USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1047 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 40 THR OG1 : rot 165:sc= 2.15 USER MOD Set 1.2: A 128 TYR OH : rot 53:sc= 1.67 USER MOD Set 2.1: A 19 TYR OH : rot -91:sc= 1.07 USER MOD Set 2.2: A 22 SER OG : rot -52:sc= 1.19 USER MOD Set 2.3: A 100 GLN : amide:sc= 0.927 K(o=6.1,f=3.1) USER MOD Set 2.4: A 102 THR OG1 : rot 93:sc= 2.01 USER MOD Set 2.5: A 119 HIS : no HD1:sc= 0.906 K(o=6.1,f=-1.6!) USER MOD Set 3.1: A 82 SER OG : rot -115:sc= 0.962 USER MOD Set 3.2: A 93 HIS : no HD1:sc= 0.142 K(o=1.9,f=-6!) USER MOD Set 3.3: A 95 GLN : amide:sc= 0.822 K(o=1.9,f=-2.4) USER MOD Set 4.1: A 54 GLN : amide:sc= 1.02 K(o=1.7,f=-0.19) USER MOD Set 4.2: A 59 ASN : amide:sc= 0.683 K(o=1.7,f=-0.57) USER MOD Set 5.1: A 48 THR OG1 : rot 180:sc= 0.697 USER MOD Set 5.2: A 65 LYS NZ :NH3+ -169:sc= 0.625! (180deg=-0.0229) USER MOD Set 6.1: A 9 LYS NZ :NH3+ 180:sc= 1.31 (180deg=0) USER MOD Set 6.2: A 39 THR OG1 : rot 150:sc= 0.984 USER MOD Set 6.3: A 131 GLN :FLIP amide:sc= -0.0801 F(o=1.1,f=2.2) USER MOD Single : A 1 VAL N :NH3+ -175:sc= -0.0218 (180deg=-0.0654) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 95:sc= 1.55 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 1.61 K(o=1.6,f=-0.16) USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 159:sc= 1.13 (180deg=0.738) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.164 USER MOD Single : A 31 GLN : amide:sc= -0.662 K(o=-0.66,f=-2.1) USER MOD Single : A 34 ASN : amide:sc= -0.0239 K(o=-0.024,f=-5.3!) USER MOD Single : A 35 MET CE :methyl -122:sc= 0 (180deg=-0.0708) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= 1.07 K(o=1.1,f=-0.82) USER MOD Single : A 52 LYS NZ :NH3+ 158:sc= 1.17 (180deg=0.856) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 103:sc= 0.926 USER MOD Single : A 56 THR OG1 : rot -47:sc= 0.646 USER MOD Single : A 58 LYS NZ :NH3+ -160:sc= 1.28 (180deg=1.18) USER MOD Single : A 60 THR OG1 : rot -161:sc= 1.26 USER MOD Single : A 63 SER OG : rot 69:sc= 0.509 USER MOD Single : A 73 THR OG1 : rot 64:sc= 1.17 USER MOD Single : A 74 THR OG1 : rot -77:sc= 1.23 USER MOD Single : A 79 LYS NZ :NH3+ -159:sc= 1.08 (180deg=0.478) USER MOD Single : A 81 LYS NZ :NH3+ -131:sc= 0.991 (180deg=-0.698!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0.205 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 157:sc= 0.828 (180deg=-1.94!) USER MOD Single : A 98 ASN : amide:sc= -0.456 X(o=-0.46,f=-0.014) USER MOD Single : A 103 SER OG : rot 180:sc= -0.191 USER MOD Single : A 108 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ -176:sc= -0.462 (180deg=-0.571) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.0105 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 65:sc= 0.793 USER MOD Single : A 125 THR OG1 : rot 42:sc= 0.0891 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -172:sc= 1.96 (180deg=1.45) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.661 -12.439 -3.769 1.00 0.00 N ATOM 2 CA VAL A 1 10.996 -11.685 -2.572 1.00 0.00 C ATOM 3 C VAL A 1 12.069 -10.631 -2.874 1.00 0.00 C ATOM 4 O VAL A 1 11.922 -9.474 -2.461 1.00 0.00 O ATOM 5 CB VAL A 1 11.313 -12.645 -1.409 1.00 0.00 C ATOM 6 CG1 VAL A 1 12.539 -13.534 -1.635 1.00 0.00 C ATOM 7 CG2 VAL A 1 11.479 -11.889 -0.087 1.00 0.00 C ATOM 0 H1 VAL A 1 9.875 -13.087 -3.562 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.379 -11.783 -4.525 1.00 0.00 H new ATOM 0 H3 VAL A 1 11.489 -12.987 -4.077 1.00 0.00 H new ATOM 0 HA VAL A 1 10.137 -11.106 -2.234 1.00 0.00 H new ATOM 0 HB VAL A 1 10.447 -13.305 -1.361 1.00 0.00 H new ATOM 0 HG11 VAL A 1 12.687 -14.177 -0.767 1.00 0.00 H new ATOM 0 HG12 VAL A 1 12.383 -14.150 -2.521 1.00 0.00 H new ATOM 0 HG13 VAL A 1 13.420 -12.909 -1.778 1.00 0.00 H new ATOM 0 HG21 VAL A 1 11.702 -12.597 0.711 1.00 0.00 H new ATOM 0 HG22 VAL A 1 12.297 -11.174 -0.177 1.00 0.00 H new ATOM 0 HG23 VAL A 1 10.557 -11.357 0.146 1.00 0.00 H new ATOM 19 N ASP A 2 13.097 -11.014 -3.648 1.00 0.00 N ATOM 20 CA ASP A 2 14.234 -10.217 -4.121 1.00 0.00 C ATOM 21 C ASP A 2 13.791 -9.162 -5.146 1.00 0.00 C ATOM 22 O ASP A 2 14.295 -9.065 -6.266 1.00 0.00 O ATOM 23 CB ASP A 2 15.281 -11.156 -4.748 1.00 0.00 C ATOM 24 CG ASP A 2 15.521 -12.407 -3.920 1.00 0.00 C ATOM 25 OD1 ASP A 2 14.586 -13.240 -3.924 1.00 0.00 O ATOM 26 OD2 ASP A 2 16.594 -12.488 -3.288 1.00 0.00 O ATOM 0 H ASP A 2 13.156 -11.974 -3.987 1.00 0.00 H new ATOM 0 HA ASP A 2 14.667 -9.690 -3.271 1.00 0.00 H new ATOM 0 HB2 ASP A 2 14.952 -11.444 -5.746 1.00 0.00 H new ATOM 0 HB3 ASP A 2 16.221 -10.617 -4.865 1.00 0.00 H new ATOM 31 N ALA A 3 12.808 -8.365 -4.754 1.00 0.00 N ATOM 32 CA ALA A 3 11.946 -7.604 -5.633 1.00 0.00 C ATOM 33 C ALA A 3 11.059 -6.693 -4.796 1.00 0.00 C ATOM 34 O ALA A 3 10.802 -5.560 -5.186 1.00 0.00 O ATOM 35 CB ALA A 3 11.085 -8.554 -6.477 1.00 0.00 C ATOM 0 H ALA A 3 12.583 -8.228 -3.769 1.00 0.00 H new ATOM 0 HA ALA A 3 12.553 -6.999 -6.306 1.00 0.00 H new ATOM 0 HB1 ALA A 3 10.440 -7.972 -7.135 1.00 0.00 H new ATOM 0 HB2 ALA A 3 11.731 -9.195 -7.076 1.00 0.00 H new ATOM 0 HB3 ALA A 3 10.472 -9.170 -5.820 1.00 0.00 H new ATOM 41 N PHE A 4 10.621 -7.184 -3.635 1.00 0.00 N ATOM 42 CA PHE A 4 9.811 -6.436 -2.693 1.00 0.00 C ATOM 43 C PHE A 4 10.711 -5.828 -1.619 1.00 0.00 C ATOM 44 O PHE A 4 10.605 -4.639 -1.341 1.00 0.00 O ATOM 45 CB PHE A 4 8.720 -7.372 -2.148 1.00 0.00 C ATOM 46 CG PHE A 4 7.890 -7.994 -3.261 1.00 0.00 C ATOM 47 CD1 PHE A 4 7.386 -7.174 -4.289 1.00 0.00 C ATOM 48 CD2 PHE A 4 7.886 -9.391 -3.432 1.00 0.00 C ATOM 49 CE1 PHE A 4 7.015 -7.733 -5.522 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.506 -9.952 -4.663 1.00 0.00 C ATOM 51 CZ PHE A 4 7.101 -9.120 -5.720 1.00 0.00 C ATOM 0 H PHE A 4 10.828 -8.133 -3.324 1.00 0.00 H new ATOM 0 HA PHE A 4 9.304 -5.595 -3.165 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.183 -8.162 -1.557 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.066 -6.814 -1.478 1.00 0.00 H new ATOM 0 HD1 PHE A 4 7.285 -6.111 -4.128 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.176 -10.034 -2.614 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.663 -7.095 -6.319 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.525 -11.024 -4.797 1.00 0.00 H new ATOM 0 HZ PHE A 4 6.857 -9.546 -6.682 1.00 0.00 H new ATOM 61 N VAL A 5 11.621 -6.622 -1.048 1.00 0.00 N ATOM 62 CA VAL A 5 12.484 -6.203 0.057 1.00 0.00 C ATOM 63 C VAL A 5 13.155 -4.845 -0.206 1.00 0.00 C ATOM 64 O VAL A 5 14.028 -4.744 -1.075 1.00 0.00 O ATOM 65 CB VAL A 5 13.543 -7.292 0.312 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.573 -6.875 1.374 1.00 0.00 C ATOM 67 CG2 VAL A 5 12.874 -8.580 0.800 1.00 0.00 C ATOM 0 H VAL A 5 11.780 -7.585 -1.344 1.00 0.00 H new ATOM 0 HA VAL A 5 11.862 -6.075 0.943 1.00 0.00 H new ATOM 0 HB VAL A 5 14.054 -7.446 -0.638 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.296 -7.679 1.515 1.00 0.00 H new ATOM 0 HG12 VAL A 5 15.091 -5.974 1.044 1.00 0.00 H new ATOM 0 HG13 VAL A 5 14.063 -6.676 2.317 1.00 0.00 H new ATOM 0 HG21 VAL A 5 13.634 -9.341 0.976 1.00 0.00 H new ATOM 0 HG22 VAL A 5 12.337 -8.382 1.728 1.00 0.00 H new ATOM 0 HG23 VAL A 5 12.174 -8.935 0.044 1.00 0.00 H new ATOM 77 N GLY A 6 12.806 -3.822 0.582 1.00 0.00 N ATOM 78 CA GLY A 6 13.594 -2.605 0.716 1.00 0.00 C ATOM 79 C GLY A 6 12.734 -1.349 0.651 1.00 0.00 C ATOM 80 O GLY A 6 11.506 -1.417 0.631 1.00 0.00 O ATOM 0 H GLY A 6 11.958 -3.822 1.148 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.132 -2.626 1.664 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.343 -2.571 -0.075 1.00 0.00 H new ATOM 84 N THR A 7 13.396 -0.191 0.617 1.00 0.00 N ATOM 85 CA THR A 7 12.738 1.101 0.540 1.00 0.00 C ATOM 86 C THR A 7 12.828 1.636 -0.884 1.00 0.00 C ATOM 87 O THR A 7 13.924 1.785 -1.430 1.00 0.00 O ATOM 88 CB THR A 7 13.353 2.068 1.557 1.00 0.00 C ATOM 89 OG1 THR A 7 13.371 1.461 2.830 1.00 0.00 O ATOM 90 CG2 THR A 7 12.509 3.338 1.653 1.00 0.00 C ATOM 0 H THR A 7 14.414 -0.130 0.643 1.00 0.00 H new ATOM 0 HA THR A 7 11.683 0.994 0.791 1.00 0.00 H new ATOM 0 HB THR A 7 14.364 2.315 1.233 1.00 0.00 H new ATOM 0 HG1 THR A 7 13.766 2.078 3.481 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.956 4.018 2.379 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.470 3.823 0.678 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.499 3.080 1.971 1.00 0.00 H new ATOM 98 N TRP A 8 11.670 1.933 -1.471 1.00 0.00 N ATOM 99 CA TRP A 8 11.536 2.368 -2.846 1.00 0.00 C ATOM 100 C TRP A 8 10.920 3.767 -2.867 1.00 0.00 C ATOM 101 O TRP A 8 10.241 4.168 -1.917 1.00 0.00 O ATOM 102 CB TRP A 8 10.698 1.339 -3.619 1.00 0.00 C ATOM 103 CG TRP A 8 11.038 -0.108 -3.381 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.664 -0.827 -2.298 1.00 0.00 C ATOM 105 CD2 TRP A 8 11.800 -1.034 -4.217 1.00 0.00 C ATOM 106 NE1 TRP A 8 11.149 -2.112 -2.394 1.00 0.00 N ATOM 107 CE2 TRP A 8 11.875 -2.291 -3.547 1.00 0.00 C ATOM 108 CE3 TRP A 8 12.414 -0.956 -5.485 1.00 0.00 C ATOM 109 CZ2 TRP A 8 12.544 -3.397 -4.086 1.00 0.00 C ATOM 110 CZ3 TRP A 8 13.099 -2.057 -6.035 1.00 0.00 C ATOM 111 CH2 TRP A 8 13.165 -3.276 -5.338 1.00 0.00 C ATOM 0 H TRP A 8 10.777 1.873 -0.982 1.00 0.00 H new ATOM 0 HA TRP A 8 12.507 2.431 -3.336 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.649 1.491 -3.365 1.00 0.00 H new ATOM 0 HB3 TRP A 8 10.801 1.544 -4.685 1.00 0.00 H new ATOM 0 HD1 TRP A 8 10.072 -0.449 -1.478 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.990 -2.840 -1.697 1.00 0.00 H new ATOM 0 HE3 TRP A 8 12.358 -0.034 -6.045 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 12.581 -4.331 -3.545 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 13.577 -1.964 -6.999 1.00 0.00 H new ATOM 0 HH2 TRP A 8 13.692 -4.116 -5.765 1.00 0.00 H new ATOM 122 N LYS A 9 11.182 4.529 -3.929 1.00 0.00 N ATOM 123 CA LYS A 9 10.599 5.845 -4.163 1.00 0.00 C ATOM 124 C LYS A 9 10.012 5.859 -5.569 1.00 0.00 C ATOM 125 O LYS A 9 10.628 5.319 -6.490 1.00 0.00 O ATOM 126 CB LYS A 9 11.664 6.942 -3.989 1.00 0.00 C ATOM 127 CG LYS A 9 11.319 7.882 -2.827 1.00 0.00 C ATOM 128 CD LYS A 9 12.489 8.847 -2.584 1.00 0.00 C ATOM 129 CE LYS A 9 12.188 9.913 -1.518 1.00 0.00 C ATOM 130 NZ LYS A 9 11.952 9.336 -0.178 1.00 0.00 N ATOM 0 H LYS A 9 11.822 4.238 -4.668 1.00 0.00 H new ATOM 0 HA LYS A 9 9.810 6.046 -3.438 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.636 6.482 -3.810 1.00 0.00 H new ATOM 0 HB3 LYS A 9 11.749 7.517 -4.911 1.00 0.00 H new ATOM 0 HG2 LYS A 9 10.413 8.443 -3.056 1.00 0.00 H new ATOM 0 HG3 LYS A 9 11.117 7.304 -1.925 1.00 0.00 H new ATOM 0 HD2 LYS A 9 13.365 8.275 -2.278 1.00 0.00 H new ATOM 0 HD3 LYS A 9 12.743 9.342 -3.521 1.00 0.00 H new ATOM 0 HE2 LYS A 9 13.022 10.612 -1.465 1.00 0.00 H new ATOM 0 HE3 LYS A 9 11.311 10.485 -1.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 11.754 10.100 0.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 11.139 8.689 -0.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 12.797 8.812 0.128 1.00 0.00 H new ATOM 144 N LEU A 10 8.808 6.424 -5.716 1.00 0.00 N ATOM 145 CA LEU A 10 8.178 6.557 -7.019 1.00 0.00 C ATOM 146 C LEU A 10 9.033 7.462 -7.896 1.00 0.00 C ATOM 147 O LEU A 10 9.528 8.483 -7.414 1.00 0.00 O ATOM 148 CB LEU A 10 6.766 7.130 -6.861 1.00 0.00 C ATOM 149 CG LEU A 10 6.056 7.289 -8.220 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.577 6.932 -8.095 1.00 0.00 C ATOM 151 CD2 LEU A 10 6.156 8.721 -8.766 1.00 0.00 C ATOM 0 H LEU A 10 8.256 6.795 -4.943 1.00 0.00 H new ATOM 0 HA LEU A 10 8.096 5.578 -7.492 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.178 6.475 -6.218 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.821 8.099 -6.364 1.00 0.00 H new ATOM 0 HG LEU A 10 6.559 6.613 -8.911 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.091 7.050 -9.064 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.479 5.898 -7.763 1.00 0.00 H new ATOM 0 HD13 LEU A 10 4.103 7.593 -7.369 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.641 8.782 -9.725 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.694 9.412 -8.061 1.00 0.00 H new ATOM 0 HD23 LEU A 10 7.205 8.987 -8.900 1.00 0.00 H new ATOM 163 N VAL A 11 9.165 7.122 -9.181 1.00 0.00 N ATOM 164 CA VAL A 11 9.788 8.015 -10.147 1.00 0.00 C ATOM 165 C VAL A 11 9.069 8.020 -11.509 1.00 0.00 C ATOM 166 O VAL A 11 9.425 8.832 -12.360 1.00 0.00 O ATOM 167 CB VAL A 11 11.311 7.768 -10.169 1.00 0.00 C ATOM 168 CG1 VAL A 11 11.701 6.457 -10.849 1.00 0.00 C ATOM 169 CG2 VAL A 11 12.092 8.919 -10.815 1.00 0.00 C ATOM 0 H VAL A 11 8.847 6.235 -9.571 1.00 0.00 H new ATOM 0 HA VAL A 11 9.664 9.051 -9.831 1.00 0.00 H new ATOM 0 HB VAL A 11 11.586 7.703 -9.116 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.785 6.346 -10.830 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.241 5.622 -10.320 1.00 0.00 H new ATOM 0 HG13 VAL A 11 11.355 6.466 -11.883 1.00 0.00 H new ATOM 0 HG21 VAL A 11 13.157 8.688 -10.802 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.762 9.049 -11.846 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.913 9.838 -10.258 1.00 0.00 H new ATOM 179 N ASP A 12 8.017 7.205 -11.705 1.00 0.00 N ATOM 180 CA ASP A 12 7.206 7.230 -12.924 1.00 0.00 C ATOM 181 C ASP A 12 5.733 7.067 -12.532 1.00 0.00 C ATOM 182 O ASP A 12 5.419 6.348 -11.579 1.00 0.00 O ATOM 183 CB ASP A 12 7.597 6.136 -13.941 1.00 0.00 C ATOM 184 CG ASP A 12 9.074 5.744 -14.002 1.00 0.00 C ATOM 185 OD1 ASP A 12 9.660 5.419 -12.946 1.00 0.00 O ATOM 186 OD2 ASP A 12 9.644 5.650 -15.111 1.00 0.00 O ATOM 0 H ASP A 12 7.710 6.514 -11.021 1.00 0.00 H new ATOM 0 HA ASP A 12 7.383 8.186 -13.417 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.017 5.241 -13.716 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.294 6.471 -14.933 1.00 0.00 H new ATOM 191 N SER A 13 4.833 7.733 -13.265 1.00 0.00 N ATOM 192 CA SER A 13 3.414 7.839 -12.959 1.00 0.00 C ATOM 193 C SER A 13 2.671 8.286 -14.219 1.00 0.00 C ATOM 194 O SER A 13 3.227 9.042 -15.014 1.00 0.00 O ATOM 195 CB SER A 13 3.230 8.880 -11.845 1.00 0.00 C ATOM 196 OG SER A 13 1.867 9.212 -11.683 1.00 0.00 O ATOM 0 H SER A 13 5.090 8.229 -14.118 1.00 0.00 H new ATOM 0 HA SER A 13 3.019 6.878 -12.629 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.627 8.489 -10.908 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.801 9.778 -12.083 1.00 0.00 H new ATOM 0 HG SER A 13 1.479 8.662 -10.971 1.00 0.00 H new ATOM 202 N LYS A 14 1.417 7.846 -14.382 1.00 0.00 N ATOM 203 CA LYS A 14 0.454 8.413 -15.316 1.00 0.00 C ATOM 204 C LYS A 14 -0.947 8.005 -14.850 1.00 0.00 C ATOM 205 O LYS A 14 -1.094 6.992 -14.162 1.00 0.00 O ATOM 206 CB LYS A 14 0.752 7.956 -16.756 1.00 0.00 C ATOM 207 CG LYS A 14 -0.080 8.725 -17.794 1.00 0.00 C ATOM 208 CD LYS A 14 0.467 8.503 -19.210 1.00 0.00 C ATOM 209 CE LYS A 14 -0.369 9.290 -20.232 1.00 0.00 C ATOM 210 NZ LYS A 14 0.168 9.178 -21.605 1.00 0.00 N ATOM 0 H LYS A 14 1.040 7.062 -13.849 1.00 0.00 H new ATOM 0 HA LYS A 14 0.522 9.501 -15.328 1.00 0.00 H new ATOM 0 HB2 LYS A 14 1.812 8.096 -16.967 1.00 0.00 H new ATOM 0 HB3 LYS A 14 0.547 6.889 -16.847 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -1.119 8.399 -17.746 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -0.069 9.789 -17.558 1.00 0.00 H new ATOM 0 HD2 LYS A 14 1.508 8.821 -19.259 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.446 7.441 -19.453 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -1.396 8.925 -20.216 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -0.399 10.340 -19.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.429 9.725 -22.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.139 9.550 -21.