USER MOD reduce.3.24.130724 H: found=0, std=0, add=1119, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1120 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 107 CYS SG : rot 160:sc= 0.0465 USER MOD Set 1.2: A 115 THR OG1 : rot -161:sc= 0.915 USER MOD Set 2.1: A 51 TYR OH : rot 41:sc= -1.42! USER MOD Set 2.2: A 94 ASN : amide:sc= 0.168 K(o=-1.3,f=-3.8) USER MOD Set 3.1: A 42 THR OG1 : rot 72:sc= 1.24 USER MOD Set 3.2: A 85 GLN : amide:sc= 0 K(o=1.2,f=0.59) USER MOD Set 4.1: A 38 ASN : amide:sc= 0.848 K(o=1.1,f=-0.055) USER MOD Set 4.2: A 89 SER OG : rot -176:sc= 0.236 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl -132:sc= -0.0202 (180deg=-0.301) USER MOD Single : A 16 TYR OH : rot -30:sc= 0.0497 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 137:sc= -0.025 (180deg=-0.237) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.391 USER MOD Single : A 29 GLN :FLIP amide:sc= -2.84! C(o=-3.5!,f=-2.8!) USER MOD Single : A 30 SER OG : rot 60:sc= 1.08 USER MOD Single : A 33 ASN : amide:sc= 0.0662 K(o=0.066,f=-2.4!) USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 ASN : amide:sc= 0.731 K(o=0.73,f=0) USER MOD Single : A 43 THR OG1 : rot 170:sc= 0.0468 USER MOD Single : A 47 ASN : amide:sc= 0.675 K(o=0.68,f=-4.3!) USER MOD Single : A 52 CYS SG : rot 69:sc= 0.343 USER MOD Single : A 60 LYS NZ :NH3+ -157:sc= -0.957 (180deg=-1.5) USER MOD Single : A 62 CYS SG : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.105) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0.449 X(o=0.45,f=0) USER MOD Single : A 79 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0147) USER MOD Single : A 87 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00682) USER MOD Single : A 90 SER OG : rot 180:sc= -1.5! USER MOD Single : A 91 GLN : amide:sc= -0.0573 X(o=-0.057,f=-0.0078) USER MOD Single : A 95 THR OG1 : rot -179:sc= 1.13 USER MOD Single : A 97 MET CE :methyl 164:sc= -0.942 (180deg=-1.16) USER MOD Single : A 102 LYS NZ :NH3+ -158:sc= 0.559 (180deg=0.314) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot -53:sc= 0.809 USER MOD Single : A 110 CYS SG : rot 140:sc= 0.477 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 172:sc= 0.214 (180deg=0.166) USER MOD Single : A 121 LYS NZ :NH3+ 167:sc= -1.64 (180deg=-1.67!) USER MOD Single : A 122 LYS NZ :NH3+ 169:sc=-3.9e-05 (180deg=-0.12) USER MOD Single : A 123 SER OG : rot 100:sc= 1.21 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 47:sc= 0.148 USER MOD Single : A 131 CYS SG : rot 154:sc= 0.128 USER MOD Single : A 134 GLN : amide:sc= -0.783 K(o=-0.78,f=-3.3) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 7 -15.606 -5.004 3.741 1.00 0.00 N ATOM 2 CA GLU A 7 -16.196 -5.016 5.097 1.00 0.00 C ATOM 3 C GLU A 7 -16.524 -3.591 5.565 1.00 0.00 C ATOM 4 O GLU A 7 -15.885 -2.627 5.127 1.00 0.00 O ATOM 5 CB GLU A 7 -15.295 -5.754 6.109 1.00 0.00 C ATOM 6 CG GLU A 7 -13.898 -5.140 6.279 1.00 0.00 C ATOM 7 CD GLU A 7 -13.106 -5.842 7.384 1.00 0.00 C ATOM 8 OE1 GLU A 7 -13.271 -5.434 8.551 1.00 0.00 O ATOM 9 OE2 GLU A 7 -12.326 -6.748 7.020 1.00 0.00 O ATOM 0 HA GLU A 7 -17.131 -5.573 5.044 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -15.793 -5.767 7.078 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -15.187 -6.791 5.792 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -13.352 -5.210 5.338 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -13.992 -4.080 6.515 1.00 0.00 H new ATOM 16 N TYR A 8 -17.547 -3.480 6.426 1.00 0.00 N ATOM 17 CA TYR A 8 -18.060 -2.223 7.019 1.00 0.00 C ATOM 18 C TYR A 8 -18.806 -1.261 6.074 1.00 0.00 C ATOM 19 O TYR A 8 -19.732 -0.577 6.509 1.00 0.00 O ATOM 20 CB TYR A 8 -16.975 -1.418 7.751 1.00 0.00 C ATOM 21 CG TYR A 8 -16.622 -2.021 9.120 1.00 0.00 C ATOM 22 CD1 TYR A 8 -15.578 -2.949 9.249 1.00 0.00 C ATOM 23 CD2 TYR A 8 -17.303 -1.560 10.260 1.00 0.00 C ATOM 24 CE1 TYR A 8 -15.222 -3.423 10.517 1.00 0.00 C ATOM 25 CE2 TYR A 8 -16.933 -2.034 11.531 1.00 0.00 C ATOM 26 CZ TYR A 8 -15.889 -2.962 11.660 1.00 0.00 C ATOM 27 OH TYR A 8 -15.552 -3.411 12.888 1.00 0.00 O ATOM 0 H TYR A 8 -18.067 -4.297 6.746 1.00 0.00 H new ATOM 0 HA TYR A 8 -18.800 -2.613 7.718 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -16.078 -1.377 7.133 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -17.317 -0.392 7.886 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -15.051 -3.297 8.373 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -18.106 -0.845 10.160 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -14.428 -4.149 10.615 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -17.454 -1.683 12.410 1.00 0.00 H new ATOM 0 HH TYR A 8 -16.120 -2.981 13.561 1.00 0.00 H new ATOM 37 N VAL A 9 -18.417 -1.229 4.801 1.00 0.00 N ATOM 38 CA VAL A 9 -18.949 -0.275 3.814 1.00 0.00 C ATOM 39 C VAL A 9 -19.704 -1.043 2.699 1.00 0.00 C ATOM 40 O VAL A 9 -19.597 -2.263 2.574 1.00 0.00 O ATOM 41 CB VAL A 9 -17.811 0.610 3.259 1.00 0.00 C ATOM 42 CG1 VAL A 9 -18.354 1.796 2.453 1.00 0.00 C ATOM 43 CG2 VAL A 9 -16.900 1.192 4.356 1.00 0.00 C ATOM 0 H VAL A 9 -17.719 -1.866 4.417 1.00 0.00 H new ATOM 0 HA VAL A 9 -19.665 0.394 4.292 1.00 0.00 H new ATOM 0 HB VAL A 9 -17.231 -0.061 2.625 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -17.522 2.394 2.080 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -18.941 1.426 1.612 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -18.985 2.412 3.093 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -16.123 1.803 3.897 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -17.493 1.807 5.033 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -16.439 0.378 4.916 1.00 0.00 H new ATOM 53 N GLU A 10 -20.623 -0.329 2.050 1.00 0.00 N ATOM 54 CA GLU A 10 -21.448 -0.821 0.918 1.00 0.00 C ATOM 55 C GLU A 10 -20.651 -1.264 -0.332 1.00 0.00 C ATOM 56 O GLU A 10 -20.551 -0.550 -1.328 1.00 0.00 O ATOM 57 CB GLU A 10 -22.524 0.227 0.588 1.00 0.00 C ATOM 58 CG GLU A 10 -21.977 1.627 0.260 1.00 0.00 C ATOM 59 CD GLU A 10 -23.078 2.616 -0.099 1.00 0.00 C ATOM 60 OE1 GLU A 10 -23.411 2.696 -1.302 1.00 0.00 O ATOM 61 OE2 GLU A 10 -23.562 3.287 0.849 1.00 0.00 O ATOM 0 H GLU A 10 -20.830 0.639 2.296 1.00 0.00 H new ATOM 0 HA GLU A 10 -21.920 -1.746 1.249 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -23.109 -0.128 -0.260 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -23.206 0.307 1.435 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -21.419 2.005 1.117 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -21.275 1.553 -0.570 1.00 0.00 H new ATOM 68 N MET A 11 -20.051 -2.445 -0.230 1.00 0.00 N ATOM 69 CA MET A 11 -19.281 -3.072 -1.323 1.00 0.00 C ATOM 70 C MET A 11 -20.102 -3.451 -2.565 1.00 0.00 C ATOM 71 O MET A 11 -21.155 -4.075 -2.474 1.00 0.00 O ATOM 72 CB MET A 11 -18.505 -4.291 -0.790 1.00 0.00 C ATOM 73 CG MET A 11 -19.373 -5.420 -0.226 1.00 0.00 C ATOM 74 SD MET A 11 -18.441 -6.857 0.429 1.00 0.00 S ATOM 75 CE MET A 11 -17.642 -7.472 -1.044 1.00 0.00 C ATOM 0 H MET A 11 -20.080 -3.008 0.620 1.00 0.00 H new ATOM 0 HA MET A 11 -18.590 -2.304 -1.671 1.00 0.00 H new ATOM 0 HB2 MET A 11 -17.893 -4.693 -1.597 1.00 0.00 H new ATOM 0 HB3 MET A 11 -17.822 -3.954 -0.010 1.00 0.00 H new ATOM 0 HG2 MET A 11 -19.996 -5.016 0.572 1.00 0.00 H new ATOM 0 HG3 MET A 11 -20.045 -5.768 -1.010 1.00 0.00 H new ATOM 0 HE1 MET A 11 -17.786 -8.550 -1.113 1.00 0.00 H new ATOM 0 HE2 MET A 11 -18.075 -6.991 -1.921 1.00 0.00 H new ATOM 0 HE3 MET A 11 -16.576 -7.251 -0.999 1.00 0.00 H new ATOM 85 N LEU A 12 -19.604 -3.027 -3.725 1.00 0.00 N ATOM 86 CA LEU A 12 -20.162 -3.436 -5.034 1.00 0.00 C ATOM 87 C LEU A 12 -19.703 -4.847 -5.472 1.00 0.00 C ATOM 88 O LEU A 12 -20.291 -5.470 -6.351 1.00 0.00 O ATOM 89 CB LEU A 12 -19.805 -2.371 -6.084 1.00 0.00 C ATOM 90 CG LEU A 12 -20.928 -2.093 -7.090 1.00 0.00 C ATOM 91 CD1 LEU A 12 -20.794 -0.662 -7.604 1.00 0.00 C ATOM 92 CD2 LEU A 12 -20.901 -3.051 -8.281 1.00 0.00 C ATOM 0 H LEU A 12 -18.807 -2.394 -3.796 1.00 0.00 H new ATOM 0 HA LEU A 12 -21.245 -3.504 -4.936 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -19.549 -1.443 -5.574 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -18.916 -2.692 -6.626 1.00 0.00 H new ATOM 0 HG LEU A 12 -21.875 -2.239 -6.571 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -21.590 -0.457 -8.320 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -20.870 0.033 -6.768 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -19.827 -0.539 -8.091 