7.571 14.292 -0.637 1.00 0.00 C ATOM 431 O ALA A 28 -8.467 13.619 -0.122 1.00 0.00 O ATOM 432 CB ALA A 28 -7.907 15.926 -2.589 1.00 0.00 C ATOM 0 H ALA A 28 -6.023 16.110 -0.089 1.00 0.00 H new ATOM 0 HA ALA A 28 -8.812 16.095 -0.688 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -8.681 15.267 -2.982 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.144 16.958 -2.846 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -6.945 15.655 -3.024 1.00 0.00 H new ATOM 438 N THR A 29 -6.327 13.813 -0.812 1.00 0.00 N ATOM 439 CA THR A 29 -5.887 12.469 -0.367 1.00 0.00 C ATOM 440 C THR A 29 -5.722 12.276 1.161 1.00 0.00 C ATOM 441 O THR A 29 -6.108 11.224 1.679 1.00 0.00 O ATOM 442 CB THR A 29 -4.559 12.040 -1.061 1.00 0.00 C ATOM 443 OG1 THR A 29 -3.480 12.900 -0.701 1.00 0.00 O ATOM 444 CG2 THR A 29 -4.623 12.002 -2.577 1.00 0.00 C ATOM 0 H THR A 29 -5.589 14.348 -1.269 1.00 0.00 H new ATOM 0 HA THR A 29 -6.718 11.832 -0.670 1.00 0.00 H new ATOM 0 HB THR A 29 -4.395 11.024 -0.702 1.00 0.00 H new ATOM 0 HG1 THR A 29 -2.661 12.372 -0.597 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.656 11.694 -2.974 1.00 0.00 H new ATOM 0 HG22 THR A 29 -5.388 11.292 -2.891 1.00 0.00 H new ATOM 0 HG23 THR A 29 -4.871 12.993 -2.956 1.00 0.00 H new ATOM 452 N ARG A 30 -5.219 13.288 1.882 1.00 0.00 N ATOM 453 CA ARG A 30 -5.216 13.275 3.363 1.00 0.00 C ATOM 454 C ARG A 30 -6.635 13.243 4.040 1.00 0.00 C ATOM 455 O ARG A 30 -6.767 12.770 5.170 1.00 0.00 O ATOM 456 CB ARG A 30 -4.430 14.528 3.789 1.00 0.00 C ATOM 457 CG ARG A 30 -3.650 14.391 5.106 1.00 0.00 C ATOM 458 CD ARG A 30 -3.456 15.738 5.817 1.00 0.00 C ATOM 459 NE ARG A 30 -2.700 16.692 4.960 1.00 0.00 N ATOM 460 CZ ARG A 30 -2.847 18.009 4.970 1.00 0.00 C ATOM 461 NH1 ARG A 30 -3.447 18.662 5.929 1.00 0.00 N ATOM 462 NH2 ARG A 30 -2.362 18.678 3.969 1.00 0.00 N ATOM 0 H ARG A 30 -4.809 14.126 1.471 1.00 0.00 H new ATOM 0 HA ARG A 30 -4.760 12.345 3.702 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -3.729 14.786 2.995 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -5.127 15.361 3.882 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -4.180 13.707 5.769 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -2.675 13.947 4.903 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -4.428 16.163 6.070 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -2.922 15.584 6.755 1.00 0.00 H new ATOM 0 HE ARG A 30 -2.014 16.301 4.314 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -3.833 18.156 6.726 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -3.529 19.678 5.881 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -1.887 18.188 3.210 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -2.455 19.693 3.941 1.00 0.00 H new ATOM 476 N GLN A 31 -7.660 13.729 3.313 1.00 0.00 N ATOM 477 CA GLN A 31 -9.072 13.668 3.738 1.00 0.00 C ATOM 478 C GLN A 31 -9.692 12.249 3.579 1.00 0.00 C ATOM 479 O GLN A 31 -10.322 11.792 4.529 1.00 0.00 O ATOM 480 CB GLN A 31 -9.890 14.743 2.981 1.00 0.00 C ATOM 481 CG GLN A 31 -9.789 16.180 3.535 1.00 0.00 C ATOM 482 CD GLN A 31 -8.564 16.991 3.154 1.00 0.00 C ATOM 483 OE1 GLN A 31 -8.574 17.788 2.225 1.00 0.00 O ATOM 484 NE2 GLN A 31 -7.464 16.849 3.857 1.00 0.00 N ATOM 0 H GLN A 31 -7.530 14.179 2.407 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.109 13.882 4.806 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -9.567 14.752 1.940 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -10.938 14.445 2.986 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -10.672 16.730 3.208 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -9.832 16.125 4.623 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -7.437 16.190 4.635 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -6.636 17.398 3.625 1.00 0.00 H new ATOM 493 N ILE A 32 -9.458 11.539 2.454 1.00 0.00 N ATOM 494 CA ILE A 32 -9.727 10.061 2.352 1.00 0.00 C ATOM 495 C ILE A 32 -8.911 9.219 3.382 1.00 0.00 C ATOM 496 O ILE A 32 -9.475 8.281 3.942 1.00 0.00 O ATOM 497 CB ILE A 32 -9.564 9.631 0.858 1.00 0.00 C ATOM 498 CG1 ILE A 32 -10.873 9.819 0.030 1.00 0.00 C ATOM 499 CG2 ILE A 32 -9.110 8.172 0.592 1.00 0.00 C ATOM 500 CD1 ILE A 32 -11.331 11.259 -0.157 1.00 0.00 C ATOM 0 H ILE A 32 -9.085 11.950 1.599 1.00 0.00 H new ATOM 0 HA ILE A 32 -10.756 9.848 2.643 1.00 0.00 H new ATOM 0 HB ILE A 32 -8.764 10.302 0.546 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -10.727 9.372 -0.953 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -11.673 9.262 0.517 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -9.036 8.004 -0.482 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -8.137 8.004 1.053 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -9.838 7.481 1.018 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -12.248 11.276 -0.746 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -11.517 11.711 0.817 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -10.556 11.823 -0.677 1.00 0.00 H new ATOM 512 N GLY A 33 -7.647 9.586 3.670 1.00 0.00 N ATOM 513 CA GLY A 33 -6.916 9.099 4.869 1.00 0.00 C ATOM 514 C GLY A 33 -7.687 9.054 6.206 1.00 0.00 C ATOM 515 O GLY A 33 -7.874 7.967 6.754 1.00 0.00 O ATOM 0 H GLY A 33 -7.103 10.222 3.087 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.553 8.093 4.656 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.039 9.731 5.008 1.00 0.00 H new ATOM 519 N ASN A 34 -8.189 10.198 6.688 1.00 0.00 N ATOM 520 CA ASN A 34 -9.123 10.242 7.846 1.00 0.00 C ATOM 521 C ASN A 34 -10.655 10.193 7.520 1.00 0.00 C ATOM 522 O ASN A 34 -11.455 10.852 8.186 1.00 0.00 O ATOM 523 CB ASN A 34 -8.671 11.415 8.748 1.00 0.00 C ATOM 524 CG ASN A 34 -8.872 12.844 8.267 1.00 0.00 C ATOM 525 OD1 ASN A 34 -9.318 13.140 7.164 1.00 0.00 O ATOM 526 ND2 ASN A 34 -8.536 13.804 9.093 1.00 0.00 N ATOM 0 H ASN A 34 -7.969 11.115 6.299 1.00 0.00 H new ATOM 0 HA ASN A 34 -9.045 9.301 8.390 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -9.190 11.314 9.701 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -7.608 11.283 8.948 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -8.647 14.779 8.814 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -8.163 13.576 10.015 1.00 0.00 H new ATOM 533 N THR A 35 -11.061 9.360 6.549 1.00 0.00 N ATOM 534 CA THR A 35 -12.477 9.227 6.106 1.00 0.00 C ATOM 535 C THR A 35 -12.722 7.771 5.628 1.00 0.00 C ATOM 536 O THR A 35 -13.529 7.061 6.234 1.00 0.00 O ATOM 537 CB THR A 35 -12.850 10.290 5.036 1.00 0.00 C ATOM 538 OG1 THR A 35 -12.624 11.611 5.524 1.00 0.00 O ATOM 539 CG2 THR A 35 -14.294 10.268 4.560 1.00 0.00 C ATOM 0 H THR A 35 -10.420 8.752 6.040 1.00 0.00 H new ATOM 0 HA THR A 35 -13.142 9.425 6.947 1.00 0.00 H new ATOM 0 HB THR A 35 -12.206 10.024 4.198 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.954 12.056 4.965 1.00 0.00 H new ATOM 0 HG21 THR A 35 -14.444 11.050 3.816 1.00 0.00 H new ATOM 0 HG22 THR A 35 -14.516 9.297 4.116 1.00 0.00 H new ATOM 0 HG23 THR A 35 -14.959 10.441 5.406 1.00 0.00 H new ATOM 547 N VAL A 36 -12.066 7.338 4.541 1.00 0.00 N ATOM 548 CA VAL A 36 -12.338 6.040 3.900 1.00 0.00 C ATOM 549 C VAL A 36 -11.172 5.090 4.286 1.00 0.00 C ATOM 550 O VAL A 36 -10.034 5.240 3.831 1.00 0.00 O ATOM 551 CB VAL A 36 -12.510 6.182 2.354 1.00 0.00 C ATOM 552 CG1 VAL A 36 -13.049 4.858 1.769 1.00 0.00 C ATOM 553 CG2 VAL A 36 -13.458 7.332 1.952 1.00 0.00 C ATOM 0 H VAL A 36 -11.332 7.877 4.081 1.00 0.00 H new ATOM 0 HA VAL A 36 -13.284 5.627 4.251 1.00 0.00 H new ATOM 0 HB VAL A 36 -11.525 6.416 1.949 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -13.168 4.959 0.690 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -12.346 4.053 1.983 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.014 4.627 2.221 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -13.535 7.377 0.866 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -14.445 7.155 2.378 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -13.064 8.276 2.328 1.00 0.00 H new ATOM 563 N THR A 37 -11.507 4.125 5.142 1.00 0.00 N ATOM 564 CA THR A 37 -10.535 3.238 5.825 1.00 0.00 C ATOM 565 C THR A 37 -9.461 2.551 4.915 1.00 0.00 C ATOM 566 O THR A 37 -9.891 1.955 3.922 1.00 0.00 O ATOM 567 CB THR A 37 -11.309 2.118 6.619 1.00 0.00 C ATOM 568 OG1 THR A 37 -11.788 1.084 5.757 1.00 0.00 O ATOM 569 CG2 THR A 37 -12.509 2.615 7.431 1.00 0.00 C ATOM 0 H THR A 37 -12.476 3.925 5.392 1.00 0.00 H new ATOM 0 HA THR A 37 -9.975 3.907 6.478 1.00 0.00 H new ATOM 0 HB THR A 37 -10.555 1.744 7.312 1.00 0.00 H new ATOM 0 HG1 THR A 37 -11.330 1.140 4.893 1.00 0.00 H new ATOM 0 HG21 THR A 37 -12.977 1.773 7.942 1.00 0.00 H new ATOM 0 HG22 THR A 37 -12.173 3.345 8.167 1.00 0.00 H new ATOM 0 HG23 THR A 37 -13.233 3.081 6.762 1.00 0.00 H new ATOM 577 N PRO A 38 -8.129 2.558 5.200 1.00 0.00 N ATOM 578 CA PRO A 38 -7.107 1.949 4.284 1.00 0.00 C ATOM 579 C PRO A 38 -7.200 0.413 4.191 1.00 0.00 C ATOM 580 O PRO A 38 -6.727 -0.326 5.062 1.00 0.00 O ATOM 581 CB PRO A 38 -5.771 2.479 4.874 1.00 0.00 C ATOM 582 CG PRO A 38 -6.074 2.731 6.369 1.00 0.00 C ATOM 583 CD PRO A 38 -7.526 3.240 6.365 1.00 0.00 C ATOM 0 HA PRO A 38 -7.241 2.230 3.239 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -4.968 1.753 4.750 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -5.453 3.394 4.375 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -5.971 1.820 6.958 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -5.393 3.466 6.797 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -8.043 2.986 7.290 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -7.571 4.324 6.263 1.00 0.00 H new ATOM 591 N THR A 39 -7.828 -0.052 3.101 1.00 0.00 N ATOM 592 CA THR A 39 -8.244 -1.472 2.966 1.00 0.00 C ATOM 593 C THR A 39 -7.064 -2.346 2.446 1.00 0.00 C ATOM 594 O THR A 39 -7.022 -2.749 1.280 1.00 0.00 O ATOM 595 CB THR A 39 -9.457 -1.506 1.987 1.00 0.00 C ATOM 596 OG1 THR A 39 -10.432 -0.487 2.228 1.00 0.00 O ATOM 597 CG2 THR A 39 -10.194 -2.835 1.954 1.00 0.00 C ATOM 0 H THR A 39 -8.063 0.528 2.295 1.00 0.00 H new ATOM 0 HA THR A 39 -8.532 -1.886 3.932 1.00 0.00 H new ATOM 0 HB THR A 39 -8.975 -1.332 1.025 1.00 0.00 H new ATOM 0 HG1 THR A 39 -10.676 -0.061 1.380 1.00 0.00 H new ATOM 0 HG21 THR A 39 -11.023 -2.774 1.249 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.509 -3.623 1.642 1.00 0.00 H new ATOM 0 HG23 THR A 39 -10.579 -3.062 2.948 1.00 0.00 H new ATOM 605 N VAL A 40 -6.087 -2.604 3.325 1.00 0.00 N ATOM 606 CA VAL A 40 -4.759 -3.139 2.899 1.00 0.00 C ATOM 607 C VAL A 40 -4.775 -4.694 2.747 1.00 0.00 C ATOM 608 O VAL A 40 -4.243 -5.436 3.573 1.00 0.00 O ATOM 609 CB VAL A 40 -3.590 -2.580 3.775 1.00 0.00 C ATOM 610 CG1 VAL A 40 -3.346 -1.076 3.494 1.00 0.00 C ATOM 611 CG2 VAL A 40 -3.708 -2.777 5.295 1.00 0.00 C ATOM 0 H VAL A 40 -6.176 -2.457 4.330 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.555 -2.764 1.896 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.746 -3.194 3.462 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.528 -0.717 4.118 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -3.088 -0.939 2.444 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -4.250 -0.512 3.722 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.836 -2.346 5.787 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -4.610 -2.283 5.657 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -3.762 -3.842 5.521 1.00 0.00 H new ATOM 621 N THR A 41 -5.416 -5.150 1.658 1.00 0.00 N ATOM 622 CA THR A 41 -5.918 -6.546 1.503 1.00 0.00 C ATOM 623 C THR A 41 -4.774 -7.575 1.324 1.00 0.00 C ATOM 624 O THR A 41 -4.272 -7.786 0.218 1.00 0.00 O ATOM 625 CB THR A 41 -6.874 -6.534 0.272 1.00 0.00 C ATOM 626 OG1 THR A 41 -7.859 -5.495 0.325 1.00 0.00 O ATOM 627 CG2 THR A 41 -7.608 -7.826 -0.045 1.00 0.00 C ATOM 0 H THR A 41 -5.607 -4.562 0.847 1.00 0.00 H new ATOM 0 HA THR A 41 -6.439 -6.861 2.407 1.00 0.00 H new ATOM 0 HB THR A 41 -6.153 -6.362 -0.527 1.00 0.00 H new ATOM 0 HG1 THR A 41 -7.703 -4.859 -0.404 