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.173 8.179 -21.895 1.00 0.00 H new ATOM 224 N ASN A 15 -1.969 8.798 -15.197 1.00 0.00 N ATOM 225 CA ASN A 15 -3.375 8.543 -14.873 1.00 0.00 C ATOM 226 C ASN A 15 -3.553 8.334 -13.364 1.00 0.00 C ATOM 227 O ASN A 15 -4.205 7.393 -12.914 1.00 0.00 O ATOM 228 CB ASN A 15 -3.898 7.364 -15.712 1.00 0.00 C ATOM 229 CG ASN A 15 -5.419 7.373 -15.858 1.00 0.00 C ATOM 230 OD1 ASN A 15 -5.927 7.726 -16.917 1.00 0.00 O ATOM 231 ND2 ASN A 15 -6.146 7.024 -14.804 1.00 0.00 N ATOM 0 H ASN A 15 -1.834 9.659 -15.726 1.00 0.00 H new ATOM 0 HA ASN A 15 -3.977 9.414 -15.133 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.442 7.397 -16.701 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -3.587 6.428 -15.249 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -7.164 7.044 -14.858 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -5.686 6.736 -13.940 1.00 0.00 H new ATOM 238 N PHE A 16 -2.906 9.182 -12.565 1.00 0.00 N ATOM 239 CA PHE A 16 -2.844 9.029 -11.117 1.00 0.00 C ATOM 240 C PHE A 16 -4.131 9.549 -10.486 1.00 0.00 C ATOM 241 O PHE A 16 -4.816 8.849 -9.738 1.00 0.00 O ATOM 242 CB PHE A 16 -1.600 9.769 -10.587 1.00 0.00 C ATOM 243 CG PHE A 16 -0.685 8.904 -9.750 1.00 0.00 C ATOM 244 CD1 PHE A 16 -0.152 7.737 -10.323 1.00 0.00 C ATOM 245 CD2 PHE A 16 -0.169 9.373 -8.531 1.00 0.00 C ATOM 246 CE1 PHE A 16 0.804 6.987 -9.631 1.00 0.00 C ATOM 247 CE2 PHE A 16 0.816 8.637 -7.853 1.00 0.00 C ATOM 248 CZ PHE A 16 1.234 7.402 -8.359 1.00 0.00 C ATOM 0 H PHE A 16 -2.406 10.001 -12.911 1.00 0.00 H new ATOM 0 HA PHE A 16 -2.754 7.976 -10.849 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -1.037 10.165 -11.432 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.923 10.623 -9.991 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -0.482 7.418 -11.301 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -0.530 10.301 -8.114 1.00 0.00 H new ATOM 0 HE1 PHE A 16 1.211 6.090 -10.073 1.00 0.00 H new ATOM 0 HE2 PHE A 16 1.250 9.024 -6.943 1.00 0.00 H new ATOM 0 HZ PHE A 16 1.885 6.769 -7.774 1.00 0.00 H new ATOM 258 N ASP A 17 -4.414 10.809 -10.793 1.00 0.00 N ATOM 259 CA ASP A 17 -5.531 11.595 -10.317 1.00 0.00 C ATOM 260 C ASP A 17 -6.830 10.904 -10.722 1.00 0.00 C ATOM 261 O ASP A 17 -7.679 10.589 -9.889 1.00 0.00 O ATOM 262 CB ASP A 17 -5.407 13.004 -10.923 1.00 0.00 C ATOM 263 CG ASP A 17 -4.053 13.683 -10.695 1.00 0.00 C ATOM 264 OD1 ASP A 17 -3.010 12.997 -10.838 1.00 0.00 O ATOM 265 OD2 ASP A 17 -4.070 14.884 -10.364 1.00 0.00 O ATOM 0 H ASP A 17 -3.821 11.342 -11.429 1.00 0.00 H new ATOM 0 HA ASP A 17 -5.533 11.684 -9.231 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -5.590 12.941 -11.996 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.190 13.635 -10.503 1.00 0.00 H new ATOM 270 N ASP A 18 -6.947 10.645 -12.025 1.00 0.00 N ATOM 271 CA ASP A 18 -8.108 10.020 -12.633 1.00 0.00 C ATOM 272 C ASP A 18 -8.457 8.681 -11.977 1.00 0.00 C ATOM 273 O ASP A 18 -9.616 8.439 -11.652 1.00 0.00 O ATOM 274 CB ASP A 18 -7.883 9.871 -14.136 1.00 0.00 C ATOM 275 CG ASP A 18 -8.987 9.010 -14.723 1.00 0.00 C ATOM 276 OD1 ASP A 18 -10.081 9.588 -14.920 1.00 0.00 O ATOM 277 OD2 ASP A 18 -8.724 7.800 -14.892 1.00 0.00 O ATOM 0 H ASP A 18 -6.215 10.872 -12.698 1.00 0.00 H new ATOM 0 HA ASP A 18 -8.969 10.668 -12.469 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.877 10.851 -14.614 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -6.911 9.417 -14.327 1.00 0.00 H new ATOM 282 N TYR A 19 -7.461 7.819 -11.750 1.00 0.00 N ATOM 283 CA TYR A 19 -7.708 6.527 -11.122 1.00 0.00 C ATOM 284 C TYR A 19 -8.411 6.729 -9.775 1.00 0.00 C ATOM 285 O TYR A 19 -9.452 6.126 -9.516 1.00 0.00 O ATOM 286 CB TYR A 19 -6.390 5.752 -11.001 1.00 0.00 C ATOM 287 CG TYR A 19 -6.519 4.269 -10.699 1.00 0.00 C ATOM 288 CD1 TYR A 19 -6.673 3.346 -11.752 1.00 0.00 C ATOM 289 CD2 TYR A 19 -6.335 3.795 -9.388 1.00 0.00 C ATOM 290 CE1 TYR A 19 -6.665 1.965 -11.491 1.00 0.00 C ATOM 291 CE2 TYR A 19 -6.313 2.414 -9.133 1.00 0.00 C ATOM 292 CZ TYR A 19 -6.512 1.498 -10.174 1.00 0.00 C ATOM 293 OH TYR A 19 -6.539 0.166 -9.875 1.00 0.00 O ATOM 0 H TYR A 19 -6.486 7.994 -11.991 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.376 5.926 -11.739 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -5.836 5.867 -11.933 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -5.791 6.212 -10.216 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -6.798 3.701 -12.764 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -6.210 4.495 -8.575 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -6.777 1.262 -12.303 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.142 2.056 -8.128 1.00 0.00 H new ATOM 0 HH TYR A 19 -7.458 -0.104 -9.669 1.00 0.00 H new ATOM 303 N MET A 20 -7.870 7.611 -8.927 1.00 0.00 N ATOM 304 CA MET A 20 -8.492 7.932 -7.649 1.00 0.00 C ATOM 305 C MET A 20 -9.882 8.554 -7.821 1.00 0.00 C ATOM 306 O MET A 20 -10.784 8.216 -7.049 1.00 0.00 O ATOM 307 CB MET A 20 -7.549 8.791 -6.797 1.00 0.00 C ATOM 308 CG MET A 20 -6.375 7.937 -6.299 1.00 0.00 C ATOM 309 SD MET A 20 -5.638 8.496 -4.740 1.00 0.00 S ATOM 310 CE MET A 20 -4.631 7.040 -4.353 1.00 0.00 C ATOM 0 H MET A 20 -7.001 8.113 -9.108 1.00 0.00 H new ATOM 0 HA MET A 20 -8.660 7.001 -7.107 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.177 9.630 -7.384 1.00 0.00 H new ATOM 0 HB3 MET A 20 -8.091 9.211 -5.949 1.00 0.00 H new ATOM 0 HG2 MET A 20 -6.718 6.910 -6.175 1.00 0.00 H new ATOM 0 HG3 MET A 20 -5.601 7.924 -7.067 1.00 0.00 H new ATOM 0 HE1 MET A 20 -4.099 7.204 -3.416 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.276 6.167 -4.256 1.00 0.00 H new ATOM 0 HE3 MET A 20 -3.911 6.872 -5.154 1.00 0.00 H new ATOM 320 N LYS A 21 -10.070 9.382 -8.856 1.00 0.00 N ATOM 321 CA LYS A 21 -11.355 9.946 -9.281 1.00 0.00 C ATOM 322 C LYS A 21 -12.289 8.862 -9.861 1.00 0.00 C ATOM 323 O LYS A 21 -12.920 9.057 -10.896 1.00 0.00 O ATOM 324 CB LYS A 21 -11.064 11.060 -10.308 1.00 0.00 C ATOM 325 CG LYS A 21 -12.248 11.967 -10.695 1.00 0.00 C ATOM 326 CD LYS A 21 -12.568 11.880 -12.200 1.00 0.00 C ATOM 327 CE LYS A 21 -11.456 12.457 -13.095 1.00 0.00 C ATOM 328 NZ LYS A 21 -11.361 11.747 -14.392 1.00 0.00 N ATOM 0 H LYS A 21 -9.296 9.690 -9.445 1.00 0.00 H new ATOM 0 HA LYS A 21 -11.881 10.363 -8.422 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.268 11.690 -9.911 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.680 10.595 -11.216 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.128 11.681 -10.119 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -12.016 12.999 -10.432 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -12.736 10.837 -12.469 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -13.497 12.414 -12.398 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -11.648 13.515 -13.274 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -10.501 12.390 -12.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -10.879 12.354 -15.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -10.821 10.867 -14.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -12.316 11.521 -14.735 1.00 0.00 H new ATOM 342 N SER A 22 -12.425 7.723 -9.182 1.00 0.00 N ATOM 343 CA SER A 22 -13.354 6.657 -9.524 1.00 0.00 C ATOM 344 C SER A 22 -13.488 5.708 -8.333 1.00 0.00 C ATOM 345 O SER A 22 -14.588 5.272 -8.006 1.00 0.00 O ATOM 346 CB SER A 22 -12.924 5.920 -10.802 1.00 0.00 C ATOM 347 OG SER A 22 -11.755 5.145 -10.607 1.00 0.00 O ATOM 0 H SER A 22 -11.871 7.514 -8.352 1.00 0.00 H new ATOM 0 HA SER A 22 -14.331 7.089 -9.739 1.00 0.00 H new ATOM 0 HB2 SER A 22 -13.735 5.273 -11.136 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.748 6.646 -11.596 1.00 0.00 H new ATOM 0 HG SER A 22 -11.056 5.702 -10.205 1.00 0.00 H new ATOM 353 N LEU A 23 -12.368 5.404 -7.666 1.00 0.00 N ATOM 354 CA LEU A 23 -12.374 4.535 -6.495 1.00 0.00 C ATOM 355 C LEU A 23 -13.169 5.150 -5.339 1.00 0.00 C ATOM 356 O LEU A 23 -13.743 4.424 -4.531 1.00 0.00 O ATOM 357 CB LEU A 23 -10.950 4.245 -6.018 1.00 0.00 C ATOM 358 CG LEU A 23 -9.953 3.754 -7.074 1.00 0.00 C ATOM 359 CD1 LEU A 23 -8.752 3.150 -6.346 1.00 0.00 C ATOM 360 CD2 LEU A 23 -10.543 2.715 -8.026 1.00 0.00 C ATOM 0 H LEU A 23 -11.444 5.752 -7.923 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.853 3.604 -6.799 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.550 5.155 -5.570 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.003 3.497 -5.227 1.00 0.00 H new ATOM 0 HG LEU A 23 -9.669 4.609 -7.688 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -8.026 2.792 -7.076 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.289 3.909 -5.716 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.084 2.317 -5.726 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -9.785 2.410 -8.747 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -10.872 1.846 -7.457 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.393 3.147 -8.554 1.00 0.00 H new ATOM 372 N GLY A 24 -13.160 6.483 -5.228 1.00 0.00 N ATOM 373 CA GLY A 24 -13.881 7.203 -4.182 1.00 0.00 C ATOM 374 C GLY A 24 -13.013 7.471 -2.951 1.00 0.00 C ATOM 375 O GLY A 24 -13.534 7.748 -1.876 1.00 0.00 O ATOM 0 H GLY A 24 -12.649 7.092 -5.866 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.243 8.151 -4.581 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -14.757 6.626 -3.886 1.00 0.00 H new ATOM 379 N VAL A 25 -11.687 7.418 -3.106 1.00 0.00 N ATOM 380 CA VAL A 25 -10.757 8.012 -2.147 1.00 0.00 C ATOM 381 C VAL A 25 -10.899 9.537 -2.193 1.00 0.00 C ATOM 382 O VAL A 25 -10.826 10.203 -1.164 1.00 0.00 O ATOM 383 CB VAL A 25 -9.313 7.536 -2.417 1.00 0.00 C ATOM 384 CG1 VAL A 25 -9.028 7.268 -3.894 1.00 0.00 C ATOM 385 CG2 VAL A 25 -8.248 8.491 -1.855 1.00 0.00 C ATOM 0 H VAL A 25 -11.231 6.963 -3.897 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.999 7.683 -1.137 1.00 0.00 H new ATOM 0 HB VAL A 25 -9.243 6.589 -1.882 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -7.996 6.937 -4.011 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -9.701 6.493 -4.260 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -9.183 8.183 -4.466 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -7.255 8.100 -2.078 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.362 9.474 -2.313 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.370 8.577 -0.775 1.00 0.00 H new ATOM 395 N GLY A 26 -11.083 10.088 -3.395 1.00 0.00 N ATOM 396 CA GLY A 26 -11.221 11.513 -3.622 1.00 0.00 C ATOM 397 C GLY A 26 -10.721 11.815 -5.028 1.00 0.00 C ATOM 398 O GLY A 26 -10.988 11.049 -5.949 1.00 0.00 O ATOM 0 H GLY A 26 -11.140 9.536 -4.251 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -12.262 11.817 -3.514 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.647 12.074 -2.884 1.00 0.00 H new ATOM 402 N PHE A 27 -9.977 12.910 -5.187 1.00 0.00 N ATOM 403 CA PHE A 27 -9.422 13.335 -6.465 1.00 0.00 C ATOM 404 C PHE A 27 -8.364 14.403 -6.189 1.00 0.00 C ATOM 405 O PHE A 27 -7.170 14.122 -6.283 1.00 0.00 O ATOM 406 CB PHE A 27 -10.554 13.822 -7.388 1.00 0.00 C ATOM 407 CG PHE A 27 -10.131 14.701 -8.552 1.00 0.00 C ATOM 408 CD1 PHE A 27 -9.123 14.279 -9.439 1.00 0.00 C ATOM 409 CD2 PHE A 27 -10.743 15.956 -8.740 1.00 0.00 C ATOM 410 CE1 PHE A 27 -8.739 15.104 -10.511 1.00 0.00 C ATOM 411 CE2 PHE A 27 -10.341 16.787 -9.799 1.00 0.00 C ATOM 412 CZ PHE A 27 -9.339 16.361 -10.684 1.00 0.00 C ATOM 0 H PHE A 27 -9.741 13.535 -4.416 1.00 0.00 H new ATOM 0 HA PHE A 27 -8.938 12.510 -6.988 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -11.072 12.950 -7.787 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -11.276 14.373 -6.785 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -8.644 13.321 -9.296 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -11.524 16.280 -8.068 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -7.980 14.770 -11.203 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -10.803 17.754 -9.932 1.00 0.00 H new ATOM 0 HZ PHE A 27 -9.030 17.000 -11.498 1.00 0.00 H new ATOM 422 N ALA A 28 -8.812 15.597 -5.782 1.00 0.00 N ATOM 423 CA ALA A 28 -7.988 16.785 -5.569 1.00 0.00 C ATOM 424 C ALA A 28 -6.664 16.479 -4.867 1.00 0.00 C ATOM 425 O ALA A 28 -5.618 16.935 -5.313 1.00 0.00 O ATOM 426 CB ALA A 28 -8.791 17.824 -4.784 1.00 0.00 C ATOM 0 H ALA A 28 -9.799 15.765 -5.585 1.00 0.00 H new ATOM 0 HA ALA A 28 -7.723 17.181 -6.549 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -8.179 18.712 -4.623 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -9.684 18.096 -5.348 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.084 17.406 -3.821 1.00 0.00 H new ATOM 432 N THR A 29 -6.714 15.689 -3.790 1.00 0.00 N ATOM 433 CA THR A 29 -5.592 15.162 -3.020 1.00 0.00 C ATOM 434 C THR A 29 -4.372 14.785 -3.872 1.00 0.00 C ATOM 435 O THR A 29 -3.227 14.947 -3.440 1.00 0.00 O ATOM 436 CB THR A 29 -6.126 13.932 -2.271 1.00 0.00 C ATOM 437 OG1 THR A 29 -7.440 14.211 -1.808 1.00 0.00 O ATOM 438 CG2 THR A 29 -5.218 13.495 -1.115 1.00 0.00 C ATOM 0 H THR A 29 -7.608 15.381 -3.408 1.00 0.00 H new ATOM 0 HA THR A 29 -5.228 15.938 -2.346 1.00 0.00 H new ATOM 0 HB THR A 29 -6.144 13.094 -2.968 1.00 0.00 H new ATOM 0 HG1 THR A 29 -7.791 13.431 -1.330 1.00 0.00 H new ATOM 0 HG21 THR A 29 -5.648 12.622 -0.625 1.00 0.00 H new ATOM 0 HG22 THR A 29 -4.231 13.244 -1.503 1.00 0.00 H new ATOM 0 HG23 THR A 29 -5.129 14.308 -0.395 1.00 0.00 H new ATOM 446 N ARG A 30 -4.586 14.263 -5.081 1.00 0.00 N ATOM 447 CA ARG A 30 -3.475 13.898 -5.941 1.00 0.00 C ATOM 448 C ARG A 30 -2.518 15.072 -6.192 1.00 0.00 C ATOM 449 O ARG A 30 -1.336 14.829 -6.398 1.00 0.00 O ATOM 450 CB ARG A 30 -3.962 13.267 -7.249 1.00 0.00 C ATOM 451 CG ARG A 30 -3.214 11.956 -7.515 1.00 0.00 C ATOM 452 CD ARG A 30 -3.904 10.768 -6.837 1.00 0.00 C ATOM 453 NE ARG A 30 -3.046 9.570 -6.859 1.00 0.00 N ATOM 454 CZ ARG A 30 -2.188 9.207 -5.890 1.00 0.00 C ATOM 455 NH1 ARG A 30 -2.092 9.933 -4.774 1.00 0.00 N ATOM 456 NH2 ARG A 30 -1.440 8.109 -6.026 1.00 0.00 N ATOM 0 H ARG A 30 -5.509 14.088 -5.477 1.00 0.00 H new ATOM 0 HA ARG A 30 -2.899 13.141 -5.409 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -5.034 13.078 -7.193 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -3.803 13.959 -8.076 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -3.157 11.780 -8.589 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -2.190 12.040 -7.151 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -4.147 11.025 -5.806 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -4.845 10.554 -7.343 1.00 0.00 H new ATOM 0 HE ARG A 30 -3.108 8.966 -7.678 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -2.670 10.765 -4.655 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -1.440 9.656 -4.040 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -1.518 7.540 -6.869 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -0.791 7.839 -5.287 1.00 0.00 H new ATOM 470 N GLN A 31 -2.982 16.323 -6.095 1.00 0.00 N ATOM 471 CA GLN A 31 -2.132 17.511 -6.152 1.00 0.00 C ATOM 472 C GLN A 31 -0.869 17.377 -5.293 1.00 0.00 C ATOM 473 O GLN A 31 0.191 17.867 -5.681 1.00 0.00 O ATOM 474 CB GLN A 31 -2.951 18.764 -5.794 1.00 0.00 C ATOM 475 CG GLN A 31 -3.467 18.814 -4.342 1.00 0.00 C ATOM 476 CD GLN A 31 -2.460 19.328 -3.316 1.00 0.00 C ATOM 477 OE1 GLN A 31 -1.412 19.867 -3.656 1.00 0.00 O ATOM 478 NE2 GLN A 31 -2.771 19.149 -2.036 1.00 0.00 N ATOM 0 H GLN A 31 -3.972 16.538 -5.973 1.00 0.00 H new ATOM 0 HA GLN A 31 -1.775 17.617 -7.176 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -2.336 19.645 -5.975 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -3.805 18.827 -6.469 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -4.353 19.449 -4.309 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -3.782 17.812 -4.050 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -3.650 18.697 -1.783 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -2.131 19.463 -1.307 1.00 0.00 H new ATOM 487 N VAL A 32 -0.977 16.709 -4.137 1.00 0.00 N ATOM 488 CA VAL A 32 0.179 16.330 -3.335 1.00 0.00 C ATOM 489 C VAL A 32 0.598 14.898 -3.687 1.00 0.00 C ATOM 490 O VAL A 32 1.780 14.616 -3.897 1.00 0.00 O ATOM 491 CB VAL A 32 -0.100 16.566 -1.837 1.00 0.00 C ATOM 492 CG1 VAL A 32 -1.354 15.870 -1.299 1.00 0.00 C ATOM 493 CG2 VAL A 32 1.103 16.183 -0.965 1.00 