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -21.718 -2.809 -8.961 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -19.951 -2.953 -8.805 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -21.016 -4.075 -7.927 1.00 0.00 H new ATOM 104 N ASP A 13 -18.572 -5.291 -4.916 1.00 0.00 N ATOM 105 CA ASP A 13 -17.947 -6.633 -5.097 1.00 0.00 C ATOM 106 C ASP A 13 -17.337 -6.926 -6.476 1.00 0.00 C ATOM 107 O ASP A 13 -16.502 -7.833 -6.587 1.00 0.00 O ATOM 108 CB ASP A 13 -18.903 -7.766 -4.678 1.00 0.00 C ATOM 109 CG ASP A 13 -18.191 -9.112 -4.505 1.00 0.00 C ATOM 110 OD1 ASP A 13 -17.063 -9.114 -3.964 1.00 0.00 O ATOM 111 OD2 ASP A 13 -18.771 -10.124 -4.960 1.00 0.00 O ATOM 0 H ASP A 13 -18.026 -4.700 -4.289 1.00 0.00 H new ATOM 0 HA ASP A 13 -17.090 -6.598 -4.424 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -19.391 -7.496 -3.742 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -19.687 -7.869 -5.428 1.00 0.00 H new ATOM 116 N ARG A 14 -17.796 -6.243 -7.519 1.00 0.00 N ATOM 117 CA ARG A 14 -17.298 -6.364 -8.909 1.00 0.00 C ATOM 118 C ARG A 14 -15.757 -6.244 -8.984 1.00 0.00 C ATOM 119 O ARG A 14 -15.185 -5.180 -8.746 1.00 0.00 O ATOM 120 CB ARG A 14 -17.970 -5.271 -9.742 1.00 0.00 C ATOM 121 CG ARG A 14 -18.017 -5.598 -11.242 1.00 0.00 C ATOM 122 CD ARG A 14 -19.079 -6.642 -11.590 1.00 0.00 C ATOM 123 NE ARG A 14 -20.417 -6.045 -11.480 1.00 0.00 N ATOM 124 CZ ARG A 14 -21.362 -6.344 -10.581 1.00 0.00 C ATOM 125 NH1 ARG A 14 -21.193 -7.275 -9.653 1.00 0.00 N ATOM 126 NH2 ARG A 14 -22.518 -5.708 -10.609 1.00 0.00 N ATOM 0 H ARG A 14 -18.551 -5.563 -7.430 1.00 0.00 H new ATOM 0 HA ARG A 14 -17.547 -7.351 -9.299 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -18.986 -5.118 -9.378 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -17.435 -4.332 -9.598 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -18.216 -4.684 -11.802 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -17.040 -5.961 -11.561 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -18.919 -7.014 -12.602 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -18.996 -7.497 -10.919 1.00 0.00 H new ATOM 0 HE ARG A 14 -20.651 -5.324 -12.163 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -20.317 -7.795 -9.605 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -21.939 -7.472 -8.986 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -22.689 -4.991 -11.314 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -23.241 -5.933 -9.925 1.00 0.00 H new ATOM 140 N LEU A 15 -15.148 -7.418 -9.151 1.00 0.00 N ATOM 141 CA LEU A 15 -13.694 -7.687 -9.189 1.00 0.00 C ATOM 142 C LEU A 15 -12.901 -7.526 -7.880 1.00 0.00 C ATOM 143 O LEU A 15 -11.670 -7.625 -7.862 1.00 0.00 O ATOM 144 CB LEU A 15 -13.023 -6.943 -10.365 1.00 0.00 C ATOM 145 CG LEU A 15 -12.929 -7.768 -11.654 1.00 0.00 C ATOM 146 CD1 LEU A 15 -14.289 -8.213 -12.204 1.00 0.00 C ATOM 147 CD2 LEU A 15 -12.194 -6.958 -12.721 1.00 0.00 C ATOM 0 H LEU A 15 -15.689 -8.274 -9.273 1.00 0.00 H new ATOM 0 HA LEU A 15 -13.647 -8.764 -9.350 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -13.582 -6.030 -10.570 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -12.019 -6.641 -10.065 1.00 0.00 H new ATOM 0 HG LEU A 15 -12.383 -8.677 -11.401 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -14.141 -8.791 -13.116 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -14.798 -8.829 -11.462 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -14.897 -7.336 -12.425 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -12.126 -7.542 -13.639 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -12.740 -6.036 -12.918 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -11.191 -6.718 -12.369 1.00 0.00 H new ATOM 159 N TYR A 16 -13.625 -7.600 -6.764 1.00 0.00 N ATOM 160 CA TYR A 16 -13.055 -7.543 -5.400 1.00 0.00 C ATOM 161 C TYR A 16 -12.494 -8.903 -4.938 1.00 0.00 C ATOM 162 O TYR A 16 -11.442 -8.981 -4.311 1.00 0.00 O ATOM 163 CB TYR A 16 -14.116 -7.060 -4.396 1.00 0.00 C ATOM 164 CG TYR A 16 -14.632 -5.610 -4.518 1.00 0.00 C ATOM 165 CD1 TYR A 16 -14.681 -4.927 -5.743 1.00 0.00 C ATOM 166 CD2 TYR A 16 -15.279 -5.047 -3.406 1.00 0.00 C ATOM 167 CE1 TYR A 16 -15.397 -3.733 -5.875 1.00 0.00 C ATOM 168 CE2 TYR A 16 -15.981 -3.840 -3.536 1.00 0.00 C ATOM 169 CZ TYR A 16 -16.051 -3.192 -4.771 1.00 0.00 C ATOM 170 OH TYR A 16 -16.842 -2.108 -4.915 1.00 0.00 O ATOM 0 H TYR A 16 -14.640 -7.703 -6.772 1.00 0.00 H new ATOM 0 HA TYR A 16 -12.226 -6.836 -5.435 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -14.975 -7.726 -4.474 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -13.706 -7.184 -3.394 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -14.157 -5.330 -6.597 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -15.236 -5.545 -2.448 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -15.443 -3.232 -6.831 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -16.471 -3.409 -2.675 1.00 0.00 H new ATOM 0 HH TYR A 16 -16.509 -1.556 -5.653 1.00 0.00 H new ATOM 180 N SER A 17 -13.277 -9.956 -5.176 1.00 0.00 N ATOM 181 CA SER A 17 -12.937 -11.357 -4.834 1.00 0.00 C ATOM 182 C SER A 17 -11.793 -11.948 -5.688 1.00 0.00 C ATOM 183 O SER A 17 -12.038 -12.543 -6.738 1.00 0.00 O ATOM 184 CB SER A 17 -14.180 -12.237 -4.969 1.00 0.00 C ATOM 185 OG SER A 17 -15.267 -11.698 -4.209 1.00 0.00 O ATOM 0 H SER A 17 -14.190 -9.867 -5.623 1.00 0.00 H new ATOM 0 HA SER A 17 -12.580 -11.342 -3.804 1.00 0.00 H new ATOM 0 HB2 SER A 17 -14.466 -12.313 -6.018 1.00 0.00 H new ATOM 0 HB3 SER A 17 -13.956 -13.247 -4.626 1.00 0.00 H new ATOM 0 HG SER A 17 -16.054 -12.274 -4.309 1.00 0.00 H new ATOM 191 N LYS A 18 -10.566 -11.705 -5.233 1.00 0.00 N ATOM 192 CA LYS A 18 -9.288 -12.281 -5.714 1.00 0.00 C ATOM 193 C LYS A 18 -8.840 -12.006 -7.175 1.00 0.00 C ATOM 194 O LYS A 18 -7.701 -11.615 -7.397 1.00 0.00 O ATOM 195 CB LYS A 18 -9.174 -13.784 -5.421 1.00 0.00 C ATOM 196 CG LYS A 18 -8.952 -14.045 -3.926 1.00 0.00 C ATOM 197 CD LYS A 18 -8.687 -15.534 -3.651 1.00 0.00 C ATOM 198 CE LYS A 18 -8.417 -15.757 -2.161 1.00 0.00 C ATOM 199 NZ LYS A 18 -8.117 -17.168 -1.868 1.00 0.00 N ATOM 0 H LYS A 18 -10.415 -11.054 -4.462 1.00 0.00 H new ATOM 0 HA LYS A 18 -8.586 -11.700 -5.116 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -10.081 -14.291 -5.750 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -8.348 -14.207 -5.993 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -8.108 -13.452 -3.573 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -9.828 -13.720 -3.364 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -9.545 -16.128 -3.965 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -7.833 -15.873 -4.237 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -7.580 -15.134 -1.845 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -9.285 -15.442 -1.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -7.940 -17.281 -0.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -8.926 -17.760 -2.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -7.274 -17.461 -2.401 1.00 0.00 H new ATOM 213 N LEU A 19 -9.727 -12.271 -8.127 1.00 0.00 N ATOM 214 CA LEU A 19 -9.492 -12.120 -9.579 1.00 0.00 C ATOM 215 C LEU A 19 -9.369 -10.652 -10.039 1.00 0.00 C ATOM 216 O LEU A 19 -10.373 -9.975 -10.204 1.00 0.00 O ATOM 217 CB LEU A 19 -10.512 -12.947 -10.375 1.00 0.00 C ATOM 218 CG LEU A 19 -11.973 -12.843 -9.899 1.00 0.00 C ATOM 219 CD1 LEU A 19 -12.786 -11.836 -10.711 1.00 0.00 C ATOM 220 CD2 LEU A 19 -12.624 -14.221 -9.911 1.00 0.00 C ATOM 0 H LEU A 19 -10.665 -12.609 -7.914 1.00 0.00 H new ATOM 0 HA LEU A 19 -8.507 -12.531 -9.798 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -10.467 -12.638 -11.419 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -10.211 -13.994 -10.339 1.00 0.00 H new ATOM 0 HG LEU A 19 -11.960 -12.466 -8.876 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -13.808 -11.804 -10.332 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -12.335 -10.848 -10.622 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -12.797 -12.137 -11.759 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -13.657 -14.138 -9.573 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -12.605 -14.624 -10.924 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -12.077 -14.888 -9.245 1.00 0.00 H new ATOM 232 N PRO A 20 -8.134 -10.196 -10.310 1.00 0.00 N ATOM 233 CA PRO A 20 -7.849 -8.774 -10.641 1.00 0.00 C ATOM 234 C PRO A 20 -8.542 -8.267 -11.921 1.00 0.00 C ATOM 235 O PRO A 20 -8.808 -7.081 -12.048 1.00 0.00 O ATOM 236 CB PRO A 20 -6.325 -8.706 -10.743 1.00 0.00 C ATOM 237 CG PRO A 20 -5.917 -10.102 -11.206 1.00 0.00 C ATOM 238 CD PRO A 20 -6.914 -11.014 -10.488 1.00 0.00 C ATOM 0 HA PRO A 20 -8.253 -8.112 -9.875 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -6.007 -7.942 -11.453 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -5.873 -8.457 -9.783 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -5.986 -10.203 -12.289 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -4.888 -10.333 -10.929 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -7.122 -11.908 -11.075 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -6.521 -11.348 -9.528 1.00 0.00 H new ATOM 246 N GLU A 21 -8.714 -9.165 -12.888 1.00 0.00 N ATOM 247 CA GLU A 21 -9.415 -8.891 -14.157 1.00 0.00 C ATOM 248 C GLU A 21 -10.270 -10.098 -14.576 1.00 0.00 C ATOM 249 O GLU A 21 -9.856 -11.235 -14.360 1.00 0.00 O ATOM 250 CB GLU A 21 -8.413 -8.495 -15.265 1.00 0.00 C ATOM 251 CG GLU A 21 -7.319 -9.538 -15.543 1.00 0.00 C ATOM 252 CD GLU A 21 -6.349 -9.049 -16.620 1.00 0.00 C ATOM 253 OE1 GLU A 21 -5.349 -8.409 -16.227 1.00 0.00 O ATOM 254 OE2 GLU A 21 -6.606 -9.359 -17.799 1.00 0.00 O ATOM 0 H GLU A 21 -8.367 -10.122 -12.819 1.00 0.00 H new ATOM 0 HA GLU A 21 -10.086 -8.046 -14.004 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -8.965 -8.313 -16.187 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.937 -7.555 -14.987 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.771 -9.748 -14.624 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.778 -10.474 -15.861 1.00 0.00 H new ATOM 261 N LYS A 22 -11.434 -9.781 -15.141 1.00 0.00 N ATOM 262 CA LYS A 22 -12.439 -10.728 -15.697 1.00 0.00 C ATOM 263 C LYS A 22 -13.638 -10.003 -16.332 1.00 0.00 C ATOM 264 O LYS A 22 -13.954 -10.248 -17.493 1.00 0.00 O ATOM 265 CB LYS A 22 -12.974 -11.755 -14.685 1.00 0.00 C ATOM 266 CG LYS A 22 -12.255 -13.100 -14.832 1.00 0.00 C ATOM 267 CD LYS A 22 -12.799 -14.144 -13.851 1.00 0.00 C ATOM 268 CE LYS A 22 -11.966 -15.423 -13.855 1.00 0.00 C ATOM 269 NZ LYS A 22 -10.605 -15.188 -13.326 1.00 0.00 N ATOM 0 H LYS A 22 -11.731 -8.810 -15.235 1.00 0.00 H new ATOM 0 HA LYS A 22 -11.881 -11.270 -16.460 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.840 -11.376 -13.672 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -14.045 -11.893 -14.834 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -12.371 -13.465 -15.853 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.187 -12.962 -14.662 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -12.813 -13.724 -12.845 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -13.830 -14.383 -14.111 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -12.464 -16.184 -13.254 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.900 -15.812 -14.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -10.341 -15.966 -12.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -9.929 -15.142 -14.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -10.587 -14.290 -12.802 1.00 0.00 H new ATOM 283 N GLY A 23 -14.278 -9.154 -15.542 1.00 0.00 N ATOM 284 CA GLY A 23 -15.442 -8.356 -15.981 1.00 0.00 C ATOM 285 C GLY A 23 -15.168 -6.847 -15.922 1.00 0.00 C ATOM 286 O GLY A 23 -14.281 -6.344 -16.606 1.00 0.00 O ATOM 0 H GLY A 23 -14.013 -8.989 -14.571 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -15.708 -8.635 -17.001 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -16.300 -8.592 -15.352 1.00 0.00 H new ATOM 290 N ARG A 24 -15.894 -6.185 -15.031 1.00 0.00 N ATOM 291 CA ARG A 24 -15.855 -4.713 -14.857 1.00 0.00 C ATOM 292 C ARG A 24 -15.341 -4.325 -13.461 1.00 0.00 C ATOM 293 O ARG A 24 -15.270 -5.159 -12.562 1.00 0.00 O ATOM 294 CB ARG A 24 -17.240 -4.095 -15.114 1.00 0.00 C ATOM 295 CG ARG A 24 -17.587 -3.951 -16.601 1.00 0.00 C ATOM 296 CD ARG A 24 -17.956 -5.280 -17.270 1.00 0.00 C ATOM 297 NE ARG A 24 -18.011 -5.121 -18.730 1.00 0.00 N ATOM 298 CZ ARG A 24 -17.177 -5.678 -19.622 1.00 0.00 C ATOM 299 NH1 ARG A 24 -16.005 -6.188 -19.275 1.00 0.00 N ATOM 300 NH2 ARG A 24 -17.403 -5.512 -20.916 1.00 0.00 N ATOM 0 H ARG A 24 -16.540 -6.649 -14.393 1.00 0.00 H new ATOM 0 HA ARG A 24 -15.157 -4.314 -15.592 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -17.998 -4.712 -14.632 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -17.282 -3.113 -14.644 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -18.420 -3.256 -16.707 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -16.737 -3.513 -17.124 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -17.222 -6.042 -17.008 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -18.921 -5.626 -16.899 1.00 0.00 H new ATOM 0 HE ARG A 24 -18.755 -4.530 -19.101 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -15.708 -6.166 -18.299 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -15.399 -6.603 -19.983 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -18.205 -4.965 -21.227 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -16.775 -5.931 -21.601 1.00 0.00 H new ATOM 314 N LYS A 25 -14.964 -3.045 -13.334 1.00 0.00 N ATOM 315 CA LYS A 25 -14.392 -2.447 -12.102 1.00 0.00 C ATOM 316 C LYS A 25 -13.062 -3.097 -11.686 1.00 0.00 C ATOM 317 O LYS A 25 -12.358 -3.650 -12.526 1.00 0.00 O ATOM 318 CB LYS A 25 -15.410 -2.469 -10.939 1.00 0.00 C ATOM 319 CG LYS A 25 -16.491 -1.398 -11.036 1.00 0.00 C ATOM 320 CD LYS A 25 -17.458 -1.450 -9.846 1.00 0.00 C ATOM 321 CE LYS A 25 -16.820 -1.105 -8.488 1.00 0.00 C ATOM 322 NZ LYS A 25 -16.444 0.314 -8.391 1.00 0.00 N ATOM 0 H LYS A 25 -15.047 -2.375 -14.098 1.00 0.00 H new ATOM 0 HA LYS A 25 -14.170 -1.407 -12.341 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -15.887 -3.449 -10.906 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -14.873 -2.344 -9.999 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -16.024 -0.414 -11.081 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -17.049 -1.529 -11.963 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -18.281 -0.760 -10.032 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -17.888 -2.450 -9.787 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -17.520 -1.348 -7.688 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -15.936 -1.724 -8.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -16.019 0.498 -7.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -15.756 0.543 -9.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -17.291 0.906 -8.508 1.00 0.00 H new ATOM 336 N GLU A 26 -12.586 -2.670 -10.514 1.00 0.00 N ATOM 337 CA GLU A 26 -11.404 -3.231 -9.835 1.00 0.00 C ATOM 338 C GLU A 26 -11.774 -3.430 -8.346 1.00 0.00 C ATOM 339 O GLU A 26 -12.284 -4.485 -7.978 1.00 0.00 O ATOM 340 CB GLU A 26 -10.150 -2.356 -10.009 1.00 0.00 C ATOM 341 CG GLU A 26 -9.687 -2.175 -11.463 1.00 0.00 C ATOM 342 CD GLU A 26 -10.208 -0.905 -12.161 1.00 0.00 C ATOM 343 OE1 GLU A 26 -11.309 -0.409 -11.792 1.00 0.00 O ATOM 344 OE2 GLU A 26 -9.460 -0.391 -13.015 1.00 0.00 O ATOM 0 H GLU A 26 -13.019 -1.906 -9.994 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.141 -4.187 -10.288 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.347 -1.373 -9.580 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.335 -2.796 -9.435 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.597 -2.160 -11.482 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -10.004 -3.044 -12.040 1.00 0.00 H new ATOM 351 N GLY A 27 -11.648 -2.353 -7.573 1.00 0.00 N ATOM 352 CA GLY A 27 -12.065 -2.280 -6.167 1.00 0.00 C ATOM 353 C GLY A 27 -11.618 -0.960 -5.519 1.00 0.00 C ATOM 354 O GLY A 27 -10.927 -0.153 -6.139 1.00 0.00 O ATOM 0 H GLY A 27 -11.242 -1.481 -7.913 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -13.149 -2.370 -6.102 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -11.642 -3.120 -5.616 1.00 0.00 H new ATOM 358 N THR A 28 -12.184 -0.705 -4.352 1.00 0.00 N ATOM 359 CA THR A 28 -11.748 0.404 -3.468 1.00 0.00 C ATOM 360 C THR A 28 -11.270 -0.186 -2.133 1.00 0.00 C ATOM 361 O THR A 28 -12.037 -0.604 -1.267 1.00 0.00 O ATOM 362 CB THR A 28 -12.792 1.525 -3.324 1.00 0.00 C ATOM 363 OG1 THR A 28 -12.269 2.538 -2.456 1.00 0.00 O ATOM 364 CG2 THR A 28 -14.176 1.037 -2.896 1.00 0.00 C ATOM 0 H THR A 28 -12.959 -1.250 -3.975 1.00 0.00 H new ATOM 0 HA THR A 28 -10.907 0.917 -3.935 1.00 0.00 H new ATOM 0 HB THR A 28 -12.964 1.950 -4.313 1.00 0.00 H new ATOM 0 HG1 THR A 28 -12.927 3.258 -2.359 1.00 0.00 H new ATOM 0 HG21 THR A 28 -14.853 1.887 -2.817 1.00 0.00 H new ATOM 0 HG22 THR A 28 -14.559 0.335 -3.636 1.00 0.00 H new ATOM 0 HG23 THR A 28 -14.104 0.540 -1.929 1.00 0.00 H new ATOM 372 N GLN A 29 -9.959 -0.403 -2.140 1.00 0.00 N ATOM 373 CA GLN A 29 -9.246 -1.284 -1.193 1.00 0.00 C ATOM 374 C GLN A 29 -8.351 -0.601 -0.156 1.00 0.00 C ATOM 375 O GLN A 29 -7.564 0.287 -0.474 1.00 0.00 O ATOM 376 CB GLN A 29 -8.432 -2.345 -1.962 1.00 0.00 C ATOM 377 CG GLN A 29 -7.517 -1.821 -3.079 1.00 0.00 C ATOM 378 CD GLN A 29 -8.324 -1.346 -4.288 1.00 0.00 C ATOM 379 OE1 GLN A 29 -8.407 -0.051 -4.512 1.00 0.00 O flip ATOM 380 NE2 GLN A 29 -8.920 -2.128 -5.021 1.00 0.00 N flip ATOM 0 H GLN A 29 -9.337 0.036 -2.819 1.00 0.00 H new ATOM 0 HA GLN A 29 -10.046 -1.735 -0.606 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.819 -2.892 -1.246 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -9.128 -3.061 -2.398 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.911 -0.998 -2.699 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -6.829 -2.608 -3.386 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -8.859 -3.132 -4.852 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -9.476 -1.774 -5.799 1.00 0.00 H new ATOM 389 N SER A 30 -8.424 -1.231 1.011 1.00 0.00 N ATOM 390 CA SER A 30 -7.676 -1.015 2.280 1.00 0.00 C ATOM 391 C SER A 30 -8.641 -1.175 3.465 1.00 0.00 C ATOM 392 O SER A 30 -9.796 -0.771 3.357 1.00 0.00 O ATOM 393 CB SER A 30 -6.926 0.307 2.470 1.00 0.00 C ATOM 394 OG SER A 30 -5.818 0.378 1.571 1.00 0.00 O ATOM 0 H SER A 30 -9.084 -2.001 1.121 1.00 0.00 H new ATOM 0 HA SER A 30 -6.890 -1.768 2.227 1.00 0.00 H new ATOM 0 HB2 SER A 30 -7.601 1.145 2.294 1.00 0.00 H new ATOM 0 HB3 SER A 30 -6.575 0.390 3.499 1.00 0.00 H new ATOM 0 HG SER A 30 -6.141 0.314 0.648 1.00 0.00 H new ATOM 400 N LEU A 31 -8.192 -1.959 4.438 1.00 0.00 N ATOM 401 CA LEU A 31 -8.893 -2.332 5.697 1.00 0.00 C ATOM 402 C LEU A 31 -8.111 -3.261 6.646 1.00 0.00 C ATOM 403 O LEU A 31 -7.937 -2.854 7.801 1.00 0.00 O ATOM 404 CB LEU A 31 -10.322 -2.891 5.490 1.00 0.00 C ATOM 405 CG LEU A 31 -11.386 -1.805 5.624 1.00 0.00 C ATOM 406 CD1 LEU A 31 -12.589 -2.129 4.730 1.00 0.00 C ATOM 407 CD2 LEU A 31 -11.849 -1.671 7.083 1.00 0.00 C ATOM 0 H LEU A 31 -7.268 -2.388 4.381 1.00 0.00 H new ATOM 0 HA LEU A 31 -8.968 -1.363 6.191 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -10.393 -3.348 4.503 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -10.513 -3.678 6.220 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.946 -0.859 5.308 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -13.341 -1.347 4.834 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -12.265 -2.185 3.691 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -13.017 -3.086 5.029 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -12.607 -0.891 7.154 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -12.270 -2.618 7.420 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -10.998 -1.408 7.712 1.00 0.00 H new ATOM 419 N PRO A 32 -7.563 -4.427 6.224 1.00 0.00 N ATOM 420 CA PRO A 32 -6.813 -5.316 7.139 1.00 0.00 C ATOM 421 C PRO A 32 -5.525 -4.703 7.719 1.00 0.00 C ATOM 422 O PRO A 32 -5.227 -4.906 8.891 1.00 0.00 O ATOM 423 CB PRO A 32 -6.555 -6.593 6.331 1.00 0.00 C ATOM 424 CG PRO A 32 -6.554 -6.121 4.890 1.00 0.00 C ATOM 425 CD PRO A 32 -7.610 -5.013 4.877 1.00 0.00 C ATOM 0 HA PRO A 32 -7.396 -5.510 8.039 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -5.604 -7.051 6.602 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -7.330 -7.340 6.506 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -5.575 -5.746 4.591 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -6.810 -6.928 4.203 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -7.389 -4.267 4.114 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -8.599 -5.413 4.655 1.00 0.00 H new ATOM 433 N ASN A 33 -4.755 -4.033 6.869 1.00 0.00 N ATOM 434 CA ASN A 33 -3.628 -3.178 7.291 1.00 0.00 C ATOM 435 C ASN A 33 -3.288 -2.176 6.184 1.00 0.00 C ATOM 436 O ASN A 33 -3.142 -2.532 5.015 1.00 0.00 O ATOM 437 CB ASN A 33 -2.377 -3.999 7.609 1.00 0.00 C ATOM 438 CG ASN A 33 -1.394 -3.165 8.437 1.00 0.00 C ATOM 439 OD1 ASN A 33 -0.765 -2.233 7.971 1.00 0.00 O ATOM 440 ND2 ASN A 33 -1.426 -3.359 9.736 1.00 0.00 N ATOM 0 H ASN A 33 -4.888 -4.062 5.858 1.00 0.00 H new ATOM 0 HA ASN A 33 -3.940 -2.657 8.196 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -2.654 -4.899 8.158 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -1.901 -4.323 6.684 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -0.922 -2.727 10.359 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -1.954 -4.141 10.122 1.00 0.00 H new ATOM 447 N MET A 34 -3.205 -0.919 6.609 1.00 0.00 N ATOM 448 CA MET A 34 -2.966 0.243 5.734 1.00 0.00 C ATOM 449 C MET A 34 -2.050 1.328 6.353 1.00 0.00 C ATOM 450 O MET A 34 -2.254 2.528 6.156 1.00 0.00 O ATOM 451 CB MET A 34 -4.322 0.795 5.255 1.00 0.00 C ATOM 452 CG MET A 34 -5.389 1.002 6.340 1.00 0.00 C ATOM 453 SD MET A 34 -4.980 2.261 7.601 1.00 0.00 S ATOM 454 CE MET A 34 -6.489 2.243 8.541 1.00 0.00 C ATOM 0 H MET A 34 -3.303 -0.665 7.592 1.00 0.00 H new ATOM 0 HA MET A 34 -2.395 -0.099 4.871 1.00 0.00 H new ATOM 0 HB2 MET A 34 -4.148 1.750 4.759 1.00 0.00 H new ATOM 0 HB3 MET A 34 -4.724 0.114 4.504 1.00 0.00 H new ATOM 0 HG2 MET A 34 -6.325 1.284 5.858 1.00 0.00 H new ATOM 0 HG3 MET A 34 -5.563 0.050 6.842 1.00 0.00 H new ATOM 0 HE1 MET A 34 -6.416 2.959 9.360 1.00 0.00 H new ATOM 0 HE2 MET A 34 -7.324 2.515 7.895 1.00 0.00 H new ATOM 0 HE3 MET A 34 -6.654 1.244 8.946 1.00 0.00 H new ATOM 464 N ILE A 35 -1.048 0.884 7.105 1.00 0.00 N ATOM 465 CA ILE A 35 -0.097 1.787 7.780 1.00 0.00 C ATOM 466 C ILE A 35 1.375 1.490 7.429 1.00 0.00 C ATOM 467 O ILE A 35 1.784 0.336 7.335 1.00 0.00 O ATOM 468 CB ILE A 35 -0.390 1.843 9.302 1.00 0.00 C ATOM 469 CG1 ILE A 35 0.401 3.005 9.941 1.00 0.00 C ATOM 470 CG2 ILE A 35 -0.135 0.496 10.000 1.00 0.00 C ATOM 471 CD1 ILE A 35 -0.169 3.469 11.284 1.00 0.00 C ATOM 0 H ILE A 35 -0.865 -0.106 7.269 1.00 0.00 H new ATOM 0 HA ILE A 35 -0.255 2.793 7.392 1.00 0.00 H new ATOM 0 HB ILE A 35 -1.453 2.038 9.442 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.436 2.694 10.083 1.00 0.00 H new ATOM 0 HG13 ILE A 35 0.413 3.848 9.250 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -0.355 0.590 11.063 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -0.778 -0.268 9.562 1.00 0.00 H new ATOM 0 HG23 ILE A 35 0.909 0.210 9.869 1.00 0.00 H new ATOM 0 HD11 ILE A 35 0.437 4.287 11.673 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.194 3.811 11.145 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.156 2.639 11.991 1.00 0.00 H new ATOM 483 N ILE A 36 2.071 2.549 7.043 1.00 0.00 N ATOM 484 CA ILE A 36 3.525 2.502 6.785 1.00 0.00 C ATOM 485 C ILE A 36 4.324 2.297 8.087 1.00 0.00 C ATOM 486 O ILE A 36 4.315 3.117 9.002 1.00 0.00 O ATOM 487 CB ILE A 36 4.034 3.741 6.015 1.00 0.00 C ATOM 488 CG1 ILE A 36 3.300 3.909 4.682 1.00 0.00 C ATOM 489 CG2 ILE A 36 5.554 3.623 5.742 1.00 0.00 C ATOM 490 CD1 ILE A 36 3.430 5.298 4.059 1.00 0.00 C ATOM 0 H ILE A 36 1.656 3.469 6.897 1.00 0.00 H new ATOM 0 HA ILE A 36 3.693 1.638 6.142 1.00 0.00 H new ATOM 0 HB ILE A 36 3.838 4.614 6.638 1.00 0.00 H new ATOM 0 HG12 ILE A 36 3.681 3.171 3.976 1.00 0.00 H new ATOM 0 HG13 ILE A 36 2.243 3.690 4.833 1.00 0.00 H new ATOM 0 HG21 ILE A 36 5.896 4.504 5.199 1.00 0.00 H new ATOM 0 HG22 ILE A 36 6.089 3.550 6.689 1.00 0.00 H new ATOM 0 HG23 ILE A 36 5.748 2.731 5.146 1.00 0.00 H new ATOM 0 HD11 ILE A 36 2.880 5.328 3.118 1.00 0.00 H new ATOM 0 HD12 ILE A 36 3.021 6.043 4.742 1.00 0.00 H new ATOM 0 HD13 ILE A 36 4.481 5.516 3.872 1.00 0.00 H new ATOM 502 N LEU A 37 5.085 1.207 8.058 1.00 0.00 N ATOM 503 CA LEU A 37 6.188 0.959 9.003 1.00 0.00 C ATOM 504 C LEU A 37 7.499 1.293 8.280 1.00 0.00 C ATOM 505 O LEU A 37 7.682 0.956 7.117 1.00 0.00 O ATOM 506 CB LEU A 37 6.196 -0.506 9.463 1.00 0.00 C ATOM 507 CG LEU A 37 4.957 -0.960 10.252 1.00 0.00 C ATOM 508 CD1 LEU A 37 3.834 -1.444 9.328 1.00 0.00 C ATOM 509 CD2 LEU A 37 5.347 -2.043 11.255 1.00 0.00 C ATOM 0 H LEU A 37 4.959 0.460 7.375 1.00 0.00 H new ATOM 0 HA LEU A 37 6.066 1.579 9.891 1.00 0.00 H new ATOM 0 HB2 LEU A 37 6.299 -1.144 8.585 1.00 0.00 H new ATOM 0 HB3 LEU A 37 7.079 -0.669 10.081 1.00 0.00 H new ATOM 0 HG LEU A 37 4.569 -0.098 10.794 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.978 -1.755 9.927 1.00 0.00 