1.00 0.00 H new ATOM 0 HG21 THR A 41 -8.238 -7.681 -0.923 1.00 0.00 H new ATOM 0 HG22 THR A 41 -6.884 -8.616 -0.245 1.00 0.00 H new ATOM 0 HG23 THR A 41 -8.229 -8.109 0.805 1.00 0.00 H new ATOM 635 N PHE A 42 -4.356 -8.196 2.427 1.00 0.00 N ATOM 636 CA PHE A 42 -3.106 -8.987 2.464 1.00 0.00 C ATOM 637 C PHE A 42 -3.383 -10.462 2.117 1.00 0.00 C ATOM 638 O PHE A 42 -4.122 -11.155 2.815 1.00 0.00 O ATOM 639 CB PHE A 42 -2.460 -8.794 3.855 1.00 0.00 C ATOM 640 CG PHE A 42 -1.075 -9.447 3.970 1.00 0.00 C ATOM 641 CD1 PHE A 42 0.063 -8.826 3.432 1.00 0.00 C ATOM 642 CD2 PHE A 42 -0.941 -10.717 4.547 1.00 0.00 C ATOM 643 CE1 PHE A 42 1.309 -9.446 3.507 1.00 0.00 C ATOM 644 CE2 PHE A 42 0.301 -11.344 4.610 1.00 0.00 C ATOM 645 CZ PHE A 42 1.427 -10.698 4.111 1.00 0.00 C ATOM 0 H PHE A 42 -4.860 -8.172 3.314 1.00 0.00 H new ATOM 0 HA PHE A 42 -2.401 -8.640 1.709 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -2.371 -7.728 4.063 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -3.118 -9.214 4.616 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -0.028 -7.861 2.956 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -1.811 -11.216 4.948 1.00 0.00 H new ATOM 0 HE1 PHE A 42 2.182 -8.958 3.098 1.00 0.00 H new ATOM 0 HE2 PHE A 42 0.389 -12.329 5.045 1.00 0.00 H new ATOM 0 HZ PHE A 42 2.396 -11.167 4.191 1.00 0.00 H new ATOM 655 N THR A 43 -2.801 -10.912 1.008 1.00 0.00 N ATOM 656 CA THR A 43 -3.202 -12.193 0.377 1.00 0.00 C ATOM 657 C THR A 43 -1.974 -12.887 -0.275 1.00 0.00 C ATOM 658 O THR A 43 -1.166 -12.226 -0.929 1.00 0.00 O ATOM 659 CB THR A 43 -4.295 -11.952 -0.720 1.00 0.00 C ATOM 660 OG1 THR A 43 -3.799 -11.149 -1.788 1.00 0.00 O ATOM 661 CG2 THR A 43 -5.551 -11.254 -0.206 1.00 0.00 C ATOM 0 H THR A 43 -2.052 -10.420 0.520 1.00 0.00 H new ATOM 0 HA THR A 43 -3.610 -12.835 1.158 1.00 0.00 H new ATOM 0 HB THR A 43 -4.553 -12.957 -1.053 1.00 0.00 H new ATOM 0 HG1 THR A 43 -3.283 -10.400 -1.422 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.257 -11.125 -1.026 1.00 0.00 H new ATOM 0 HG22 THR A 43 -6.010 -11.860 0.576 1.00 0.00 H new ATOM 0 HG23 THR A 43 -5.285 -10.278 0.200 1.00 0.00 H new ATOM 669 N MET A 44 -1.858 -14.217 -0.170 1.00 0.00 N ATOM 670 CA MET A 44 -0.872 -14.983 -0.988 1.00 0.00 C ATOM 671 C MET A 44 -1.379 -15.161 -2.455 1.00 0.00 C ATOM 672 O MET A 44 -2.306 -15.940 -2.701 1.00 0.00 O ATOM 673 CB MET A 44 -0.592 -16.329 -0.278 1.00 0.00 C ATOM 674 CG MET A 44 0.559 -17.131 -0.905 1.00 0.00 C ATOM 675 SD MET A 44 0.764 -18.695 -0.032 1.00 0.00 S ATOM 676 CE MET A 44 2.024 -18.249 1.174 1.00 0.00 C ATOM 0 H MET A 44 -2.420 -14.790 0.460 1.00 0.00 H new ATOM 0 HA MET A 44 0.066 -14.434 -1.067 1.00 0.00 H new ATOM 0 HB2 MET A 44 -0.360 -16.136 0.769 1.00 0.00 H new ATOM 0 HB3 MET A 44 -1.498 -16.935 -0.297 1.00 0.00 H new ATOM 0 HG2 MET A 44 0.352 -17.317 -1.959 1.00 0.00 H new ATOM 0 HG3 MET A 44 1.483 -16.555 -0.858 1.00 0.00 H new ATOM 0 HE1 MET A 44 2.259 -19.116 1.792 1.00 0.00 H new ATOM 0 HE2 MET A 44 2.924 -17.919 0.655 1.00 0.00 H new ATOM 0 HE3 MET A 44 1.653 -17.442 1.806 1.00 0.00 H new ATOM 686 N ASP A 45 -0.775 -14.437 -3.410 1.00 0.00 N ATOM 687 CA ASP A 45 -1.180 -14.500 -4.842 1.00 0.00 C ATOM 688 C ASP A 45 -0.252 -15.488 -5.607 1.00 0.00 C ATOM 689 O ASP A 45 0.818 -15.131 -6.113 1.00 0.00 O ATOM 690 CB ASP A 45 -1.176 -13.056 -5.387 1.00 0.00 C ATOM 691 CG ASP A 45 -1.936 -12.897 -6.699 1.00 0.00 C ATOM 692 OD1 ASP A 45 -3.186 -12.905 -6.669 1.00 0.00 O ATOM 693 OD2 ASP A 45 -1.295 -12.764 -7.763 1.00 0.00 O ATOM 0 H ASP A 45 -0.002 -13.797 -3.226 1.00 0.00 H new ATOM 0 HA ASP A 45 -2.186 -14.897 -4.977 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -1.614 -12.394 -4.640 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -0.145 -12.734 -5.533 1.00 0.00 H new ATOM 698 N GLY A 46 -0.657 -16.769 -5.621 1.00 0.00 N ATOM 699 CA GLY A 46 0.126 -17.850 -6.258 1.00 0.00 C ATOM 700 C GLY A 46 1.306 -18.386 -5.429 1.00 0.00 C ATOM 701 O GLY A 46 1.232 -19.488 -4.883 1.00 0.00 O ATOM 0 H GLY A 46 -1.528 -17.086 -5.196 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -0.546 -18.679 -6.481 1.00 0.00 H new ATOM 0 HA3 GLY A 46 0.509 -17.485 -7.211 1.00 0.00 H new ATOM 705 N ASP A 47 2.375 -17.588 -5.379 1.00 0.00 N ATOM 706 CA ASP A 47 3.569 -17.858 -4.537 1.00 0.00 C ATOM 707 C ASP A 47 3.696 -16.786 -3.410 1.00 0.00 C ATOM 708 O ASP A 47 3.714 -17.142 -2.229 1.00 0.00 O ATOM 709 CB ASP A 47 4.786 -17.949 -5.487 1.00 0.00 C ATOM 710 CG ASP A 47 6.111 -18.267 -4.806 1.00 0.00 C ATOM 711 OD1 ASP A 47 6.407 -19.460 -4.586 1.00 0.00 O ATOM 712 OD2 ASP A 47 6.863 -17.318 -4.489 1.00 0.00 O ATOM 0 H ASP A 47 2.448 -16.727 -5.921 1.00 0.00 H new ATOM 0 HA ASP A 47 3.493 -18.804 -4.001 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.587 -18.715 -6.236 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.885 -17.002 -6.018 1.00 0.00 H new ATOM 717 N LYS A 48 3.810 -15.498 -3.777 1.00 0.00 N ATOM 718 CA LYS A 48 4.208 -14.424 -2.844 1.00 0.00 C ATOM 719 C LYS A 48 3.037 -13.501 -2.423 1.00 0.00 C ATOM 720 O LYS A 48 1.951 -13.456 -3.013 1.00 0.00 O ATOM 721 CB LYS A 48 5.475 -13.749 -3.413 1.00 0.00 C ATOM 722 CG LYS A 48 5.345 -12.732 -4.555 1.00 0.00 C ATOM 723 CD LYS A 48 6.750 -12.247 -4.975 1.00 0.00 C ATOM 724 CE LYS A 48 6.783 -11.163 -6.060 1.00 0.00 C ATOM 725 NZ LYS A 48 6.279 -11.638 -7.366 1.00 0.00 N ATOM 0 H LYS A 48 3.630 -15.170 -4.726 1.00 0.00 H new ATOM 0 HA LYS A 48 4.482 -14.833 -1.871 1.00 0.00 H new ATOM 0 HB2 LYS A 48 5.977 -13.248 -2.585 1.00 0.00 H new ATOM 0 HB3 LYS A 48 6.140 -14.541 -3.756 1.00 0.00 H new ATOM 0 HG2 LYS A 48 4.836 -13.187 -5.405 1.00 0.00 H new ATOM 0 HG3 LYS A 48 4.737 -11.886 -4.235 1.00 0.00 H new ATOM 0 HD2 LYS A 48 7.262 -11.866 -4.091 1.00 0.00 H new ATOM 0 HD3 LYS A 48 7.320 -13.106 -5.328 1.00 0.00 H new ATOM 0 HE2 LYS A 48 6.185 -10.312 -5.734 1.00 0.00 H new ATOM 0 HE3 LYS A 48 7.806 -10.807 -6.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 6.325 -10.863 -8.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 6.864 -12.433 -7.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 5.293 -11.953 -7.264 1.00 0.00 H new ATOM 738 N MET A 49 3.261 -12.793 -1.317 1.00 0.00 N ATOM 739 CA MET A 49 2.212 -12.016 -0.617 1.00 0.00 C ATOM 740 C MET A 49 1.916 -10.636 -1.259 1.00 0.00 C ATOM 741 O MET A 49 2.800 -9.981 -1.819 1.00 0.00 O ATOM 742 CB MET A 49 2.581 -11.986 0.883 1.00 0.00 C ATOM 743 CG MET A 49 3.840 -11.214 1.286 1.00 0.00 C ATOM 744 SD MET A 49 4.464 -11.821 2.857 1.00 0.00 S ATOM 745 CE MET A 49 5.395 -10.374 3.374 1.00 0.00 C ATOM 0 H MET A 49 4.176 -12.735 -0.871 1.00 0.00 H new ATOM 0 HA MET A 49 1.245 -12.508 -0.725 1.00 0.00 H new ATOM 0 HB2 MET A 49 1.738 -11.562 1.428 1.00 0.00 H new ATOM 0 HB3 MET A 49 2.695 -13.016 1.222 1.00 0.00 H new ATOM 0 HG2 MET A 49 4.604 -11.323 0.516 1.00 0.00 H new ATOM 0 HG3 MET A 49 3.614 -10.150 1.363 1.00 0.00 H new ATOM 0 HE1 MET A 49 5.859 -10.566 4.341 1.00 0.00 H new ATOM 0 HE2 MET A 49 6.168 -10.157 2.637 1.00 0.00 H new ATOM 0 HE3 MET A 49 4.723 -9.520 3.458 1.00 0.00 H new ATOM 755 N THR A 50 0.647 -10.211 -1.234 1.00 0.00 N ATOM 756 CA THR A 50 0.177 -9.065 -2.053 1.00 0.00 C ATOM 757 C THR A 50 -0.819 -8.231 -1.209 1.00 0.00 C ATOM 758 O THR A 50 -1.830 -8.756 -0.730 1.00 0.00 O ATOM 759 CB THR A 50 -0.507 -9.594 -3.353 1.00 0.00 C ATOM 760 OG1 THR A 50 0.360 -10.468 -4.063 1.00 0.00 O ATOM 761 CG2 THR A 50 -0.868 -8.493 -4.339 1.00 0.00 C ATOM 0 H THR A 50 -0.080 -10.637 -0.659 1.00 0.00 H new ATOM 0 HA THR A 50 1.018 -8.435 -2.343 1.00 0.00 H new ATOM 0 HB THR A 50 -1.410 -10.093 -3.002 1.00 0.00 H new ATOM 0 HG1 THR A 50 0.065 -10.535 -4.995 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.339 -8.932 -5.218 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.559 -7.795 -3.867 1.00 0.00 H new ATOM 0 HG23 THR A 50 0.036 -7.962 -4.639 1.00 0.00 H new ATOM 769 N MET A 51 -0.548 -6.923 -1.106 1.00 0.00 N ATOM 770 CA MET A 51 -1.547 -5.938 -0.631 1.00 0.00 C ATOM 771 C MET A 51 -2.432 -5.478 -1.827 1.00 0.00 C ATOM 772 O MET A 51 -2.007 -4.678 -2.669 1.00 0.00 O ATOM 773 CB MET A 51 -0.853 -4.709 0.012 1.00 0.00 C ATOM 774 CG MET A 51 -0.523 -4.862 1.504 1.00 0.00 C ATOM 775 SD MET A 51 0.837 -3.752 1.937 1.00 0.00 S ATOM 776 CE MET A 51 -0.006 -2.175 2.155 1.00 0.00 C ATOM 0 H MET A 51 0.356 -6.515 -1.345 1.00 0.00 H new ATOM 0 HA MET A 51 -2.170 -6.413 0.127 1.00 0.00 H new ATOM 0 HB2 MET A 51 0.070 -4.506 -0.531 1.00 0.00 H new ATOM 0 HB3 MET A 51 -1.496 -3.838 -0.116 1.00 0.00 H new ATOM 0 HG2 MET A 51 -1.401 -4.631 2.107 1.00 0.00 H new ATOM 0 HG3 MET A 51 -0.248 -5.894 1.723 1.00 0.00 H new ATOM 0 HE1 MET A 51 0.728 -1.370 2.176 1.00 0.00 H new ATOM 0 HE2 MET A 51 -0.697 -2.014 1.327 1.00 0.00 H new ATOM 0 HE3 MET A 51 -0.560 -2.185 3.094 1.00 0.00 H new ATOM 786 N LEU A 52 -3.678 -5.956 -1.858 1.00 0.00 N ATOM 787 CA LEU A 52 -4.688 -5.521 -2.858 1.00 0.00 C ATOM 788 C LEU A 52 -5.483 -4.298 -2.273 1.00 0.00 C ATOM 789 O LEU A 52 -6.656 -4.383 -1.895 1.00 0.00 O ATOM 790 CB LEU A 52 -5.586 -6.714 -3.304 1.00 0.00 C ATOM 791 CG LEU A 52 -4.843 -8.015 -3.699 1.00 0.00 C ATOM 792 CD1 LEU A 52 -5.749 -9.248 -3.672 1.00 0.00 C ATOM 793 CD2 LEU A 52 -4.187 -7.883 -5.071 1.00 0.00 C ATOM 0 H LEU A 52 -4.026 -6.653 -1.199 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.202 -5.183 -3.773 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.276 -6.946 -2.493 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.188 -6.391 -4.153 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.070 -8.160 -2.945 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.174 -10.129 -3.957 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.147 -9.385 -2.667 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.572 -9.110 -4.373 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -3.674 -8.812 -5.320 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.951 -7.678 -5.821 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -3.467 -7.064 -5.053 1.00 0.00 H new ATOM 805 N THR A 53 -4.768 -3.172 -2.151 1.00 0.00 N ATOM 806 CA THR A 53 -5.210 -1.958 -1.423 1.00 0.00 C ATOM 807 C THR A 53 -6.435 -1.299 -2.082 1.00 0.00 C ATOM 808 O THR A 53 -6.381 -0.895 -3.240 1.00 0.00 O ATOM 809 CB THR A 53 -3.979 -1.004 -1.375 1.00 0.00 C ATOM 810 OG1 THR A 53 -2.920 -1.591 -0.621 1.00 0.00 O ATOM 811 CG2 THR A 53 -4.270 0.339 -0.717 1.00 0.00 C ATOM 0 H THR A 53 -3.841 -3.070 -2.564 1.00 0.00 H new ATOM 0 HA THR A 53 -5.541 -2.210 -0.416 1.00 0.00 H new ATOM 0 HB THR A 53 -3.711 -0.844 -2.419 1.00 0.00 H new ATOM 0 HG1 THR A 53 -2.154 -0.980 -0.602 1.00 0.00 H new ATOM 0 HG21 THR A 53 -3.367 0.949 -0.720 1.00 0.00 H new ATOM 0 HG22 THR A 53 -5.057 0.852 -1.270 1.00 0.00 H new ATOM 0 HG23 THR A 53 -4.595 0.178 0.311 1.00 0.00 H new ATOM 819 N GLU A 54 -7.537 -1.216 -1.336 1.00 0.00 N ATOM 820 CA GLU A 54 -8.884 -1.034 -1.947 1.00 0.00 C ATOM 821 C GLU A 54 -9.598 0.182 -1.284 1.00 0.00 C ATOM 822 O GLU A 54 -10.484 0.061 -0.430 1.00 0.00 O ATOM 823 CB GLU A 54 -9.522 -2.431 -1.763 1.00 0.00 C ATOM 824 CG GLU A 54 -10.882 -2.683 -2.407 1.00 0.00 C ATOM 825 CD GLU A 54 -11.449 -4.051 -2.036 1.00 0.00 C ATOM 826 OE1 GLU A 54 -12.140 -4.177 -1.001 1.00 0.00 O ATOM 827 OE2 GLU A 54 -11.195 -5.036 -2.757 1.00 0.00 O ATOM 0 H GLU A 54 -7.540 -1.270 -0.317 1.00 0.00 H new ATOM 0 HA GLU A 54 -8.921 -0.763 -3.002 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -8.824 -3.172 -2.153 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -9.619 -2.617 -0.693 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.580 -1.905 -2.096 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.788 -2.612 -3.491 1.00 0.00 H new ATOM 834 N SER A 55 -9.133 1.381 -1.650 1.00 0.00 N ATOM 835 CA SER A 55 -9.514 2.665 -0.998 1.00 0.00 C ATOM 836 C SER A 55 -10.030 3.688 -2.058 1.00 0.00 C ATOM 837 O SER A 55 -9.802 3.522 -3.260 1.00 0.00 O ATOM 838 CB SER