0.00 C ATOM 0 H VAL A 32 -1.870 16.419 -3.737 1.00 0.00 H new ATOM 0 HA VAL A 32 1.034 16.965 -3.568 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.283 17.639 -1.772 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -1.468 16.094 -0.238 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.229 16.227 -1.841 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -1.258 14.793 -1.434 1.00 0.00 H new ATOM 0 HG21 VAL A 32 0.865 16.364 0.083 1.00 0.00 H new ATOM 0 HG22 VAL A 32 1.334 15.127 -1.107 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.966 16.785 -1.251 1.00 0.00 H new ATOM 503 N GLY A 33 -0.376 13.989 -3.779 1.00 0.00 N ATOM 504 CA GLY A 33 -0.125 12.559 -3.878 1.00 0.00 C ATOM 505 C GLY A 33 0.414 12.066 -5.230 1.00 0.00 C ATOM 506 O GLY A 33 0.679 10.870 -5.350 1.00 0.00 O ATOM 0 H GLY A 33 -1.367 14.232 -3.786 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.587 12.280 -3.101 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.054 12.031 -3.664 1.00 0.00 H new ATOM 510 N ASN A 34 0.550 12.937 -6.236 1.00 0.00 N ATOM 511 CA ASN A 34 1.257 12.684 -7.496 1.00 0.00 C ATOM 512 C ASN A 34 2.547 13.506 -7.578 1.00 0.00 C ATOM 513 O ASN A 34 3.239 13.447 -8.590 1.00 0.00 O ATOM 514 CB ASN A 34 0.358 12.947 -8.728 1.00 0.00 C ATOM 515 CG ASN A 34 -0.037 14.405 -8.981 1.00 0.00 C ATOM 516 OD1 ASN A 34 0.629 15.337 -8.542 1.00 0.00 O ATOM 517 ND2 ASN A 34 -1.140 14.619 -9.694 1.00 0.00 N ATOM 0 H ASN A 34 0.154 13.876 -6.193 1.00 0.00 H new ATOM 0 HA ASN A 34 1.522 11.627 -7.507 1.00 0.00 H new ATOM 0 HB2 ASN A 34 0.873 12.574 -9.613 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -0.554 12.360 -8.618 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -1.447 15.573 -9.885 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -1.679 13.829 -10.049 1.00 0.00 H new ATOM 524 N MET A 35 2.856 14.282 -6.532 1.00 0.00 N ATOM 525 CA MET A 35 3.804 15.379 -6.590 1.00 0.00 C ATOM 526 C MET A 35 4.937 15.126 -5.600 1.00 0.00 C ATOM 527 O MET A 35 6.102 15.042 -5.988 1.00 0.00 O ATOM 528 CB MET A 35 3.015 16.658 -6.288 1.00 0.00 C ATOM 529 CG MET A 35 3.789 17.964 -6.457 1.00 0.00 C ATOM 530 SD MET A 35 2.729 19.431 -6.281 1.00 0.00 S ATOM 531 CE MET A 35 1.873 19.422 -7.880 1.00 0.00 C ATOM 0 H MET A 35 2.441 14.155 -5.609 1.00 0.00 H new ATOM 0 HA MET A 35 4.274 15.476 -7.569 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.141 16.687 -6.939 1.00 0.00 H new ATOM 0 HB3 MET A 35 2.648 16.604 -5.263 1.00 0.00 H new ATOM 0 HG2 MET A 35 4.588 18.007 -5.717 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.262 17.978 -7.439 1.00 0.00 H new ATOM 0 HE1 MET A 35 2.057 20.364 -8.397 1.00 0.00 H new ATOM 0 HE2 MET A 35 2.245 18.596 -8.487 1.00 0.00 H new ATOM 0 HE3 MET A 35 0.802 19.300 -7.719 1.00 0.00 H new ATOM 541 N THR A 36 4.609 14.993 -4.313 1.00 0.00 N ATOM 542 CA THR A 36 5.618 14.787 -3.286 1.00 0.00 C ATOM 543 C THR A 36 6.080 13.328 -3.292 1.00 0.00 C ATOM 544 O THR A 36 5.679 12.557 -2.418 1.00 0.00 O ATOM 545 CB THR A 36 5.091 15.247 -1.921 1.00 0.00 C ATOM 546 OG1 THR A 36 4.584 16.560 -2.037 1.00 0.00 O ATOM 547 CG2 THR A 36 6.230 15.254 -0.896 1.00 0.00 C ATOM 0 H THR A 36 3.652 15.025 -3.963 1.00 0.00 H new ATOM 0 HA THR A 36 6.495 15.397 -3.501 1.00 0.00 H new ATOM 0 HB THR A 36 4.307 14.564 -1.594 1.00 0.00 H new ATOM 0 HG1 THR A 36 4.244 16.858 -1.167 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.848 15.582 0.071 1.00 0.00 H new ATOM 0 HG22 THR A 36 6.641 14.249 -0.802 1.00 0.00 H new ATOM 0 HG23 THR A 36 7.013 15.936 -1.227 1.00 0.00 H new ATOM 555 N LYS A 37 6.916 12.995 -4.289 1.00 0.00 N ATOM 556 CA LYS A 37 7.616 11.728 -4.517 1.00 0.00 C ATOM 557 C LYS A 37 7.218 10.626 -3.527 1.00 0.00 C ATOM 558 O LYS A 37 7.964 10.370 -2.575 1.00 0.00 O ATOM 559 CB LYS A 37 9.137 11.957 -4.493 1.00 0.00 C ATOM 560 CG LYS A 37 9.629 12.734 -5.721 1.00 0.00 C ATOM 561 CD LYS A 37 11.165 12.781 -5.733 1.00 0.00 C ATOM 562 CE LYS A 37 11.676 13.411 -7.037 1.00 0.00 C ATOM 563 NZ LYS A 37 13.153 13.430 -7.111 1.00 0.00 N ATOM 0 H LYS A 37 7.137 13.670 -5.021 1.00 0.00 H new ATOM 0 HA LYS A 37 7.313 11.372 -5.502 1.00 0.00 H new ATOM 0 HB2 LYS A 37 9.406 12.503 -3.589 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.646 10.994 -4.447 1.00 0.00 H new ATOM 0 HG2 LYS A 37 9.264 12.259 -6.632 1.00 0.00 H new ATOM 0 HG3 LYS A 37 9.226 13.747 -5.706 1.00 0.00 H new ATOM 0 HD2 LYS A 37 11.523 13.357 -4.880 1.00 0.00 H new ATOM 0 HD3 LYS A 37 11.566 11.773 -5.628 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.279 12.855 -7.886 1.00 0.00 H new ATOM 0 HE3 LYS A 37 11.297 14.430 -7.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 13.450 13.864 -8.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 13.533 13.983 -6.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 13.516 12.457 -7.061 1.00 0.00 H new ATOM 577 N PRO A 38 6.050 9.987 -3.723 1.00 0.00 N ATOM 578 CA PRO A 38 5.531 9.042 -2.761 1.00 0.00 C ATOM 579 C PRO A 38 6.545 7.925 -2.541 1.00 0.00 C ATOM 580 O PRO A 38 7.004 7.266 -3.478 1.00 0.00 O ATOM 581 CB PRO A 38 4.170 8.572 -3.283 1.00 0.00 C ATOM 582 CG PRO A 38 4.194 8.947 -4.763 1.00 0.00 C ATOM 583 CD PRO A 38 5.113 10.168 -4.819 1.00 0.00 C ATOM 0 HA PRO A 38 5.376 9.482 -1.776 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.038 7.499 -3.145 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.350 9.064 -2.760 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.577 8.131 -5.376 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.195 9.181 -5.132 1.00 0.00 H new ATOM 0 HD2 PRO A 38 5.632 10.227 -5.776 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.547 11.093 -4.705 1.00 0.00 H new ATOM 591 N THR A 39 6.935 7.780 -1.278 1.00 0.00 N ATOM 592 CA THR A 39 7.878 6.788 -0.827 1.00 0.00 C ATOM 593 C THR A 39 7.103 5.519 -0.493 1.00 0.00 C ATOM 594 O THR A 39 5.890 5.540 -0.275 1.00 0.00 O ATOM 595 CB THR A 39 8.683 7.385 0.336 1.00 0.00 C ATOM 596 OG1 THR A 39 9.413 8.481 -0.172 1.00 0.00 O ATOM 597 CG2 THR A 39 9.714 6.418 0.890 1.00 0.00 C ATOM 0 H THR A 39 6.587 8.373 -0.525 1.00 0.00 H new ATOM 0 HA THR A 39 8.608 6.508 -1.586 1.00 0.00 H new ATOM 0 HB THR A 39 7.978 7.646 1.125 1.00 0.00 H new ATOM 0 HG1 THR A 39 9.538 9.147 0.536 1.00 0.00 H new ATOM 0 HG21 THR A 39 10.254 6.892 1.710 1.00 0.00 H new ATOM 0 HG22 THR A 39 9.213 5.522 1.256 1.00 0.00 H new ATOM 0 HG23 THR A 39 10.417 6.145 0.103 1.00 0.00 H new ATOM 605 N THR A 40 7.789 4.385 -0.557 1.00 0.00 N ATOM 606 CA THR A 40 7.185 3.077 -0.456 1.00 0.00 C ATOM 607 C THR A 40 8.216 2.183 0.226 1.00 0.00 C ATOM 608 O THR A 40 9.058 1.563 -0.418 1.00 0.00 O ATOM 609 CB THR A 40 6.703 2.683 -1.860 1.00 0.00 C ATOM 610 OG1 THR A 40 5.491 3.385 -2.106 1.00 0.00 O ATOM 611 CG2 THR A 40 6.434 1.197 -2.067 1.00 0.00 C ATOM 0 H THR A 40 8.801 4.356 -0.683 1.00 0.00 H new ATOM 0 HA THR A 40 6.289 3.005 0.161 1.00 0.00 H new ATOM 0 HB THR A 40 7.512 2.937 -2.545 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.282 3.352 -3.063 1.00 0.00 H new ATOM 0 HG21 THR A 40 6.099 1.027 -3.090 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.349 0.633 -1.886 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.661 0.867 -1.373 1.00 0.00 H new ATOM 619 N ILE A 41 8.171 2.177 1.560 1.00 0.00 N ATOM 620 CA ILE A 41 8.922 1.237 2.379 1.00 0.00 C ATOM 621 C ILE A 41 8.223 -0.105 2.203 1.00 0.00 C ATOM 622 O ILE A 41 7.036 -0.179 2.511 1.00 0.00 O ATOM 623 CB ILE A 41 8.910 1.690 3.853 1.00 0.00 C ATOM 624 CG1 ILE A 41 9.658 3.022 4.039 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.536 0.614 4.753 1.00 0.00 C ATOM 626 CD1 ILE A 41 9.263 3.746 5.330 1.00 0.00 C ATOM 0 H ILE A 41 7.606 2.831 2.102 1.00 0.00 H new ATOM 0 HA ILE A 41 9.969 1.175 2.083 1.00 0.00 H new ATOM 0 HB ILE A 41 7.869 1.839 4.141 1.00 0.00 H new ATOM 0 HG12 ILE A 41 10.731 2.833 4.047 1.00 0.00 H new ATOM 0 HG13 ILE A 41 9.455 3.670 3.187 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.519 0.951 5.789 1.00 0.00 H new ATOM 0 HG22 ILE A 41 8.967 -0.311 4.663 1.00 0.00 H new ATOM 0 HG23 ILE A 41 10.567 0.438 4.446 1.00 0.00 H new ATOM 0 HD11 ILE A 41 9.821 4.679 5.409 1.00 0.00 H new ATOM 0 HD12 ILE A 41 8.195 3.963 5.314 1.00 0.00 H new ATOM 0 HD13 ILE A 41 9.492 3.112 6.187 1.00 0.00 H new ATOM 638 N ILE A 42 8.916 -1.131 1.696 1.00 0.00 N ATOM 639 CA ILE A 42 8.389 -2.483 1.568 1.00 0.00 C ATOM 640 C ILE A 42 9.234 -3.403 2.453 1.00 0.00 C ATOM 641 O ILE A 42 10.361 -3.767 2.110 1.00 0.00 O ATOM 642 CB ILE A 42 8.366 -2.928 0.098 1.00 0.00 C ATOM 643 CG1 ILE A 42 7.493 -1.991 -0.751 1.00 0.00 C ATOM 644 CG2 ILE A 42 7.825 -4.362 0.008 1.00 0.00 C ATOM 645 CD1 ILE A 42 7.471 -2.351 -2.243 1.00 0.00 C ATOM 0 H ILE A 42 9.874 -1.037 1.359 1.00 0.00 H new ATOM 0 HA ILE A 42 7.353 -2.526 1.904 1.00 0.00 H new ATOM 0 HB ILE A 42 9.384 -2.889 -0.291 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.473 -2.011 -0.366 1.00 0.00 H new ATOM 0 HG13 ILE A 42 7.856 -0.969 -0.638 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.808 -4.680 -1.035 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.468 -5.030 0.580 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.814 -4.396 0.414 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.835 -1.646 -2.778 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.483 -2.302 -2.644 1.00 0.00 H new ATOM 0 HD13 ILE A 42 7.079 -3.360 -2.368 1.00 0.00 H new ATOM 657 N GLU A 43 8.668 -3.763 3.604 1.00 0.00 N ATOM 658 CA GLU A 43 9.261 -4.636 4.597 1.00 0.00 C ATOM 659 C GLU A 43 8.802 -6.072 4.325 1.00 0.00 C ATOM 660 O GLU A 43 7.672 -6.283 3.880 1.00 0.00 O ATOM 661 CB GLU A 43 8.785 -4.155 5.972 1.00 0.00 C ATOM 662 CG GLU A 43 9.494 -4.847 7.137 1.00 0.00 C ATOM 663 CD GLU A 43 8.854 -4.423 8.449 1.00 0.00 C ATOM 664 OE1 GLU A 43 7.743 -4.936 8.711 1.00 0.00 O ATOM 665 OE2 GLU A 43 9.468 -3.588 9.144 1.00 0.00 O ATOM 0 H GLU A 43 7.741 -3.435 3.875 1.00 0.00 H new ATOM 0 HA GLU A 43 10.350 -4.613 4.560 1.00 0.00 H new ATOM 0 HB2 GLU A 43 8.944 -3.079 6.047 1.00 0.00 H new ATOM 0 HB3 GLU A 43 7.712 -4.326 6.057 1.00 0.00 H new ATOM 0 HG2 GLU A 43 9.431 -5.929 7.023 1.00 0.00 H new ATOM 0 HG3 GLU A 43 10.553 -4.588 7.137 1.00 0.00 H new ATOM 672 N VAL A 44 9.665 -7.051 4.609 1.00 0.00 N ATOM 673 CA VAL A 44 9.319 -8.467 4.624 1.00 0.00 C ATOM 674 C VAL A 44 9.303 -8.930 6.080 1.00 0.00 C ATOM 675 O VAL A 44 10.136 -8.500 6.877 1.00 0.00 O ATOM 676 CB VAL A 44 10.294 -9.272 3.745 1.00 0.00 C ATOM 677 CG1 VAL A 44 11.698 -9.392 4.351 1.00 0.00 C ATOM 678 CG2 VAL A 44 9.748 -10.677 3.457 1.00 0.00 C ATOM 0 H VAL A 44 10.643 -6.873 4.839 1.00 0.00 H new ATOM 0 HA VAL A 44 8.330 -8.634 4.197 1.00 0.00 H new ATOM 0 HB VAL A 44 10.382 -8.709 2.816 1.00 0.00 H new ATOM 0 HG11 VAL A 44 12.335 -9.971 3.682 1.00 0.00 H new ATOM 0 HG12 VAL A 44 12.122 -8.397 4.486 1.00 0.00 H new ATOM 0 HG13 VAL A 44 11.636 -9.894 5.317 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.457 -11.222 2.834 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.604 -11.211 4.396 1.00 0.00 H new ATOM 0 HG23 VAL A 44 8.794 -10.597 2.935 1.00 0.00 H new ATOM 688 N ASN A 45 8.356 -9.800 6.428 1.00 0.00 N ATOM 689 CA ASN A 45 8.274 -10.459 7.723 1.00 0.00 C ATOM 690 C ASN A 45 8.142 -11.954 7.446 1.00 0.00 C ATOM 691 O ASN A 45 7.833 -12.326 6.316 1.00 0.00 O ATOM 692 CB ASN A 45 7.064 -9.967 8.532 1.00 0.00 C ATOM 693 CG ASN A 45 6.741 -8.483 8.363 1.00 0.00 C ATOM 694 OD1 ASN A 45 5.643 -8.139 7.931 1.00 0.00 O ATOM 695 ND2 ASN A 45 7.682 -7.612 8.708 1.00 0.00 N ATOM 0 H ASN A 45 7.604 -10.071 5.795 1.00 0.00 H new ATOM 0 HA ASN A 45 9.162 -10.235 8.314 1.00 0.00 H new ATOM 0 HB2 ASN A 45 6.190 -10.550 8.242 1.00 0.00 H new ATOM 0 HB3 ASN A 45 7.245 -10.167 9.588 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.508 -6.611 8.619 1.00 0.00 H new ATOM 0 HD22 ASN A 45 8.579 -7.944 9.062 1.00 0.00 H new ATOM 702 N GLY A 46 8.353 -12.786 8.474 1.00 0.00 N ATOM 703 CA GLY A 46 8.361 -14.249 8.426 1.00 0.00 C ATOM 704 C GLY A 46 7.738 -14.859 7.169 1.00 0.00 C ATOM 705 O GLY A 46 8.450 -15.421 6.339 1.00 0.00 O ATOM 0 H GLY A 46 8.533 -12.433 9.414 1.00 0.00 H new ATOM 0 HA2 GLY A 46 9.392 -14.594 8.506 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.829 -14.629 9.298 1.00 0.00 H new ATOM 709 N ASP A 47 6.414 -14.740 7.039 1.00 0.00 N ATOM 710 CA ASP A 47 5.631 -15.225 5.913 1.00 0.00 C ATOM 711 C ASP A 47 4.681 -14.120 5.417 1.00 0.00 C ATOM 712 O ASP A 47 3.558 -14.404 5.002 1.00 0.00 O ATOM 713 CB ASP A 47 4.848 -16.458 6.391 1.00 0.00 C ATOM 714 CG ASP A 47 3.754 -16.075 7.377 1.00 0.00 C ATOM 715 OD1 ASP A 47 3.926 -15.065 8.101 1.00 0.00 O ATOM 716 OD2 ASP A 47 2.657 -16.671 7.316 1.00 0.00 O ATOM 0 H ASP A 47 5.840 -14.283 7.748 1.00 0.00 H new ATOM 0 HA ASP A 47 6.276 -15.498 5.077 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.405 -16.964 5.533 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.532 -17.165 6.861 1.00 0.00 H new ATOM 721 N THR A 48 5.108 -12.855 5.470 1.00 0.00 N ATOM 722 CA THR A 48 4.255 -11.701 5.197 1.00 0.00 C ATOM 723 C THR A 48 5.108 -10.599 4.565 1.00 0.00 C ATOM 724 O THR A 48 6.330 -10.613 4.680 1.00 0.00 O ATOM 725 CB THR A 48 3.636 -11.198 6.517 1.00 0.00 C ATOM 726 OG1 THR A 48 3.190 -12.257 7.340 1.00 0.00 O ATOM 727 CG2 THR A 48 2.445 -10.256 6.346 1.00 0.00 C ATOM 0 H THR A 48 6.068 -12.603 5.707 1.00 0.00 H new ATOM 0 HA THR A 48 3.452 -11.979 4.514 1.00 0.00 H new ATOM 0 HB THR A 48 4.461 -10.652 6.975 1.00 0.00 H new ATOM 0 HG1 THR A 48 2.807 -11.891 8.165 1.00 0.00 H new ATOM 0 HG21 THR A 48 2.076 -9.954 7.326 1.00 0.00 H new ATOM 0 HG22 THR A 48 2.757 -9.373 5.788 1.00 0.00 H new ATOM 0 HG23 THR A 48 1.652 -10.768 5.801 1.00 0.00 H new ATOM 735 N VAL A 49 4.470 -9.618 3.933 1.00 0.00 N ATOM 736 CA VAL A 49 5.097 -8.362 3.548 1.00 0.00 C ATOM 737 C VAL A 49 4.263 -7.231 4.153 1.00 0.00 C ATOM 738 O VAL A 49 3.068 -7.405 4.382 1.00 0.00 O ATOM 739 CB VAL A 49 5.209 -8.321 2.010 1.00 0.00 C ATOM 740 CG1 VAL A 49 5.350 -6.915 1.406 1.00 0.00 C ATOM 741 CG2 VAL A 49 6.404 -9.170 1.559 1.00 0.00 C ATOM 0 H VAL A 49 3.486 -9.677 3.671 1.00 0.00 H new ATOM 0 HA VAL A 49 6.113 -8.253 3.927 1.00 0.00 H new ATOM 0 HB VAL A 49 4.263 -8.718 1.643 1.00 0.00 H new ATOM 0 HG11 VAL A 49 5.422 -6.991 0.321 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.479 -6.316 1.671 1.00 0.00 H new ATOM 0 HG13 VAL A 49 6.250 -6.440 1.797 1.00 0.00 H new ATOM 0 HG21 VAL A 49 6.482 -9.140 0.472 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.319 -8.774 1.999 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.262 -10.201 1.884 1.00 0.00 H new ATOM 751 N ILE A 50 4.876 -6.077 4.408 1.00 0.00 N ATOM 752 CA ILE A 50 4.191 -4.847 4.786 1.00 0.00 C ATOM 753 C ILE A 50 4.698 -3.769 3.839 1.00 0.00 C ATOM 754 O ILE A 50 5.889 -3.743 3.536 1.00 0.00 O ATOM 755 CB ILE A 50 4.444 -4.530 6.279 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.295 -5.125 7.112 1.00 0.00 C ATOM 757 CG2 ILE A 50 4.565 -3.024 6.562 1.00 0.00 C ATOM 758 CD1 ILE A 50 3.594 -5.163 8.614 1.00 0.00 C ATOM 0 H ILE A 50 5.889 -5.971 4.356 1.00 0.00 H new ATOM 0 HA ILE A 50 3.108 -4.925 4.692 1.00 0.00 H new ATOM 0 HB ILE A 50 5.400 -4.976 6.554 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.391 -4.539 6.943 1.00 0.00 H new ATOM 0 HG13 ILE A 50 3.089 -6.137 6.764 1.00 0.00 H new ATOM 0 HG21 ILE A 50 4.742 -2.867 7.626 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.397 -2.612 5.991 1.00 0.00 H new ATOM 0 HG23 ILE A 50 3.642 -2.524 6.270 1.00 0.00 H new ATOM 0 HD11 ILE A 50 2.744 -5.593 9.143 1.00 0.00 H new ATOM 0 HD12 ILE A 50 4.480 -5.773 8.793 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.771 -4.150 8.975 1.00 0.00 H new ATOM 770 N ILE A 51 3.807 -2.898 3.356 1.00 0.00 N ATOM 771 CA ILE A 51 4.187 -1.730 2.579 1.00 0.00 C ATOM 772 C ILE A 51 3.601 -0.480 3.223 1.00 0.00 C ATOM 773 O ILE A 51 2.432 -0.491 3.606 1.00 0.00 O ATOM 774 CB ILE A 51 3.824 -1.912 1.094 1.00 0.00 C ATOM 775 CG1 ILE A 51 4.153 -0.671 0.243 1.00 0.00 C ATOM 776 CG2 ILE A 51 2.386 -2.374 0.862 1.00 0.00 C ATOM 777 CD1 ILE A 51 3.028 0.365 0.113 1.00 0.00 C ATOM 0 H ILE A 51 2.801 -2.990 3.497 1.00 0.00 H new ATOM 0 HA ILE A 51 5.270 -1.606 2.588 1.00 0.00 H new ATOM 0 HB ILE A 51 4.466 -2.724 0.754 1.00 0.00 H new ATOM 0 HG12 ILE A 51 5.026 -0.180 0.673 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.434 -1.003 -0.757 1.00 0.00 H new ATOM 0 HG21 ILE A 51 2.206 -2.480 -0.208 1.00 0.00 H new ATOM 0 HG22 ILE A 51 2.229 -3.334 1.353 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.696 -1.638 1.275 1.00 0.00 H new ATOM 0 HD11 ILE A 51 3.368 1.195 -0.506 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.157 -0.100 -0.349 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.759 0.736 1.102 1.00 0.00 H new ATOM 789 N LYS A 52 4.409 0.581 3.343 1.00 0.00 N ATOM 790 CA LYS A 52 3.966 1.901 3.770 1.00 0.00 C ATOM 791 C LYS A 52 4.029 2.885 2.606 1.00 0.00 C ATOM 792 O LYS A 52 5.109 3.345 2.238 1.00 0.00 O ATOM 793 CB LYS A 52 4.766 2.392 4.990 1.00 0.00 C ATOM 794 CG LYS A 52 4.079 1.854 6.244 1.00 0.00 C ATOM 795 CD LYS A 52 4.642 2.372 7.577 1.00 0.00 C ATOM 796 CE LYS A 52 3.558 2.016 8.602 1.00 0.00 C ATOM 797 NZ LYS A 52 3.774 2.464 9.989 1.00 0.00 N ATOM 0 H LYS A 52 5.408 0.538 3.140 1.00 0.00 H new ATOM 0 HA LYS A 52 2.925 1.832 4.087 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.796 2.041 4.938 1.00 0.00 H new ATOM 0 HB3 LYS A 52 4.801 3.481 5.011 1.00 0.00 H new ATOM 0 HG2 LYS A 52 3.020 2.106 6.194 1.00 0.00 H new ATOM 0 HG3 LYS A 52 4.149 0.766 6.238 1.00 0.00 H new ATOM 0 HD2 LYS A 52 5.592 1.897 7.820 1.00 0.00 H new ATOM 0 HD3 LYS A 52 4.822 3.447 7.543 1.00 0.00 H new ATOM 0 HE2 LYS A 52 2.613 2.434 8.255 1.00 0.00 H new ATOM 0 HE3 LYS A 52 3.443 0.932 8.