H new ATOM 0 HD12 LEU A 37 3.536 -0.634 8.663 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.188 -2.288 8.736 1.00 0.00 H new ATOM 0 HD21 LEU A 37 4.464 -2.360 11.810 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.767 -2.897 10.723 1.00 0.00 H new ATOM 0 HD23 LEU A 37 6.089 -1.647 11.948 1.00 0.00 H new ATOM 521 N ASN A 38 8.387 1.991 8.991 1.00 0.00 N ATOM 522 CA ASN A 38 9.632 2.519 8.400 1.00 0.00 C ATOM 523 C ASN A 38 10.895 1.988 9.083 1.00 0.00 C ATOM 524 O ASN A 38 11.015 1.979 10.308 1.00 0.00 O ATOM 525 CB ASN A 38 9.595 4.057 8.484 1.00 0.00 C ATOM 526 CG ASN A 38 10.816 4.739 7.843 1.00 0.00 C ATOM 527 OD1 ASN A 38 11.344 4.361 6.810 1.00 0.00 O ATOM 528 ND2 ASN A 38 11.215 5.852 8.406 1.00 0.00 N ATOM 0 H ASN A 38 8.272 2.208 9.981 1.00 0.00 H new ATOM 0 HA ASN A 38 9.681 2.182 7.365 1.00 0.00 H new ATOM 0 HB2 ASN A 38 8.690 4.417 7.995 1.00 0.00 H new ATOM 0 HB3 ASN A 38 9.532 4.354 9.531 1.00 0.00 H new ATOM 0 HD21 ASN A 38 11.964 6.399 7.981 1.00 0.00 H new ATOM 0 HD22 ASN A 38 10.777 6.172 9.270 1.00 0.00 H new ATOM 535 N ILE A 39 11.862 1.669 8.229 1.00 0.00 N ATOM 536 CA ILE A 39 13.243 1.355 8.627 1.00 0.00 C ATOM 537 C ILE A 39 14.221 2.318 7.907 1.00 0.00 C ATOM 538 O ILE A 39 14.663 2.093 6.779 1.00 0.00 O ATOM 539 CB ILE A 39 13.547 -0.160 8.500 1.00 0.00 C ATOM 540 CG1 ILE A 39 14.964 -0.468 9.020 1.00 0.00 C ATOM 541 CG2 ILE A 39 13.292 -0.715 7.088 1.00 0.00 C ATOM 542 CD1 ILE A 39 15.178 -1.941 9.385 1.00 0.00 C ATOM 0 H ILE A 39 11.712 1.619 7.221 1.00 0.00 H new ATOM 0 HA ILE A 39 13.388 1.540 9.691 1.00 0.00 H new ATOM 0 HB ILE A 39 12.837 -0.690 9.134 1.00 0.00 H new ATOM 0 HG12 ILE A 39 15.691 -0.182 8.260 1.00 0.00 H new ATOM 0 HG13 ILE A 39 15.161 0.147 9.898 1.00 0.00 H new ATOM 0 HG21 ILE A 39 13.524 -1.780 7.068 1.00 0.00 H new ATOM 0 HG22 ILE A 39 12.245 -0.567 6.822 1.00 0.00 H new ATOM 0 HG23 ILE A 39 13.926 -0.192 6.372 1.00 0.00 H new ATOM 0 HD11 ILE A 39 16.198 -2.083 9.743 1.00 0.00 H new ATOM 0 HD12 ILE A 39 14.475 -2.228 10.168 1.00 0.00 H new ATOM 0 HD13 ILE A 39 15.013 -2.562 8.504 1.00 0.00 H new ATOM 554 N GLY A 40 14.410 3.442 8.585 1.00 0.00 N ATOM 555 CA GLY A 40 15.236 4.589 8.134 1.00 0.00 C ATOM 556 C GLY A 40 14.512 5.394 7.040 1.00 0.00 C ATOM 557 O GLY A 40 13.775 6.337 7.326 1.00 0.00 O ATOM 0 H GLY A 40 13.984 3.601 9.498 1.00 0.00 H new ATOM 0 HA2 GLY A 40 15.457 5.238 8.981 1.00 0.00 H new ATOM 0 HA3 GLY A 40 16.190 4.227 7.752 1.00 0.00 H new ATOM 561 N ASN A 41 14.852 5.056 5.801 1.00 0.00 N ATOM 562 CA ASN A 41 14.163 5.579 4.591 1.00 0.00 C ATOM 563 C ASN A 41 13.262 4.548 3.896 1.00 0.00 C ATOM 564 O ASN A 41 12.410 4.906 3.077 1.00 0.00 O ATOM 565 CB ASN A 41 15.215 6.100 3.602 1.00 0.00 C ATOM 566 CG ASN A 41 15.949 7.320 4.157 1.00 0.00 C ATOM 567 OD1 ASN A 41 16.998 7.233 4.763 1.00 0.00 O ATOM 568 ND2 ASN A 41 15.348 8.480 3.996 1.00 0.00 N ATOM 0 H ASN A 41 15.613 4.411 5.590 1.00 0.00 H new ATOM 0 HA ASN A 41 13.504 6.381 4.923 1.00 0.00 H new ATOM 0 HB2 ASN A 41 15.933 5.310 3.384 1.00 0.00 H new ATOM 0 HB3 ASN A 41 14.733 6.361 2.660 1.00 0.00 H new ATOM 0 HD21 ASN A 41 15.763 9.327 4.384 1.00 0.00 H new ATOM 0 HD22 ASN A 41 14.467 8.531 3.484 1.00 0.00 H new ATOM 575 N THR A 42 13.617 3.284 4.086 1.00 0.00 N ATOM 576 CA THR A 42 12.924 2.091 3.547 1.00 0.00 C ATOM 577 C THR A 42 11.584 1.835 4.252 1.00 0.00 C ATOM 578 O THR A 42 11.536 1.595 5.461 1.00 0.00 O ATOM 579 CB THR A 42 13.769 0.824 3.700 1.00 0.00 C ATOM 580 OG1 THR A 42 15.056 1.078 4.271 1.00 0.00 O ATOM 581 CG2 THR A 42 13.898 0.103 2.352 1.00 0.00 C ATOM 0 H THR A 42 14.433 3.036 4.645 1.00 0.00 H new ATOM 0 HA THR A 42 12.756 2.307 2.492 1.00 0.00 H new ATOM 0 HB THR A 42 13.246 0.175 4.402 1.00 0.00 H new ATOM 0 HG1 THR A 42 14.955 1.292 5.222 1.00 0.00 H new ATOM 0 HG21 THR A 42 14.502 -0.796 2.477 1.00 0.00 H new ATOM 0 HG22 THR A 42 12.907 -0.172 1.990 1.00 0.00 H new ATOM 0 HG23 THR A 42 14.377 0.764 1.630 1.00 0.00 H new ATOM 589 N THR A 43 10.505 1.976 3.484 1.00 0.00 N ATOM 590 CA THR A 43 9.177 1.473 3.886 1.00 0.00 C ATOM 591 C THR A 43 9.219 -0.063 3.990 1.00 0.00 C ATOM 592 O THR A 43 10.007 -0.697 3.296 1.00 0.00 O ATOM 593 CB THR A 43 8.044 1.833 2.906 1.00 0.00 C ATOM 594 OG1 THR A 43 8.187 1.159 1.659 1.00 0.00 O ATOM 595 CG2 THR A 43 7.919 3.343 2.661 1.00 0.00 C ATOM 0 H THR A 43 10.517 2.436 2.574 1.00 0.00 H new ATOM 0 HA THR A 43 8.959 1.953 4.840 1.00 0.00 H new ATOM 0 HB THR A 43 7.127 1.496 3.391 1.00 0.00 H new ATOM 0 HG1 THR A 43 7.374 1.282 1.125 1.00 0.00 H new ATOM 0 HG21 THR A 43 7.104 3.532 1.962 1.00 0.00 H new ATOM 0 HG22 THR A 43 7.713 3.849 3.604 1.00 0.00 H new ATOM 0 HG23 THR A 43 8.851 3.722 2.242 1.00 0.00 H new ATOM 603 N ILE A 44 8.488 -0.608 4.946 1.00 0.00 N ATOM 604 CA ILE A 44 8.237 -2.067 5.010 1.00 0.00 C ATOM 605 C ILE A 44 6.724 -2.333 5.030 1.00 0.00 C ATOM 606 O ILE A 44 6.029 -2.124 6.027 1.00 0.00 O ATOM 607 CB ILE A 44 9.069 -2.767 6.103 1.00 0.00 C ATOM 608 CG1 ILE A 44 8.843 -4.286 6.057 1.00 0.00 C ATOM 609 CG2 ILE A 44 8.855 -2.167 7.510 1.00 0.00 C ATOM 610 CD1 ILE A 44 9.908 -5.115 6.799 1.00 0.00 C ATOM 0 H ILE A 44 8.050 -0.075 5.697 1.00 0.00 H new ATOM 0 HA ILE A 44 8.606 -2.545 4.102 1.00 0.00 H new ATOM 0 HB ILE A 44 10.120 -2.581 5.884 1.00 0.00 H new ATOM 0 HG12 ILE A 44 7.865 -4.508 6.485 1.00 0.00 H new ATOM 0 HG13 ILE A 44 8.814 -4.605 5.015 1.00 0.00 H new ATOM 0 HG21 ILE A 44 9.469 -2.705 8.232 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.140 -1.115 7.504 1.00 0.00 H new ATOM 0 HG23 ILE A 44 7.805 -2.257 7.788 1.00 0.00 H new ATOM 0 HD11 ILE A 44 9.668 -6.175 6.714 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.887 -4.928 6.358 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.923 -4.830 7.851 1.00 0.00 H new ATOM 622 N ILE A 45 6.228 -2.583 3.826 1.00 0.00 N ATOM 623 CA ILE A 45 4.779 -2.720 3.552 1.00 0.00 C ATOM 624 C ILE A 45 4.411 -4.161 3.180 1.00 0.00 C ATOM 625 O ILE A 45 4.847 -4.708 2.161 1.00 0.00 O ATOM 626 CB ILE A 45 4.328 -1.723 2.454 1.00 0.00 C ATOM 627 CG1 ILE A 45 4.784 -0.275 2.710 1.00 0.00 C ATOM 628 CG2 ILE A 45 2.809 -1.785 2.214 1.00 0.00 C ATOM 629 CD1 ILE A 45 4.379 0.333 4.061 1.00 0.00 C ATOM 0 H ILE A 45 6.812 -2.699 2.998 1.00 0.00 H new ATOM 0 HA ILE A 45 4.243 -2.475 4.469 1.00 0.00 H new ATOM 0 HB ILE A 45 4.834 -2.048 1.545 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.870 -0.238 2.629 1.00 0.00 H new ATOM 0 HG13 ILE A 45 4.384 0.356 1.916 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.534 -1.071 1.437 1.00 0.00 H new ATOM 0 HG22 ILE A 45 2.531 -2.790 1.898 1.00 0.00 H new ATOM 0 HG23 ILE A 45 2.284 -1.537 3.137 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.755 1.354 4.128 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.292 0.340 4.146 1.00 0.00 H new ATOM 0 HD13 ILE A 45 4.802 -0.263 4.870 1.00 0.00 H new ATOM 641 N ARG A 46 3.601 -4.730 4.069 1.00 0.00 N ATOM 642 CA ARG A 46 2.949 -6.043 3.901 1.00 0.00 C ATOM 643 C ARG A 46 1.972 -6.117 2.701 1.00 0.00 C ATOM 644 O ARG A 46 2.385 -6.417 1.588 1.00 0.00 O ATOM 645 CB ARG A 46 2.338 -6.527 5.240 1.00 0.00 C ATOM 646 CG ARG A 46 1.522 -5.462 5.987 1.00 0.00 C ATOM 647 CD ARG A 46 0.911 -5.986 7.290 1.00 0.00 C ATOM 648 NE ARG A 46 -0.251 -6.850 7.006 1.00 0.00 N ATOM 649 CZ ARG A 46 -1.101 -7.373 7.888 1.00 0.00 C ATOM 650 NH1 ARG A 46 -0.997 -7.163 9.191 1.00 0.00 N ATOM 651 NH2 ARG A 46 -2.102 -8.113 7.447 1.00 0.00 N ATOM 0 H ARG A 46 3.368 -4.283 4.956 1.00 0.00 H new ATOM 0 HA ARG A 46 3.730 -6.753 3.628 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.697 -7.386 5.043 1.00 0.00 H new ATOM 0 HB3 ARG A 46 3.143 -6.872 5.889 1.00 0.00 H new ATOM 0 HG2 ARG A 46 2.164 -4.609 6.209 1.00 0.00 H new ATOM 0 HG3 ARG A 46 0.725 -5.100 5.337 1.00 0.00 H new ATOM 0 HD2 ARG A 46 1.660 -6.546 7.850 1.00 0.00 H new ATOM 0 HD3 ARG A 46 0.604 -5.149 7.917 1.00 0.00 H new ATOM 0 HE ARG A 46 -0.422 -7.071 6.025 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -0.243 -6.580 9.555 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -1.671 -7.584 9.831 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -2.214 -8.275 6.446 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -2.763 -8.522 8.107 1.00 0.00 H new ATOM 665 N ASN A 47 0.715 -5.728 2.914 1.00 0.00 N ATOM 666 CA ASN A 47 -0.354 -5.779 1.886 1.00 0.00 C ATOM 667 C ASN A 47 -0.360 -4.547 0.953 1.00 0.00 C ATOM 668 O ASN A 47 -1.380 -3.916 0.698 1.00 0.00 O