A 55 -8.240 3.204 -0.288 1.00 0.00 C ATOM 839 OG SER A 55 -7.757 2.272 0.684 1.00 0.00 O ATOM 0 H SER A 55 -8.471 1.502 -2.417 1.00 0.00 H new ATOM 0 HA SER A 55 -10.322 2.513 -0.282 1.00 0.00 H new ATOM 0 HB2 SER A 55 -7.463 3.398 -1.027 1.00 0.00 H new ATOM 0 HB3 SER A 55 -8.465 4.155 0.196 1.00 0.00 H new ATOM 0 HG SER A 55 -6.955 2.635 1.114 1.00 0.00 H new ATOM 845 N THR A 56 -10.689 4.784 -1.641 1.00 0.00 N ATOM 846 CA THR A 56 -11.230 5.802 -2.614 1.00 0.00 C ATOM 847 C THR A 56 -10.178 6.493 -3.541 1.00 0.00 C ATOM 848 O THR A 56 -10.454 6.644 -4.732 1.00 0.00 O ATOM 849 CB THR A 56 -12.161 6.790 -1.866 1.00 0.00 C ATOM 850 OG1 THR A 56 -13.303 6.091 -1.391 1.00 0.00 O ATOM 851 CG2 THR A 56 -12.744 7.933 -2.687 1.00 0.00 C ATOM 0 H THR A 56 -10.867 5.002 -0.661 1.00 0.00 H new ATOM 0 HA THR A 56 -11.819 5.249 -3.345 1.00 0.00 H new ATOM 0 HB THR A 56 -11.509 7.212 -1.101 1.00 0.00 H new ATOM 0 HG1 THR A 56 -14.024 6.729 -1.208 1.00 0.00 H new ATOM 0 HG21 THR A 56 -13.377 8.552 -2.051 1.00 0.00 H new ATOM 0 HG22 THR A 56 -11.934 8.539 -3.093 1.00 0.00 H new ATOM 0 HG23 THR A 56 -13.339 7.527 -3.505 1.00 0.00 H new ATOM 859 N PHE A 57 -9.005 6.882 -3.020 1.00 0.00 N ATOM 860 CA PHE A 57 -7.875 7.351 -3.864 1.00 0.00 C ATOM 861 C PHE A 57 -6.875 6.245 -4.314 1.00 0.00 C ATOM 862 O PHE A 57 -6.398 6.314 -5.449 1.00 0.00 O ATOM 863 CB PHE A 57 -7.148 8.516 -3.145 1.00 0.00 C ATOM 864 CG PHE A 57 -7.624 9.889 -3.645 1.00 0.00 C ATOM 865 CD1 PHE A 57 -7.207 10.399 -4.891 1.00 0.00 C ATOM 866 CD2 PHE A 57 -8.521 10.636 -2.883 1.00 0.00 C ATOM 867 CE1 PHE A 57 -7.674 11.632 -5.346 1.00 0.00 C ATOM 868 CE2 PHE A 57 -9.005 11.857 -3.349 1.00 0.00 C ATOM 869 CZ PHE A 57 -8.576 12.360 -4.574 1.00 0.00 C ATOM 0 H PHE A 57 -8.805 6.884 -2.020 1.00 0.00 H new ATOM 0 HA PHE A 57 -8.317 7.696 -4.799 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.319 8.442 -2.071 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -6.073 8.425 -3.303 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -6.520 9.830 -5.499 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -8.844 10.265 -1.922 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -7.337 12.021 -6.295 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -9.716 12.415 -2.757 1.00 0.00 H new ATOM 0 HZ PHE A 57 -8.942 13.313 -4.925 1.00 0.00 H new ATOM 879 N LYS A 58 -6.543 5.270 -3.449 1.00 0.00 N ATOM 880 CA LYS A 58 -5.719 4.107 -3.854 1.00 0.00 C ATOM 881 C LYS A 58 -6.568 2.797 -3.885 1.00 0.00 C ATOM 882 O LYS A 58 -6.538 1.995 -2.950 1.00 0.00 O ATOM 883 CB LYS A 58 -4.480 3.951 -2.931 1.00 0.00 C ATOM 884 CG LYS A 58 -3.377 5.004 -3.152 1.00 0.00 C ATOM 885 CD LYS A 58 -2.000 4.526 -2.657 1.00 0.00 C ATOM 886 CE LYS A 58 -1.831 4.555 -1.136 1.00 0.00 C ATOM 887 NZ LYS A 58 -0.539 3.895 -0.794 1.00 0.00 N ATOM 0 H LYS A 58 -6.829 5.260 -2.470 1.00 0.00 H new ATOM 0 HA LYS A 58 -5.359 4.292 -4.866 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -4.808 4.001 -1.893 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -4.053 2.960 -3.083 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -3.315 5.244 -4.214 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.647 5.924 -2.633 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -1.834 3.508 -3.010 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -1.228 5.150 -3.108 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -1.840 5.583 -0.773 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.660 4.039 -0.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -0.307 4.081 0.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -0.623 2.869 -0.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 0.216 4.274 -1.401 1.00 0.00 H new ATOM 901 N ASN A 59 -7.269 2.563 -5.000 1.00 0.00 N ATOM 902 CA ASN A 59 -7.802 1.214 -5.345 1.00 0.00 C ATOM 903 C ASN A 59 -6.814 0.531 -6.348 1.00 0.00 C ATOM 904 O ASN A 59 -6.937 0.679 -7.567 1.00 0.00 O ATOM 905 CB ASN A 59 -9.238 1.401 -5.881 1.00 0.00 C ATOM 906 CG ASN A 59 -10.060 0.121 -5.914 1.00 0.00 C ATOM 907 OD1 ASN A 59 -9.888 -0.743 -6.765 1.00 0.00 O ATOM 908 ND2 ASN A 59 -10.986 -0.053 -5.002 1.00 0.00 N ATOM 0 H ASN A 59 -7.488 3.283 -5.688 1.00 0.00 H new ATOM 0 HA ASN A 59 -7.869 0.545 -4.487 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -9.753 2.135 -5.261 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.187 1.814 -6.889 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -11.553 -0.901 -5.007 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -11.139 0.659 -4.288 1.00 0.00 H new ATOM 915 N LEU A 60 -5.786 -0.141 -5.809 1.00 0.00 N ATOM 916 CA LEU A 60 -4.621 -0.633 -6.589 1.00 0.00 C ATOM 917 C LEU A 60 -3.842 -1.766 -5.856 1.00 0.00 C ATOM 918 O LEU A 60 -3.742 -1.775 -4.629 1.00 0.00 O ATOM 919 CB LEU A 60 -3.688 0.543 -7.009 1.00 0.00 C ATOM 920 CG LEU A 60 -3.097 1.404 -5.865 1.00 0.00 C ATOM 921 CD1 LEU A 60 -1.750 0.875 -5.350 1.00 0.00 C ATOM 922 CD2 LEU A 60 -2.888 2.849 -6.350 1.00 0.00 C ATOM 0 H LEU A 60 -5.731 -0.364 -4.815 1.00 0.00 H new ATOM 0 HA LEU A 60 -5.016 -1.083 -7.500 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.861 0.131 -7.587 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -4.247 1.200 -7.675 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.816 1.360 -5.047 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.388 1.520 -4.550 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.879 -0.138 -4.969 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.027 0.867 -6.165 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -2.472 3.448 -5.540 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -2.199 2.853 -7.195 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.844 3.271 -6.659 1.00 0.00 H new ATOM 934 N SER A 61 -3.233 -2.691 -6.609 1.00 0.00 N ATOM 935 CA SER A 61 -2.450 -3.811 -6.027 1.00 0.00 C ATOM 936 C SER A 61 -0.908 -3.603 -6.015 1.00 0.00 C ATOM 937 O SER A 61 -0.338 -3.138 -7.007 1.00 0.00 O ATOM 938 CB SER A 61 -2.753 -5.089 -6.858 1.00 0.00 C ATOM 939 OG SER A 61 -2.366 -4.953 -8.229 1.00 0.00 O ATOM 0 H SER A 61 -3.263 -2.693 -7.629 1.00 0.00 H new ATOM 0 HA SER A 61 -2.755 -3.885 -4.983 1.00 0.00 H new ATOM 0 HB2 SER A 61 -2.229 -5.938 -6.418 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.819 -5.310 -6.804 1.00 0.00 H new ATOM 0 HG SER A 61 -1.659 -4.279 -8.304 1.00 0.00 H new ATOM 945 N VAL A 62 -0.243 -4.069 -4.947 1.00 0.00 N ATOM 946 CA VAL A 62 1.247 -4.106 -4.870 1.00 0.00 C ATOM 947 C VAL A 62 1.676 -5.539 -4.368 1.00 0.00 C ATOM 948 O VAL A 62 1.133 -6.061 -3.389 1.00 0.00 O ATOM 949 CB VAL A 62 1.929 -3.013 -3.979 1.00 0.00 C ATOM 950 CG1 VAL A 62 3.126 -2.369 -4.717 1.00 0.00 C ATOM 951 CG2 VAL A 62 1.026 -1.889 -3.457 1.00 0.00 C ATOM 0 H VAL A 62 -0.707 -4.430 -4.113 1.00 0.00 H new ATOM 0 HA VAL A 62 1.598 -3.882 -5.877 1.00 0.00 H new ATOM 0 HB VAL A 62 2.241 -3.576 -3.099 1.00 0.00 H new ATOM 0 HG11 VAL A 62 3.583 -1.613 -4.078 1.00 0.00 H new ATOM 0 HG12 VAL A 62 3.862 -3.137 -4.955 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.777 -1.903 -5.638 1.00 0.00 H new ATOM 0 HG21 VAL A 62 1.616 -1.198 -2.855 1.00 0.00 H new ATOM 0 HG22 VAL A 62 0.588 -1.353 -4.299 1.00 0.00 H new ATOM 0 HG23 VAL A 62 0.231 -2.315 -2.845 1.00 0.00 H new ATOM 961 N THR A 63 2.655 -6.128 -5.058 1.00 0.00 N ATOM 962 CA THR A 63 3.074 -7.549 -4.852 1.00 0.00 C ATOM 963 C THR A 63 4.587 -7.647 -4.487 1.00 0.00 C ATOM 964 O THR A 63 5.426 -6.881 -4.971 1.00 0.00 O ATOM 965 CB THR A 63 2.787 -8.364 -6.154 1.00 0.00 C ATOM 966 OG1 THR A 63 1.453 -8.156 -6.613 1.00 0.00 O ATOM 967 CG2 THR A 63 2.957 -9.871 -5.979 1.00 0.00 C ATOM 0 H THR A 63 3.191 -5.647 -5.780 1.00 0.00 H new ATOM 0 HA THR A 63 2.503 -7.962 -4.021 1.00 0.00 H new ATOM 0 HB THR A 63 3.521 -7.998 -6.872 1.00 0.00 H new ATOM 0 HG1 THR A 63 1.303 -8.677 -7.429 1.00 0.00 H new ATOM 0 HG21 THR A 63 2.742 -10.373 -6.922 1.00 0.00 H new ATOM 0 HG22 THR A 63 3.981 -10.089 -5.677 1.00 0.00 H new ATOM 0 HG23 THR A 63 2.269 -10.228 -5.213 1.00 0.00 H new ATOM 975 N PHE A 64 4.903 -8.590 -3.591 1.00 0.00 N ATOM 976 CA PHE A 64 6.180 -8.578 -2.823 1.00 0.00 C ATOM 977 C PHE A 64 6.410 -9.910 -2.029 1.00 0.00 C ATOM 978 O PHE A 64 5.506 -10.725 -1.834 1.00 0.00 O ATOM 979 CB PHE A 64 6.296 -7.306 -1.911 1.00 0.00 C ATOM 980 CG PHE A 64 5.030 -6.898 -1.134 1.00 0.00 C ATOM 981 CD1 PHE A 64 4.422 -7.774 -0.222 1.00 0.00 C ATOM 982 CD2 PHE A 64 4.360 -5.708 -1.461 1.00 0.00 C ATOM 983 CE1 PHE A 64 3.178 -7.475 0.326 1.00 0.00 C ATOM 984 CE2 PHE A 64 3.149 -5.379 -0.854 1.00 0.00 C ATOM 985 CZ PHE A 64 2.565 -6.266 0.036 1.00 0.00 C ATOM 0 H PHE A 64 4.296 -9.380 -3.371 1.00 0.00 H new ATOM 0 HA PHE A 64 6.989 -8.518 -3.551 1.00 0.00 H new ATOM 0 HB2 PHE A 64 7.098 -7.474 -1.192 1.00 0.00 H new ATOM 0 HB3 PHE A 64 6.599 -6.465 -2.535 1.00 0.00 H new ATOM 0 HD1 PHE A 64 4.924 -8.689 0.057 1.00 0.00 H new ATOM 0 HD2 PHE A 64 4.789 -5.039 -2.192 1.00 0.00 H new ATOM 0 HE1 PHE A 64 2.690 -8.185 0.977 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.668 -4.438 -1.076 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.626 -6.014 0.507 1.00 0.00 H new ATOM 995 N LYS A 65 7.642 -10.113 -1.545 1.00 0.00 N ATOM 996 CA LYS A 65 7.963 -11.199 -0.572 1.00 0.00 C ATOM 997 C LYS A 65 8.486 -10.656 0.787 1.00 0.00 C ATOM 998 O LYS A 65 8.746 -9.457 0.950 1.00 0.00 O ATOM 999 CB LYS A 65 8.825 -12.286 -1.263 1.00 0.00 C ATOM 1000 CG LYS A 65 10.302 -11.956 -1.519 1.00 0.00 C ATOM 1001 CD LYS A 65 11.044 -13.108 -2.218 1.00 0.00 C ATOM 1002 CE LYS A 65 12.568 -12.892 -2.360 1.00 0.00 C ATOM 1003 NZ LYS A 65 12.924 -11.754 -3.258 1.00 0.00 N ATOM 0 H LYS A 65 8.447 -9.543 -1.805 1.00 0.00 H new ATOM 0 HA LYS A 65 7.047 -11.707 -0.270 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.782 -13.189 -0.653 1.00 0.00 H new ATOM 0 HB3 LYS A 65 8.362 -12.525 -2.220 1.00 0.00 H new ATOM 0 HG2 LYS A 65 10.370 -11.057 -2.132 1.00 0.00 H new ATOM 0 HG3 LYS A 65 10.792 -11.733 -0.571 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.870 -14.028 -1.660 1.00 0.00 H new ATOM 0 HD3 LYS A 65 10.616 -13.251 -3.210 1.00 0.00 H new ATOM 0 HE2 LYS A 65 12.996 -12.714 -1.373 1.00 0.00 H new ATOM 0 HE3 LYS A 65 13.023 -13.805 -2.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 13.724 -12.027 -3.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 12.106 -11.512 -3.