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 2.862 2.506 10.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 4.403 1.794 10.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 4.210 3.408 9.985 1.00 0.00 H new ATOM 811 N THR A 53 2.856 3.216 2.062 1.00 0.00 N ATOM 812 CA THR A 53 2.654 4.298 1.117 1.00 0.00 C ATOM 813 C THR A 53 2.837 5.596 1.900 1.00 0.00 C ATOM 814 O THR A 53 2.001 5.922 2.741 1.00 0.00 O ATOM 815 CB THR A 53 1.231 4.188 0.547 1.00 0.00 C ATOM 816 OG1 THR A 53 1.055 2.948 -0.102 1.00 0.00 O ATOM 817 CG2 THR A 53 0.916 5.275 -0.479 1.00 0.00 C ATOM 0 H THR A 53 1.995 2.715 2.280 1.00 0.00 H new ATOM 0 HA THR A 53 3.355 4.264 0.283 1.00 0.00 H new ATOM 0 HB THR A 53 0.563 4.296 1.401 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.144 2.892 -0.458 1.00 0.00 H new ATOM 0 HG21 THR A 53 -0.102 5.145 -0.846 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.011 6.255 -0.012 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.614 5.201 -1.313 1.00 0.00 H new ATOM 825 N GLN A 54 3.946 6.301 1.669 1.00 0.00 N ATOM 826 CA GLN A 54 4.402 7.384 2.524 1.00 0.00 C ATOM 827 C GLN A 54 4.548 8.684 1.729 1.00 0.00 C ATOM 828 O GLN A 54 5.437 8.791 0.882 1.00 0.00 O ATOM 829 CB GLN A 54 5.711 6.916 3.175 1.00 0.00 C ATOM 830 CG GLN A 54 6.429 8.004 3.978 1.00 0.00 C ATOM 831 CD GLN A 54 7.323 7.380 5.041 1.00 0.00 C ATOM 832 OE1 GLN A 54 8.519 7.208 4.835 1.00 0.00 O ATOM 833 NE2 GLN A 54 6.738 7.027 6.182 1.00 0.00 N ATOM 0 H GLN A 54 4.557 6.129 0.870 1.00 0.00 H new ATOM 0 HA GLN A 54 3.677 7.614 3.305 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.497 6.074 3.833 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.381 6.550 2.397 1.00 0.00 H new ATOM 0 HG2 GLN A 54 7.027 8.623 3.309 1.00 0.00 H new ATOM 0 HG3 GLN A 54 5.697 8.659 4.449 1.00 0.00 H new ATOM 0 HE21 GLN A 54 5.739 7.187 6.314 1.00 0.00 H new ATOM 0 HE22 GLN A 54 7.288 6.596 6.925 1.00 0.00 H new ATOM 842 N SER A 55 3.705 9.686 2.016 1.00 0.00 N ATOM 843 CA SER A 55 3.873 11.050 1.527 1.00 0.00 C ATOM 844 C SER A 55 3.290 12.051 2.534 1.00 0.00 C ATOM 845 O SER A 55 2.631 11.667 3.502 1.00 0.00 O ATOM 846 CB SER A 55 3.250 11.211 0.136 1.00 0.00 C ATOM 847 OG SER A 55 3.690 12.427 -0.443 1.00 0.00 O ATOM 0 H SER A 55 2.879 9.564 2.602 1.00 0.00 H new ATOM 0 HA SER A 55 4.938 11.260 1.428 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.531 10.371 -0.499 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.163 11.204 0.210 1.00 0.00 H new ATOM 0 HG SER A 55 4.388 12.240 -1.105 1.00 0.00 H new ATOM 853 N THR A 56 3.551 13.342 2.315 1.00 0.00 N ATOM 854 CA THR A 56 3.453 14.398 3.326 1.00 0.00 C ATOM 855 C THR A 56 2.016 14.875 3.580 1.00 0.00 C ATOM 856 O THR A 56 1.785 16.068 3.775 1.00 0.00 O ATOM 857 CB THR A 56 4.377 15.565 2.925 1.00 0.00 C ATOM 858 OG1 THR A 56 4.446 16.504 3.971 1.00 0.00 O ATOM 859 CG2 THR A 56 3.912 16.310 1.665 1.00 0.00 C ATOM 0 H THR A 56 3.845 13.692 1.403 1.00 0.00 H new ATOM 0 HA THR A 56 3.780 13.977 4.277 1.00 0.00 H new ATOM 0 HB THR A 56 5.348 15.115 2.717 1.00 0.00 H new ATOM 0 HG1 THR A 56 3.542 16.703 4.292 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.609 17.118 1.442 1.00 0.00 H new ATOM 0 HG22 THR A 56 3.879 15.617 0.824 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.918 16.724 1.833 1.00 0.00 H new ATOM 867 N PHE A 57 1.038 13.970 3.571 1.00 0.00 N ATOM 868 CA PHE A 57 -0.368 14.350 3.659 1.00 0.00 C ATOM 869 C PHE A 57 -1.209 13.149 4.070 1.00 0.00 C ATOM 870 O PHE A 57 -2.107 13.261 4.900 1.00 0.00 O ATOM 871 CB PHE A 57 -0.838 14.921 2.311 1.00 0.00 C ATOM 872 CG PHE A 57 -1.895 16.004 2.420 1.00 0.00 C ATOM 873 CD1 PHE A 57 -3.260 15.671 2.486 1.00 0.00 C ATOM 874 CD2 PHE A 57 -1.508 17.357 2.389 1.00 0.00 C ATOM 875 CE1 PHE A 57 -4.233 16.685 2.482 1.00 0.00 C ATOM 876 CE2 PHE A 57 -2.482 18.369 2.376 1.00 0.00 C ATOM 877 CZ PHE A 57 -3.846 18.033 2.415 1.00 0.00 C ATOM 0 H PHE A 57 1.197 12.965 3.503 1.00 0.00 H new ATOM 0 HA PHE A 57 -0.488 15.122 4.419 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.025 15.325 1.781 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -1.232 14.106 1.703 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -3.561 14.635 2.540 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -0.460 17.618 2.375 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -5.281 16.427 2.531 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -2.182 19.406 2.336 1.00 0.00 H new ATOM 0 HZ PHE A 57 -4.595 18.810 2.393 1.00 0.00 H new ATOM 887 N LYS A 58 -0.922 11.992 3.468 1.00 0.00 N ATOM 888 CA LYS A 58 -1.498 10.716 3.850 1.00 0.00 C ATOM 889 C LYS A 58 -0.343 9.716 3.877 1.00 0.00 C ATOM 890 O LYS A 58 0.471 9.685 2.953 1.00 0.00 O ATOM 891 CB LYS A 58 -2.623 10.317 2.878 1.00 0.00 C ATOM 892 CG LYS A 58 -3.752 11.365 2.880 1.00 0.00 C ATOM 893 CD LYS A 58 -4.861 11.078 1.859 1.00 0.00 C ATOM 894 CE LYS A 58 -5.812 9.936 2.242 1.00 0.00 C ATOM 895 NZ LYS A 58 -6.751 10.291 3.326 1.00 0.00 N ATOM 0 H LYS A 58 -0.269 11.923 2.687 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.970 10.754 4.832 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.219 10.215 1.871 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.025 9.344 3.161 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.191 11.412 3.877 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.325 12.346 2.674 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.446 11.986 1.715 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -4.400 10.841 0.900 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -6.381 9.637 1.362 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.224 9.071 2.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.118 9.423 3.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.255 10.859 4.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -7.541 10.842 2.934 1.00 0.00 H new ATOM 909 N ASN A 59 -0.245 8.956 4.967 1.00 0.00 N ATOM 910 CA ASN A 59 0.699 7.867 5.155 1.00 0.00 C ATOM 911 C ASN A 59 -0.168 6.655 5.464 1.00 0.00 C ATOM 912 O ASN A 59 -0.955 6.725 6.407 1.00 0.00 O ATOM 913 CB ASN A 59 1.633 8.170 6.340 1.00 0.00 C ATOM 914 CG ASN A 59 3.057 8.510 5.914 1.00 0.00 C ATOM 915 OD1 ASN A 59 3.998 7.789 6.241 1.00 0.00 O ATOM 916 ND2 ASN A 59 3.253 9.611 5.193 1.00 0.00 N ATOM 0 H ASN A 59 -0.851 9.093 5.776 1.00 0.00 H new ATOM 0 HA ASN A 59 1.333 7.712 4.282 1.00 0.00 H new ATOM 0 HB2 ASN A 59 1.224 9.002 6.912 1.00 0.00 H new ATOM 0 HB3 ASN A 59 1.656 7.307 7.005 1.00 0.00 H new ATOM 0 HD21 ASN A 59 4.196 9.869 4.902 1.00 0.00 H new ATOM 0 HD22 ASN A 59 2.460 10.197 4.931 1.00 0.00 H new ATOM 923 N THR A 60 -0.079 5.589 4.670 1.00 0.00 N ATOM 924 CA THR A 60 -0.981 4.449 4.773 1.00 0.00 C ATOM 925 C THR A 60 -0.194 3.140 4.668 1.00 0.00 C ATOM 926 O THR A 60 0.626 2.971 3.763 1.00 0.00 O ATOM 927 CB THR A 60 -2.103 4.582 3.724 1.00 0.00 C ATOM 928 OG1 THR A 60 -1.595 5.114 2.507 1.00 0.00 O ATOM 929 CG2 THR A 60 -3.195 5.516 4.272 1.00 0.00 C ATOM 0 H THR A 60 0.623 5.494 3.936 1.00 0.00 H new ATOM 0 HA THR A 60 -1.464 4.433 5.750 1.00 0.00 H new ATOM 0 HB THR A 60 -2.517 3.594 3.524 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.335 5.464 1.969 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.992 5.615 3.535 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.602 5.099 5.193 1.00 0.00 H new ATOM 0 HG23 THR A 60 -2.766 6.497 4.476 1.00 0.00 H new ATOM 937 N GLU A 61 -0.417 2.236 5.632 1.00 0.00 N ATOM 938 CA GLU A 61 0.193 0.920 5.701 1.00 0.00 C ATOM 939 C GLU A 61 -0.778 -0.112 5.135 1.00 0.00 C ATOM 940 O GLU A 61 -1.957 -0.097 5.484 1.00 0.00 O ATOM 941 CB GLU A 61 0.616 0.557 7.140 1.00 0.00 C ATOM 942 CG GLU A 61 0.082 1.443 8.285 1.00 0.00 C ATOM 943 CD GLU A 61 0.800 1.133 9.598 1.00 0.00 C ATOM 944 OE1 GLU A 61 1.085 -0.057 9.835 1.00 0.00 O ATOM 945 OE2 GLU A 61 1.210 2.102 10.280 1.00 0.00 O ATOM 0 H GLU A 61 -1.052 2.417 6.409 1.00 0.00 H new ATOM 0 HA GLU A 61 1.104 0.926 5.102 1.00 0.00 H new ATOM 0 HB2 GLU A 61 0.302 -0.469 7.334 1.00 0.00 H new ATOM 0 HB3 GLU A 61 1.705 0.571 7.184 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.219 2.494 8.031 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -0.989 1.281 8.405 1.00 0.00 H new ATOM 952 N ILE A 62 -0.277 -1.007 4.281 1.00 0.00 N ATOM 953 CA ILE A 62 -1.017 -2.145 3.765 1.00 0.00 C ATOM 954 C ILE A 62 -0.155 -3.384 4.011 1.00 0.00 C ATOM 955 O ILE A 62 1.003 -3.437 3.590 1.00 0.00 O ATOM 956 CB ILE A 62 -1.372 -1.944 2.276 1.00 0.00 C ATOM 957 CG1 ILE A 62 -2.215 -0.674 2.038 1.00 0.00 C ATOM 958 CG2 ILE A 62 -2.152 -3.163 1.769 1.00 0.00 C ATOM 959 CD1 ILE A 62 -1.361 0.550 1.680 1.00 0.00 C ATOM 0 H ILE A 62 0.677 -0.953 3.925 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.974 -2.263 4.274 1.00 0.00 H new ATOM 0 HB ILE A 62 -0.435 -1.828 1.731 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.927 -0.862 1.234 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -2.796 -0.456 2.934 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -2.403 -3.023 0.718 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -1.540 -4.058 1.879 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.068 -3.276 2.349 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.009 1.413 1.524 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -0.667 0.760 2.494 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -0.800 0.348 0.768 1.00 0.00 H new ATOM 971 N SER A 63 -0.702 -4.369 4.725 1.00 0.00 N ATOM 972 CA SER A 63 -0.080 -5.659 4.946 1.00 0.00 C ATOM 973 C SER A 63 -0.305 -6.549 3.721 1.00 0.00 C ATOM 974 O SER A 63 -1.179 -6.282 2.903 1.00 0.00 O ATOM 975 CB SER A 63 -0.691 -6.255 6.217 1.00 0.00 C ATOM 976 OG SER A 63 -2.092 -6.042 6.198 1.00 0.00 O ATOM 0 H SER A 63 -1.614 -4.281 5.174 1.00 0.00 H new ATOM 0 HA SER A 63 0.998 -5.570 5.081 1.00 0.00 H new ATOM 0 HB2 SER A 63 -0.473 -7.321 6.276 1.00 0.00 H new ATOM 0 HB3 SER A 63 -0.251 -5.791 7.100 1.00 0.00 H new ATOM 0 HG SER A 63 -2.497 -6.594 5.497 1.00 0.00 H new ATOM 982 N PHE A 64 0.517 -7.588 3.569 1.00 0.00 N ATOM 983 CA PHE A 64 0.520 -8.499 2.436 1.00 0.00 C ATOM 984 C PHE A 64 0.767 -9.916 2.951 1.00 0.00 C ATOM 985 O PHE A 64 1.907 -10.382 2.976 1.00 0.00 O ATOM 986 CB PHE A 64 1.586 -8.063 1.417 1.00 0.00 C ATOM 987 CG PHE A 64 1.094 -7.115 0.341 1.00 0.00 C ATOM 988 CD1 PHE A 64 0.853 -5.759 0.622 1.00 0.00 C ATOM 989 CD2 PHE A 64 0.872 -7.602 -0.957 1.00 0.00 C ATOM 990 CE1 PHE A 64 0.365 -4.907 -0.384 1.00 0.00 C ATOM 991 CE2 PHE A 64 0.418 -6.746 -1.970 1.00 0.00 C ATOM 992 CZ PHE A 64 0.165 -5.396 -1.686 1.00 0.00 C ATOM 0 H PHE A 64 1.226 -7.823 4.264 1.00 0.00 H new ATOM 0 HA PHE A 64 -0.442 -8.479 1.924 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.406 -7.586 1.953 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.994 -8.953 0.937 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.043 -5.371 1.612 1.00 0.00 H new ATOM 0 HD2 PHE A 64 1.052 -8.644 -1.177 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.143 -3.875 -0.156 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.263 -7.126 -2.969 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.182 -4.734 -2.466 1.00 0.00 H new ATOM 1002 N LYS A 65 -0.305 -10.605 3.352 1.00 0.00 N ATOM 1003 CA LYS A 65 -0.279 -12.035 3.620 1.00 0.00 C ATOM 1004 C LYS A 65 -0.368 -12.762 2.274 1.00 0.00 C ATOM 1005 O LYS A 65 -1.454 -12.975 1.739 1.00 0.00 O ATOM 1006 CB LYS A 65 -1.427 -12.398 4.581 1.00 0.00 C ATOM 1007 CG LYS A 65 -1.458 -13.875 5.016 1.00 0.00 C ATOM 1008 CD LYS A 65 -0.743 -14.186 6.337 1.00 0.00 C ATOM 1009 CE LYS A 65 0.741 -13.828 6.283 1.00 0.00 C ATOM 1010 NZ LYS A 65 1.489 -14.341 7.444 1.00 0.00 N ATOM 0 H LYS A 65 -1.219 -10.178 3.499 1.00 0.00 H new ATOM 0 HA LYS A 65 0.644 -12.341 4.113 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.350 -11.773 5.470 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.375 -12.154 4.102 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -2.498 -14.189 5.103 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.007 -14.478 4.228 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.220 -13.633 7.146 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.852 -15.246 6.567 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.175 -14.231 5.368 1.00 0.00 H new ATOM 0 HE3 LYS A 65 0.848 -12.744 6.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.440 -13.920 7.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 0.986 -14.091 8.