ATOM 669 CB ASN A 47 -1.706 -5.961 2.598 1.00 0.00 C ATOM 670 CG ASN A 47 -1.809 -7.315 3.294 1.00 0.00 C ATOM 671 OD1 ASN A 47 -1.301 -7.531 4.383 1.00 0.00 O ATOM 672 ND2 ASN A 47 -2.445 -8.274 2.662 1.00 0.00 N ATOM 0 H ASN A 47 0.395 -5.363 3.811 1.00 0.00 H new ATOM 0 HA ASN A 47 -0.161 -6.628 1.230 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -1.839 -5.166 3.331 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -2.514 -5.864 1.872 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -2.515 -9.201 3.081 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -2.869 -8.092 1.752 1.00 0.00 H new ATOM 679 N PHE A 48 0.763 -4.410 0.245 1.00 0.00 N ATOM 680 CA PHE A 48 1.072 -3.253 -0.622 1.00 0.00 C ATOM 681 C PHE A 48 0.004 -2.839 -1.646 1.00 0.00 C ATOM 682 O PHE A 48 -0.343 -1.659 -1.708 1.00 0.00 O ATOM 683 CB PHE A 48 2.425 -3.420 -1.323 1.00 0.00 C ATOM 684 CG PHE A 48 2.652 -4.784 -1.990 1.00 0.00 C ATOM 685 CD1 PHE A 48 2.194 -5.036 -3.288 1.00 0.00 C ATOM 686 CD2 PHE A 48 3.355 -5.775 -1.289 1.00 0.00 C ATOM 687 CE1 PHE A 48 2.423 -6.276 -3.879 1.00 0.00 C ATOM 688 CE2 PHE A 48 3.576 -7.022 -1.882 1.00 0.00 C ATOM 689 CZ PHE A 48 3.110 -7.280 -3.180 1.00 0.00 C ATOM 0 H PHE A 48 1.504 -5.111 0.253 1.00 0.00 H new ATOM 0 HA PHE A 48 1.101 -2.428 0.090 1.00 0.00 H new ATOM 0 HB2 PHE A 48 2.522 -2.642 -2.081 1.00 0.00 H new ATOM 0 HB3 PHE A 48 3.217 -3.254 -0.593 1.00 0.00 H new ATOM 0 HD1 PHE A 48 1.663 -4.269 -3.832 1.00 0.00 H new ATOM 0 HD2 PHE A 48 3.725 -5.575 -0.294 1.00 0.00 H new ATOM 0 HE1 PHE A 48 2.070 -6.466 -4.882 1.00 0.00 H new ATOM 0 HE2 PHE A 48 4.107 -7.789 -1.339 1.00 0.00 H new ATOM 0 HZ PHE A 48 3.279 -8.244 -3.637 1.00 0.00 H new ATOM 699 N ALA A 49 -0.650 -3.824 -2.269 1.00 0.00 N ATOM 700 CA ALA A 49 -1.729 -3.598 -3.257 1.00 0.00 C ATOM 701 C ALA A 49 -2.844 -2.648 -2.772 1.00 0.00 C ATOM 702 O ALA A 49 -3.058 -1.611 -3.404 1.00 0.00 O ATOM 703 CB ALA A 49 -2.328 -4.940 -3.678 1.00 0.00 C ATOM 0 H ALA A 49 -0.450 -4.811 -2.106 1.00 0.00 H new ATOM 0 HA ALA A 49 -1.265 -3.099 -4.107 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -3.122 -4.772 -4.405 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.552 -5.561 -4.125 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -2.738 -5.446 -2.804 1.00 0.00 H new ATOM 709 N GLU A 50 -3.298 -2.844 -1.532 1.00 0.00 N ATOM 710 CA GLU A 50 -4.381 -2.000 -0.961 1.00 0.00 C ATOM 711 C GLU A 50 -3.984 -0.520 -0.817 1.00 0.00 C ATOM 712 O GLU A 50 -4.671 0.343 -1.339 1.00 0.00 O ATOM 713 CB GLU A 50 -4.965 -2.615 0.331 1.00 0.00 C ATOM 714 CG GLU A 50 -4.085 -2.590 1.587 1.00 0.00 C ATOM 715 CD GLU A 50 -4.743 -3.374 2.732 1.00 0.00 C ATOM 716 OE1 GLU A 50 -4.565 -4.613 2.730 1.00 0.00 O ATOM 717 OE2 GLU A 50 -5.500 -2.772 3.531 1.00 0.00 O ATOM 0 H GLU A 50 -2.947 -3.565 -0.902 1.00 0.00 H new ATOM 0 HA GLU A 50 -5.192 -1.995 -1.689 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.895 -2.094 0.561 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -5.224 -3.653 0.122 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -3.109 -3.019 1.361 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -3.916 -1.559 1.897 1.00 0.00 H new ATOM 724 N TYR A 51 -2.738 -0.309 -0.384 1.00 0.00 N ATOM 725 CA TYR A 51 -2.103 1.013 -0.263 1.00 0.00 C ATOM 726 C TYR A 51 -1.815 1.680 -1.613 1.00 0.00 C ATOM 727 O TYR A 51 -2.127 2.852 -1.821 1.00 0.00 O ATOM 728 CB TYR A 51 -0.784 0.845 0.504 1.00 0.00 C ATOM 729 CG TYR A 51 -0.742 1.508 1.891 1.00 0.00 C ATOM 730 CD1 TYR A 51 -1.410 2.706 2.155 1.00 0.00 C ATOM 731 CD2 TYR A 51 0.221 1.030 2.795 1.00 0.00 C ATOM 732 CE1 TYR A 51 -1.082 3.455 3.285 1.00 0.00 C ATOM 733 CE2 TYR A 51 0.550 1.792 3.924 1.00 0.00 C ATOM 734 CZ TYR A 51 -0.089 3.006 4.161 1.00 0.00 C ATOM 735 OH TYR A 51 0.143 3.680 5.311 1.00 0.00 O ATOM 0 H TYR A 51 -2.124 -1.072 -0.099 1.00 0.00 H new ATOM 0 HA TYR A 51 -2.802 1.663 0.263 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -0.585 -0.220 0.622 1.00 0.00 H new ATOM 0 HB3 TYR A 51 0.024 1.255 -0.101 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -2.181 3.053 1.483 1.00 0.00 H new ATOM 0 HD2 TYR A 51 0.705 0.080 2.621 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -1.596 4.384 3.484 1.00 0.00 H new ATOM 0 HE2 TYR A 51 1.302 1.436 4.613 1.00 0.00 H new ATOM 0 HH TYR A 51 -0.710 3.953 5.708 1.00 0.00 H new ATOM 745 N CYS A 52 -1.227 0.905 -2.530 1.00 0.00 N ATOM 746 CA CYS A 52 -0.881 1.328 -3.903 1.00 0.00 C ATOM 747 C CYS A 52 -2.116 1.754 -4.719 1.00 0.00 C ATOM 748 O CYS A 52 -2.101 2.807 -5.361 1.00 0.00 O ATOM 749 CB CYS A 52 -0.120 0.214 -4.615 1.00 0.00 C ATOM 750 SG CYS A 52 1.475 -0.204 -3.838 1.00 0.00 S ATOM 0 H CYS A 52 -0.969 -0.063 -2.338 1.00 0.00 H new ATOM 0 HA CYS A 52 -0.242 2.208 -3.823 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -0.744 -0.679 -4.643 1.00 0.00 H new ATOM 0 HB3 CYS A 52 0.057 0.511 -5.649 1.00 0.00 H new ATOM 0 HG CYS A 52 1.262 -0.771 -2.688 1.00 0.00 H new ATOM 756 N ASP A 53 -3.203 1.008 -4.546 1.00 0.00 N ATOM 757 CA ASP A 53 -4.522 1.349 -5.131 1.00 0.00 C ATOM 758 C ASP A 53 -5.369 2.299 -4.250 1.00 0.00 C ATOM 759 O ASP A 53 -6.594 2.202 -4.185 1.00 0.00 O ATOM 760 CB ASP A 53 -5.283 0.059 -5.474 1.00 0.00 C ATOM 761 CG ASP A 53 -4.596 -0.845 -6.494 1.00 0.00 C ATOM 762 OD1 ASP A 53 -4.704 -0.550 -7.707 1.00 0.00 O ATOM 763 OD2 ASP A 53 -3.975 -1.834 -6.053 1.00 0.00 O ATOM 0 H ASP A 53 -3.208 0.147 -3.998 1.00 0.00 H new ATOM 0 HA ASP A 53 -4.333 1.912 -6.045 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.439 -0.508 -4.556 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -6.269 0.327 -5.855 1.00 0.00 H new ATOM 768 N ARG A 54 -4.661 3.115 -3.464 1.00 0.00 N ATOM 769 CA ARG A 54 -5.220 4.253 -2.708 1.00 0.00 C ATOM 770 C ARG A 54 -4.531 5.565 -3.133 1.00 0.00 C ATOM 771 O ARG A 54 -5.019 6.207 -4.063 1.00 0.00 O ATOM 772 CB ARG A 54 -5.116 4.032 -1.195 1.00 0.00 C ATOM 773 CG ARG A 54 -6.173 3.073 -0.661 1.00 0.00 C ATOM 774 CD ARG A 54 -7.177 3.789 0.249 1.00 0.00 C ATOM 775 NE ARG A 54 -8.173 4.600 -0.484 1.00 0.00 N ATOM 776 CZ ARG A 54 -9.259 4.143 -1.113 1.00 0.00 C ATOM 777 NH1 ARG A 54 -9.466 2.855 -1.365 1.00 0.00 N ATOM 778 NH2 ARG A 54 -10.113 4.997 -1.642 1.00 0.00 N ATOM 0 H ARG A 54 -3.656 3.004 -3.328 1.00 0.00 H new ATOM 0 HA ARG A 54 -6.281 4.329 -2.945 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -4.126 3.643 -0.957 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -5.212 4.991 -0.686 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -6.702 2.612 -1.495 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -5.689 2.269 -0.107 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -7.700 3.047 0.853 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -6.633 4.435 0.938 1.00 0.00 H new ATOM 0 HE ARG A 54 -8.015 5.607 -0.512 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -8.777 2.161 -1.074 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -10.314 2.560 -1.849 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -9.942 6.000 -1.570 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -10.944 4.655 -2.124 1.00 0.00 H new ATOM 792 N ILE A 55 -3.366 5.846 -2.533 1.00 0.00 N ATOM 793 CA ILE A 55 -2.502 7.042 -2.744 1.00 0.00 C ATOM 794 C ILE A 55 -2.936 7.966 -3.899 1.00 0.00 C ATOM 795 O ILE A 55 -3.555 8.993 -3.660 1.00 0.00 O ATOM 796 CB ILE A 55 -1.003 6.627 -2.728 1.00 0.00 C ATOM 797 CG1 ILE A 55 -0.033 7.797 -2.961 1.00 0.00 C ATOM 798 CG2 ILE A 55 -0.666 5.455 -3.657 1.00 0.00 C ATOM 799 CD1 ILE A 55 -0.037 8.825 -1.817 1.00 0.00 C ATOM 0 H ILE A 55 -2.966 5.211 -1.842 1.00 0.00 H new ATOM 0 HA ILE A 55 -2.648 7.710 -1.895 1.00 0.00 H new ATOM 0 HB ILE A 55 -0.853 6.277 -1.707 1.00 0.00 H new ATOM 0 HG12 ILE A 55 0.976 7.404 -3.084 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -0.296 8.299 -3.892 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.398 5.229 -3.586 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -1.243 4.579 -3.362 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -0.913 5.723 -4.684 1.00 0.00 H new ATOM 0 HD11 ILE A 55 0.669 9.624 -2.044 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.037 9.244 -1.708 1.00 0.00 H new ATOM 0 HD13 ILE A 55 0.255 8.336 -0.888 1.00 0.00 H new ATOM 811 N ARG A 56 -2.522 7.632 -5.112 1.00 0.00 N ATOM 812 CA ARG A 56 -3.092 8.191 -6.350 1.00 0.00 C ATOM 813 C ARG A 56 -3.523 7.105 -7.340 1.00 0.00 C ATOM 814 O ARG A 56 -3.081 7.034 -8.492 1.00 