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 13.190 -10.929 -2.684 1.00 0.00 H new ATOM 1017 N PHE A 66 8.631 -11.547 1.783 1.00 0.00 N ATOM 1018 CA PHE A 66 9.210 -11.210 3.108 1.00 0.00 C ATOM 1019 C PHE A 66 10.744 -10.931 3.030 1.00 0.00 C ATOM 1020 O PHE A 66 11.594 -11.807 3.188 1.00 0.00 O ATOM 1021 CB PHE A 66 8.790 -12.239 4.186 1.00 0.00 C ATOM 1022 CG PHE A 66 8.805 -13.735 3.852 1.00 0.00 C ATOM 1023 CD1 PHE A 66 9.993 -14.473 3.925 1.00 0.00 C ATOM 1024 CD2 PHE A 66 7.626 -14.394 3.464 1.00 0.00 C ATOM 1025 CE1 PHE A 66 10.007 -15.836 3.626 1.00 0.00 C ATOM 1026 CE2 PHE A 66 7.639 -15.757 3.160 1.00 0.00 C ATOM 1027 CZ PHE A 66 8.829 -16.476 3.246 1.00 0.00 C ATOM 0 H PHE A 66 8.352 -12.524 1.698 1.00 0.00 H new ATOM 0 HA PHE A 66 8.783 -10.262 3.435 1.00 0.00 H new ATOM 0 HB2 PHE A 66 9.440 -12.091 5.049 1.00 0.00 H new ATOM 0 HB3 PHE A 66 7.778 -11.986 4.502 1.00 0.00 H new ATOM 0 HD1 PHE A 66 10.909 -13.981 4.216 1.00 0.00 H new ATOM 0 HD2 PHE A 66 6.701 -13.841 3.400 1.00 0.00 H new ATOM 0 HE1 PHE A 66 10.930 -16.394 3.689 1.00 0.00 H new ATOM 0 HE2 PHE A 66 6.728 -16.253 2.859 1.00 0.00 H new ATOM 0 HZ PHE A 66 8.839 -17.532 3.018 1.00 0.00 H new ATOM 1037 N GLY A 67 11.030 -9.674 2.691 1.00 0.00 N ATOM 1038 CA GLY A 67 12.392 -9.219 2.346 1.00 0.00 C ATOM 1039 C GLY A 67 12.500 -7.933 1.497 1.00 0.00 C ATOM 1040 O GLY A 67 13.483 -7.207 1.643 1.00 0.00 O ATOM 0 H GLY A 67 10.328 -8.935 2.645 1.00 0.00 H new ATOM 0 HA2 GLY A 67 12.943 -9.062 3.273 1.00 0.00 H new ATOM 0 HA3 GLY A 67 12.894 -10.024 1.809 1.00 0.00 H new ATOM 1044 N GLU A 68 11.547 -7.684 0.585 1.00 0.00 N ATOM 1045 CA GLU A 68 11.699 -6.664 -0.477 1.00 0.00 C ATOM 1046 C GLU A 68 11.537 -5.195 0.028 1.00 0.00 C ATOM 1047 O GLU A 68 10.646 -4.891 0.826 1.00 0.00 O ATOM 1048 CB GLU A 68 10.642 -6.863 -1.610 1.00 0.00 C ATOM 1049 CG GLU A 68 10.518 -8.245 -2.245 1.00 0.00 C ATOM 1050 CD GLU A 68 11.742 -8.871 -2.870 1.00 0.00 C ATOM 1051 OE1 GLU A 68 12.589 -9.413 -2.127 1.00 0.00 O ATOM 1052 OE2 GLU A 68 11.800 -8.994 -4.108 1.00 0.00 O ATOM 0 H GLU A 68 10.654 -8.177 0.558 1.00 0.00 H new ATOM 0 HA GLU A 68 12.717 -6.807 -0.841 1.00 0.00 H new ATOM 0 HB2 GLU A 68 9.666 -6.593 -1.206 1.00 0.00 H new ATOM 0 HB3 GLU A 68 10.867 -6.151 -2.404 1.00 0.00 H new ATOM 0 HG2 GLU A 68 10.152 -8.929 -1.479 1.00 0.00 H new ATOM 0 HG3 GLU A 68 9.748 -8.187 -3.014 1.00 0.00 H new ATOM 1059 N GLU A 69 12.325 -4.288 -0.560 1.00 0.00 N ATOM 1060 CA GLU A 69 11.979 -2.844 -0.624 1.00 0.00 C ATOM 1061 C GLU A 69 10.964 -2.554 -1.771 1.00 0.00 C ATOM 1062 O GLU A 69 11.342 -2.206 -2.893 1.00 0.00 O ATOM 1063 CB GLU A 69 13.256 -1.973 -0.628 1.00 0.00 C ATOM 1064 CG GLU A 69 14.334 -2.252 -1.688 1.00 0.00 C ATOM 1065 CD GLU A 69 15.488 -1.261 -1.653 1.00 0.00 C ATOM 1066 OE1 GLU A 69 16.229 -1.225 -0.648 1.00 0.00 O ATOM 1067 OE2 GLU A 69 15.669 -0.524 -2.645 1.00 0.00 O ATOM 0 H GLU A 69 13.214 -4.520 -1.004 1.00 0.00 H new ATOM 0 HA GLU A 69 11.447 -2.555 0.282 1.00 0.00 H new ATOM 0 HB2 GLU A 69 12.947 -0.933 -0.736 1.00 0.00 H new ATOM 0 HB3 GLU A 69 13.724 -2.067 0.352 1.00 0.00 H new ATOM 0 HG2 GLU A 69 14.725 -3.259 -1.541 1.00 0.00 H new ATOM 0 HG3 GLU A 69 13.875 -2.229 -2.677 1.00 0.00 H new ATOM 1074 N PHE A 70 9.658 -2.734 -1.487 1.00 0.00 N ATOM 1075 CA PHE A 70 8.602 -2.682 -2.533 1.00 0.00 C ATOM 1076 C PHE A 70 8.229 -1.232 -2.931 1.00 0.00 C ATOM 1077 O PHE A 70 7.812 -0.456 -2.066 1.00 0.00 O ATOM 1078 CB PHE A 70 7.382 -3.550 -2.142 1.00 0.00 C ATOM 1079 CG PHE A 70 6.395 -3.056 -1.077 1.00 0.00 C ATOM 1080 CD1 PHE A 70 5.352 -2.171 -1.409 1.00 0.00 C ATOM 1081 CD2 PHE A 70 6.431 -3.590 0.216 1.00 0.00 C ATOM 1082 CE1 PHE A 70 4.382 -1.825 -0.469 1.00 0.00 C ATOM 1083 CE2 PHE A 70 5.451 -3.260 1.154 1.00 0.00 C ATOM 1084 CZ PHE A 70 4.429 -2.377 0.809 1.00 0.00 C ATOM 0 H PHE A 70 9.305 -2.916 -0.548 1.00 0.00 H new ATOM 0 HA PHE A 70 9.016 -3.123 -3.440 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.811 -3.734 -3.052 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.765 -4.514 -1.806 1.00 0.00 H new ATOM 0 HD1 PHE A 70 5.302 -1.755 -2.404 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.227 -4.266 0.492 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.597 -1.131 -0.731 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.485 -3.688 2.145 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.671 -2.120 1.535 1.00 0.00 H new ATOM 1094 N ASP A 71 8.354 -0.861 -4.212 1.00 0.00 N ATOM 1095 CA ASP A 71 7.982 0.501 -4.684 1.00 0.00 C ATOM 1096 C ASP A 71 6.480 0.664 -5.077 1.00 0.00 C ATOM 1097 O ASP A 71 5.890 -0.179 -5.760 1.00 0.00 O ATOM 1098 CB ASP A 71 8.940 1.064 -5.760 1.00 0.00 C ATOM 1099 CG ASP A 71 9.446 0.168 -6.867 1.00 0.00 C ATOM 1100 OD1 ASP A 71 8.782 0.038 -7.913 1.00 0.00 O ATOM 1101 OD2 ASP A 71 10.562 -0.379 -6.701 1.00 0.00 O ATOM 0 H ASP A 71 8.708 -1.475 -4.946 1.00 0.00 H new ATOM 0 HA ASP A 71 8.112 1.127 -3.801 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.437 1.908 -6.231 1.00 0.00 H new ATOM 0 HB3 ASP A 71 9.812 1.462 -5.241 1.00 0.00 H new ATOM 1106 N GLU A 72 5.887 1.796 -4.665 1.00 0.00 N ATOM 1107 CA GLU A 72 4.617 2.304 -5.239 1.00 0.00 C ATOM 1108 C GLU A 72 4.734 3.842 -5.494 1.00 0.00 C ATOM 1109 O GLU A 72 5.383 4.565 -4.728 1.00 0.00 O ATOM 1110 CB GLU A 72 3.367 1.958 -4.380 1.00 0.00 C ATOM 1111 CG GLU A 72 3.286 2.556 -2.963 1.00 0.00 C ATOM 1112 CD GLU A 72 1.870 2.764 -2.451 1.00 0.00 C ATOM 1113 OE1 GLU A 72 1.304 3.861 -2.667 1.00 0.00 O ATOM 1114 OE2 GLU A 72 1.309 1.878 -1.773 1.00 0.00 O ATOM 0 H GLU A 72 6.268 2.388 -3.927 1.00 0.00 H new ATOM 0 HA GLU A 72 4.461 1.792 -6.188 1.00 0.00 H new ATOM 0 HB2 GLU A 72 2.482 2.278 -4.930 1.00 0.00 H new ATOM 0 HB3 GLU A 72 3.311 0.873 -4.290 1.00 0.00 H new ATOM 0 HG2 GLU A 72 3.816 1.899 -2.273 1.00 0.00 H new ATOM 0 HG3 GLU A 72 3.807 3.513 -2.955 1.00 0.00 H new ATOM 1121 N LYS A 73 4.047 4.353 -6.532 1.00 0.00 N ATOM 1122 CA LYS A 73 3.723 5.803 -6.602 1.00 0.00 C ATOM 1123 C LYS A 73 2.301 6.069 -6.052 1.00 0.00 C ATOM 1124 O LYS A 73 1.311 5.483 -6.503 1.00 0.00 O ATOM 1125 CB LYS A 73 4.021 6.429 -7.981 1.00 0.00 C ATOM 1126 CG LYS A 73 3.037 6.153 -9.122 1.00 0.00 C ATOM 1127 CD LYS A 73 2.337 7.386 -9.724 1.00 0.00 C ATOM 1128 CE LYS A 73 1.289 7.993 -8.785 1.00 0.00 C ATOM 1129 NZ LYS A 73 0.510 9.071 -9.452 1.00 0.00 N ATOM 0 H LYS A 73 3.708 3.803 -7.322 1.00 0.00 H new ATOM 0 HA LYS A 73 4.406 6.337 -5.942 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.087 7.509 -7.851 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.006 6.085 -8.298 1.00 0.00 H new ATOM 0 HG2 LYS A 73 3.572 5.638 -9.920 1.00 0.00 H new ATOM 0 HG3 LYS A 73 2.272 5.468 -8.757 1.00 0.00 H new ATOM 0 HD2 LYS A 73 3.085 8.142 -9.963 1.00 0.00 H new ATOM 0 HD3 LYS A 73 1.858 7.104 -10.662 1.00 0.00 H new ATOM 0 HE2 LYS A 73 0.610 7.211 -8.444 1.00 0.00 H new ATOM 0 HE3 LYS A 73 1.783 8.395 -7.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -0.189 9.457 -8.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 1.155 9.828 -9.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 0.019 8.682 -10.282 1.00 0.00 H new ATOM 1143 N THR A 74 2.208 6.987 -5.093 1.00 0.00 N ATOM 1144 CA THR A 74 0.952 7.216 -4.332 1.00 0.00 C ATOM 1145 C THR A 74 -0.089 8.063 -5.131 1.00 0.00 C ATOM 1146 O THR A 74 0.263 8.790 -6.066 1.00 0.00 O ATOM 1147 CB THR A 74 1.292 7.892 -2.962 1.00 0.00 C ATOM 1148 OG1 THR A 74 1.798 9.209 -3.147 1.00 0.00 O ATOM 1149 CG2 THR A 74 2.315 7.136 -2.111 1.00 0.00 C ATOM 0 H THR A 74 2.980 7.592 -4.814 1.00 0.00 H new ATOM 0 HA THR A 74 0.484 6.247 -4.157 1.00 0.00 H new ATOM 0 HB THR A 74 0.340 7.892 -2.432 1.00 0.00 H new ATOM 0 HG1 THR A 74 2.000 9.607 -2.275 1.00 0.00 H new ATOM 0 HG21 THR A 74 2.487 7.679 -1.182 1.00 0.00 H new ATOM 0 HG22 THR A 74 1.935 6.140 -1.884 1.00 0.00 H new ATOM 0 HG23 THR A 74 3.253 7.050 -2.660 1.00 0.00 H new ATOM 1157 N SER A 75 -1.366 8.034 -4.732 1.00 0.00 N ATOM 1158 CA SER A 75 -2.391 9.014 -5.206 1.00 0.00 C ATOM 1159 C SER A 75 -2.031 10.536 -5.260 1.00 0.00 C ATOM 1160 O SER A 75 -2.432 11.230 -6.195 1.00 0.00 O ATOM 1161 CB SER A 75 -3.665 8.774 -4.365 1.00 0.00 C ATOM 1162 OG SER A 75 -3.458 8.931 -2.957 1.00 0.00 O ATOM 0 H SER A 75 -1.731 7.343 -4.077 1.00 0.00 H new ATOM 0 HA SER A 75 -2.508 8.806 -6.269 1.00 0.00 H new ATOM 0 HB2 SER A 75 -4.441 9.467 -4.690 1.00 0.00 H new ATOM 0 HB3 SER A 75 -4.035 7.767 -4.560 1.00 0.00 H new ATOM 0 HG SER A 75 -4.075 8.346 -2.469 1.00 0.00 H new ATOM 1168 N ASP A 76 -1.238 11.003 -4.299 1.00 0.00 N ATOM 1169 CA ASP A 76 -0.561 12.316 -4.328 1.00 0.00 C ATOM 1170 C ASP A 76 0.478 12.590 -5.481 1.00 0.00 C ATOM 1171 O ASP A 76 0.723 13.756 -5.801 1.00 0.00 O ATOM 1172 CB ASP A 76 0.216 12.403 -2.987 1.00 0.00 C ATOM 1173 CG ASP A 76 -0.630 12.672 -1.766 1.00 0.00 C ATOM 1174 OD1 ASP A 76 -1.465 11.830 -1.370 1.00 0.00 O ATOM 1175 OD2 ASP A 76 -0.476 13.765 -1.199 1.00 0.00 O ATOM 0 H ASP A 76 -1.037 10.472 -3.452 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.346 13.053 -4.498 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.754 11.467 -2.837 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.965 13.191 -3.071 1.00 0.00 H new ATOM 1180 N GLY A 77 1.145 11.546 -5.997 1.00 0.00 N ATOM 1181 CA GLY A 77 2.369 11.681 -6.805 1.00 0.00 C ATOM 1182 C GLY A 77 3.648 11.612 -5.962 1.00 0.00 C ATOM 1183 O GLY A 77 4.296 12.643 -5.764 1.00 0.00 O ATOM 0 H GLY A 77 0.849 10.579 -5.865 1.00 0.00 H new ATOM 0 HA2 GLY A 77 2.392 10.892 -7.557 1.00 0.00 H new ATOM 0 HA3 GLY A 77 2.343 12.630 -7.340 1.00 0.00 H new ATOM 1187 N ARG A 78 3.986 10.422 -5.440 1.00 0.00 N ATOM 1188 CA ARG A 78 5.163 10.245 -4.555 1.00 0.00 C ATOM 1189 C ARG A 78 5.683 8.786 -4.768 1.00 0.00 C ATOM 1190 O ARG A 78 5.046 7.842 -4.292 1.00 0.00 O ATOM 1191 CB ARG A 78 4.872 10.436 -3.035 1.00 0.00 C ATOM 1192 CG ARG A 78 4.079 11.662 -2.576 1.00 0.00 C ATOM 1193 CD ARG A 78 4.869 12.972 -2.503 1.00 0.00 C ATOM 1194 NE ARG A 78 3.986 14.062 -2.003 1.00 0.00 N ATOM 1195 CZ ARG A 78 3.168 14.799 -2.751 1.00 0.00 C ATOM 1196 NH1 ARG A 78 3.107 14.730 -4.059 1.00 0.00 N ATOM 1197 NH2 ARG A 78 2.364 15.616 -2.138 1.00 0.00 N ATOM 0 H ARG A 78 3.464 9.563 -5.612 1.00 0.00 H new ATOM 0 HA ARG A 78 5.885 11.016 -4.825 1.00 0.00 H new ATOM 0 HB2 ARG A 78 4.338 9.551 -2.689 1.00 0.00 H new ATOM 0 HB3 ARG A 78 5.831 10.452 -2.517 1.00 0.00 H new ATOM 0 HG2 ARG A 78 3.238 11.803 -3.255 1.00 0.00 H new ATOM 0 HG3 ARG A 78 3.662 11.455 -1.590 1.00 0.00 H new ATOM 0 HD2 ARG A 78 5.728 12.854 -1.842 1.00 0.00 H new ATOM 0 HD3 ARG A 78 5.258 13.229 -3.488 1.00 0.00 H new ATOM 0 HE ARG A 78 4.010 14.261 -1.003 1.00 0.00 H new ATOM 0 HH11 ARG A 78 3.711 14.081 -4.564 1.00 0.00 H new ATOM 0 HH12 ARG A 78 2.456 15.325 -4.571 1.00 0.00 H new ATOM 0 HH21 ARG A 78 2.376 15.675 -1.120 1.00 0.00 H new ATOM 0 HH22 ARG A 78 1.722 16.198 -2.675 1.00 0.00 H new ATOM 1211 N ASN A 79 6.815 8.600 -5.459 1.00 0.00 N ATOM 1212 CA ASN A 79 7.479 7.269 -5.551 1.00 0.00 C ATOM 1213 C ASN A 79 8.162 6.872 -4.213 1.00 0.00 C ATOM 1214 O ASN A 79 9.073 7.569 -3.756 1.00 0.00 O ATOM 1215 CB ASN A 79 8.395 7.185 -6.793 1.00 0.00 C ATOM 1216 CG ASN A 79 9.611 8.091 -6.871 1.00 0.00 C ATOM 1217 OD1 ASN A 79 10.692 7.770 -6.393 1.00 0.00 O ATOM 1218 ND2 ASN A 79 9.507 9.238 -7.500 1.00 0.00 N ATOM 0 H ASN A 79 7.298 9.343 -5.964 1.00 0.00 H new ATOM 0 HA ASN A 79 6.714 6.508 -5.706 1.00 0.00 H new ATOM 0 HB2 ASN A 79 8.745 6.156 -6.875 1.00 0.00 H new ATOM 0 HB3 ASN A 79 7.779 7.383 -7.670 1.00 0.00 H new ATOM 0 HD21 ASN A 79 10.320 9.848 -7.585 1.00 0.00 H new ATOM 0 HD22 ASN A 79 8.613 9.519 -7.903 1.00 0.00 H new ATOM 1225 N VAL A 80 7.675 5.810 -3.554 1.00 0.00 N ATOM 1226 CA VAL A 80 8.129 5.443 -2.187 1.00 0.00 C ATOM 1227 C VAL A 80 8.364 3.910 -2.117 1.00 0.00 C ATOM 1228 O VAL A 80 7.572 3.122 -2.640 1.00 0.00 O ATOM 1229 CB VAL A 80 7.194 5.924 -1.027 1.00 0.00 C ATOM 1230 CG1 VAL A 80 6.895 7.435 -1.080 1.00 0.00 C ATOM 1231 CG2 VAL A 80 5.846 5.196 -0.876 1.00 0.00 C ATOM 0 H VAL A 80 6.967 5.185 -3.938 1.00 0.00 H new ATOM 0 HA VAL A 80 9.062 5.981 -2.021 1.00 0.00 H new ATOM 0 HB VAL A 80 7.800 5.667 -0.158 1.00 0.00 H new ATOM 0 HG11 VAL A 80 6.242 7.706 -0.250 1.00 0.00 H new ATOM 0 HG12 VAL A 80 7.828 7.993 -1.005 1.00 0.00 H new ATOM 0 HG13 VAL A 80 6.403 7.676 -2.022 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.294 5.623 -0.039 1.00 0.00 H new ATOM 0 HG22 VAL A 80 5.265 5.313 -1.791 1.00 0.00 H new ATOM 0 HG23 VAL A 80 6.023 4.136 -0.692 1.00 0.00 H new ATOM 1241 N LYS A 81 9.431 3.516 -1.421 1.00 0.00 N ATOM 1242 CA LYS A 81 9.731 2.090 -1.150 1.00 0.00 C ATOM 1243 C LYS A 81 9.261 1.670 0.270 1.00 0.00 C ATOM 1244 O LYS A 81 8.767 2.478 1.065 1.00 0.00 O ATOM 1245 CB LYS A 81 11.240 1.858 -1.442 1.00 0.00 C ATOM 1246 CG LYS A 81 11.466 1.432 -2.911 1.00 0.00 C ATOM 1247 CD LYS A 81 12.945 1.269 -3.268 1.00 0.00 C ATOM 1248 CE LYS A 81 13.226 0.317 -4.454 1.00 0.00 C ATOM 1249 NZ LYS A 81 12.694 0.787 -5.764 1.00 0.00 N ATOM 0 H LYS A 81 10.114 4.163 -1.027 1.00 0.00 H new ATOM 0 HA LYS A 81 9.166 1.432 -1.809 1.00 0.00 H new ATOM 0 HB2 LYS A 81 11.798 2.771 -1.236 1.00 0.00 H new ATOM 0 HB3 LYS A 81 11.628 1.089 -0.774 1.00 0.00 H new ATOM 0 HG2 LYS A 81 10.948 0.490 -3.094 1.00 0.00 H new ATOM 0 HG3 LYS A 81 11.019 2.175 -3.571 1.00 0.00 H new ATOM 0 HD2 LYS A 81 13.358 2.250 -3.503 1.00 0.00 H new ATOM 0 HD3 LYS A 81 13.477 0.901 -2.391 1.00 0.00 H new ATOM 0 HE2 LYS A 81 14.303 0.177 -4.543 1.00 0.00 H new ATOM 0 HE3 LYS A 81 12.795 -0.659 -4.