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 1.570 -15.376 7.375 1.00 0.00 H new ATOM 1024 N LEU A 66 0.790 -13.109 1.712 1.00 0.00 N ATOM 1025 CA LEU A 66 0.885 -13.806 0.438 1.00 0.00 C ATOM 1026 C LEU A 66 0.043 -15.090 0.406 1.00 0.00 C ATOM 1027 O LEU A 66 0.375 -16.073 1.063 1.00 0.00 O ATOM 1028 CB LEU A 66 2.354 -14.058 0.066 1.00 0.00 C ATOM 1029 CG LEU A 66 3.183 -14.736 1.176 1.00 0.00 C ATOM 1030 CD1 LEU A 66 3.868 -15.995 0.635 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.259 -13.782 1.706 1.00 0.00 C ATOM 0 H LEU A 66 1.696 -12.910 2.137 1.00 0.00 H new ATOM 0 HA LEU A 66 0.458 -13.156 -0.326 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.388 -14.680 -0.828 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.820 -13.106 -0.190 1.00 0.00 H new ATOM 0 HG LEU A 66 2.503 -15.003 1.985 1.00 0.00 H new ATOM 0 HD11 LEU A 66 4.449 -16.463 1.429 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.113 -16.695 0.278 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.530 -15.724 -0.188 1.00 0.00 H new ATOM 0 HD21 LEU A 66 4.833 -14.279 2.488 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.926 -13.497 0.892 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.785 -12.890 2.115 1.00 0.00 H new ATOM 1043 N GLY A 67 -1.032 -15.082 -0.388 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.848 -16.250 -0.690 1.00 0.00 C ATOM 1045 C GLY A 67 -3.103 -16.311 0.177 1.00 0.00 C ATOM 1046 O GLY A 67 -3.601 -17.401 0.448 1.00 0.00 O ATOM 0 H GLY A 67 -1.364 -14.235 -0.849 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.134 -16.230 -1.741 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.258 -17.154 -0.538 1.00 0.00 H new ATOM 1050 N VAL A 68 -3.612 -15.157 0.621 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.715 -15.047 1.568 1.00 0.00 C ATOM 1052 C VAL A 68 -5.467 -13.745 1.276 1.00 0.00 C ATOM 1053 O VAL A 68 -4.910 -12.833 0.658 1.00 0.00 O ATOM 1054 CB VAL A 68 -4.147 -15.087 3.006 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -5.179 -14.796 4.100 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -3.524 -16.452 3.328 1.00 0.00 C ATOM 0 H VAL A 68 -3.254 -14.251 0.320 1.00 0.00 H new ATOM 0 HA VAL A 68 -5.416 -15.876 1.469 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.399 -14.294 3.013 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.697 -14.844 5.077 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -5.597 -13.801 3.950 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.978 -15.536 4.053 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.135 -16.443 4.346 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.283 -17.229 3.236 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.711 -16.654 2.631 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.726 -13.663 1.728 1.00 0.00 N ATOM 1067 CA GLU A 69 -7.496 -12.433 1.774 1.00 0.00 C ATOM 1068 C GLU A 69 -7.671 -11.973 3.224 1.00 0.00 C ATOM 1069 O GLU A 69 -7.851 -12.792 4.124 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.831 -12.593 1.040 1.00 0.00 C ATOM 1071 CG GLU A 69 -9.802 -13.636 1.615 1.00 0.00 C ATOM 1072 CD GLU A 69 -11.207 -13.426 1.062 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -11.322 -13.002 -0.105 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -12.165 -13.566 1.855 1.00 0.00 O ATOM 0 H GLU A 69 -7.239 -14.472 2.077 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.948 -11.650 1.250 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.334 -11.626 1.030 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.622 -12.855 0.003 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.455 -14.639 1.368 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.819 -13.564 2.702 1.00 0.00 H new ATOM 1081 N PHE A 70 -7.588 -10.664 3.456 1.00 0.00 N ATOM 1082 CA PHE A 70 -7.681 -10.050 4.774 1.00 0.00 C ATOM 1083 C PHE A 70 -8.167 -8.616 4.582 1.00 0.00 C ATOM 1084 O PHE A 70 -8.058 -8.084 3.477 1.00 0.00 O ATOM 1085 CB PHE A 70 -6.314 -10.107 5.474 1.00 0.00 C ATOM 1086 CG PHE A 70 -5.162 -9.586 4.634 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -4.558 -10.421 3.676 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -4.790 -8.232 4.713 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -3.636 -9.896 2.759 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -3.835 -7.717 3.824 1.00 0.00 C ATOM 1091 CZ PHE A 70 -3.276 -8.542 2.835 1.00 0.00 C ATOM 0 H PHE A 70 -7.450 -9.984 2.708 1.00 0.00 H new ATOM 0 HA PHE A 70 -8.385 -10.584 5.412 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.367 -9.529 6.397 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.106 -11.139 5.756 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.806 -11.472 3.647 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.239 -7.590 5.457 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.205 -10.530 1.998 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -3.529 -6.684 3.900 1.00 0.00 H new ATOM 0 HZ PHE A 70 -2.567 -8.133 2.131 1.00 0.00 H new ATOM 1101 N ASP A 71 -8.757 -8.008 5.615 1.00 0.00 N ATOM 1102 CA ASP A 71 -9.303 -6.662 5.493 1.00 0.00 C ATOM 1103 C ASP A 71 -8.179 -5.629 5.388 1.00 0.00 C ATOM 1104 O ASP A 71 -7.097 -5.820 5.943 1.00 0.00 O ATOM 1105 CB ASP A 71 -10.247 -6.343 6.655 1.00 0.00 C ATOM 1106 CG ASP A 71 -11.019 -5.064 6.365 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -10.522 -3.978 6.729 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -12.116 -5.190 5.776 1.00 0.00 O ATOM 0 H ASP A 71 -8.866 -8.427 6.538 1.00 0.00 H new ATOM 0 HA ASP A 71 -9.887 -6.615 4.574 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -10.941 -7.169 6.807 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -9.677 -6.232 7.577 1.00 0.00 H new ATOM 1113 N GLU A 72 -8.447 -4.554 4.654 1.00 0.00 N ATOM 1114 CA GLU A 72 -7.562 -3.442 4.386 1.00 0.00 C ATOM 1115 C GLU A 72 -8.412 -2.180 4.565 1.00 0.00 C ATOM 1116 O GLU A 72 -9.023 -1.679 3.624 1.00 0.00 O ATOM 1117 CB GLU A 72 -6.980 -3.652 2.980 1.00 0.00 C ATOM 1118 CG GLU A 72 -6.121 -2.521 2.397 1.00 0.00 C ATOM 1119 CD GLU A 72 -5.666 -2.873 0.983 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -5.021 -3.932 0.831 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -5.991 -2.121 0.042 1.00 0.00 O ATOM 0 H GLU A 72 -9.354 -4.435 4.202 1.00 0.00 H new ATOM 0 HA GLU A 72 -6.705 -3.353 5.053 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.376 -4.559 2.997 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.809 -3.833 2.296 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.692 -1.593 2.382 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.253 -2.350 3.033 1.00 0.00 H new ATOM 1128 N THR A 73 -8.485 -1.695 5.806 1.00 0.00 N ATOM 1129 CA THR A 73 -9.097 -0.422 6.150 1.00 0.00 C ATOM 1130 C THR A 73 -8.014 0.650 6.090 1.00 0.00 C ATOM 1131 O THR A 73 -7.263 0.807 7.051 1.00 0.00 O ATOM 1132 CB THR A 73 -9.774 -0.532 7.525 1.00 0.00 C ATOM 1133 OG1 THR A 73 -10.828 -1.475 7.472 1.00 0.00 O ATOM 1134 CG2 THR A 73 -10.403 0.796 7.955 1.00 0.00 C ATOM 0 H THR A 73 -8.110 -2.192 6.614 1.00 0.00 H new ATOM 0 HA THR A 73 -9.882 -0.144 5.447 1.00 0.00 H new ATOM 0 HB THR A 73 -8.999 -0.828 8.232 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.463 -2.363 7.276 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.872 0.677 8.932 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.630 1.562 8.014 1.00 0.00 H new ATOM 0 HG23 THR A 73 -11.156 1.095 7.226 1.00 0.00 H new ATOM 1142 N THR A 74 -7.921 1.367 4.963 1.00 0.00 N ATOM 1143 CA THR A 74 -6.884 2.361 4.724 1.00 0.00 C ATOM 1144 C THR A 74 -7.506 3.738 4.458 1.00 0.00 C ATOM 1145 O THR A 74 -8.526 3.867 3.778 1.00 0.00 O ATOM 1146 CB THR A 74 -5.934 1.865 3.625 1.00 0.00 C ATOM 1147 OG1 THR A 74 -4.871 2.779 3.463 1.00 0.00 O ATOM 1148 CG2 THR A 74 -6.626 1.592 2.288 1.00 0.00 C ATOM 0 H THR A 74 -8.575 1.267 4.186 1.00 0.00 H new ATOM 0 HA THR A 74 -6.271 2.494 5.615 1.00 0.00 H new ATOM 0 HB THR A 74 -5.547 0.901 3.957 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.183 3.558 2.957 1.00 0.00 H new ATOM 0 HG21 THR A 74 -5.891 1.245 1.562 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.391 0.827 2.424 1.00 0.00 H new ATOM 0 HG23 THR A 74 -7.090 2.509 1.925 1.00 0.00 H new ATOM 1156 N ALA A 75 -6.905 4.779 5.044 1.00 0.00 N ATOM 1157 CA ALA A 75 -7.479 6.117 5.119 1.00 0.00 C ATOM 1158 C ALA A 75 -7.482 6.854 3.778 1.00 0.00 C ATOM 1159 O ALA A 75 -8.027 7.956 3.692 1.00 0.00 O ATOM 1160 CB ALA A 75 -6.733 6.930 6.182 1.00 0.00 C ATOM 0 H ALA A 75 -5.989 4.709 5.486 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.527 6.004 5.398 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.160 7.931 6.240 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.828 6.438 7.150 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -5.679 7.000 5.913 1.00 0.00 H new ATOM 1166 N ASP A 76 -6.848 6.296 2.747 1.00 0.00 N ATOM 1167 CA ASP A 76 -7.014 6.697 1.364 1.00 0.00 C ATOM 1168 C ASP A 76 -8.087 5.805 0.747 1.00 0.00 C ATOM 1169 O ASP A 76 -9.209 6.256 0.527 1.00 0.00 O ATOM 1170 CB ASP A 76 -5.670 6.641 0.603 1.00 0.00 C ATOM 1171 CG ASP A 76 -4.769 5.462 0.963 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -5.310 4.476 1.510 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -3.545 5.585 0.744 1.00 0.00 O ATOM 0 H ASP A 76 -6.186 5.529 2.863 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.339 7.735 1.298 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -5.877 6.606 -0.467 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -5.125 7.566 0.792 1.00 0.00 H new ATOM 1178 N ASP A 77 -7.746 4.552 0.450 1.00 0.00 N ATOM 1179 CA ASP A 77 -8.521 3.717 -0.455 1.00 0.00 C ATOM 1180 C ASP A 77 -9.655 2.949 0.241 1.00 0.00 C ATOM 1181 O ASP A 77 -10.225 2.036 -0.353 1.00 0.00 O ATOM 1182 CB ASP A 77 -7.578 2.826 -1.283 1.00 0.00 C ATOM 1183 CG ASP A 77 -8.044 2.576 -2.715 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -9.155 3.024 -3.085 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -7.265 1.931 -3.447 1.00 0.00 O ATOM 0 H ASP A 77 -6.922 4.090 0.833 1.00 0.00 H new ATOM 0 HA ASP A 77 -9.048 4.371 -1.150 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.591 3.289 -1.310 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -7.467 1.867 -0.777 1.00 0.00 H new ATOM 1190 N ARG A 78 -10.041 3.368 1.454 1.00 0.00 N ATOM 1191 CA ARG A 78 -11.270 2.988 2.151 1.00 0.00 C ATOM 1192 C ARG A 78 -11.119 1.617 2.822 1.00 0.00 C ATOM 1193 O ARG A 78 -10.007 1.128 3.011 1.00 0.00 O ATOM 1194 CB ARG A 78 -12.508 3.058 1.228 1.00 0.00 C ATOM 1195 CG ARG A 78 -12.656 4.389 0.472 1.00 0.00 C ATOM 1196 CD ARG A 78 -13.627 4.252 -0.716 1.00 0.00 C ATOM 1197 NE ARG A 78 -13.209 3.207 -1.671 1.00 0.00 N ATOM 1198 CZ ARG A 78 -12.052 3.205 -2.351 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -11.301 4.305 -2.413 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -11.597 2.101 -2.948 1.00 0.00 N ATOM 0 H ARG A 78 -9.472 4.015 2.001 1.00 0.00 H new ATOM 0 HA ARG A 78 -11.441 3.719 2.941 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -12.453 2.246 0.503 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.404 2.892 1.827 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -13.018 5.159 1.154 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -11.681 4.716 0.112 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -14.624 4.019 -0.341 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -13.697 5.208 -1.236 1.00 0.00 H new ATOM 0 HE ARG A 78 -13.848 2.427 -1.826 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -11.604 5.157 -1.941 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -10.423 4.295 -2.932 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.132 1.234 -2.893 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -10.715 2.124 -3.459 1.00 0.00 H new ATOM 1214 N LYS A 79 -12.248 1.008 3.203 1.00 0.00 N ATOM 1215 CA LYS A 79 -12.315 -0.361 3.682 1.00 0.00 C ATOM 1216 C LYS A 79 -12.504 -1.284 2.486 1.00 0.00 C ATOM 1217 O LYS A 79 -13.577 -1.302 1.883 1.00 0.00 O ATOM 1218 CB LYS A 79 -13.436 -0.501 4.718 1.00 0.00 C ATOM 1219 CG LYS A 79 -13.468 -1.917 5.308 1.00 0.00 C ATOM 1220 CD LYS A 79 -14.521 -1.989 6.422 1.00 0.00 C ATOM 1221 CE LYS A 79 -14.473 -3.319 7.184 1.00 0.00 C ATOM 1222 NZ LYS A 79 -14.522 -4.484 6.283 1.00 0.00 N ATOM 0 H LYS A 79 -13.156 1.471 3.183 1.00 0.00 H new ATOM 0 HA LYS A 79 -11.389 -0.642 4.185 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -13.290 0.226 5.517 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -14.396 -0.276 4.253 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.700 -2.642 4.527 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.487 -2.179 5.704 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -14.364 -1.167 7.120 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -15.513 -1.856 5.990 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -13.561 -3.361 7.779 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -15.310 -3.366 7.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -14.841 -5.320 6.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -15.186 -4.294 5.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -13.574 -4.662 5.894 1.00 0.00 H new ATOM 1236 N VAL A 80 -11.465 -2.047 2.157 1.00 0.00 N ATOM 1237 CA VAL A 80 -11.468 -3.029 1.088 1.00 0.00 C ATOM 1238 C VAL A 80 -10.970 -4.352 1.673 1.00 0.00 C ATOM 1239 O VAL A 80 -10.456 -4.370 2.790 1.00 0.00 O ATOM 1240 CB VAL A 80 -10.600 -2.514 -0.076 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -10.943 -1.058 -0.428 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -9.104 -2.561 0.244 1.00 0.00 C ATOM 0 H VAL A 80 -10.571 -1.993 2.646 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.466 -3.193 0.681 1.00 0.00 H new ATOM 0 HB VAL A 80 -10.817 -3.177 -0.913 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -10.313 -0.725 -1.253 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -11.991 -0.992 -0.722 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -10.769 -0.423 0.441 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -8.538 -2.187 -0.609 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -8.899 -1.940 1.116 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -8.809 -3.589 0.453 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.111 -5.457 0.939 1.00 0.00 N ATOM 1253 CA LYS A 81 -10.480 -6.724 1.266 1.00 0.00 C ATOM 1254 C LYS A 81 -9.359 -6.976 0.258 1.00 0.00 C ATOM 1255 O LYS A 81 -9.512 -6.757 -0.943 1.00 0.00 O ATOM 1256 CB LYS A 81 -11.495 -7.877 1.307 1.00 0.00 C ATOM 1257 CG LYS A 81 -10.927 -8.994 2.196 1.00 0.00 C ATOM 1258 CD LYS A 81 -11.643 -10.338 2.055 1.00 0.00 C ATOM 1259 CE LYS A 81 -13.123 -10.305 2.450 1.00 0.00 C ATOM 1260 NZ LYS A 81 -13.640 -11.675 2.644 1.00 0.00 N ATOM 0 H LYS A 81 -11.676 -5.491 0.090 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.057 -6.674 2.269 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.449 -7.528 1.701 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.683 -8.252 0.301 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -9.872 -9.131 1.957 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -10.979 -8.675 3.237 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -11.562 -10.674 1.021 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.130 -11.077 2.671 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.247 -9.730 3.368 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.700 -9.799 1.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.532 -11.787 2.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -12.943 -12.362 2.