0.00 O ATOM 815 CB ARG A 56 -2.191 9.300 -6.933 1.00 0.00 C ATOM 816 CG ARG A 56 -0.704 8.945 -7.065 1.00 0.00 C ATOM 817 CD ARG A 56 0.125 10.205 -7.356 1.00 0.00 C ATOM 818 NE ARG A 56 0.252 11.066 -6.155 1.00 0.00 N ATOM 819 CZ ARG A 56 -0.505 12.115 -5.828 1.00 0.00 C ATOM 820 NH1 ARG A 56 -1.479 12.560 -6.605 1.00 0.00 N ATOM 821 NH2 ARG A 56 -0.268 12.770 -4.705 1.00 0.00 N ATOM 0 H ARG A 56 -1.773 6.959 -5.277 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.027 8.693 -6.101 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -2.570 9.571 -7.918 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -2.280 10.185 -6.303 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -0.353 8.476 -6.146 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -0.567 8.219 -7.866 1.00 0.00 H new ATOM 0 HD2 ARG A 56 1.117 9.916 -7.703 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -0.343 10.771 -8.162 1.00 0.00 H new ATOM 0 HE ARG A 56 1.003 10.830 -5.506 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -1.675 12.097 -7.493 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -2.034 13.366 -6.316 1.00 0.00 H new ATOM 0 HH21 ARG A 56 0.491 12.473 -4.092 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -0.844 13.572 -4.451 1.00 0.00 H new ATOM 835 N ARG A 57 -4.292 6.168 -6.782 1.00 0.00 N ATOM 836 CA ARG A 57 -4.845 4.932 -7.395 1.00 0.00 C ATOM 837 C ARG A 57 -3.887 3.865 -7.952 1.00 0.00 C ATOM 838 O ARG A 57 -4.251 2.693 -7.958 1.00 0.00 O ATOM 839 CB ARG A 57 -5.967 5.253 -8.397 1.00 0.00 C ATOM 840 CG ARG A 57 -7.281 5.585 -7.670 1.00 0.00 C ATOM 841 CD ARG A 57 -7.909 4.331 -7.041 1.00 0.00 C ATOM 842 NE ARG A 57 -9.107 4.642 -6.231 1.00 0.00 N ATOM 843 CZ ARG A 57 -10.286 5.108 -6.646 1.00 0.00 C ATOM 844 NH1 ARG A 57 -10.590 5.254 -7.925 1.00 0.00 N ATOM 845 NH2 ARG A 57 -11.247 5.311 -5.753 1.00 0.00 N ATOM 0 H ARG A 57 -4.575 6.250 -5.806 1.00 0.00 H new ATOM 0 HA ARG A 57 -5.234 4.423 -6.513 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -5.671 6.096 -9.022 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.120 4.402 -9.061 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.091 6.327 -6.894 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.984 6.032 -8.373 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -8.180 3.630 -7.830 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -7.169 3.834 -6.413 1.00 0.00 H new ATOM 0 HE ARG A 57 -9.021 4.479 -5.228 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -9.909 5.006 -8.643 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -11.506 5.615 -8.194 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.078 5.111 -4.767 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -12.155 5.667 -6.053 1.00 0.00 H new ATOM 859 N GLU A 58 -2.751 4.330 -8.497 1.00 0.00 N ATOM 860 CA GLU A 58 -1.519 3.671 -8.987 1.00 0.00 C ATOM 861 C GLU A 58 -1.143 4.054 -10.430 1.00 0.00 C ATOM 862 O GLU A 58 -0.688 5.179 -10.624 1.00 0.00 O ATOM 863 CB GLU A 58 -1.217 2.213 -8.562 1.00 0.00 C ATOM 864 CG GLU A 58 -2.107 1.088 -9.086 1.00 0.00 C ATOM 865 CD GLU A 58 -1.635 -0.260 -8.533 1.00 0.00 C ATOM 866 OE1 GLU A 58 -1.815 -0.488 -7.316 1.00 0.00 O ATOM 867 OE2 GLU A 58 -0.973 -0.967 -9.318 1.00 0.00 O ATOM 0 H GLU A 58 -2.660 5.338 -8.625 1.00 0.00 H new ATOM 0 HA GLU A 58 -0.769 4.144 -8.353 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.193 1.989 -8.861 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.246 2.175 -7.473 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.142 1.267 -8.794 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.081 1.072 -10.176 1.00 0.00 H new ATOM 874 N ASP A 59 -1.041 3.069 -11.339 1.00 0.00 N ATOM 875 CA ASP A 59 -0.818 3.219 -12.804 1.00 0.00 C ATOM 876 C ASP A 59 -0.072 4.486 -13.261 1.00 0.00 C ATOM 877 O ASP A 59 -0.674 5.543 -13.439 1.00 0.00 O ATOM 878 CB ASP A 59 -2.184 3.070 -13.504 1.00 0.00 C ATOM 879 CG ASP A 59 -2.049 2.948 -15.022 1.00 0.00 C ATOM 880 OD1 ASP A 59 -1.773 1.803 -15.461 1.00 0.00 O ATOM 881 OD2 ASP A 59 -2.142 3.992 -15.699 1.00 0.00 O ATOM 0 H ASP A 59 -1.115 2.089 -11.065 1.00 0.00 H new ATOM 0 HA ASP A 59 -0.124 2.431 -13.097 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -2.695 2.189 -13.115 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -2.808 3.931 -13.265 1.00 0.00 H new ATOM 886 N LYS A 60 1.230 4.320 -13.486 1.00 0.00 N ATOM 887 CA LYS A 60 2.195 5.367 -13.900 1.00 0.00 C ATOM 888 C LYS A 60 2.398 6.493 -12.866 1.00 0.00 C ATOM 889 O LYS A 60 3.440 6.528 -12.206 1.00 0.00 O ATOM 890 CB LYS A 60 1.856 5.885 -15.315 1.00 0.00 C ATOM 891 CG LYS A 60 2.908 6.802 -15.959 1.00 0.00 C ATOM 892 CD LYS A 60 2.717 8.282 -15.591 1.00 0.00 C ATOM 893 CE LYS A 60 3.764 9.190 -16.245 1.00 0.00 C ATOM 894 NZ LYS A 60 5.114 8.970 -15.702 1.00 0.00 N ATOM 0 H LYS A 60 1.675 3.408 -13.382 1.00 0.00 H new ATOM 0 HA LYS A 60 3.174 4.890 -13.944 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.700 5.027 -15.968 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.910 6.425 -15.267 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.902 6.481 -15.648 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.863 6.693 -17.043 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.721 8.603 -15.896 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.770 8.393 -14.508 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.774 9.012 -17.320 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.481 10.232 -16.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.694 9.819 -15.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.051 8.779 -14.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 5.552 8.157 -16.180 1.00 0.00 H new ATOM 908 N ILE A 61 1.343 7.266 -12.600 1.00 0.00 N ATOM 909 CA ILE A 61 1.393 8.462 -11.727 1.00 0.00 C ATOM 910 C ILE A 61 1.910 8.181 -10.304 1.00 0.00 C ATOM 911 O ILE A 61 2.849 8.839 -9.866 1.00 0.00 O ATOM 912 CB ILE A 61 0.054 9.230 -11.788 1.00 0.00 C ATOM 913 CG1 ILE A 61 0.200 10.614 -11.118 1.00 0.00 C ATOM 914 CG2 ILE A 61 -1.133 8.415 -11.223 1.00 0.00 C ATOM 915 CD1 ILE A 61 -0.909 11.612 -11.470 1.00 0.00 C ATOM 0 H ILE A 61 0.416 7.085 -12.984 1.00 0.00 H new ATOM 0 HA ILE A 61 2.157 9.129 -12.127 1.00 0.00 H new ATOM 0 HB ILE A 61 -0.189 9.390 -12.838 1.00 0.00 H new ATOM 0 HG12 ILE A 61 0.220 10.479 -10.037 1.00 0.00 H new ATOM 0 HG13 ILE A 61 1.161 11.042 -11.404 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.046 9.006 -11.292 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.251 7.497 -11.798 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.940 8.167 -10.179 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.726 12.556 -10.956 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -0.918 11.781 -12.547 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.873 11.210 -11.158 1.00 0.00 H new ATOM 927 N CYS A 62 1.456 7.081 -9.698 1.00 0.00 N ATOM 928 CA CYS A 62 1.969 6.621 -8.385 1.00 0.00 C ATOM 929 C CYS A 62 3.471 6.296 -8.392 1.00 0.00 C ATOM 930 O CYS A 62 4.184 6.713 -7.473 1.00 0.00 O ATOM 931 CB CYS A 62 1.173 5.395 -7.925 1.00 0.00 C ATOM 932 SG CYS A 62 1.656 4.706 -6.304 1.00 0.00 S ATOM 0 H CYS A 62 0.730 6.482 -10.091 1.00 0.00 H new ATOM 0 HA CYS A 62 1.837 7.449 -7.689 1.00 0.00 H new ATOM 0 HB2 CYS A 62 0.117 5.663 -7.886 1.00 0.00 H new ATOM 0 HB3 CYS A 62 1.276 4.613 -8.678 1.00 0.00 H new ATOM 0 HG CYS A 62 0.909 3.678 -6.030 1.00 0.00 H new ATOM 938 N MET A 63 3.951 5.674 -9.463 1.00 0.00 N ATOM 939 CA MET A 63 5.381 5.312 -9.627 1.00 0.00 C ATOM 940 C MET A 63 6.257 6.560 -9.874 1.00 0.00 C ATOM 941 O MET A 63 7.356 6.681 -9.338 1.00 0.00 O ATOM 942 CB MET A 63 5.529 4.302 -10.761 1.00 0.00 C ATOM 943 CG MET A 63 6.916 3.655 -10.779 1.00 0.00 C ATOM 944 SD MET A 63 7.121 2.441 -12.128 1.00 0.00 S ATOM 945 CE MET A 63 8.792 1.916 -11.795 1.00 0.00 C ATOM 0 H MET A 63 3.368 5.399 -10.254 1.00 0.00 H new ATOM 0 HA MET A 63 5.731 4.856 -8.701 1.00 0.00 H new ATOM 0 HB2 MET A 63 4.769 3.527 -10.657 1.00 0.00 H new ATOM 0 HB3 MET A 63 5.349 4.799 -11.714 1.00 0.00 H new ATOM 0 HG2 MET A 63 7.672 4.433 -10.880 1.00 0.00 H new ATOM 0 HG3 MET A 63 7.093 3.161 -9.823 1.00 0.00 H new ATOM 0 HE1 MET A 63 9.091 1.167 -12.528 1.00 0.00 H new ATOM 0 HE2 MET A 63 9.462 2.773 -11.859 1.00 0.00 H new ATOM 0 HE3 MET A 63 8.846 1.487 -10.795 1.00 0.00 H new ATOM 955 N LYS A 64 5.724 7.505 -10.652 1.00 0.00 N ATOM 956 CA LYS A 64 6.327 8.840 -10.841 1.00 0.00 C ATOM 957 C LYS A 64 6.443 9.590 -9.502 1.00 0.00 C ATOM 958 O LYS A 64 7.542 9.938 -9.094 1.00 0.00 O ATOM 959 CB LYS A 64 5.477 9.599 -11.875 1.00 0.00 C ATOM 960 CG LYS A 64 6.055 10.969 -12.253 1.00 0.00 C ATOM 961 CD LYS A 64 5.281 11.639 -13.380 1.00 0.00 C ATOM 962 CE LYS A 64 3.844 12.028 -13.003 1.00 0.00 C ATOM 963 NZ LYS A 64 3.147 12.587 -14.167 1.00 0.00 N ATOM 0 H LYS A 64 4.858 7.372 -11.174 1.00 0.00 H new ATOM 0 HA LYS A 64 7.347 8.752 -11.216 1.00 0.00 H new ATOM 0 HB2 LYS A 64 5.385 8.991 -12.775 1.00 0.00 H new ATOM 0 HB3 LYS A 64 4.471 9.735 -11.478 1.00 0.00 H new ATOM 0 HG2 LYS A 64 6.048 11.617 -11.377 1.00 0.00 H new ATOM 0 HG3 LYS A 64 7.096 10.850 -12.553 1.00 0.00 H new ATOM 0 HD2 LYS A 64 5.818 12.534 -13.695 1.00 0.00 H new ATOM 0 HD3 LYS A 64 5.252 10.967 -14.237 1.00 0.00 H new ATOM 0 HE2 LYS A 64 3.308 11.153 -12.635 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.858 12.758 -12.