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 11.992 0.106 -6.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 12.244 1.717 -5.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 13.474 0.866 -6.447 1.00 0.00 H new ATOM 1263 N SER A 82 9.329 0.371 0.573 1.00 0.00 N ATOM 1264 CA SER A 82 8.884 -0.172 1.884 1.00 0.00 C ATOM 1265 C SER A 82 9.613 -1.503 2.179 1.00 0.00 C ATOM 1266 O SER A 82 9.281 -2.532 1.585 1.00 0.00 O ATOM 1267 CB SER A 82 7.349 -0.328 1.897 1.00 0.00 C ATOM 1268 OG SER A 82 6.714 0.949 1.899 1.00 0.00 O ATOM 0 H SER A 82 9.688 -0.337 -0.067 1.00 0.00 H new ATOM 0 HA SER A 82 9.146 0.525 2.680 1.00 0.00 H new ATOM 0 HB2 SER A 82 7.029 -0.898 1.025 1.00 0.00 H new ATOM 0 HB3 SER A 82 7.043 -0.894 2.777 1.00 0.00 H new ATOM 0 HG SER A 82 7.395 1.653 1.880 1.00 0.00 H new ATOM 1274 N VAL A 83 10.624 -1.475 3.064 1.00 0.00 N ATOM 1275 CA VAL A 83 11.520 -2.641 3.315 1.00 0.00 C ATOM 1276 C VAL A 83 10.895 -3.630 4.319 1.00 0.00 C ATOM 1277 O VAL A 83 10.828 -3.384 5.527 1.00 0.00 O ATOM 1278 CB VAL A 83 12.967 -2.150 3.600 1.00 0.00 C ATOM 1279 CG1 VAL A 83 13.207 -1.361 4.884 1.00 0.00 C ATOM 1280 CG2 VAL A 83 13.988 -3.299 3.513 1.00 0.00 C ATOM 0 H VAL A 83 10.851 -0.655 3.627 1.00 0.00 H new ATOM 0 HA VAL A 83 11.621 -3.254 2.419 1.00 0.00 H new ATOM 0 HB VAL A 83 13.114 -1.425 2.800 1.00 0.00 H new ATOM 0 HG11 VAL A 83 14.259 -1.085 4.950 1.00 0.00 H new ATOM 0 HG12 VAL A 83 12.595 -0.459 4.877 1.00 0.00 H new ATOM 0 HG13 VAL A 83 12.938 -1.975 5.744 1.00 0.00 H new ATOM 0 HG21 VAL A 83 14.987 -2.914 3.719 1.00 0.00 H new ATOM 0 HG22 VAL A 83 13.736 -4.066 4.246 1.00 0.00 H new ATOM 0 HG23 VAL A 83 13.964 -3.732 2.513 1.00 0.00 H new ATOM 1290 N VAL A 84 10.403 -4.750 3.781 1.00 0.00 N ATOM 1291 CA VAL A 84 9.641 -5.757 4.550 1.00 0.00 C ATOM 1292 C VAL A 84 10.612 -6.701 5.301 1.00 0.00 C ATOM 1293 O VAL A 84 11.542 -7.268 4.724 1.00 0.00 O ATOM 1294 CB VAL A 84 8.699 -6.563 3.589 1.00 0.00 C ATOM 1295 CG1 VAL A 84 7.878 -7.657 4.305 1.00 0.00 C ATOM 1296 CG2 VAL A 84 7.667 -5.661 2.884 1.00 0.00 C ATOM 0 H VAL A 84 10.519 -4.991 2.797 1.00 0.00 H new ATOM 0 HA VAL A 84 9.021 -5.251 5.291 1.00 0.00 H new ATOM 0 HB VAL A 84 9.391 -7.012 2.876 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.249 -8.174 3.580 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.555 -8.372 4.773 1.00 0.00 H new ATOM 0 HG13 VAL A 84 7.249 -7.199 5.069 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.040 -6.268 2.231 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.044 -5.169 3.631 1.00 0.00 H new ATOM 0 HG23 VAL A 84 8.187 -4.908 2.292 1.00 0.00 H new ATOM 1306 N GLU A 85 10.268 -6.961 6.566 1.00 0.00 N ATOM 1307 CA GLU A 85 10.545 -8.287 7.170 1.00 0.00 C ATOM 1308 C GLU A 85 9.455 -8.641 8.224 1.00 0.00 C ATOM 1309 O GLU A 85 8.946 -7.805 8.983 1.00 0.00 O ATOM 1310 CB GLU A 85 11.998 -8.384 7.684 1.00 0.00 C ATOM 1311 CG GLU A 85 12.445 -9.773 8.190 1.00 0.00 C ATOM 1312 CD GLU A 85 12.266 -10.949 7.234 1.00 0.00 C ATOM 1313 OE1 GLU A 85 11.119 -11.431 7.077 1.00 0.00 O ATOM 1314 OE2 GLU A 85 13.269 -11.409 6.654 1.00 0.00 O ATOM 0 H GLU A 85 9.808 -6.295 7.187 1.00 0.00 H new ATOM 0 HA GLU A 85 10.476 -9.057 6.402 1.00 0.00 H new ATOM 0 HB2 GLU A 85 12.668 -8.079 6.880 1.00 0.00 H new ATOM 0 HB3 GLU A 85 12.125 -7.666 8.494 1.00 0.00 H new ATOM 0 HG2 GLU A 85 13.500 -9.712 8.459 1.00 0.00 H new ATOM 0 HG3 GLU A 85 11.895 -9.993 9.105 1.00 0.00 H new ATOM 1321 N LYS A 86 9.125 -9.935 8.238 1.00 0.00 N ATOM 1322 CA LYS A 86 8.327 -10.575 9.298 1.00 0.00 C ATOM 1323 C LYS A 86 9.175 -10.756 10.597 1.00 0.00 C ATOM 1324 O LYS A 86 10.187 -11.462 10.606 1.00 0.00 O ATOM 1325 CB LYS A 86 7.918 -11.955 8.694 1.00 0.00 C ATOM 1326 CG LYS A 86 6.925 -12.767 9.531 1.00 0.00 C ATOM 1327 CD LYS A 86 7.045 -14.295 9.420 1.00 0.00 C ATOM 1328 CE LYS A 86 6.679 -14.954 8.083 1.00 0.00 C ATOM 1329 NZ LYS A 86 7.779 -14.859 7.081 1.00 0.00 N ATOM 0 H LYS A 86 9.408 -10.582 7.502 1.00 0.00 H new ATOM 0 HA LYS A 86 7.461 -9.980 9.587 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.485 -11.787 7.708 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.819 -12.551 8.549 1.00 0.00 H new ATOM 0 HG2 LYS A 86 7.048 -12.487 10.577 1.00 0.00 H new ATOM 0 HG3 LYS A 86 5.915 -12.479 9.241 1.00 0.00 H new ATOM 0 HD2 LYS A 86 8.074 -14.566 9.655 1.00 0.00 H new ATOM 0 HD3 LYS A 86 6.415 -14.736 10.192 1.00 0.00 H new ATOM 0 HE2 LYS A 86 6.436 -16.003 8.253 1.00 0.00 H new ATOM 0 HE3 LYS A 86 5.783 -14.480 7.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 7.547 -15.446 6.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 7.892 -13.869 6.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 8.666 -15.196 7.506 1.00 0.00 H new ATOM 1343 N ASN A 87 8.724 -10.146 11.694 1.00 0.00 N ATOM 1344 CA ASN A 87 9.289 -10.425 13.054 1.00 0.00 C ATOM 1345 C ASN A 87 8.666 -11.709 13.691 1.00 0.00 C ATOM 1346 O ASN A 87 9.409 -12.596 14.113 1.00 0.00 O ATOM 1347 CB ASN A 87 9.127 -9.113 13.847 1.00 0.00 C ATOM 1348 CG ASN A 87 9.536 -9.108 15.307 1.00 0.00 C ATOM 1349 OD1 ASN A 87 8.704 -9.008 16.202 1.00 0.00 O ATOM 1350 ND2 ASN A 87 10.809 -9.180 15.611 1.00 0.00 N ATOM 0 H ASN A 87 7.973 -9.456 11.688 1.00 0.00 H new ATOM 0 HA ASN A 87 10.348 -10.684 13.036 1.00 0.00 H new ATOM 0 HB2 ASN A 87 9.703 -8.341 13.336 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.079 -8.817 13.793 1.00 0.00 H new ATOM 0 HD21 ASN A 87 11.102 -9.153 16.587 1.00 0.00 H new ATOM 0 HD22 ASN A 87 11.506 -9.263 14.871 1.00 0.00 H new ATOM 1357 N SER A 88 7.331 -11.811 13.721 1.00 0.00 N ATOM 1358 CA SER A 88 6.615 -13.097 13.933 1.00 0.00 C ATOM 1359 C SER A 88 5.480 -13.256 12.868 1.00 0.00 C ATOM 1360 O SER A 88 5.130 -12.313 12.146 1.00 0.00 O ATOM 1361 CB SER A 88 6.083 -13.080 15.388 1.00 0.00 C ATOM 1362 OG SER A 88 5.469 -14.320 15.736 1.00 0.00 O ATOM 0 H SER A 88 6.709 -11.012 13.600 1.00 0.00 H new ATOM 0 HA SER A 88 7.269 -13.959 13.804 1.00 0.00 H new ATOM 0 HB2 SER A 88 6.905 -12.875 16.074 1.00 0.00 H new ATOM 0 HB3 SER A 88 5.362 -12.271 15.503 1.00 0.00 H new ATOM 0 HG SER A 88 5.146 -14.277 16.660 1.00 0.00 H new ATOM 1368 N GLU A 89 4.820 -14.424 12.829 1.00 0.00 N ATOM 1369 CA GLU A 89 3.524 -14.593 12.091 1.00 0.00 C ATOM 1370 C GLU A 89 2.305 -13.663 12.492 1.00 0.00 C ATOM 1371 O GLU A 89 1.275 -13.662 11.814 1.00 0.00 O ATOM 1372 CB GLU A 89 3.118 -16.085 12.213 1.00 0.00 C ATOM 1373 CG GLU A 89 3.790 -17.042 11.210 1.00 0.00 C ATOM 1374 CD GLU A 89 3.329 -16.885 9.771 1.00 0.00 C ATOM 1375 OE1 GLU A 89 2.179 -17.263 9.458 1.00 0.00 O ATOM 1376 OE2 GLU A 89 4.110 -16.374 8.943 1.00 0.00 O ATOM 0 H GLU A 89 5.147 -15.272 13.293 1.00 0.00 H new ATOM 0 HA GLU A 89 3.731 -14.268 11.071 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.349 -16.425 13.223 1.00 0.00 H new ATOM 0 HB3 GLU A 89 2.037 -16.160 12.091 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.868 -16.888 11.250 1.00 0.00 H new ATOM 0 HG3 GLU A 89 3.602 -18.068 11.527 1.00 0.00 H new ATOM 1383 N SER A 90 2.488 -12.853 13.541 1.00 0.00 N ATOM 1384 CA SER A 90 1.630 -11.697 13.856 1.00 0.00 C ATOM 1385 C SER A 90 2.377 -10.340 14.094 1.00 0.00 C ATOM 1386 O SER A 90 1.880 -9.507 14.855 1.00 0.00 O ATOM 1387 CB SER A 90 0.733 -12.111 15.054 1.00 0.00 C ATOM 1388 OG SER A 90 1.496 -12.503 16.199 1.00 0.00 O ATOM 0 H SER A 90 3.249 -12.982 14.208 1.00 0.00 H new ATOM 0 HA SER A 90 1.032 -11.467 12.974 1.00 0.00 H new ATOM 0 HB2 SER A 90 0.083 -11.278 15.322 1.00 0.00 H new ATOM 0 HB3 SER A 90 0.087 -12.935 14.752 1.00 0.00 H new ATOM 0 HG SER A 90 0.889 -12.753 16.927 1.00 0.00 H new ATOM 1394 N LYS A 91 3.521 -10.065 13.431 1.00 0.00 N ATOM 1395 CA LYS A 91 4.337 -8.850 13.695 1.00 0.00 C ATOM 1396 C LYS A 91 5.258 -8.635 12.453 1.00 0.00 C ATOM 1397 O LYS A 91 6.146 -9.449 12.202 1.00 0.00 O ATOM 1398 CB LYS A 91 5.141 -9.035 15.010 1.00 0.00 C ATOM 1399 CG LYS A 91 5.276 -7.813 15.925 1.00 0.00 C ATOM 1400 CD LYS A 91 6.073 -6.627 15.378 1.00 0.00 C ATOM 1401 CE LYS A 91 6.506 -5.629 16.478 1.00 0.00 C ATOM 1402 NZ LYS A 91 5.362 -4.895 17.098 1.00 0.00 N ATOM 0 H LYS A 91 3.906 -10.669 12.704 1.00 0.00 H new ATOM 0 HA LYS A 91 3.717 -7.965 13.835 1.00 0.00 H new ATOM 0 HB2 LYS A 91 4.673 -9.836 15.582 1.00 0.00 H new ATOM 0 HB3 LYS A 91 6.143 -9.374 14.748 1.00 0.00 H new ATOM 0 HG2 LYS A 91 4.274 -7.463 16.175 1.00 0.00 H new ATOM 0 HG3 LYS A 91 5.742 -8.135 16.856 1.00 0.00 H new ATOM 0 HD2 LYS A 91 6.959 -6.999 14.863 1.00 0.00 H new ATOM 0 HD3 LYS A 91 5.470 -6.103 14.637 1.00 0.00 H new ATOM 0 HE2 LYS A 91 7.046 -6.169 17.256 1.00 0.00 H new ATOM 0 HE3 LYS A 91 7.202 -4.907 16.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 5.708 -4.320 17.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 4.922 -4.275 16.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 4.659 -5.578 17.445 1.00 0.00 H new ATOM 1416 N LEU A 92 5.022 -7.582 11.664 1.00 0.00 N ATOM 1417 CA LEU A 92 5.784 -7.313 10.401 1.00 0.00 C ATOM 1418 C LEU A 92 6.127 -5.795 10.272 1.00 0.00 C ATOM 1419 O LEU A 92 5.278 -4.938 10.523 1.00 0.00 O ATOM 1420 CB LEU A 92 4.895 -7.853 9.244 1.00 0.00 C ATOM 1421 CG LEU A 92 5.516 -7.737 7.835 1.00 0.00 C ATOM 1422 CD1 LEU A 92 5.188 -8.962 6.972 1.00 0.00 C ATOM 1423 CD2 LEU A 92 5.032 -6.474 7.111 1.00 0.00 C ATOM 0 H LEU A 92 4.305 -6.885 11.865 1.00 0.00 H new ATOM 0 HA LEU A 92 6.752 -7.814 10.383 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.668 -8.901 9.439 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.947 -7.314 9.252 1.00 0.00 H new ATOM 0 HG LEU A 92 6.595 -7.679 7.976 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.641 -8.845 5.988 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.582 -9.859 7.449 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.107 -9.053 6.865 1.00 0.00 H new ATOM 0 HD21 LEU A 92 5.489 -6.424 6.122 1.00 0.00 H new ATOM 0 HD22 LEU A 92 3.947 -6.506 7.009 1.00 0.00 H new ATOM 0 HD23 LEU A 92 5.316 -5.593 7.687 1.00 0.00 H new ATOM 1435 N THR A 93 7.349 -5.447 9.841 1.00 0.00 N ATOM 1436 CA THR A 93 7.846 -4.032 9.847 1.00 0.00 C ATOM 1437 C THR A 93 8.198 -3.512 8.426 1.00 0.00 C ATOM 1438 O THR A 93 9.362 -3.408 8.035 1.00 0.00 O ATOM 1439 CB THR A 93 9.001 -3.922 10.884 1.00 0.00 C ATOM 1440 OG1 THR A 93 9.273 -2.553 11.163 1.00 0.00 O ATOM 1441 CG2 THR A 93 10.324 -4.588 10.521 1.00 0.00 C ATOM 0 H THR A 93 8.026 -6.119 9.479 1.00 0.00 H new ATOM 0 HA THR A 93 7.049 -3.359 10.163 1.00 0.00 H new ATOM 0 HB THR A 93 8.617 -4.473 11.743 1.00 0.00 H new ATOM 0 HG1 THR A 93 10.000 -2.491 11.817 1.00 0.00 H new ATOM 0 HG21 THR A 93 11.041 -4.436 11.328 1.00 0.00 H new ATOM 0 HG22 THR A 93 10.165 -5.656 10.373 1.00 0.00 H new ATOM 0 HG23 THR A 93 10.713 -4.148 9.603 1.00 0.00 H new ATOM 1449 N GLN A 94 7.169 -3.133 7.661 1.00 0.00 N ATOM 1450 CA GLN A 94 7.328 -2.720 6.229 1.00 0.00 C ATOM 1451 C GLN A 94 7.875 -1.263 5.970 1.00 0.00 C ATOM 1452 O GLN A 94 7.256 -0.437 5.300 1.00 0.00 O ATOM 1453 CB GLN A 94 6.032 -3.051 5.452 1.00 0.00 C ATOM 1454 CG GLN A 94 4.756 -2.283 5.853 1.00 0.00 C ATOM 1455 CD GLN A 94 3.623 -2.483 4.856 1.00 0.00 C ATOM 1456 OE1 GLN A 94 3.138 -3.590 4.641 1.00 0.00 O ATOM 1457 NE2 GLN A 94 3.147 -1.435 4.230 1.00 0.00 N ATOM 0 H GLN A 94 6.206 -3.098 7.995 1.00 0.00 H new ATOM 0 HA GLN A 94 8.149 -3.317 5.832 1.00 0.00 H new ATOM 0 HB2 GLN A 94 6.217 -2.870 4.393 1.00 0.00 H new ATOM 0 HB3 GLN A 94 5.834 -4.117 5.563 1.00 0.00 H new ATOM 0 HG2 GLN A 94 4.431 -2.613 6.840 1.00 0.00 H new ATOM 0 HG3 GLN A 94 4.984 -1.220 5.932 1.00 0.00 H new ATOM 0 HE21 GLN A 94 3.546 -0.512 4.404 1.00 0.00 H new ATOM 0 HE22 GLN A 94 2.378 -1.542 3.569 1.00 0.00 H new ATOM 1466 N THR A 95 9.069 -1.019 6.513 1.00 0.00 N ATOM 1467 CA THR A 95 9.650 0.321 6.802 1.00 0.00 C ATOM 1468 C THR A 95 9.763 1.256 5.573 1.00 