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -13.809 -11.842 3.656 1.00 0.00 H new ATOM 1274 N SER A 82 -8.217 -7.406 0.778 1.00 0.00 N ATOM 1275 CA SER A 82 -6.946 -7.487 0.096 1.00 0.00 C ATOM 1276 C SER A 82 -6.639 -8.940 -0.243 1.00 0.00 C ATOM 1277 O SER A 82 -5.970 -9.609 0.541 1.00 0.00 O ATOM 1278 CB SER A 82 -5.914 -6.919 1.070 1.00 0.00 C ATOM 1279 OG SER A 82 -4.615 -7.008 0.537 1.00 0.00 O ATOM 0 H SER A 82 -8.157 -7.725 1.745 1.00 0.00 H new ATOM 0 HA SER A 82 -6.943 -6.931 -0.841 1.00 0.00 H new ATOM 0 HB2 SER A 82 -6.150 -5.878 1.289 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.962 -7.462 2.014 1.00 0.00 H new ATOM 0 HG SER A 82 -4.078 -7.618 1.085 1.00 0.00 H new ATOM 1285 N ILE A 83 -7.095 -9.430 -1.398 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.777 -10.782 -1.833 1.00 0.00 C ATOM 1287 C ILE A 83 -5.373 -10.746 -2.442 1.00 0.00 C ATOM 1288 O ILE A 83 -5.198 -10.237 -3.551 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.838 -11.309 -2.818 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -9.270 -10.980 -2.350 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -7.621 -12.814 -3.038 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -10.356 -11.673 -3.176 1.00 0.00 C ATOM 0 H ILE A 83 -7.685 -8.907 -2.045 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.788 -11.477 -0.993 1.00 0.00 H new ATOM 0 HB ILE A 83 -7.720 -10.801 -3.775 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.378 -11.271 -1.305 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -9.421 -9.902 -2.398 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -8.370 -13.192 -3.734 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -6.626 -12.982 -3.449 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.714 -13.338 -2.087 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -11.338 -11.397 -2.791 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -10.274 -11.363 -4.218 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -10.231 -12.754 -3.108 1.00 0.00 H new ATOM 1304 N VAL A 84 -4.367 -11.243 -1.714 1.00 0.00 N ATOM 1305 CA VAL A 84 -2.983 -11.243 -2.175 1.00 0.00 C ATOM 1306 C VAL A 84 -2.588 -12.650 -2.605 1.00 0.00 C ATOM 1307 O VAL A 84 -2.817 -13.603 -1.862 1.00 0.00 O ATOM 1308 CB VAL A 84 -2.036 -10.740 -1.075 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -0.567 -10.803 -1.519 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -2.361 -9.286 -0.730 1.00 0.00 C ATOM 0 H VAL A 84 -4.494 -11.655 -0.790 1.00 0.00 H new ATOM 0 HA VAL A 84 -2.900 -10.567 -3.026 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.178 -11.387 -0.209 1.00 0.00 H new ATOM 0 HG11 VAL A 84 0.072 -10.439 -0.715 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.302 -11.834 -1.755 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.427 -10.181 -2.403 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -1.685 -8.937 0.051 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -2.240 -8.666 -1.618 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -3.390 -9.217 -0.376 1.00 0.00 H new ATOM 1320 N THR A 85 -1.908 -12.772 -3.747 1.00 0.00 N ATOM 1321 CA THR A 85 -1.143 -13.963 -4.095 1.00 0.00 C ATOM 1322 C THR A 85 -0.008 -13.538 -5.030 1.00 0.00 C ATOM 1323 O THR A 85 0.309 -12.351 -5.101 1.00 0.00 O ATOM 1324 CB THR A 85 -2.063 -15.067 -4.655 1.00 0.00 C ATOM 1325 OG1 THR A 85 -1.317 -16.244 -4.879 1.00 0.00 O ATOM 1326 CG2 THR A 85 -2.770 -14.688 -5.958 1.00 0.00 C ATOM 0 H THR A 85 -1.875 -12.041 -4.458 1.00 0.00 H new ATOM 0 HA THR A 85 -0.688 -14.417 -3.215 1.00 0.00 H new ATOM 0 HB THR A 85 -2.835 -15.218 -3.901 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.906 -16.942 -5.233 1.00 0.00 H new ATOM 0 HG21 THR A 85 -3.397 -15.517 -6.286 1.00 0.00 H new ATOM 0 HG22 THR A 85 -3.390 -13.807 -5.793 1.00 0.00 H new ATOM 0 HG23 THR A 85 -2.027 -14.470 -6.725 1.00 0.00 H new ATOM 1334 N LEU A 86 0.601 -14.478 -5.750 1.00 0.00 N ATOM 1335 CA LEU A 86 1.573 -14.199 -6.792 1.00 0.00 C ATOM 1336 C LEU A 86 1.463 -15.261 -7.882 1.00 0.00 C ATOM 1337 O LEU A 86 1.016 -16.372 -7.594 1.00 0.00 O ATOM 1338 CB LEU A 86 2.983 -14.092 -6.183 1.00 0.00 C ATOM 1339 CG LEU A 86 3.605 -15.423 -5.720 1.00 0.00 C ATOM 1340 CD1 LEU A 86 4.214 -16.207 -6.896 1.00 0.00 C ATOM 1341 CD2 LEU A 86 4.704 -15.152 -4.683 1.00 0.00 C ATOM 0 H LEU A 86 0.425 -15.474 -5.619 1.00 0.00 H new ATOM 0 HA LEU A 86 1.368 -13.237 -7.261 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.645 -13.638 -6.920 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.942 -13.414 -5.331 1.00 0.00 H new ATOM 0 HG LEU A 86 2.807 -16.022 -5.281 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.643 -17.139 -6.529 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.437 -16.428 -7.627 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.995 -15.609 -7.366 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.140 -16.097 -4.359 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.479 -14.529 -5.129 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.274 -14.638 -3.823 1.00 0.00 H new ATOM 1353 N ASP A 87 1.866 -14.928 -9.111 1.00 0.00 N ATOM 1354 CA ASP A 87 1.921 -15.858 -10.233 1.00 0.00 C ATOM 1355 C ASP A 87 3.071 -15.465 -11.160 1.00 0.00 C ATOM 1356 O ASP A 87 3.407 -14.286 -11.262 1.00 0.00 O ATOM 1357 CB ASP A 87 0.584 -15.902 -10.986 1.00 0.00 C ATOM 1358 CG ASP A 87 0.397 -14.707 -11.913 1.00 0.00 C ATOM 1359 OD1 ASP A 87 0.848 -14.825 -13.073 1.00 0.00 O ATOM 1360 OD2 ASP A 87 -0.195 -13.710 -11.449 1.00 0.00 O ATOM 0 H ASP A 87 2.168 -13.985 -9.355 1.00 0.00 H new ATOM 0 HA ASP A 87 2.102 -16.863 -9.853 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.529 -16.822 -11.568 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -0.234 -15.931 -10.266 1.00 0.00 H new ATOM 1365 N GLY A 88 3.712 -16.456 -11.788 1.00 0.00 N ATOM 1366 CA GLY A 88 4.874 -16.263 -12.646 1.00 0.00 C ATOM 1367 C GLY A 88 6.053 -15.682 -11.861 1.00 0.00 C ATOM 1368 O GLY A 88 6.933 -16.416 -11.419 1.00 0.00 O ATOM 0 H GLY A 88 3.428 -17.432 -11.709 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.164 -17.216 -13.090 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.616 -15.594 -13.467 1.00 0.00 H new ATOM 1372 N GLY A 89 6.050 -14.361 -11.682 1.00 0.00 N ATOM 1373 CA GLY A 89 6.973 -13.629 -10.822 1.00 0.00 C ATOM 1374 C GLY A 89 6.362 -12.314 -10.323 1.00 0.00 C ATOM 1375 O GLY A 89 7.080 -11.452 -9.818 1.00 0.00 O ATOM 0 H GLY A 89 5.379 -13.751 -12.150 1.00 0.00 H new ATOM 0 HA2 GLY A 89 7.246 -14.250 -9.969 1.00 0.00 H new ATOM 0 HA3 GLY A 89 7.892 -13.419 -11.370 1.00 0.00 H new ATOM 1379 N LYS A 90 5.038 -12.166 -10.448 1.00 0.00 N ATOM 1380 CA LYS A 90 4.294 -10.959 -10.152 1.00 0.00 C ATOM 1381 C LYS A 90 3.440 -11.223 -8.923 1.00 0.00 C ATOM 1382 O LYS A 90 2.713 -12.212 -8.874 1.00 0.00 O ATOM 1383 CB LYS A 90 3.443 -10.567 -11.367 1.00 0.00 C ATOM 1384 CG LYS A 90 4.378 -10.146 -12.504 1.00 0.00 C ATOM 1385 CD LYS A 90 3.654 -9.703 -13.777 1.00 0.00 C ATOM 1386 CE LYS A 90 4.719 -9.051 -14.672 1.00 0.00 C ATOM 1387 NZ LYS A 90 4.229 -8.703 -16.016 1.00 0.00 N ATOM 0 H LYS A 90 4.439 -12.925 -10.774 1.00 0.00 H new ATOM 0 HA LYS A 90 4.964 -10.124 -9.944 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.821 -11.406 -11.680 1.00 0.00 H new ATOM 0 HB3 LYS A 90 2.769 -9.750 -11.109 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.011 -9.330 -12.156 1.00 0.00 H new ATOM 0 HG3 LYS A 90 5.037 -10.980 -12.745 1.00 0.00 H new ATOM 0 HD2 LYS A 90 3.192 -10.554 -14.278 1.00 0.00 H new ATOM 0 HD3 LYS A 90 2.856 -8.998 -13.545 1.00 0.00 H new ATOM 0 HE2 LYS A 90 5.088 -8.149 -14.184 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.566 -9.730 -14.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 4.998 -8.268 -16.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.902 -9.564 -16.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.440 -8.031 -15.934 1.00 0.00 H new ATOM 1401 N LEU A 91 3.559 -10.346 -7.929 1.00 0.00 N ATOM 1402 CA LEU A 91 2.833 -10.400 -6.676 1.00 0.00 C ATOM 1403 C LEU A 91 1.568 -9.565 -6.855 1.00 0.00 C ATOM 1404 O LEU A 91 1.650 -8.357 -7.071 1.00 0.00 O ATOM 1405 CB LEU A 91 3.783 -9.911 -5.577 1.00 0.00 C ATOM 1406 CG LEU A 91 3.130 -9.717 -4.203 1.00 0.00 C ATOM 1407 CD1 LEU A 91 4.071 -10.199 -3.100 1.00 0.00 C ATOM 1408 CD2 LEU A 91 2.913 -8.229 -3.950 1.00 0.00 C ATOM 0 H LEU A 91 4.192 -9.548 -7.983 1.00 0.00 H new ATOM 0 HA LEU A 91 2.510 -11.399 -6.383 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.600 -10.626 -5.478 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.224 -8.965 -5.891 1.00 0.00 H new ATOM 0 HG LEU A 91 2.193 -10.273 -4.195 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.597 -10.056 -2.129 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.290 -11.257 -3.245 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.999 -9.628 -3.138 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.449 -8.090 -2.974 1.00 0.00 H new ATOM 0 HD22 LEU A 91 3.873 -7.712 -3.973 1.00 0.00 H new ATOM 0 HD23 LEU A 91 2.262 -7.820 -4.723 1.00 0.00 H new ATOM 1420 N VAL A 92 0.403 -10.216 -6.838 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.862 -9.628 -7.244 1.00 0.00 C ATOM 1422 C VAL A 92 -1.694 -9.302 -6.002 1.00 0.00 C ATOM 1423 O VAL A 92 -1.817 -10.132 -5.101 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.591 -10.545 -8.250 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -0.615 -11.157 -9.269 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -2.378 -11.682 -7.589 1.00 0.00 C ATOM 0 H VAL A 92 0.318 -11.186 -6.534 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.688 -8.689 -7.770 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.302 -9.890 -8.754 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.164 -11.796 -9.960 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.122 -10.360 -9.825 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.134 -11.750 -8.744 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.863 -12.284 -8.358 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.697 -12.309 -7.013 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.134 -11.263 -6.925 1.00 0.00 H new ATOM 1436 N HIS A 93 -2.249 -8.087 -5.959 1.00 0.00 N ATOM 1437 CA HIS A 93 -3.184 -7.605 -4.954 1.00 0.00 C ATOM 1438 C HIS A 93 -4.501 -7.340 -5.674 1.00 0.00 C ATOM 1439 O HIS A 93 -4.640 -6.300 -6.321 1.00 0.00 O ATOM 1440 CB HIS A 93 -2.617 -6.318 -4.339 1.00 0.00 C ATOM 1441 CG HIS A 93 -3.491 -5.581 -3.346 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -3.706 -4.210 -3.312 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -3.939 -6.095 -2.160 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -4.257 -3.904 -2.124 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -4.402 -5.031 -1.409 1.00 0.00 N ATOM 0 H HIS A 93 -2.043 -7.380 -6.665 1.00 0.00 H new ATOM 0 HA HIS A 93 -3.340 -8.324 -4.149 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.678 -6.566 -3.844 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -2.377 -5.632 -5.152 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -3.932 -7.134 -1.866 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -4.537 -2.913 -1.798 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -4.790 -5.092 -0.468 1.00 0.00 H new ATOM 1454 N VAL A 94 -5.443 -8.281 -5.581 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.812 -8.081 -6.024 1.00 0.00 C ATOM 1456 C VAL A 94 -7.551 -7.461 -4.838 1.00 0.00 C ATOM 1457 O VAL A 94 -7.820 -8.117 -3.830 1.00 0.00 O ATOM 1458 CB VAL A 94 -7.425 -9.396 -6.532 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -8.884 -9.181 -6.948 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -6.657 -9.936 -7.742 1.00 0.00 C ATOM 0 H VAL A 94 -5.269 -9.208 -5.192 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.881 -7.410 -6.880 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.367 -10.115 -5.715 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -9.303 -10.122 -7.305 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -9.459 -8.830 -6.091 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.930 -8.438 -7.744 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -7.115 -10.866 -8.078 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.688 -9.204 -8.549 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -5.620 -10.122 -7.461 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.791 -6.157 -4.936 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.320 -5.324 -3.878 1.00 0.00 C ATOM 1472 C GLN A 95 -9.831 -5.218 -4.099 1.00 0.00 C ATOM 1473 O GLN A 95 -10.275 -4.433 -4.935 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.582 -3.986 -3.984 1.00 0.00 C ATOM 1475 CG GLN A 95 -7.784 -3.053 -2.795 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.042 -1.741 -3.042 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -5.899 -1.748 -3.497 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -7.711 -0.617 -2.822 1.00 0.00 N ATOM 0 H GLN A 95 -7.612 -5.636 -5.795 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.171 -5.715 -2.871 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.516 -4.182 -4.098 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.911 -3.476 -4.889 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -8.847 -2.860 -2.648 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -7.417 -3.524 -1.883 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.658 -0.653 -2.444 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -7.279 0.283 -3.031 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.605 -6.056 -3.404 1.00 0.00 N ATOM 1488 CA LYS A 96 -12.038 -6.244 -3.595 1.00 0.00 C ATOM 1489 C LYS A 96 -12.793 -5.568 -2.460 1.00 0.00 C ATOM 1490 O LYS A 96 -12.591 -5.934 -1.308 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.340 -7.751 -3.631 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.833 -8.053 -3.858 1.00 0.00 C ATOM 1493 CD LYS A 96 -14.150 -9.553 -3.717 1.00 0.00 C ATOM 1494 CE LYS A 96 -13.536 -10.426 -4.822 1.00 0.00 C ATOM 1495 NZ LYS A 96 -14.154 -10.186 -6.140 1.00 0.00 N ATOM 0 H LYS A 96 -10.229 -6.646 -2.661 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.358 -5.796 -4.536 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.755 -8.216 -4.425 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.021 -8.204 -2.692 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.429 -7.488 -3.141 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.124 -7.714 -4.852 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.788 -9.901 -2.750 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.232 -9.688 -3.720 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -12.466 -10.228 -4.885 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.651 -11.477 -4.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -13.493 -10.472 -6.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -15.030 -10.741 -6.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -14.375 -9.175 -6.241 1.00 0.00 H new ATOM 1509 N TRP A 97 -13.687 -4.625 -2.769 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.574 -4.051 -1.766 1.00 0.00 C ATOM 1511 C TRP A 97 -15.975 -4.623 -1.927 1.00 0.00 C ATOM 1512 O TRP A 97 -16.395 -5.478 -1.151 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.535 -2.519 -1.798 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.408 -1.816 -3.117 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.423 -1.248 -3.801 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.193 -1.431 -3.828 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -14.925 -0.499 -4.842 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.550 -0.531 -4.875 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -11.821 -1.715 -3.673 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.594 0.116 -5.668 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -10.854 -1.097 -4.484 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.235 -0.147 -5.443 1.00 0.00 C ATOM 0 H TRP A 97 -13.812 -4.246 -3.708 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.225 -4.331 -0.772 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.446 -2.158 -1.321 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -13.700 -2.199 -1.174 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.471 -1.364 -3.566 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.503 0.016 -5.506 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.507 -2.420 -2.917 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -12.899 0.807 -6.441 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -9.812 -1.355 -4.368 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.482 0.382 -6.008 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.701 -4.154 -2.938 1.00 0.00 N ATOM 1534 CA ASN A 98 -18.081 -4.529 -3.181 1.00 0.00 C ATOM 1535 C ASN A 98 -18.428 -4.140 -4.606 1.00 0.00 C ATOM 1536 O ASN A 98 -17.975 -3.100 -5.091 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.035 -3.880 -2.164 1.00 0.00 C ATOM 1538 CG ASN A 98 -18.858 -2.373 -1.964 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -18.623 -1.922 -0.848 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -18.972 -1.563 -3.013 1.00 0.00 N ATOM 0 H ASN A 98 -16.335 -3.491 -3.621 1.00 0.00 H new ATOM 0 HA ASN A 98 -18.199 -5.605 -3.054 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.060 -4.069 -2.482 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -18.904 -4.375 -1.202 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -18.864 -0.556 -2.894 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -19.168 -1.949 -3.937 1.00 0.00 H new ATOM 1547 N GLY A 99 -19.162 -4.996 -5.314 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.522 -4.772 -6.706 1.00 0.00 C ATOM 1549 C GLY A 99 -18.351 -5.042 -7.652 1.00 0.00 C ATOM 1550 O GLY A 99 -18.563 -5.508 -8.767 1.00 0.00 O ATOM 0 H GLY A 99 -19.524 -5.870 -4.932 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.359 -5.417 -6.972 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -19.860 -3.743 -6.832 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.122 -4.736 -7.224 1.00 0.00 N ATOM 1555 CA GLN A 100 -15.937 -4.801 -8.050 1.00 0.00 C ATOM 1556 C GLN A 100 -14.697 -5.050 -7.188 1.00 0.00 C ATOM 1557 O GLN A 100 -14.774 -5.103 -5.955 1.00 0.00 O ATOM 1558 CB GLN A 100 -15.813 -3.460 -8.793 1.00 0.00 C ATOM 1559 CG GLN A 100 -15.305 -2.333 -7.871 1.00 0.00 C ATOM 1560 CD GLN A 100 -16.209 -1.112 -7.849 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -15.920 -0.113 -8.502 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -17.265 -1.160 -7.040 1.00 0.00 N ATOM 0 H GLN A 100 -16.931 -4.430 -6.270 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.015 -5.624 -8.761 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -15.131 -3.574 -9.636 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -16.784 -3.182 -9.204 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -15.207 -2.721 -6.857 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -14.309 -2.031 -8.194 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -17.468 -2.011 -6.516 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -17.871 -0.345 -6.944 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.552 -5.026 -7.866 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.230 -4.924 -7.299 1.00 0.00 C ATOM 1573 C GLU A 101 -11.449 -3.879 -8.091 1.00 0.00 C ATOM 1574 O GLU A 101 -11.936 -3.317 -9.076 1.00 0.00 O ATOM 1575 CB GLU A 101 -11.520 -6.297 -7.302 1.00 0.00 C ATOM 1576 CG GLU A 101 -11.908 -7.249 -8.448 1.00 0.00 C ATOM 1577 CD GLU A 101 -12.882 -8.314 -7.964 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -13.949 -7.954 -7.419 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -12.531 -9.514 -8.000 1.00 0.00 O ATOM 0 H GLU A 101 -13.532 -5.081 -8.884 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.292 -4.611 -6.257 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -10.444 -6.128 -7.343 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -11.728 -6.795 -6.355 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -12.359 -6.681 -9.261 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.013 -7.725 -8.850 1.00 0.00 H new ATOM 1586 N THR A 102 -10.222 -3.628 -7.648 1.00 0.00 N ATOM 1587 CA THR A 102 -9.177 -3.019 -8.446 1.00 0.00 C ATOM 1588 C THR A 102 -7.943 -3.901 -8.253 1.00 0.00 C ATOM 1589 O THR A 102 -7.769 -4.472 -7.176 1.00 0.00 O ATOM 1590 CB THR A 102 -9.037 -1.542 -8.039 1.00 0.00 C ATOM 1591 OG1 THR A 102 -9.103 -0.720 -9.180 1.00 0.00 O ATOM 1592 CG2 THR A 102 -7.796 -1.171 -7.231 1.00 0.00 C ATOM 0 H THR A 102 -9.924 -3.850 -6.698 1.00 0.00 H new ATOM 0 HA THR A 102 -9.378 -2.977 -9.516 1.00 0.00 H new ATOM 0 HB THR A 102 -9.875 -1.377 -7.362 1.00 0.00 H new ATOM 0 HG1 THR A 102 -10.028 -0.428 -9.320 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.813 -0.105 -7.007 1.00 0.00 H new ATOM 0 HG22 THR A 102 -7.785 -1.738 -6.300 1.00 0.00 H new ATOM 0 HG23 THR A 102 -6.902 -1.406 -7.809 1.00 0.00 H new ATOM 1600 N SER A 103 -7.140 -4.095 -9.299 1.00 0.00 N ATOM 1601 CA SER A 103 -6.068 -5.082 -9.309 1.00 0.00 C ATOM 1602 C SER A 103 -4.726 -4.375 -9.479 1.00 0.00 C ATOM 1603 O SER A 103 -4.552 -3.583 -10.406 1.00 0.00 O ATOM 1604 CB SER A 103 -6.337 -6.133 -10.393 1.00 0.00 C ATOM 1605 OG SER A 103 -7.121 -5.596 -11.440 1.00 0.00 O ATOM 0 H SER A 103 -7.218 -3.566 -10.168 1.00 0.00 H new ATOM 0 HA SER A 103 -6.031 -5.615 -8.359 1.00 0.00 H new ATOM 0 HB2 SER A 103 -5.391 -6.497 -10.793 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.849 -6.990 -9.954 1.00 0.00 H new ATOM 0 HG SER A 103 -7.277 -6.285 -12.119 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.804 -4.636 -8.546 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.495 -4.008 -8.470 1.00 0.00 C ATOM 1613 C LEU A 104 -1.444 -5.119 -8.519 1.00 0.00 C ATOM 1614 O LEU A 104 -1.469 -5.996 -7.656 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.367 -3.198 -7.169 1.00 0.00 C ATOM 1616 CG LEU A 104 -3.436 -2.109 -6.951 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -4.769 -2.669 -6.437 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -2.913 -1.093 -5.924 1.00 0.00 C ATOM 0 H LEU A 104 -3.961 -5.315 -7.801 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.353 -3.318 -9.302 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.403 -3.890 -6.327 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.385 -2.726 -7.152 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.622 -1.648 -7.921 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.479 -1.853 -6.304 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.167 -3.382 -7.159 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.609 -3.170 -5.482 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.663 -0.319 -5.764 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.708 -1.601 -4.981 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.996 -0.638 -6.297 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.552 -5.112 -9.516 1.00 0.00 N ATOM 1631 CA VAL A 105 0.450 -6.168 -9.697 1.00 0.00 C ATOM 1632 C VAL A 105 1.868 -5.615 -9.490 1.00 0.00 C ATOM 1633 O VAL A 105 2.271 -4.707 -10.212 1.00 0.00 O ATOM 1634 CB VAL A 105 0.260 -6.854 -11.064 1.00 0.00 C ATOM 1635 CG1 VAL A 105 -1.016 -7.708 -11.038 1.00 0.00 C ATOM 1636 CG2 VAL A 105 0.161 -5.887 -12.252 1.00 0.00 C ATOM 0 H VAL A 105 -0.505 -4.375 -10.219 1.00 0.00 H new ATOM 0 HA VAL A 105 0.309 -6.936 -8.936 1.00 0.00 H new ATOM 0 HB VAL A 105 1.156 -7.456 -11.215 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -1.149 -8.193 -12.005 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -0.930 -8.467 -10.261 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -1.876 -7.071 -10.830 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.029 -6.455 -13.173 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -0.691 -5.222 -12.110 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.075 -5.297 -12.318 1.00 0.00 H new ATOM 1646 N ARG A 106 2.601 -6.131 -8.491 1.00 0.00 N ATOM 1647 CA ARG A 106 3.951 -5.699 -8.125 1.00 0.00 C ATOM 1648 C ARG A 106 4.998 -6.681 -8.653 1.00 0.00 C ATOM 1649 O ARG A 106 4.833 -7.890 -8.492 1.00 0.00 O ATOM 1650 CB ARG A 106 4.102 -5.606 -6.593 1.00 0.00 C ATOM 1651 CG ARG A 106 3.029 -4.718 -5.954 1.00 0.00 C ATOM 1652 CD ARG A 106 3.455 -4.084 -4.623 1.00 0.00 C ATOM 1653 NE ARG A 106 3.319 -5.004 -3.483 1.00 0.00 N ATOM 1654 CZ ARG A 106 3.724 -4.718 -2.235 1.00 0.00 C ATOM 1655 NH1 ARG A 106 4.384 -3.581 -2.001 1.00 0.00 N ATOM 1656 NH2 ARG A 106 3.461 -5.552 -1.227 1.00 0.00 N ATOM 0 H ARG A 106 2.255 -6.886 -7.898 1.00 0.00 H new ATOM 0 HA ARG A 106 4.108 -4.717 -8.571 1.00 0.00 H new ATOM 0 HB2 ARG A 106 4.045 -6.606 -6.164 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.089 -5.211 -6.351 1.00 0.00 H new ATOM 0 HG2 ARG A 106 2.764 -3.925 -6.654 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.130 -5.313 -5.790 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.492 -3.756 -4.698 1.00 0.00 H new ATOM 0 HD3 ARG A 106 2.852 -3.195 -4.440 1.00 0.00 H new ATOM 0 HE ARG A 106 2.891 -5.915 -3.651 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.577 -2.937 -2.768 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.695 -3.357 -1.056 1.00 0.00 H new ATOM 0 HH21 ARG A 106 2.948 -6.416 -1.401 1.00 0.00 H new ATOM 0 HH22 ARG A 106 3.773 -5.325 -0.283 1.00 0.00 H new ATOM 1670 N GLU A 107 6.098 -6.169 -9.211 1.00 0.00 N ATOM 1671 CA GLU A 107 7.267 -6.950 -9.602 1.00 0.00 C ATOM 1672 C GLU A 107 8.453 -5.997 -9.728 1.00 0.00 C ATOM 1673 O GLU A 107 8.260 -4.800 -9.936 1.00 0.00 O ATOM 1674 CB GLU A 107 6.960 -7.693 -10.911 1.00 0.00 C ATOM 1675 CG GLU A 107 8.158 -8.220 -11.715 1.00 0.00 C ATOM 1676 CD GLU A 107 7.681 -8.827 -13.028 1.00 0.00 C ATOM 1677 OE1 GLU A 107 7.497 -8.041 -13.983 1.00 0.00 O ATOM 1678 OE2 GLU A 107 7.434 -10.050 -13.046 1.00 0.00 O ATOM 0 H GLU A 107 6.200 -5.173 -9.407 1.00 0.00 H new ATOM 0 HA GLU A 107 7.517 -7.705 -8.857 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.312 -8.538 -10.676 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.390 -7.023 -11.554 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.858 -7.408 -11.914 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.695 -8.969 -11.133 1.00 0.00 H new ATOM 1685 N MET A 108 9.671 -6.530 -9.602 1.00 0.00 N ATOM 1686 CA MET A 108 10.907 -5.855 -9.956 1.00 0.00 C ATOM 1687 C MET A 108 11.746 -6.854 -10.730 1.00 0.00 C ATOM 1688 O MET A 108 11.986 -7.954 -10.237 1.00 0.00 O ATOM 1689 CB MET A 108 11.643 -5.368 -8.694 1.00 0.00 C ATOM 1690 CG MET A 108 13.163 -5.180 -8.855 1.00 0.00 C ATOM 1691 SD MET A 108 14.197 -6.666 -8.634 1.00 0.00 S ATOM 1692 CE MET A 108 15.827 -5.934 -8.931 1.00 0.00 C ATOM 0 H MET A 108 9.821 -7.471 -9.239 1.00 0.00 H new ATOM 0 HA MET A 108 10.710 -4.971 -10.562 1.00 0.00 H new ATOM 0 HB2 MET A 108 11.207 -4.419 -8.381 1.00 0.00 H new ATOM 0 HB3 MET A 108 11.464 -6.082 -7.890 1.00 0.00 H new ATOM 0 HG2 MET A 108 13.353 -4.777 -9.850 1.00 0.00 H new ATOM 0 HG3 MET A 108 13.491 -4.427 -8.138 1.00 0.00 H new ATOM 0 HE1 MET A 108 16.594 -6.703 -8.837 1.00 0.00 H new ATOM 0 HE2 MET A 108 15.858 -5.511 -9.935 1.00 0.00 H new ATOM 0 HE3 MET A 108 16.011 -5.147 -8.200 1.00 0.00 H new ATOM 1702 N VAL A 109 12.261 -6.432 -11.879 1.00 0.00 N ATOM 1703 CA VAL A 109 13.250 -7.148 -12.664 1.00 0.00 C ATOM 1704 C VAL A 109 14.112 -6.082 -13.329 1.00 0.00 C ATOM 1705 O VAL A 109 13.676 -4.932 -13.421 1.00 0.00 O ATOM 1706 CB VAL A 109 12.590 -8.087 -13.693 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.900 -9.277 -13.018 1.00 0.00 C ATOM 1708 CG2 VAL A 109 11.580 -7.360 -14.590 1.00 0.00 C ATOM 0 H VAL A 109 11.988 -5.546 -12.303 1.00 0.00 H new ATOM 0 HA VAL A 109 13.857 -7.800 -12.035 1.00 0.00 H new ATOM 0 HB VAL A 109 13.404 -8.453 -14.319 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.448 -9.914 -13.778 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.635 -9.851 -12.453 1.00 0.00 H new ATOM 0 HG13 VAL A 109 11.126 -8.913 -12.342 1.00 0.00 H new ATOM 0 HG21 VAL A 109 11.145 -8.068 -15.296 1.00 0.00 H new ATOM 0 HG22 VAL A 109 10.790 -6.930 -13.974 1.00 0.00 H new ATOM 0 HG23 VAL A 109 12.086 -6.565 -15.138 1.00 0.00 H new ATOM 1718 N ASP A 110 15.325 -6.461 -13.743 1.00 0.00 N ATOM 1719 CA ASP A 110 16.309 -5.603 -14.392 1.00 0.00 C ATOM 1720 C ASP A 110 16.771 -4.450 -13.492 1.00 0.00 C ATOM 1721 O ASP A 110 17.887 -4.475 -12.977 1.00 0.00 O ATOM 1722 CB ASP A 110 15.791 -5.120 -15.751 1.00 0.00 C ATOM 1723 CG ASP A 110 16.838 -4.263 -16.444 1.00 0.00 C ATOM 1724 OD1 ASP A 110 17.782 -4.867 -16.995 1.00 0.00 O ATOM 1725 OD2 ASP A 110 16.678 -3.026 -16.396 1.00 0.00 O ATOM 0 H ASP A 110 15.658 -7.418 -13.628 1.00 0.00 H new ATOM 0 HA ASP A 110 17.201 -6.202 -14.574 1.00 0.00 H new ATOM 0 HB2 ASP A 110 15.541 -5.976 -16.377 1.00 0.00 H new ATOM 0 HB3 ASP A 110 14.874 -4.546 -15.615 1.00 0.00 H new ATOM 1730 N GLY A 111 15.906 -3.461 -13.273 1.00 0.00 N ATOM 1731 CA GLY A 111 16.253 -2.228 -12.593 1.00 0.00 C ATOM 1732 C GLY A 111 15.078 -1.257 -12.605 1.00 0.00 C ATOM 1733 O GLY A 111 15.137 -0.238 -13.284 1.00 0.00 O ATOM 0 H GLY A 111 14.931 -3.501 -13.570 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.543 -2.443 -11.565 1.00 0.00 H new ATOM 0 HA3 GLY A 111 17.115 -1.770 -13.078 1.00 0.00 H new ATOM 1737 N LYS A 112 14.020 -1.617 -11.869 1.00 0.00 N ATOM 1738 CA LYS A 112 12.930 -0.792 -11.347 1.00 0.00 C ATOM 1739 C LYS A 112 11.931 -1.763 -10.711 1.00 0.00 C ATOM 1740 O LYS A 112 12.019 -2.969 -10.959 1.00 0.00 O ATOM 1741 CB LYS A 112 12.254 0.102 -12.412 1.00 0.00 C ATOM 1742 CG LYS A 112 12.798 1.543 -12.411 1.00 0.00 C ATOM 1743 CD LYS A 112 11.932 2.488 -13.257 1.00 0.00 C ATOM 1744 CE LYS A 112 12.741 3.733 -13.651 1.00 0.00 C ATOM 1745 NZ LYS A 112 11.887 4.858 -14.087 1.00 0.00 N ATOM 0 H LYS A 112 13.896 -2.593 -11.598 1.00 0.00 H new ATOM 0 HA LYS A 112 13.326 -0.080 -10.623 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.404 -0.338 -13.398 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.179 0.124 -12.233 1.00 0.00 H new ATOM 0 HG2 LYS A 112 12.843 1.913 -11.387 1.00 0.00 H new ATOM 0 HG3 LYS A 112 13.818 1.545 -12.795 1.00 0.00 H new ATOM 0 HD2 LYS A 112 11.584 1.972 -14.152 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.046 2.783 -12.695 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.347 4.051 -12.802 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.430 3.473 -14.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 12.487 5.646 -14.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.278 4.548 -14.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 11.294 5.172 -13.292 1.00 0.00 H new ATOM 1759 N LEU A 113 11.003 -1.253 -9.893 1.00 0.00 N ATOM 1760 CA LEU A 113 9.855 -2.000 -9.386 1.00 0.00 C ATOM 1761 C LEU A 113 8.619 -1.398 -10.045 1.00 0.00 C ATOM 1762 O LEU A 113 8.356 -0.207 -9.872 1.00 0.00 O ATOM 1763 CB LEU A 113 9.816 -1.954 -7.848 1.00 0.00 C ATOM 1764 CG LEU A 113 8.801 -2.913 -7.189 1.00 0.00 C ATOM 1765 CD1 LEU A 113 9.019 -2.950 -5.672 1.00 0.00 C ATOM 1766 CD2 LEU A 113 7.344 -2.518 -7.458 1.00 0.00 C ATOM 0 H LEU A 113 11.033 -0.289 -9.560 1.00 0.00 H new ATOM 0 HA LEU A 113 9.912 -3.060 -9.635 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.811 -2.186 -7.468 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.585 -0.935 -7.536 1.00 0.00 H new ATOM 0 HG LEU A 113 8.974 -3.893 -7.633 1.00 0.00 H new ATOM 0 HD11 LEU A 113 8.298 -3.629 -5.217 1.00 0.00 H new ATOM 0 HD12 LEU A 113 10.030 -3.297 -5.458 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.884 -1.950 -5.261 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.678 -3.229 -6.969 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.159 -1.519 -7.064 1.00 0.00 H new ATOM 0 HD23 LEU A 113 7.157 -2.525 -8.532 1.00 0.00 H new ATOM 1778 N ILE A 114 7.899 -2.196 -10.839 1.00 0.00 N ATOM 1779 CA ILE A 114 6.796 -1.728 -11.664 1.00 0.00 C ATOM 1780 C ILE A 114 5.461 -2.105 -11.027 1.00 0.00 C ATOM 1781 O ILE A 114 5.320 -3.194 -10.468 1.00 0.00 O ATOM 1782 CB ILE A 114 6.956 -2.163 -13.142 1.00 0.00 C ATOM 1783 CG1 ILE A 114 6.222 -3.446 -13.576 1.00 0.00 C ATOM 1784 CG2 ILE A 114 8.430 -2.217 -13.579 1.00 0.00 C ATOM 1785 CD1 ILE A 114 6.772 -4.745 -12.987 1.00 0.00 C ATOM 0 H ILE A 114 8.073 -3.197 -10.924 1.00 0.00 H new ATOM 0 HA ILE A 114 6.813 -0.639 -11.703 1.00 0.00 H new ATOM 0 HB ILE A 114 6.440 -1.362 -13.672 1.00 0.00 H new ATOM 0 HG12 ILE A 114 5.172 -3.356 -13.297 1.00 0.00 H new ATOM 0 HG13 ILE A 114 6.258 -3.515 -14.663 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.489 -2.527 -14.622 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.879 -1.230 -13.468 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.968 -2.932 -12.957 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.186 -5.588 -13.354 1.00 0.00 H new ATOM 0 HD12 ILE A 114 7.813 -4.868 -13.287 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.710 -4.706 -11.899 1.00 0.00 H new ATOM 1797 N LEU A 115 4.494 -1.185 -11.096 1.00 0.00 N ATOM 1798 CA LEU A 115 3.133 -1.365 -10.624 1.00 0.00 C ATOM 1799 C LEU A 115 2.192 -1.033 -11.779 1.00 0.00 C ATOM 1800 O LEU A 115 2.155 0.111 -12.231 1.00 0.00 O ATOM 1801 CB LEU A 115 2.852 -0.411 -9.451 1.00 0.00 C ATOM 1802 CG LEU A 115 2.764 -1.017 -8.048 1.00 0.00 C ATOM 1803 CD1 LEU A 115 1.690 -2.105 -7.971 1.00 0.00 C ATOM 1804 CD2 LEU A 115 4.121 -1.540 -7.587 1.00 0.00 C ATOM 0 H LEU A 115 4.652 -0.261 -11.499 1.00 0.00 H new ATOM 0 HA LEU A 115 2.986 -2.390 -10.284 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.635 0.348 -9.440 1.00 0.00 H new ATOM 0 HB3 LEU A 115 1.913 0.103 -9.654 1.00 0.00 H new ATOM 0 HG LEU A 115 2.467 -0.221 -7.365 1.00 0.00 H new ATOM 0 HD11 LEU A 115 1.656 -2.512 -6.960 1.00 0.00 H new ATOM 0 HD12 LEU A 