0.00 C ATOM 1469 O THR A 95 10.505 0.968 4.632 1.00 0.00 O ATOM 1470 CB THR A 95 11.020 0.120 7.536 1.00 0.00 C ATOM 1471 OG1 THR A 95 10.936 -0.890 8.553 1.00 0.00 O ATOM 1472 CG2 THR A 95 11.486 1.397 8.232 1.00 0.00 C ATOM 0 H THR A 95 9.697 -1.776 6.781 1.00 0.00 H new ATOM 0 HA THR A 95 8.954 0.852 7.451 1.00 0.00 H new ATOM 0 HB THR A 95 11.723 -0.172 6.756 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.808 -0.989 8.988 1.00 0.00 H new ATOM 0 HG21 THR A 95 12.439 1.214 8.728 1.00 0.00 H new ATOM 0 HG22 THR A 95 11.608 2.190 7.494 1.00 0.00 H new ATOM 0 HG23 THR A 95 10.744 1.700 8.971 1.00 0.00 H new ATOM 1480 N GLN A 96 8.985 2.350 5.569 1.00 0.00 N ATOM 1481 CA GLN A 96 8.749 3.169 4.357 1.00 0.00 C ATOM 1482 C GLN A 96 9.969 4.065 3.999 1.00 0.00 C ATOM 1483 O GLN A 96 10.441 4.862 4.814 1.00 0.00 O ATOM 1484 CB GLN A 96 7.449 3.994 4.552 1.00 0.00 C ATOM 1485 CG GLN A 96 6.250 3.493 3.729 1.00 0.00 C ATOM 1486 CD GLN A 96 4.995 4.342 3.894 1.00 0.00 C ATOM 1487 OE1 GLN A 96 4.034 3.948 4.549 1.00 0.00 O ATOM 1488 NE2 GLN A 96 4.931 5.519 3.312 1.00 0.00 N ATOM 0 H GLN A 96 8.502 2.695 6.398 1.00 0.00 H new ATOM 0 HA GLN A 96 8.622 2.504 3.502 1.00 0.00 H new ATOM 0 HB2 GLN A 96 7.180 3.981 5.608 1.00 0.00 H new ATOM 0 HB3 GLN A 96 7.648 5.032 4.286 1.00 0.00 H new ATOM 0 HG2 GLN A 96 6.528 3.472 2.675 1.00 0.00 H new ATOM 0 HG3 GLN A 96 6.025 2.467 4.020 1.00 0.00 H new ATOM 0 HE21 GLN A 96 5.721 5.861 2.764 1.00 0.00 H new ATOM 0 HE22 GLN A 96 4.092 6.090 3.408 1.00 0.00 H new ATOM 1497 N VAL A 97 10.477 3.917 2.775 1.00 0.00 N ATOM 1498 CA VAL A 97 11.668 4.657 2.292 1.00 0.00 C ATOM 1499 C VAL A 97 11.145 5.687 1.252 1.00 0.00 C ATOM 1500 O VAL A 97 11.038 5.418 0.052 1.00 0.00 O ATOM 1501 CB VAL A 97 12.714 3.616 1.784 1.00 0.00 C ATOM 1502 CG1 VAL A 97 13.908 4.291 1.092 1.00 0.00 C ATOM 1503 CG2 VAL A 97 13.291 2.793 2.970 1.00 0.00 C ATOM 0 H VAL A 97 10.082 3.282 2.081 1.00 0.00 H new ATOM 0 HA VAL A 97 12.201 5.229 3.052 1.00 0.00 H new ATOM 0 HB VAL A 97 12.184 2.977 1.077 1.00 0.00 H new ATOM 0 HG11 VAL A 97 14.611 3.529 0.754 1.00 0.00 H new ATOM 0 HG12 VAL A 97 13.555 4.865 0.235 1.00 0.00 H new ATOM 0 HG13 VAL A 97 14.406 4.958 1.795 1.00 0.00 H new ATOM 0 HG21 VAL A 97 14.018 2.073 2.594 1.00 0.00 H new ATOM 0 HG22 VAL A 97 13.778 3.465 3.676 1.00 0.00 H new ATOM 0 HG23 VAL A 97 12.482 2.263 3.472 1.00 0.00 H new ATOM 1513 N ASP A 98 10.777 6.860 1.770 1.00 0.00 N ATOM 1514 CA ASP A 98 10.088 7.922 0.997 1.00 0.00 C ATOM 1515 C ASP A 98 11.120 9.017 0.528 1.00 0.00 C ATOM 1516 O ASP A 98 12.275 8.985 0.977 1.00 0.00 O ATOM 1517 CB ASP A 98 9.036 8.543 1.969 1.00 0.00 C ATOM 1518 CG ASP A 98 8.129 7.585 2.730 1.00 0.00 C ATOM 1519 OD1 ASP A 98 8.562 7.174 3.826 1.00 0.00 O ATOM 1520 OD2 ASP A 98 7.024 7.231 2.276 1.00 0.00 O ATOM 0 H ASP A 98 10.945 7.112 2.744 1.00 0.00 H new ATOM 0 HA ASP A 98 9.616 7.523 0.100 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.570 9.151 2.699 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.404 9.219 1.393 1.00 0.00 H new ATOM 1525 N PRO A 99 10.775 10.099 -0.224 1.00 0.00 N ATOM 1526 CA PRO A 99 11.596 11.367 -0.189 1.00 0.00 C ATOM 1527 C PRO A 99 11.833 12.056 1.198 1.00 0.00 C ATOM 1528 O PRO A 99 12.760 12.855 1.326 1.00 0.00 O ATOM 1529 CB PRO A 99 10.874 12.260 -1.224 1.00 0.00 C ATOM 1530 CG PRO A 99 9.416 11.750 -1.236 1.00 0.00 C ATOM 1531 CD PRO A 99 9.550 10.230 -1.032 1.00 0.00 C ATOM 0 HA PRO A 99 12.638 11.151 -0.423 1.00 0.00 H new ATOM 0 HB2 PRO A 99 10.923 13.312 -0.942 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.332 12.173 -2.209 1.00 0.00 H new ATOM 0 HG2 PRO A 99 8.826 12.209 -0.442 1.00 0.00 H new ATOM 0 HG3 PRO A 99 8.919 11.984 -2.178 1.00 0.00 H new ATOM 0 HD2 PRO A 99 8.683 9.816 -0.517 1.00 0.00 H new ATOM 0 HD3 PRO A 99 9.638 9.703 -1.982 1.00 0.00 H new ATOM 1539 N LYS A 100 11.044 11.698 2.222 1.00 0.00 N ATOM 1540 CA LYS A 100 11.402 11.911 3.642 1.00 0.00 C ATOM 1541 C LYS A 100 12.260 10.791 4.336 1.00 0.00 C ATOM 1542 O LYS A 100 13.068 11.142 5.197 1.00 0.00 O ATOM 1543 CB LYS A 100 10.080 12.057 4.446 1.00 0.00 C ATOM 1544 CG LYS A 100 9.351 13.401 4.310 1.00 0.00 C ATOM 1545 CD LYS A 100 10.137 14.576 4.905 1.00 0.00 C ATOM 1546 CE LYS A 100 9.301 15.819 5.264 1.00 0.00 C ATOM 1547 NZ LYS A 100 8.547 16.390 4.110 1.00 0.00 N ATOM 0 H LYS A 100 10.136 11.251 2.094 1.00 0.00 H new ATOM 0 HA LYS A 100 12.037 12.797 3.643 1.00 0.00 H new ATOM 0 HB2 LYS A 100 9.400 11.265 4.134 1.00 0.00 H new ATOM 0 HB3 LYS A 100 10.300 11.891 5.501 1.00 0.00 H new ATOM 0 HG2 LYS A 100 9.158 13.598 3.255 1.00 0.00 H new ATOM 0 HG3 LYS A 100 8.382 13.333 4.804 1.00 0.00 H new ATOM 0 HD2 LYS A 100 10.647 14.231 5.804 1.00 0.00 H new ATOM 0 HD3 LYS A 100 10.909 14.872 4.194 1.00 0.00 H new ATOM 0 HE2 LYS A 100 8.596 15.556 6.053 1.00 0.00 H new ATOM 0 HE3 LYS A 100 9.962 16.585 5.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 8.380 17.404 4.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 9.100 16.265 3.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 7.635 15.900 4.015 1.00 0.00 H new ATOM 1561 N ASN A 101 12.010 9.499 4.057 1.00 0.00 N ATOM 1562 CA ASN A 101 12.398 8.354 4.930 1.00 0.00 C ATOM 1563 C ASN A 101 11.525 8.294 6.234 1.00 0.00 C ATOM 1564 O ASN A 101 11.783 8.999 7.213 1.00 0.00 O ATOM 1565 CB ASN A 101 13.909 8.204 5.231 1.00 0.00 C ATOM 1566 CG ASN A 101 14.766 7.922 4.007 1.00 0.00 C ATOM 1567 OD1 ASN A 101 14.928 6.784 3.584 1.00 0.00 O ATOM 1568 ND2 ASN A 101 15.333 8.933 3.393 1.00 0.00 N ATOM 0 H ASN A 101 11.526 9.207 3.208 1.00 0.00 H new ATOM 0 HA ASN A 101 12.176 7.477 4.321 1.00 0.00 H new ATOM 0 HB2 ASN A 101 14.265 9.118 5.707 1.00 0.00 H new ATOM 0 HB3 ASN A 101 14.046 7.396 5.950 1.00 0.00 H new ATOM 0 HD21 ASN A 101 15.907 8.770 2.566 1.00 0.00 H new ATOM 0 HD22 ASN A 101 15.200 9.882 3.743 1.00 0.00 H new ATOM 1575 N THR A 102 10.498 7.440 6.221 1.00 0.00 N ATOM 1576 CA THR A 102 9.594 7.209 7.386 1.00 0.00 C ATOM 1577 C THR A 102 10.232 6.278 8.459 1.00 0.00 C ATOM 1578 O THR A 102 11.051 5.401 8.165 1.00 0.00 O ATOM 1579 CB THR A 102 8.258 6.626 6.839 1.00 0.00 C ATOM 1580 OG1 THR A 102 7.656 7.530 5.921 1.00 0.00 O ATOM 1581 CG2 THR A 102 7.135 6.377 7.828 1.00 0.00 C ATOM 0 H THR A 102 10.256 6.879 5.404 1.00 0.00 H new ATOM 0 HA THR A 102 9.412 8.154 7.898 1.00 0.00 H new ATOM 0 HB THR A 102 8.602 5.673 6.436 1.00 0.00 H new ATOM 0 HG1 THR A 102 8.220 7.611 5.124 1.00 0.00 H new ATOM 0 HG21 THR A 102 6.271 5.971 7.302 1.00 0.00 H new ATOM 0 HG22 THR A 102 7.467 5.665 8.584 1.00 0.00 H new ATOM 0 HG23 THR A 102 6.859 7.315 8.309 1.00 0.00 H new ATOM 1589 N THR A 103 9.817 6.454 9.724 1.00 0.00 N ATOM 1590 CA THR A 103 10.200 5.520 10.828 1.00 0.00 C ATOM 1591 C THR A 103 9.507 4.124 10.721 1.00 0.00 C ATOM 1592 O THR A 103 8.592 3.916 9.923 1.00 0.00 O ATOM 1593 CB THR A 103 9.976 6.326 12.125 1.00 0.00 C ATOM 1594 OG1 THR A 103 10.799 7.490 12.080 1.00 0.00 O ATOM 1595 CG2 THR A 103 10.358 5.659 13.429 1.00 0.00 C ATOM 0 H THR A 103 9.219 7.226 10.020 1.00 0.00 H new ATOM 0 HA THR A 103 11.243 5.208 10.786 1.00 0.00 H new ATOM 0 HB THR A 103 8.898 6.488 12.137 1.00 0.00 H new ATOM 0 HG1 THR A 103 11.305 7.565 12.916 1.00 0.00 H new ATOM 0 HG21 THR A 103 10.149 6.335 14.258 1.00 0.00 H new ATOM 0 HG22 THR A 103 9.780 4.743 13.552 1.00 0.00 H new ATOM 0 HG23 THR A 103 11.421 5.418 13.417 1.00 0.00 H new ATOM 1603 N VAL A 104 9.985 3.140 11.494 1.00 0.00 N ATOM 1604 CA VAL A 104 9.460 1.749 11.491 1.00 0.00 C ATOM 1605 C VAL A 104 7.926 1.618 11.791 1.00 0.00 C ATOM 1606 O VAL A 104 7.477 1.733 12.935 1.00 0.00 O ATOM 1607 CB VAL A 104 10.290 0.797 12.419 1.00 0.00 C ATOM 1608 CG1 VAL A 104 11.701 0.504 11.870 1.00 0.00 C ATOM 1609 CG2 VAL A 104 10.423 1.212 13.894 1.00 0.00 C ATOM 0 H VAL A 104 10.755 3.278 12.149 1.00 0.00 H new ATOM 0 HA VAL A 104 9.585 1.427 10.457 1.00 0.00 H new ATOM 0 HB VAL A 104 9.673 -0.102 12.405 1.00 0.00 H new ATOM 0 HG11 VAL A 104 12.227 -0.160 12.555 1.00 0.00 H new ATOM 0 HG12 VAL A 104 11.620 0.027 10.893 1.00 0.00 H new ATOM 0 HG13 VAL A 104 12.255 1.438 11.773 1.00 0.00 H new ATOM 0 HG21 VAL A 104 11.019 0.472 14.428 1.00 0.00 H new ATOM 0 HG22 VAL A 104 10.912 2.184 13.956 1.00 0.00 H new ATOM 0 HG23 VAL A 104 9.433 1.274 14.345 1.00 0.00 H new ATOM 1619 N ILE A 105 7.126 1.337 10.754 1.00 0.00 N ATOM 1620 CA ILE A 105 5.646 1.204 10.881 1.00 0.00 C ATOM 1621 C ILE A 105 5.259 -0.289 11.121 1.00 0.00 C ATOM 1622 O ILE A 105 4.717 -1.002 10.274 1.00 0.00 O ATOM 1623 CB ILE A 105 4.905 1.892 9.697 1.00 0.00 C ATOM 1624 CG1 ILE A 105 5.110 1.322 8.284 1.00 0.00 C ATOM 1625 CG2 ILE A 105 5.148 3.425 9.690 1.00 0.00 C ATOM 1626 CD1 ILE A 105 6.505 1.392 7.712 1.00 0.00 C ATOM 0 H ILE A 105 7.471 1.194 9.805 1.00 0.00 H new ATOM 0 HA ILE A 105 5.304 1.746 11.763 1.00 0.00 H new ATOM 0 HB ILE A 105 3.865 1.654 9.919 1.00 0.00 H new ATOM 0 HG12 ILE A 105 4.799 0.277 8.292 1.00 0.00 H new ATOM 0 HG13 ILE A 105 4.439 1.849 7.606 1.00 0.00 H new ATOM 0 HG21 ILE A 105 4.617 3.874 8.851 1.00 0.00 H new ATOM 0 HG22 ILE A 105 4.783 3.855 10.623 1.00 0.00 H new ATOM 0 HG23 ILE A 105 6.215 3.624 9.592 1.00 0.00 H new ATOM 0 HD11 ILE A 105 6.511 0.957 6.713 1.00 0.00 H new ATOM 0 HD12 ILE A 105 6.824 2.433 7.656 1.00 0.00 H new ATOM 0 HD13 ILE A 105 7.189 0.837 8.353 1.00 0.00 H new ATOM 1638 N VAL A 106 5.572 -0.725 12.341 1.00 0.00 N ATOM 1639 CA VAL A 106 5.345 -2.109 12.821 1.00 0.00 C ATOM 1640 C VAL A 106 3.832 -2.520 12.845 1.00 0.00 C ATOM 1641 O VAL A 106 3.041 -2.028 13.654 1.00 0.00 O ATOM 1642 CB VAL A 106 6.004 -2.333 14.231 1.00 0.00 C ATOM 1643 CG1 VAL A 106 7.538 -2.437 14.164 1.00 0.00 C ATOM 1644 CG2 VAL A 106 5.633 -1.275 15.289 1.00 0.00 C ATOM 0 H VAL A 106 5.999 -0.123 13.045 1.00 0.00 H new ATOM 0 HA VAL A 106 5.830 -2.762 12.095 1.00 0.00 H new ATOM 0 HB VAL A 106 5.582 -3.286 14.549 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.936 -2.591 15.167 1.00 0.00 H new ATOM 0 HG12 VAL A 106 7.818 -3.277 13.529 1.00 0.00 H new ATOM 0 HG13 VAL A 106 7.947 -1.516 13.749 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.133 -1.510 16.229 1.00 0.00 H new ATOM 0 HG22 VAL A 106 5.950 -0.290 14.946 1.00 0.00 H new ATOM 0 HG23 VAL A 106 4.554 -1.276 15.442 1.00 0.00 H new ATOM 1654 N ARG A 107 3.461 -3.429 11.937 1.00 0.00 N ATOM 1655 CA ARG A 107 2.080 -3.934 11.813 1.00 0.00 C ATOM 1656 C ARG A 107 1.887 -5.258 12.579 1.00 0.00 C ATOM 1657 O ARG A 107 2.382 -6.314 12.170 1.00 0.00 O ATOM 1658 CB ARG A 107 1.562 -3.864 10.370 1.00 0.00 C ATOM 1659 CG ARG A 107 2.106 -4.708 9.212 1.00 0.00 C ATOM 1660 CD ARG A 107 1.202 -4.420 7.980 1.00 0.00 C ATOM 1661 NE ARG A 107 1.750 -4.931 6.707 1.00 0.00 N ATOM 1662 CZ ARG A 107 1.295 -5.964 6.010 1.00 0.00 C ATOM 1663 NH1 ARG A 107 0.402 -6.810 6.447 1.00 0.00 N ATOM 1664 NH2 ARG A 107 1.782 -6.138 4.818 1.00 0.00 N ATOM 0 H ARG A 107 4.108 -3.839 11.264 1.00 0.00 H new ATOM 0 HA ARG A 107 1.400 -3.257 12.330 1.00 0.00 H new ATOM 0 HB2 ARG A 107 0.494 -4.075 10.422 1.00 0.00 H new ATOM 0 HB3 ARG A 107 1.667 -2.824 10.061 1.00 0.00 H new ATOM 0 HG2 ARG A 107 3.143 -4.449 8.999 1.00 0.00 H new ATOM 0 HG3 ARG A 107 2.088 -5.768 9.465 1.00 0.00 H new ATOM 0 HD2 ARG A 107 0.222 -4.866 8.148 1.00 0.00 H new ATOM 0 HD3 ARG A 107 1.052 -3.344 7.894 1.00 0.00 H new ATOM 0 HE ARG A 107 2.559 -4.441 6.326 1.00 0.00 H new ATOM 0 HH11 ARG A 107 0.008 -6.698 7.381 1.00 0.00 H new ATOM 0 HH12 ARG A 107 0.098 -7.583 5.854 1.00 0.00 H new ATOM 0 HH21 ARG A 107 2.484 -5.494 4.455 1.00 0.00 H new ATOM 0 HH22 ARG A 107 1.462 -6.919 4.245 1.00 0.00 H new ATOM 1678 N GLU A 108 1.197 -5.161 13.724 1.00 0.00 N ATOM 1679 CA GLU A 108 1.063 -6.265 14.707 1.00 0.00 C ATOM 1680 C GLU A 108 -0.423 -6.660 14.845 1.00 0.00 C ATOM 1681 O GLU A 108 -1.240 -5.836 15.254 1.00 0.00 O ATOM 1682 CB GLU A 108 1.647 -5.728 16.040 1.00 0.00 C ATOM 1683 CG GLU A 108 1.650 -6.741 17.201 1.00 0.00 C ATOM 1684 CD GLU A 108 2.362 -6.212 18.429 1.00 0.00 C ATOM 1685 OE1 GLU A 108 3.612 -6.226 18.449 1.00 0.00 O ATOM 1686 OE2 GLU A 108 1.678 -5.747 19.366 1.00 0.00 O ATOM 0 H GLU A 108 0.709 -4.310 14.004 1.00 0.00 H new ATOM 0 HA GLU A 108 1.597 -7.164 14.398 1.00 0.00 H new ATOM 0 HB2 GLU A 108 2.670 -5.396 15.864 1.00 0.00 H new ATOM 0 HB3 GLU A 108 1.075 -4.851 16.343 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.622 -6.994 17.461 1.00 0.00 H new ATOM 0 HG3 GLU A 108 2.132 -7.662 16.874 1.00 0.00 H new ATOM 1693 N VAL A 109 -0.791 -7.910 14.534 1.00 0.00 N ATOM 1694 CA VAL A 109 -2.206 -8.364 14.699 1.00 0.00 C ATOM 1695 C VAL A 109 -2.478 -8.939 16.098 1.00 0.00 C ATOM 1696 O VAL A 109 -1.850 -9.915 16.519 1.00 0.00 O ATOM 1697 CB VAL A 109 -2.669 -9.253 13.513 1.00 0.00 C ATOM 1698 CG1 VAL A 109 -1.980 -10.611 13.415 1.00 0.00 C ATOM 1699 CG2 VAL A 109 -4.188 -9.458 13.445 1.00 0.00 C ATOM 0 H VAL A 109 -0.155 -8.622 14.174 1.00 0.00 H new ATOM 0 HA VAL A 109 -2.850 -7.486 14.650 1.00 0.00 H new ATOM 0 HB VAL A 109 -2.354 -8.661 12.654 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -2.371 -11.156 12.556 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.906 -10.466 13.295 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -2.170 -11.182 14.324 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -4.432 -10.089 12.591 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -4.532 -9.938 14.361 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -4.681 -8.492 13.335 1.00 0.00 H new ATOM 1709 N ASP A 110 -3.484 -8.380 16.783 1.00 0.00 N ATOM 1710 CA ASP A 110 -3.919 -8.883 18.108 1.00 0.00 C ATOM 1711 C ASP A 110 -5.032 -9.975 17.923 1.00 0.00 C ATOM 1712 O ASP A 110 -6.195 -9.800 18.297 1.00 0.00 O ATOM 1713 CB ASP A 110 -4.343 -7.660 18.949 1.00 0.00 C ATOM 1714 CG ASP A 110 -3.192 -6.755 19.397 1.00 0.00 C ATOM 1715 OD1 ASP A 110 -2.690 -5.961 18.571 1.00 0.00 O ATOM 1716 OD2 ASP A 110 -2.778 -6.804 20.571 1.00 0.00 O ATOM 0 H ASP A 110 -4.017 -7.578 16.447 1.00 0.00 H new ATOM 0 HA ASP A 110 -3.119 -9.389 18.649 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -5.049 -7.065 18.369 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -4.874 -8.012 19.833 1.00 0.00 H new ATOM 1721 N GLY A 111 -4.642 -11.102 17.290 1.00 0.00 N ATOM 1722 CA GLY A 111 -5.590 -12.149 16.857 1.00 0.00 C ATOM 1723 C GLY A 111 -6.179 -11.887 15.463 1.00 0.00 C ATOM 1724 O GLY A 111 -5.582 -12.284 14.459 1.00 0.00 O ATOM 0 H GLY A 111 -3.669 -11.310 17.066 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -5.082 -13.113 16.855 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -6.402 -12.218 17.581 1.00 0.00 H new ATOM 1728 N ASP A 112 -7.312 -11.175 15.430 1.00 0.00 N ATOM 1729 CA ASP A 112 -7.929 -10.680 14.163 1.00 0.00 C ATOM 1730 C ASP A 112 -8.260 -9.126 14.195 1.00 0.00 C ATOM 1731 O ASP A 112 -9.267 -8.666 13.644 1.00 0.00 O ATOM 1732 CB ASP A 112 -9.186 -11.527 13.855 1.00 0.00 C ATOM 1733 CG ASP A 112 -8.948 -12.996 13.506 1.00 0.00 C ATOM 1734 OD1 ASP A 112 -8.059 -13.296 12.679 1.00 0.00 O ATOM 1735 OD2 ASP A 112 -9.675 -13.860 14.034 1.00 0.00 O ATOM 0 H ASP A 112 -7.835 -10.920 16.268 1.00 0.00 H new ATOM 0 HA ASP A 112 -7.200 -10.798 13.361 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -9.847 -11.484 14.721 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -9.717 -11.061 13.025 1.00 0.00 H new ATOM 1740 N THR A 113 -7.353 -8.320 14.772 1.00 0.00 N ATOM 1741 CA THR A 113 -7.449 -6.843 14.810 1.00 0.00 C ATOM 1742 C THR A 113 -6.021 -6.301 14.573 1.00 0.00 C ATOM 1743 O THR A 113 -5.185 -6.264 15.481 1.00 0.00 O ATOM 1744 CB THR A 113 -8.182 -6.323 16.063 1.00 0.00 C ATOM 1745 OG1 THR A 113 -8.550 -4.963 15.852 1.00 0.00 O ATOM 1746 CG2 THR A 113 -7.497 -6.378 17.416 1.00 0.00 C ATOM 0 H THR A 113 -6.517 -8.678 15.234 1.00 0.00 H new ATOM 0 HA THR A 113 -8.090 -6.456 14.018 1.00 0.00 H new ATOM 0 HB THR A 113 -9.002 -7.036 16.148 1.00 0.00 H new ATOM 0 HG1 THR A 113 -7.746 -4.428 15.687 1.00 0.00 H new ATOM 0 HG21 THR A 113 -8.162 -5.970 18.177 1.00 0.00 H new ATOM 0 HG22 THR A 113 -7.257 -7.413 17.660 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.579 -5.790 17.383 1.00 0.00 H new ATOM 1754 N MET A 114 -5.715 -5.966 13.310 1.00 0.00 N ATOM 1755 CA MET A 114 -4.363 -5.512 12.915 1.00 0.00 C ATOM 1756 C MET A 114 -4.053 -4.088 13.421 1.00 0.00 C ATOM 1757 O MET A 114 -4.553 -3.087 12.906 1.00 0.00 O ATOM 1758 CB MET A 114 -4.024 -5.814 11.445 1.00 0.00 C ATOM 1759 CG MET A 114 -2.554 -5.506 11.100 1.00 0.00 C ATOM 1760 SD MET A 114 -2.077 -6.373 9.597 1.00 0.00 S ATOM 1761 CE MET A 114 -0.537 -7.105 10.179 1.00 0.00 C ATOM 0 H MET A 114 -6.383 -5.999 12.540 1.00 0.00 H new ATOM 0 HA MET A 114 -3.639 -6.130 13.446 1.00 0.00 H new ATOM 0 HB2 MET A 114 -4.230 -6.864 11.237 1.00 0.00 H new ATOM 0 HB3 MET A 114 -4.676 -5.227 10.798 1.00 0.00 H new ATOM 0 HG2 MET A 114 -2.421 -4.432 10.968 1.00 0.00 H new ATOM 0 HG3 MET A 114 -1.908 -5.808 11.924 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.051 -7.443 9.325 1.00 0.00 H new ATOM 0 HE2 MET A 114 0.031 -6.361 10.739 1.00 0.00 H new ATOM 0 HE3 MET A 114 -0.759 -7.954 10.826 1.00 0.00 H new ATOM 1771 N LYS A 115 -3.219 -4.059 14.459 1.00 0.00 N ATOM 1772 CA LYS A 115 -2.755 -2.828 15.129 1.00 0.00 C ATOM 1773 C LYS A 115 -1.381 -2.402 14.543 1.00 0.00 C ATOM 1774 O LYS A 115 -0.322 -2.886 14.957 1.00 0.00 O ATOM 1775 CB LYS A 115 -2.708 -3.197 16.627 1.00 0.00 C ATOM 1776 CG LYS A 115 -2.330 -2.055 17.585 1.00 0.00 C ATOM 1777 CD LYS A 115 -1.996 -2.615 18.984 1.00 0.00 C ATOM 1778 CE LYS A 115 -0.609 -3.289 19.067 1.00 0.00 C ATOM 1779 NZ LYS A 115 -0.689 -4.655 19.652 1.00 0.00 N ATOM 0 H LYS A 115 -2.833 -4.907 14.874 1.00 0.00 H new ATOM 0 HA LYS A 115 -3.404 -1.965 14.978 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -3.685 -3.582 16.918 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.993 -4.009 16.760 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -1.473 -1.509 17.190 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.154 -1.345 17.658 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.040 -1.804 19.711 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -2.760 -3.339 19.268 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -0.173 -3.346 18.070 1.00 0.00 H new ATOM 0 HE3 LYS A 115 0.058 -2.674 19.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 0.271 -5.013 19.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -1.218 -4.619 20.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -1.176 -5.289 18.987 1.00 0.00 H new ATOM 1793 N THR A 116 -1.415 -1.477 13.576 1.00 0.00 N ATOM 1794 CA THR A 116 -0.191 -0.865 13.010 1.00 0.00 C ATOM 1795 C THR A 116 0.006 0.548 13.582 1.00 0.00 C ATOM 1796 O THR A 116 -0.690 1.509 13.241 1.00 0.00 O ATOM 1797 CB THR A 116 -0.101 -0.970 11.477 1.00 0.00 C ATOM 1798 OG1 THR A 116 1.211 -0.594 11.065 1.00 0.00 O ATOM 1799 CG2 THR A 116 -1.049 -0.176 10.614 1.00 0.00 C ATOM 0 H THR A 116 -2.280 -1.129 13.162 1.00 0.00 H new ATOM 0 HA THR A 116 0.668 -1.453 13.334 1.00 0.00 H new ATOM 0 HB THR A 116 -0.383 -2.010 11.314 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.279 -0.659 10.090 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.838 -0.375 9.563 1.00 0.00 H new ATOM 0 HG22 THR A 116 -2.075 -0.465 10.839 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.920 0.888 10.815 1.00 0.00 H new ATOM 1807 N THR A 117 1.004 0.652 14.450 1.00 0.00 N ATOM 1808 CA THR A 117 1.382 1.912 15.119 1.00 0.00 C ATOM 1809 C THR A 117 2.216 2.776 14.136 1.00 0.00 C ATOM 1810 O THR A 117 3.433 2.585 14.009 1.00 0.00 O ATOM 1811 CB THR A 117 2.193 1.500 16.390 1.00 0.00 C ATOM 1812 OG1 THR A 117 1.491 0.568 17.212 1.00 0.00 O ATOM 1813 CG2 THR A 117 2.534 2.670 17.292 1.00 0.00 C ATOM 0 H THR A 117 1.587 -0.140 14.720 1.00 0.00 H new ATOM 0 HA THR A 117 0.522 2.514 15.413 1.00 0.00 H new ATOM 0 HB THR A 117 3.100 1.059 15.977 1.00 0.00 H new ATOM 0 HG1 THR A 117 2.040 0.341 17.991 1.00 0.00 H new ATOM 0 HG21 THR A 117 3.097 2.313 18.154 1.00 0.00 H new ATOM 0 HG22 THR A 117 3.136 3.392 16.740 1.00 0.00 H new ATOM 0 HG23 THR A 117 1.615 3.148 17.631 1.00 0.00 H new ATOM 1821 N VAL A 118 1.563 3.682 13.385 1.00 0.00 N ATOM 1822 CA VAL A 118 2.244 4.378 12.257 1.00 0.00 C ATOM 1823 C VAL A 118 2.980 5.644 12.776 1.00 0.00 C ATOM 1824 O VAL A 118 2.369 6.682 13.031 1.00 0.00 O ATOM 1825 CB VAL A 118 1.291 4.493 11.032 1.00 0.00 C ATOM 1826 CG1 VAL A 118 0.127 5.471 11.098 1.00 0.00 C ATOM 1827 CG2 VAL A 118 2.085 4.771 9.739 1.00 0.00 C ATOM 0 H VAL A 118 0.589 3.950 13.526 1.00 0.00 H new ATOM 0 HA VAL A 118 3.065 3.797 11.838 1.00 0.00 H new ATOM 0 HB VAL A 118 0.817 3.512 11.042 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.437 5.428 10.166 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -0.525 5.205 11.930 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.509 6.481 11.245 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.396 4.847 8.898 1.00 0.00 H new ATOM 0 HG22 VAL A 118 2.634 5.707 9.843 1.00 0.00 H new ATOM 0 HG23 VAL A 118 2.787 3.956 9.561 1.00 0.00 H new ATOM 1837 N THR A 119 4.294 5.522 13.013 1.00 0.00 N ATOM 1838 CA THR A 119 5.141 6.604 13.599 1.00 0.00 C ATOM 1839 C THR A 119 6.170 7.157 12.569 1.00 0.00 C ATOM 1840 O THR A 119 6.605 6.451 11.653 1.00 0.00 O ATOM 1841 CB THR A 119 5.844 6.093 14.894 1.00 0.00 C ATOM 1842 OG1 THR A 119 6.663 7.117 15.463 1.00 0.00 O ATOM 1843 CG2 THR A 119 6.690 4.833 14.748 1.00 0.00 C ATOM 0 H THR A 119 4.815 4.670 12.807 1.00 0.00 H new ATOM 0 HA THR A 119 4.490 7.437 13.866 1.00 0.00 H new ATOM 0 HB THR A 119 5.011 5.825 15.544 1.00 0.00 H new ATOM 0 HG1 THR A 119 7.094 6.778 16.275 1.00 0.00 H new ATOM 0 HG21 THR A 119 7.128 4.575 15.712 1.00 0.00 H new ATOM 0 HG22 THR A 119 6.062 4.011 14.403 1.00 0.00 H new ATOM 0 HG23 THR A 119 7.486 5.011 14.024 1.00 0.00 H new ATOM 1851 N VAL A 120 6.551 8.436 12.731 1.00 0.00 N ATOM 1852 CA VAL A 120 7.472 9.139 11.776 1.00 0.00 C ATOM 1853 C VAL A 120 8.363 10.112 12.614 1.00 0.00 C ATOM 1854 O VAL A 120 8.090 11.313 12.712 1.00 0.00 O ATOM 1855 CB VAL A 120 6.720 9.896 10.626 1.00 0.00 C ATOM 1856 CG1 VAL A 120 7.672 10.169 9.452 1.00 0.00 C ATOM 1857 CG2 VAL A 120 5.484 9.142 10.123 1.00 0.00 C ATOM 0 H VAL A 120 6.243 9.018 13.510 1.00 0.00 H new ATOM 0 HA VAL A 120 8.082 8.395 11.263 1.00 0.00 H new ATOM 0 HB VAL A 120 6.374 10.838 11.051 1.00 0.00 H new ATOM 0 HG11 VAL A 120 7.135 10.695 8.663 1.00 0.00 H new ATOM 0 HG12 VAL A 120 8.505 10.782 9.794 1.00 0.00 H new ATOM 0 HG13 VAL A 120 8.052 9.224 9.065 1.00 0.00 H new ATOM 0 HG21 VAL A 120 5.006 9.715 9.328 1.00 0.00 H new ATOM 0 HG22 VAL A 120 5.784 8.168 9.737 1.00 0.00 H new ATOM 0 HG23 VAL A 120 4.781 9.006 10.945 1.00 0.00 H new ATOM 1867 N GLY A 121 9.365 9.559 13.306 1.00 0.00 N ATOM 1868 CA GLY A 121 10.106 10.267 14.373 1.00 0.00 C ATOM 1869 C GLY A 121 9.379 10.458 15.723 1.00 0.00 C ATOM 1870 O GLY A 121 9.932 10.166 16.783 1.00 0.00 O ATOM 0 H GLY A 121 9.691 8.606 13.147 1.00 0.00 H new ATOM 0 HA2 GLY A 121 11.032 9.723 14.561 1.00 0.00 H new ATOM 0 HA3 GLY A 121 10.385 11.251 13.996 1.00 0.00 H new ATOM 1874 N ASP A 122 8.176 11.033 15.643 1.00 0.00 N ATOM 1875 CA ASP A 122 7.557 11.806 16.751 1.00 0.00 C ATOM 1876 C ASP A 122 5.992 11.925 16.712 1.00 0.00 C ATOM 1877 O ASP A 122 5.428 12.925 17.164 1.00 0.00 O ATOM 1878 CB ASP A 122 8.261 13.192 16.883 1.00 0.00 C ATOM 1879 CG ASP A 122 8.300 14.053 15.618 1.00 0.00 C ATOM 1880 OD1 ASP A 122 7.237 14.401 15.057 1.00 0.00 O ATOM 1881 OD2 ASP A 122 9.405 14.301 15.091 1.00 0.00 O ATOM 0 H ASP A 122 7.592 10.982 14.808 1.00 0.00 H new ATOM 0 HA ASP A 122 7.727 11.221 17.655 1.00 0.00 H new ATOM 0 HB2 ASP A 122 7.759 13.758 17.667 1.00 0.00 H new ATOM 0 HB3 ASP A 122 9.285 13.026 17.216 1.00 0.00 H new ATOM 1886 N VAL A 123 5.286 10.886 16.236 1.00 0.00 N ATOM 