115 0.720 -1.677 -8.222 1.00 0.00 H new ATOM 0 HD13 LEU A 115 1.928 -2.902 -8.675 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.027 -1.964 -6.587 1.00 0.00 H new ATOM 0 HD22 LEU A 115 4.468 -2.309 -8.277 1.00 0.00 H new ATOM 0 HD23 LEU A 115 4.839 -0.720 -7.567 1.00 0.00 H new ATOM 1816 N THR A 116 1.388 -2.002 -12.219 1.00 0.00 N ATOM 1817 CA THR A 116 0.205 -1.710 -13.020 1.00 0.00 C ATOM 1818 C THR A 116 -0.986 -1.776 -12.069 1.00 0.00 C ATOM 1819 O THR A 116 -1.180 -2.807 -11.420 1.00 0.00 O ATOM 1820 CB THR A 116 0.079 -2.702 -14.183 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.282 -2.701 -14.921 1.00 0.00 O ATOM 1822 CG2 THR A 116 -1.065 -2.316 -15.126 1.00 0.00 C ATOM 0 H THR A 116 1.537 -2.994 -12.033 1.00 0.00 H new ATOM 0 HA THR A 116 0.262 -0.723 -13.479 1.00 0.00 H new ATOM 0 HB THR A 116 -0.127 -3.688 -13.766 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.210 -3.334 -15.665 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.126 -3.040 -15.939 1.00 0.00 H new ATOM 0 HG22 THR A 116 -2.005 -2.309 -14.574 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.879 -1.324 -15.537 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.735 -0.673 -11.956 1.00 0.00 N ATOM 1831 CA LEU A 117 -2.987 -0.601 -11.224 1.00 0.00 C ATOM 1832 C LEU A 117 -4.094 -0.534 -12.275 1.00 0.00 C ATOM 1833 O LEU A 117 -4.134 0.428 -13.043 1.00 0.00 O ATOM 1834 CB LEU A 117 -3.070 0.648 -10.318 1.00 0.00 C ATOM 1835 CG LEU A 117 -1.874 1.030 -9.426 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -1.032 -0.150 -8.969 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -0.924 2.024 -10.091 1.00 0.00 C ATOM 0 H LEU A 117 -1.472 0.214 -12.386 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.078 -1.468 -10.570 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.281 1.502 -10.961 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -3.934 0.519 -9.666 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.358 1.483 -8.561 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.212 0.208 -8.346 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -1.652 -0.838 -8.394 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.628 -0.667 -9.839 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.103 2.253 -9.412 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.526 1.589 -11.008 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.464 2.940 -10.329 1.00 0.00 H new ATOM 1849 N THR A 118 -4.992 -1.518 -12.331 1.00 0.00 N ATOM 1850 CA THR A 118 -6.142 -1.470 -13.229 1.00 0.00 C ATOM 1851 C THR A 118 -7.428 -1.494 -12.407 1.00 0.00 C ATOM 1852 O THR A 118 -7.449 -2.017 -11.290 1.00 0.00 O ATOM 1853 CB THR A 118 -6.040 -2.546 -14.321 1.00 0.00 C ATOM 1854 OG1 THR A 118 -6.985 -2.302 -15.339 1.00 0.00 O ATOM 1855 CG2 THR A 118 -6.242 -3.966 -13.805 1.00 0.00 C ATOM 0 H THR A 118 -4.943 -2.362 -11.761 1.00 0.00 H new ATOM 0 HA THR A 118 -6.157 -0.532 -13.784 1.00 0.00 H new ATOM 0 HB THR A 118 -5.022 -2.478 -14.705 1.00 0.00 H new ATOM 0 HG1 THR A 118 -6.908 -2.994 -16.029 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.156 -4.670 -14.633 1.00 0.00 H new ATOM 0 HG22 THR A 118 -5.483 -4.192 -13.056 1.00 0.00 H new ATOM 0 HG23 THR A 118 -7.232 -4.053 -13.357 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.456 -0.805 -12.899 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.798 -0.757 -12.349 1.00 0.00 C ATOM 1865 C HIS A 119 -10.749 -1.116 -13.490 1.00 0.00 C ATOM 1866 O HIS A 119 -10.327 -1.172 -14.644 1.00 0.00 O ATOM 1867 CB HIS A 119 -10.073 0.661 -11.815 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.322 0.767 -10.978 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -11.600 -0.019 -9.878 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -12.345 1.664 -11.136 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -12.791 0.372 -9.391 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.263 1.391 -10.137 1.00 0.00 N ATOM 0 H HIS A 119 -8.363 -0.235 -13.740 1.00 0.00 H new ATOM 0 HA HIS A 119 -9.930 -1.452 -11.520 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.220 0.986 -11.220 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -10.153 1.347 -12.658 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -12.420 2.433 -11.891 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -13.290 -0.062 -8.537 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -14.147 1.878 -9.990 1.00 0.00 H new ATOM 1881 N GLY A 120 -12.034 -1.324 -13.196 1.00 0.00 N ATOM 1882 CA GLY A 120 -13.034 -1.609 -14.218 1.00 0.00 C ATOM 1883 C GLY A 120 -13.427 -0.349 -14.995 1.00 0.00 C ATOM 1884 O GLY A 120 -14.604 -0.006 -15.033 1.00 0.00 O ATOM 0 H GLY A 120 -12.406 -1.299 -12.247 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -12.644 -2.356 -14.910 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -13.920 -2.039 -13.750 1.00 0.00 H new ATOM 1888 N THR A 121 -12.437 0.331 -15.589 1.00 0.00 N ATOM 1889 CA THR A 121 -12.518 1.488 -16.478 1.00 0.00 C ATOM 1890 C THR A 121 -11.150 2.182 -16.496 1.00 0.00 C ATOM 1891 O THR A 121 -10.489 2.219 -17.530 1.00 0.00 O ATOM 1892 CB THR A 121 -13.698 2.445 -16.182 1.00 0.00 C ATOM 1893 OG1 THR A 121 -13.646 3.553 -17.050 1.00 0.00 O ATOM 1894 CG2 THR A 121 -13.757 3.017 -14.765 1.00 0.00 C ATOM 0 H THR A 121 -11.466 0.054 -15.442 1.00 0.00 H new ATOM 0 HA THR A 121 -12.753 1.133 -17.481 1.00 0.00 H new ATOM 0 HB THR A 121 -14.578 1.817 -16.320 1.00 0.00 H new ATOM 0 HG1 THR A 121 -14.396 4.154 -16.859 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.623 3.673 -14.673 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.841 2.202 -14.047 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.849 3.585 -14.564 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.707 2.708 -15.349 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.454 3.445 -15.250 1.00 0.00 C ATOM 1904 C ALA A 122 -8.272 2.477 -15.169 1.00 0.00 C ATOM 1905 O ALA A 122 -8.371 1.429 -14.529 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.492 4.375 -14.033 1.00 0.00 C ATOM 0 H ALA A 122 -11.211 2.632 -14.466 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.325 4.055 -16.144 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.552 4.923 -13.964 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.316 5.080 -14.139 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.634 3.784 -13.128 1.00 0.00 H new ATOM 1912 N VAL A 123 -7.150 2.837 -15.797 1.00 0.00 N ATOM 1913 CA VAL A 123 -5.916 2.064 -15.808 1.00 0.00 C ATOM 1914 C VAL A 123 -4.783 3.052 -15.534 1.00 0.00 C ATOM 1915 O VAL A 123 -4.807 4.167 -16.050 1.00 0.00 O ATOM 1916 CB VAL A 123 -5.753 1.356 -17.167 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -4.543 0.409 -17.192 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -7.015 0.550 -17.513 1.00 0.00 C ATOM 0 H VAL A 123 -7.078 3.705 -16.328 1.00 0.00 H new ATOM 0 HA VAL A 123 -5.916 1.281 -15.050 1.00 0.00 H new ATOM 0 HB VAL A 123 -5.592 2.141 -17.905 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -4.472 -0.065 -18.171 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -3.633 0.976 -16.997 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -4.665 -0.357 -16.426 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -6.880 0.058 -18.476 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -7.189 -0.201 -16.743 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -7.872 1.221 -17.566 1.00 0.00 H new ATOM 1928 N CYS A 124 -3.822 2.682 -14.683 1.00 0.00 N ATOM 1929 CA CYS A 124 -2.809 3.597 -14.187 1.00 0.00 C ATOM 1930 C CYS A 124 -1.525 2.849 -13.855 1.00 0.00 C ATOM 1931 O CYS A 124 -1.560 1.853 -13.143 1.00 0.00 O ATOM 1932 CB CYS A 124 -3.368 4.277 -12.936 1.00 0.00 C ATOM 1933 SG CYS A 124 -2.094 5.227 -12.063 1.00 0.00 S ATOM 0 H CYS A 124 -3.731 1.733 -14.321 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.568 4.339 -14.948 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -4.187 4.939 -13.217 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -3.783 3.523 -12.267 1.00 0.00 H new ATOM 0 HG CYS A 124 -1.694 6.209 -12.815 1.00 0.00 H new ATOM 1939 N THR A 125 -0.385 3.381 -14.287 1.00 0.00 N ATOM 1940 CA THR A 125 0.919 2.892 -13.891 1.00 0.00 C ATOM 1941 C THR A 125 1.349 3.544 -12.571 1.00 0.00 C ATOM 1942 O THR A 125 0.855 4.617 -12.206 1.00 0.00 O ATOM 1943 CB THR A 125 1.893 3.245 -15.022 1.00 0.00 C ATOM 1944 OG1 THR A 125 1.604 4.554 -15.476 1.00 0.00 O ATOM 1945 CG2 THR A 125 1.715 2.298 -16.210 1.00 0.00 C ATOM 0 H THR A 125 -0.347 4.173 -14.929 1.00 0.00 H new ATOM 0 HA THR A 125 0.903 1.814 -13.728 1.00 0.00 H new ATOM 0 HB THR A 125 2.910 3.164 -14.639 1.00 0.00 H new ATOM 0 HG1 THR A 125 1.428 5.136 -14.707 1.00 0.00 H new ATOM 0 HG21 THR A 125 2.417 2.568 -16.999 1.00 0.00 H new ATOM 0 HG22 THR A 125 1.906 1.274 -15.890 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.696 2.376 -16.588 1.00 0.00 H new ATOM 1953 N ARG A 126 2.276 2.886 -11.877 1.00 0.00 N ATOM 1954 CA ARG A 126 3.238 3.449 -10.942 1.00 0.00 C ATOM 1955 C ARG A 126 4.554 2.772 -11.318 1.00 0.00 C ATOM 1956 O ARG A 126 4.535 1.579 -11.622 1.00 0.00 O ATOM 1957 CB ARG A 126 2.904 3.037 -9.498 1.00 0.00 C ATOM 1958 CG ARG A 126 2.108 4.039 -8.673 1.00 0.00 C ATOM 1959 CD ARG A 126 2.047 3.566 -7.208 1.00 0.00 C ATOM 1960 NE ARG A 126 0.741 3.813 -6.577 1.00 0.00 N ATOM 1961 CZ ARG A 126 0.450 3.536 -5.291 1.00 0.00 C ATOM 1962 NH1 ARG A 126 1.414 3.194 -4.429 1.00 0.00 N ATOM 1963 NH2 ARG A 126 -0.819 3.598 -4.870 1.00 0.00 N ATOM 0 H ARG A 126 2.379 1.875 -11.962 1.00 0.00 H new ATOM 0 HA ARG A 126 3.254 4.538 -10.991 1.00 0.00 H new ATOM 0 HB2 ARG A 126 2.345 2.102 -9.531 1.00 0.00 H new ATOM 0 HB3 ARG A 126 3.839 2.832 -8.977 1.00 0.00 H new ATOM 0 HG2 ARG A 126 2.573 5.023 -8.729 1.00 0.00 H new ATOM 0 HG3 ARG A 126 1.100 4.139 -9.076 1.00 0.00 H new ATOM 0 HD2 ARG A 126 2.268 2.499 -7.167 1.00 0.00 H new ATOM 0 HD3 ARG A 126 2.823 4.074 -6.635 1.00 0.00 H new ATOM 0 HE ARG A 126 0.005 4.222 -7.153 1.00 0.00 H new ATOM 0 HH11 ARG A 126 2.383 3.140 -4.743 1.00 0.00 H new ATOM 0 HH12 ARG A 126 1.180 2.987 -3.458 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -1.561 3.854 -5.522 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -1.044 3.389 -3.897 1.00 0.00 H new ATOM 1977 N THR A 127 5.685 3.475 -11.262 1.00 0.00 N ATOM 1978 CA THR A 127 6.972 2.791 -11.286 1.00 0.00 C ATOM 1979 C THR A 127 7.900 3.445 -10.263 1.00 0.00 C ATOM 1980 O THR A 127 7.905 4.671 -10.098 1.00 0.00 O ATOM 1981 CB THR A 127 7.563 2.746 -12.701 1.00 0.00 C ATOM 1982 OG1 THR A 127 6.552 2.691 -13.687 1.00 0.00 O ATOM 1983 CG2 THR A 127 8.473 1.544 -12.923 1.00 0.00 C ATOM 0 H THR A 127 5.735 4.492 -11.201 1.00 0.00 H new ATOM 0 HA THR A 127 6.840 1.747 -11.002 1.00 0.00 H new ATOM 0 HB THR A 127 8.142 3.665 -12.792 1.00 0.00 H new ATOM 0 HG1 THR A 127 6.963 2.665 -14.576 1.00 0.00 H new ATOM 0 HG21 THR A 127 8.862 1.565 -13.941 1.00 0.00 H new ATOM 0 HG22 THR A 127 9.303 1.580 -12.217 1.00 0.00 H new ATOM 0 HG23 THR A 127 7.906 0.626 -12.770 1.00 0.00 H new ATOM 1991 N TYR A 128 8.621 2.593 -9.534 1.00 0.00 N ATOM 1992 CA TYR A 128 9.474 2.937 -8.416 1.00 0.00 C ATOM 1993 C TYR A 128 10.894 2.468 -8.695 1.00 0.00 C ATOM 1994 O TYR A 128 11.100 1.576 -9.519 1.00 0.00 O ATOM 1995 CB TYR A 128 8.977 2.200 -7.168 1.00 0.00 C ATOM 1996 CG TYR A 128 7.628 2.615 -6.631 1.00 0.00 C ATOM 1997 CD1 TYR A 128 6.450 1.986 -7.077 1.00 0.00 C ATOM 1998 CD2 TYR A 128 7.577 3.479 -5.527 1.00 0.00 C ATOM 1999 CE1 TYR A 128 5.244 2.189 -6.384 1.00 0.00 C ATOM 2000 CE2 TYR A 128 6.350 3.803 -4.943 1.00 0.00 C ATOM 2001 CZ TYR A 128 5.202 3.083 -5.300 1.00 0.00 C ATOM 2002 OH TYR A 128 4.106 3.138 -4.490 1.00 0.00 O ATOM 0 H TYR A 128 8.620 1.591 -9.725 1.00 0.00 H new ATOM 0 HA TYR A 128 9.453 4.017 -8.268 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.941 1.134 -7.393 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.715 2.334 -6.377 1.00 0.00 H new ATOM 0 HD1 TYR A 128 6.473 1.349 -7.949 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.490 3.895 -5.127 1.00 0.00 H new ATOM 0 HE1 TYR A 128 4.352 1.659 -6.684 1.00 0.00 H new ATOM 0 HE2 TYR A 128 6.287 4.603 -4.221 1.00 0.00 H new ATOM 0 HH TYR A 128 3.895 2.238 -4.163 1.00 0.00 H new ATOM 2012 N GLU A 129 11.851 3.019 -7.943 1.00 0.00 N ATOM 2013 CA GLU A 129 13.199 2.482 -7.847 1.00 0.00 C ATOM 2014 C GLU A 129 13.613 2.426 -6.376 1.00 0.00 C ATOM 2015 O GLU A 129 13.086 3.179 -5.552 1.00 0.00 O ATOM 2016 CB GLU A 129 14.160 3.323 -8.704 1.00 0.00 C ATOM 2017 CG GLU A 129 15.579 2.737 -8.780 1.00 0.00 C ATOM 2018 CD GLU A 129 15.582 1.278 -9.218 1.00 0.00 C ATOM 2019 OE1 GLU A 129 15.609 1.052 -10.444 1.00 0.00 O ATOM 2020 OE2 GLU A 129 15.496 0.416 -8.314 1.00 0.00 O ATOM 0 H GLU A 129 11.704 3.858 -7.381 1.00 0.00 H new ATOM 0 HA GLU A 129 13.235 1.465 -8.239 1.00 0.00 H new ATOM 0 HB2 GLU A 129 13.756 3.409 -9.713 1.00 0.00 H new ATOM 0 HB3 GLU A 129 14.213 4.332 -8.295 1.00 0.00 H new ATOM 0 HG2 GLU A 129 16.175 3.324 -9.479 1.00 0.00 H new ATOM 0 HG3 GLU A 129 16.057 2.822 -7.804 1.00 0.00 H new ATOM 2027 N LYS A 130 14.519 1.502 -6.049 1.00 0.00 N ATOM 2028 CA LYS A 130 15.069 1.296 -4.722 1.00 0.00 C ATOM 2029 C LYS A 130 15.929 2.509 -4.360 1.00 0.00 C ATOM 2030 O LYS A 130 16.892 2.803 -5.063 1.00 0.00 O ATOM 2031 CB LYS A 130 15.907 0.007 -4.720 1.00 0.00 C ATOM 2032 CG LYS A 130 16.328 -0.393 -3.297 1.00 0.00 C ATOM 2033 CD LYS A 130 15.652 -1.682 -2.814 1.00 0.00 C ATOM 2034 CE LYS A 130 16.318 -2.928 -3.416 1.00 0.00 C ATOM 2035 NZ LYS A 130 15.570 -4.166 -3.112 1.00 0.00 N ATOM 0 H LYS A 130 14.901 0.853 -6.737 1.00 0.00 H new ATOM 0 HA LYS A 130 14.274 1.191 -3.983 1.00 0.00 H new ATOM 0 HB2 LYS A 130 15.332 -0.802 -5.171 1.00 0.00 H new ATOM 0 HB3 LYS A 130 16.795 0.149 -5.336 1.00 0.00 H new ATOM 0 HG2 LYS A 130 17.410 -0.523 -3.267 1.00 0.00 H new ATOM 0 HG3 LYS A 130 16.085 0.418 -2.610 1.00 0.00 H new ATOM 0 HD2 LYS A 130 15.699 -1.733 -1.726 1.00 0.00 H new ATOM 0 HD3 LYS A 130 14.597 -1.665 -3.087 1.00 0.00 H new ATOM 0 HE2 LYS A 130 16.396 -2.809 -4.497 1.00 0.00 H new ATOM 0 HE3 LYS A 130 17.334 -3.016 -3.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 16.124 -4.991 -3.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 15.399 -4.226 -2.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 14.659 -4.154 -3.614 1.00 0.00 H new ATOM 2049 N GLN A 131 15.611 3.211 -3.267 1.00 0.00 N ATOM 2050 CA GLN A 131 16.360 4.418 -2.920 1.00 0.00 C ATOM 2051 C GLN A 131 17.685 4.092 -2.223 1.00 0.00 C ATOM 2052 O GLN A 131 18.615 4.893 -2.269 1.00 0.00 O ATOM 2053 CB GLN A 131 15.490 5.413 -2.144 1.00 0.00 C ATOM 2054 CG GLN A 131 15.215 5.021 -0.690 1.00 0.00 C ATOM 2055 CD GLN A 131 14.179 5.951 -0.067 1.00 0.00 C ATOM 2056 OE1 GLN A 131 12.951 5.921 -0.574 1.00 0.00 O flip ATOM 2057 NE2 GLN A 131 14.452 6.700 0.864 1.00 0.00 N flip ATOM 0 H GLN A 131 14.858 2.970 -2.622 1.00 0.00 H new ATOM 0 HA GLN A 131 16.636 4.917 -3.849 1.00 0.00 H new ATOM 0 HB2 GLN A 131 15.976 6.388 -2.158 1.00 0.00 H new ATOM 0 HB3 GLN A 131 14.538 5.524 -2.663 1.00 0.00 H new ATOM 0 HG2 GLN A 131 14.859 3.992 -0.647 1.00 0.00 H new ATOM 0 HG3 GLN A 131 16.140 5.063 -0.116 1.00 0.00 H new ATOM 0 HE21 GLN A 131 15.398 6.715 1.246 1.00 0.00 H new ATOM 0 HE22 GLN A 131 13.733 7.308 1.257 1.00 0.00 H new ATOM 2066 N ALA A 132 17.775 2.930 -1.568 1.00 0.00 N ATOM 2067 CA ALA A 132 18.993 2.452 -0.927 1.00 0.00 C ATOM 2068 C ALA A 132 18.911 0.938 -0.761 1.00 0.00 C ATOM 2069 O ALA A 132 17.814 0.380 -0.777 1.00 0.00 O ATOM 2070 CB ALA A 132 19.176 3.131 0.433 1.00 0.00 C ATOM 2071 OXT ALA A 132 20.062 0.196 -0.594 1.00 0.00 O ATOM 0 H ALA A 132 16.988 2.289 -1.470 1.00 0.00 H new ATOM 0 HA ALA A 132 19.853 2.699 -1.549 1.00 0.00 H new ATOM 0 HB1 ALA A 132 20.089 2.766 0.902 1.00 0.00 H new ATOM 0 HB2 ALA A 132 19.246 4.210 0.295 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.323 2.902 1.072 1.00 0.00 H new