1887 CA VAL A 123 3.806 10.945 16.044 1.00 0.00 C ATOM 1888 C VAL A 123 3.108 9.732 16.713 1.00 0.00 C ATOM 1889 O VAL A 123 2.278 9.934 17.602 1.00 0.00 O ATOM 1890 CB VAL A 123 3.394 11.164 14.550 1.00 0.00 C ATOM 1891 CG1 VAL A 123 1.856 11.296 14.409 1.00 0.00 C ATOM 1892 CG2 VAL A 123 3.984 12.461 13.953 1.00 0.00 C ATOM 0 H VAL A 123 5.704 9.993 15.975 1.00 0.00 H new ATOM 0 HA VAL A 123 3.444 11.835 16.559 1.00 0.00 H new ATOM 0 HB VAL A 123 3.779 10.293 14.020 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.598 11.447 13.361 1.00 0.00 H new ATOM 0 HG12 VAL A 123 1.378 10.386 14.772 1.00 0.00 H new ATOM 0 HG13 VAL A 123 1.509 12.147 14.995 1.00 0.00 H new ATOM 0 HG21 VAL A 123 3.666 12.562 12.915 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.631 13.319 14.526 1.00 0.00 H new ATOM 0 HG23 VAL A 123 5.072 12.419 13.996 1.00 0.00 H new ATOM 1902 N THR A 124 3.413 8.498 16.267 1.00 0.00 N ATOM 1903 CA THR A 124 2.802 7.245 16.816 1.00 0.00 C ATOM 1904 C THR A 124 1.255 7.194 16.668 1.00 0.00 C ATOM 1905 O THR A 124 0.504 7.405 17.626 1.00 0.00 O ATOM 1906 CB THR A 124 3.372 6.983 18.234 1.00 0.00 C ATOM 1907 OG1 THR A 124 4.797 6.898 18.185 1.00 0.00 O ATOM 1908 CG2 THR A 124 2.922 5.725 18.953 1.00 0.00 C ATOM 0 H THR A 124 4.086 8.329 15.519 1.00 0.00 H new ATOM 0 HA THR A 124 3.097 6.391 16.206 1.00 0.00 H new ATOM 0 HB THR A 124 2.979 7.832 18.794 1.00 0.00 H new ATOM 0 HG1 THR A 124 5.146 6.734 19.086 1.00 0.00 H new ATOM 0 HG21 THR A 124 3.400 5.674 19.931 1.00 0.00 H new ATOM 0 HG22 THR A 124 1.840 5.745 19.079 1.00 0.00 H new ATOM 0 HG23 THR A 124 3.202 4.850 18.366 1.00 0.00 H new ATOM 1916 N ALA A 125 0.776 6.923 15.447 1.00 0.00 N ATOM 1917 CA ALA A 125 -0.668 6.937 15.135 1.00 0.00 C ATOM 1918 C ALA A 125 -1.200 5.493 15.155 1.00 0.00 C ATOM 1919 O ALA A 125 -0.968 4.715 14.226 1.00 0.00 O ATOM 1920 CB ALA A 125 -0.807 7.651 13.786 1.00 0.00 C ATOM 0 H ALA A 125 1.369 6.689 14.650 1.00 0.00 H new ATOM 0 HA ALA A 125 -1.271 7.474 15.867 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -1.859 7.692 13.502 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -0.414 8.664 13.868 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -0.247 7.106 13.026 1.00 0.00 H new ATOM 1926 N ILE A 126 -1.903 5.119 16.237 1.00 0.00 N ATOM 1927 CA ILE A 126 -2.440 3.730 16.392 1.00 0.00 C ATOM 1928 C ILE A 126 -3.512 3.421 15.316 1.00 0.00 C ATOM 1929 O ILE A 126 -4.618 3.969 15.364 1.00 0.00 O ATOM 1930 CB ILE A 126 -2.857 3.478 17.882 1.00 0.00 C ATOM 1931 CG1 ILE A 126 -2.656 1.993 18.315 1.00 0.00 C ATOM 1932 CG2 ILE A 126 -4.296 3.873 18.267 1.00 0.00 C ATOM 1933 CD1 ILE A 126 -1.190 1.653 18.575 1.00 0.00 C ATOM 0 H ILE A 126 -2.118 5.741 17.016 1.00 0.00 H new ATOM 0 HA ILE A 126 -1.662 2.993 16.194 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.181 4.149 18.413 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -3.236 1.799 19.217 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -3.046 1.335 17.538 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -4.465 3.651 19.321 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -4.439 4.939 18.093 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -5.003 3.308 17.660 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -1.106 0.608 18.873 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -0.611 1.819 17.666 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.805 2.290 19.371 1.00 0.00 H new ATOM 1945 N ARG A 127 -3.163 2.599 14.310 1.00 0.00 N ATOM 1946 CA ARG A 127 -4.156 2.147 13.311 1.00 0.00 C ATOM 1947 C ARG A 127 -4.611 0.700 13.667 1.00 0.00 C ATOM 1948 O ARG A 127 -3.936 -0.269 13.314 1.00 0.00 O ATOM 1949 CB ARG A 127 -3.718 2.172 11.833 1.00 0.00 C ATOM 1950 CG ARG A 127 -3.055 3.434 11.289 1.00 0.00 C ATOM 1951 CD ARG A 127 -3.119 3.592 9.756 1.00 0.00 C ATOM 1952 NE ARG A 127 -2.672 2.397 8.997 1.00 0.00 N ATOM 1953 CZ ARG A 127 -2.403 2.359 7.698 1.00 0.00 C ATOM 1954 NH1 ARG A 127 -2.307 3.423 6.945 1.00 0.00 N ATOM 1955 NH2 ARG A 127 -2.226 1.199 7.140 1.00 0.00 N ATOM 0 H ARG A 127 -2.220 2.238 14.166 1.00 0.00 H new ATOM 0 HA ARG A 127 -4.959 2.881 13.377 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -3.028 1.343 11.678 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -4.599 1.972 11.223 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -3.527 4.302 11.749 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -2.009 3.439 11.597 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -4.144 3.827 9.470 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -2.504 4.443 9.465 1.00 0.00 H new ATOM 0 HE ARG A 127 -2.562 1.528 9.520 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -2.442 4.349 7.351 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -2.098 3.327 5.951 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -2.295 0.348 7.699 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -2.018 1.139 6.143 1.00 0.00 H new ATOM 1969 N ASN A 128 -5.745 0.576 14.352 1.00 0.00 N ATOM 1970 CA ASN A 128 -6.353 -0.747 14.656 1.00 0.00 C ATOM 1971 C ASN A 128 -7.544 -0.986 13.690 1.00 0.00 C ATOM 1972 O ASN A 128 -8.369 -0.091 13.489 1.00 0.00 O ATOM 1973 CB ASN A 128 -6.788 -0.750 16.132 1.00 0.00 C ATOM 1974 CG ASN A 128 -6.853 -2.102 16.826 1.00 0.00 C ATOM 1975 OD1 ASN A 128 -6.780 -3.178 16.235 1.00 0.00 O ATOM 1976 ND2 ASN A 128 -7.017 -2.086 18.126 1.00 0.00 N ATOM 0 H ASN A 128 -6.274 1.369 14.714 1.00 0.00 H new ATOM 0 HA ASN A 128 -5.642 -1.560 14.509 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -6.100 -0.115 16.690 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -7.773 -0.287 16.197 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -7.083 -2.963 18.642 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -7.078 -1.196 18.621 1.00 0.00 H new ATOM 1983 N TYR A 129 -7.629 -2.175 13.095 1.00 0.00 N ATOM 1984 CA TYR A 129 -8.634 -2.472 12.046 1.00 0.00 C ATOM 1985 C TYR A 129 -9.033 -3.982 12.063 1.00 0.00 C ATOM 1986 O TYR A 129 -8.196 -4.850 12.301 1.00 0.00 O ATOM 1987 CB TYR A 129 -8.230 -2.016 10.621 1.00 0.00 C ATOM 1988 CG TYR A 129 -6.781 -1.765 10.210 1.00 0.00 C ATOM 1989 CD1 TYR A 129 -5.889 -2.832 10.084 1.00 0.00 C ATOM 1990 CD2 TYR A 129 -6.367 -0.489 9.795 1.00 0.00 C ATOM 1991 CE1 TYR A 129 -4.632 -2.647 9.502 1.00 0.00 C ATOM 1992 CE2 TYR A 129 -5.104 -0.301 9.233 1.00 0.00 C ATOM 1993 CZ TYR A 129 -4.244 -1.383 9.067 1.00 0.00 C ATOM 1994 OH TYR A 129 -3.041 -1.221 8.449 1.00 0.00 O ATOM 0 H TYR A 129 -7.015 -2.960 13.315 1.00 0.00 H new ATOM 0 HA TYR A 129 -9.505 -1.870 12.303 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -8.622 -2.765 9.933 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -8.772 -1.091 10.427 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -6.174 -3.811 10.440 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -7.032 0.354 9.912 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -3.961 -3.486 9.390 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -4.793 0.687 8.926 1.00 0.00 H new ATOM 0 HH TYR A 129 -2.804 -2.044 7.973 1.00 0.00 H new ATOM 2004 N LYS A 130 -10.311 -4.292 11.793 1.00 0.00 N ATOM 2005 CA LYS A 130 -10.857 -5.673 11.963 1.00 0.00 C ATOM 2006 C LYS A 130 -10.825 -6.508 10.644 1.00 0.00 C ATOM 2007 O LYS A 130 -11.012 -5.981 9.544 1.00 0.00 O ATOM 2008 CB LYS A 130 -12.297 -5.591 12.548 1.00 0.00 C ATOM 2009 CG LYS A 130 -12.381 -5.591 14.096 1.00 0.00 C ATOM 2010 CD LYS A 130 -11.693 -4.397 14.765 1.00 0.00 C ATOM 2011 CE LYS A 130 -11.740 -4.393 16.303 1.00 0.00 C ATOM 2012 NZ LYS A 130 -12.849 -3.543 16.817 1.00 0.00 N ATOM 0 H LYS A 130 -10.995 -3.615 11.456 1.00 0.00 H new ATOM 0 HA LYS A 130 -10.210 -6.203 12.662 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -12.773 -4.684 12.174 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -12.875 -6.434 12.169 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -13.430 -5.603 14.391 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -11.934 -6.511 14.472 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -10.650 -4.375 14.449 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -12.156 -3.480 14.401 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -11.865 -5.413 16.666 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -10.790 -4.029 16.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -13.059 -3.805 17.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -12.567 -2.543 16.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -13.697 -3.687 16.232 1.00 0.00 H new ATOM 2026 N ARG A 131 -10.583 -7.819 10.795 1.00 0.00 N ATOM 2027 CA ARG A 131 -10.283 -8.733 9.662 1.00 0.00 C ATOM 2028 C ARG A 131 -11.527 -9.151 8.840 1.00 0.00 C ATOM 2029 O ARG A 131 -12.515 -9.651 9.386 1.00 0.00 O ATOM 2030 CB ARG A 131 -9.594 -9.977 10.279 1.00 0.00 C ATOM 2031 CG ARG A 131 -8.822 -10.850 9.261 1.00 0.00 C ATOM 2032 CD ARG A 131 -8.215 -12.050 9.998 1.00 0.00 C ATOM 2033 NE ARG A 131 -7.412 -12.903 9.102 1.00 0.00 N ATOM 2034 CZ ARG A 131 -6.737 -13.982 9.493 1.00 0.00 C ATOM 2035 NH1 ARG A 131 -6.720 -14.453 10.716 1.00 0.00 N ATOM 2036 NH2 ARG A 131 -6.044 -14.604 8.589 1.00 0.00 N ATOM 0 H ARG A 131 -10.588 -8.284 11.703 1.00 0.00 H new ATOM 0 HA ARG A 131 -9.646 -8.213 8.947 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -8.903 -9.647 11.055 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -10.350 -10.592 10.767 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -9.492 -11.191 8.472 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -8.037 -10.265 8.781 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -7.589 -11.694 10.816 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -9.014 -12.643 10.443 1.00 0.00 H new ATOM 0 HE ARG A 131 -7.371 -12.649 8.115 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -7.251 -13.985 11.450 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -6.176 -15.288 10.934 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -6.034 -14.261 7.629 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -5.510 -15.436 8.839 1.00 0.00 H new ATOM 2050 N LEU A 132 -11.438 -8.969 7.519 1.00 0.00 N ATOM 2051 CA LEU A 132 -12.568 -9.209 6.597 1.00 0.00 C ATOM 2052 C LEU A 132 -12.148 -10.187 5.449 1.00 0.00 C ATOM 2053 O LEU A 132 -11.097 -10.027 4.815 1.00 0.00 O ATOM 2054 CB LEU A 132 -13.024 -7.872 5.976 1.00 0.00 C ATOM 2055 CG LEU A 132 -13.533 -6.763 6.919 1.00 0.00 C ATOM 2056 CD1 LEU A 132 -14.020 -5.599 6.043 1.00 0.00 C ATOM 2057 CD2 LEU A 132 -14.630 -7.184 7.893 1.00 0.00 C ATOM 0 H LEU A 132 -10.587 -8.653 7.054 1.00 0.00 H new ATOM 0 HA LEU A 132 -13.384 -9.656 7.164 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -12.187 -7.467 5.408 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -13.818 -8.091 5.262 1.00 0.00 H new ATOM 0 HG LEU A 132 -12.699 -6.483 7.562 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -14.388 -4.794 6.679 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -13.194 -5.231 5.434 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -14.824 -5.944 5.393 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -14.916 -6.332 8.509 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -15.497 -7.535 7.334 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -14.261 -7.986 8.532 1.00 0.00 H new ATOM 2069 N SER A 133 -13.012 -11.171 5.177 1.00 0.00 N ATOM 2070 CA SER A 133 -12.777 -12.192 4.128 1.00 0.00 C ATOM 2071 C SER A 133 -14.080 -12.506 3.367 1.00 0.00 C ATOM 2072 O SER A 133 -15.181 -12.635 3.906 1.00 0.00 O ATOM 2073 CB SER A 133 -12.177 -13.462 4.764 1.00 0.00 C ATOM 2074 OG SER A 133 -11.814 -14.398 3.752 1.00 0.00 O ATOM 0 H SER A 133 -13.896 -11.290 5.673 1.00 0.00 H new ATOM 0 HA SER A 133 -12.065 -11.800 3.402 1.00 0.00 H new ATOM 0 HB2 SER A 133 -11.301 -13.201 5.358 1.00 0.00 H new ATOM 0 HB3 SER A 133 -12.900 -13.913 5.444 1.00 0.00 H new ATOM 0 HG SER A 133 -11.433 -15.199 4.169 1.00 0.00 H new TER 2081 SER A 133