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.340 13.159 -13.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.802 13.185 -14.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 2.804 11.813 -14.771 1.00 0.00 H new ATOM 977 N TYR A 65 5.333 9.614 -8.753 1.00 0.00 N ATOM 978 CA TYR A 65 5.266 10.176 -7.388 1.00 0.00 C ATOM 979 C TYR A 65 6.226 9.480 -6.400 1.00 0.00 C ATOM 980 O TYR A 65 6.887 10.150 -5.604 1.00 0.00 O ATOM 981 CB TYR A 65 3.830 10.067 -6.884 1.00 0.00 C ATOM 982 CG TYR A 65 3.565 10.875 -5.614 1.00 0.00 C ATOM 983 CD1 TYR A 65 3.759 12.269 -5.609 1.00 0.00 C ATOM 984 CD2 TYR A 65 2.955 10.253 -4.514 1.00 0.00 C ATOM 985 CE1 TYR A 65 3.324 13.033 -4.518 1.00 0.00 C ATOM 986 CE2 TYR A 65 2.528 11.023 -3.422 1.00 0.00 C ATOM 987 CZ TYR A 65 2.703 12.409 -3.431 1.00 0.00 C ATOM 988 OH TYR A 65 2.107 13.157 -2.459 1.00 0.00 O ATOM 0 H TYR A 65 4.442 9.240 -9.078 1.00 0.00 H new ATOM 0 HA TYR A 65 5.582 11.218 -7.442 1.00 0.00 H new ATOM 0 HB2 TYR A 65 3.152 10.405 -7.668 1.00 0.00 H new ATOM 0 HB3 TYR A 65 3.599 9.019 -6.693 1.00 0.00 H new ATOM 0 HD1 TYR A 65 4.243 12.750 -6.446 1.00 0.00 H new ATOM 0 HD2 TYR A 65 2.814 9.182 -4.508 1.00 0.00 H new ATOM 0 HE1 TYR A 65 3.468 14.103 -4.516 1.00 0.00 H new ATOM 0 HE2 TYR A 65 2.063 10.544 -2.573 1.00 0.00 H new ATOM 0 HH TYR A 65 1.724 12.564 -1.779 1.00 0.00 H new ATOM 998 N LEU A 66 6.320 8.154 -6.523 1.00 0.00 N ATOM 999 CA LEU A 66 7.279 7.295 -5.801 1.00 0.00 C ATOM 1000 C LEU A 66 8.707 7.849 -5.916 1.00 0.00 C ATOM 1001 O LEU A 66 9.197 8.467 -4.966 1.00 0.00 O ATOM 1002 CB LEU A 66 7.170 5.872 -6.363 1.00 0.00 C ATOM 1003 CG LEU A 66 7.873 4.791 -5.535 1.00 0.00 C ATOM 1004 CD1 LEU A 66 6.845 4.049 -4.683 1.00 0.00 C ATOM 1005 CD2 LEU A 66 8.626 3.830 -6.448 1.00 0.00 C ATOM 0 H LEU A 66 5.712 7.624 -7.148 1.00 0.00 H new ATOM 0 HA LEU A 66 7.040 7.278 -4.738 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.115 5.612 -6.450 1.00 0.00 H new ATOM 0 HB3 LEU A 66 7.585 5.863 -7.371 1.00 0.00 H new ATOM 0 HG LEU A 66 8.600 5.259 -4.872 1.00 0.00 H new ATOM 0 HD11 LEU A 66 7.347 3.281 -4.095 1.00 0.00 H new ATOM 0 HD12 LEU A 66 6.351 4.753 -4.014 1.00 0.00 H new ATOM 0 HD13 LEU A 66 6.103 3.583 -5.332 1.00 0.00 H new ATOM 0 HD21 LEU A 66 9.120 3.068 -5.846 1.00 0.00 H new ATOM 0 HD22 LEU A 66 7.924 3.353 -7.132 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.373 4.381 -7.020 1.00 0.00 H new ATOM 1017 N LEU A 67 9.199 7.912 -7.158 1.00 0.00 N ATOM 1018 CA LEU A 67 10.521 8.460 -7.495 1.00 0.00 C ATOM 1019 C LEU A 67 10.660 9.944 -7.102 1.00 0.00 C ATOM 1020 O LEU A 67 11.657 10.335 -6.485 1.00 0.00 O ATOM 1021 CB LEU A 67 10.769 8.224 -8.990 1.00 0.00 C ATOM 1022 CG LEU A 67 12.233 8.210 -9.490 1.00 0.00 C ATOM 1023 CD1 LEU A 67 12.876 9.600 -9.502 1.00 0.00 C ATOM 1024 CD2 LEU A 67 13.094 7.200 -8.728 1.00 0.00 C ATOM 0 H LEU A 67 8.683 7.579 -7.972 1.00 0.00 H new ATOM 0 HA LEU A 67 11.286 7.944 -6.915 1.00 0.00 H new ATOM 0 HB2 LEU A 67 10.316 7.269 -9.257 1.00 0.00 H new ATOM 0 HB3 LEU A 67 10.235 8.996 -9.543 1.00 0.00 H new ATOM 0 HG LEU A 67 12.187 7.882 -10.529 1.00 0.00 H new ATOM 0 HD11 LEU A 67 13.902 9.523 -9.862 1.00 0.00 H new ATOM 0 HD12 LEU A 67 12.308 10.258 -10.160 1.00 0.00 H new ATOM 0 HD13 LEU A 67 12.876 10.010 -8.492 1.00 0.00 H new ATOM 0 HD21 LEU A 67 14.113 7.226 -9.114 1.00 0.00 H new ATOM 0 HD22 LEU A 67 13.101 7.454 -7.668 1.00 0.00 H new ATOM 0 HD23 LEU A 67 12.682 6.199 -8.858 1.00 0.00 H new ATOM 1036 N LYS A 68 9.592 10.713 -7.316 1.00 0.00 N ATOM 1037 CA LYS A 68 9.500 12.146 -6.970 1.00 0.00 C ATOM 1038 C LYS A 68 9.795 12.437 -5.478 1.00 0.00 C ATOM 1039 O LYS A 68 10.341 13.487 -5.140 1.00 0.00 O ATOM 1040 CB LYS A 68 8.077 12.635 -7.311 1.00 0.00 C ATOM 1041 CG LYS A 68 8.000 14.131 -7.635 1.00 0.00 C ATOM 1042 CD LYS A 68 8.624 14.483 -8.993 1.00 0.00 C ATOM 1043 CE LYS A 68 7.809 13.939 -10.177 1.00 0.00 C ATOM 1044 NZ LYS A 68 8.481 14.227 -11.452 1.00 0.00 N ATOM 0 H LYS A 68 8.740 10.354 -7.746 1.00 0.00 H new ATOM 0 HA LYS A 68 10.260 12.674 -7.547 1.00 0.00 H new ATOM 0 HB2 LYS A 68 7.702 12.068 -8.163 1.00 0.00 H new ATOM 0 HB3 LYS A 68 7.417 12.420 -6.470 1.00 0.00 H new ATOM 0 HG2 LYS A 68 6.956 14.445 -7.628 1.00 0.00 H new ATOM 0 HG3 LYS A 68 8.507 14.694 -6.851 1.00 0.00 H new ATOM 0 HD2 LYS A 68 8.707 15.566 -9.081 1.00 0.00 H new ATOM 0 HD3 LYS A 68 9.636 14.081 -9.039 1.00 0.00 H new ATOM 0 HE2 LYS A 68 7.674 12.863 -10.067 1.00 0.00 H new ATOM 0 HE3 LYS A 68 6.815 14.386 -10.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 7.912 13.850 -12.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 8.587 15.255 -11.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 9.420 13.779 -11.459 1.00 0.00 H new ATOM 1058 N GLU A 69 9.417 11.492 -4.617 1.00 0.00 N ATOM 1059 CA GLU A 69 9.698 11.563 -3.168 1.00 0.00 C ATOM 1060 C GLU A 69 10.674 10.446 -2.716 1.00 0.00 C ATOM 1061 O GLU A 69 10.645 9.981 -1.573 1.00 0.00 O ATOM 1062 CB GLU A 69 8.319 11.503 -2.471 1.00 0.00 C ATOM 1063 CG GLU A 69 8.304 11.902 -0.996 1.00 0.00 C ATOM 1064 CD GLU A 69 8.674 13.374 -0.774 1.00 0.00 C ATOM 1065 OE1 GLU A 69 9.879 13.646 -0.609 1.00 0.00 O ATOM 1066 OE2 GLU A 69 7.728 14.194 -0.790 1.00 0.00 O ATOM 0 H GLU A 69 8.908 10.653 -4.896 1.00 0.00 H new ATOM 0 HA GLU A 69 10.214 12.484 -2.896 1.00 0.00 H new ATOM 0 HB2 GLU A 69 7.631 12.153 -3.011 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.933 10.487 -2.558 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.312 11.715 -0.584 1.00 0.00 H new ATOM 0 HG3 GLU A 69 9.002 11.270 -0.446 1.00 0.00 H new ATOM 1073 N LEU A 70 11.590 10.083 -3.606 1.00 0.00 N ATOM 1074 CA LEU A 70 12.584 9.016 -3.365 1.00 0.00 C ATOM 1075 C LEU A 70 14.039 9.461 -3.582 1.00 0.00 C ATOM 1076 O LEU A 70 14.526 9.561 -4.706 1.00 0.00 O ATOM 1077 CB LEU A 70 12.257 7.800 -4.238 1.00 0.00 C ATOM 1078 CG LEU A 70 11.847 6.565 -3.425 1.00 0.00 C ATOM 1079 CD1 LEU A 70 10.571 6.784 -2.610 1.00 0.00 C ATOM 1080 CD2 LEU A 70 11.679 5.376 -4.378 1.00 0.00 C ATOM 0 H LEU A 70 11.674 10.517 -4.525 1.00 0.00 H new ATOM 0 HA LEU A 70 12.511 8.753 -2.310 1.00 0.00 H new ATOM 0 HB2 LEU A 70 11.451 8.060 -4.924 1.00 0.00 H new ATOM 0 HB3 LEU A 70 13.127 7.554 -4.847 1.00 0.00 H new ATOM 0 HG LEU A 70 12.637 6.363 -2.702 1.00 0.00 H new ATOM 0 HD11 LEU A 70 10.332 5.876 -2.057 1.00 0.00 H new ATOM 0 HD12 LEU A 70 10.723 7.606 -1.910 1.00 0.00 H new ATOM 0 HD13 LEU A 70 9.748 7.027 -3.282 1.00 0.00 H new ATOM 0 HD21 LEU A 70 11.388 4.493 -3.810 1.00 0.00 H new ATOM 0 HD22 LEU A 70 10.908 5.605 -5.113 1.00 0.00 H new ATOM 0 HD23 LEU A 70 12.622 5.184 -4.889 1.00 0.00 H new ATOM 1092 N ALA A 71 14.689 9.759 -2.462 1.00 0.00 N ATOM 1093 CA ALA A 71 16.139 10.041 -2.397 1.00 0.00 C ATOM 1094 C ALA A 71 17.025 8.906 -2.971 1.00 0.00 C ATOM 1095 O ALA A 71 18.117 9.158 -3.474 1.00 0.00 O ATOM 1096 CB ALA A 71 16.530 10.319 -0.942 1.00 0.00 C ATOM 0 H ALA A 71 14.227 9.815 -1.555 1.00 0.00 H new ATOM 0 HA ALA A 71 16.320 10.912 -3.026 1.00 0.00 H new ATOM 0 HB1 ALA A 71 17.598 10.528 -0.886 1.00 0.00 H new ATOM 0 HB2 ALA A 71 15.972 11.180 -0.573 1.00 0.00 H new ATOM 0 HB3 ALA A 71 16.298 9.447 -0.330 1.00 0.00 H new ATOM 1102 N ALA A 72 16.540 7.670 -2.830 1.00 0.00 N ATOM 1103 CA ALA A 72 17.144 6.459 -3.398 1.00 0.00 C ATOM 1104 C ALA A 72 16.093 5.719 -4.256 1.00 0.00 C ATOM 1105 O ALA A 72 14.900 5.862 -3.971 1.00 0.00 O ATOM 1106 CB ALA A 72 17.602 5.553 -2.250 1.00 0.00 C ATOM 0 H ALA A 72 15.690 7.477 -2.301 1.00 0.00 H new ATOM 0 HA ALA A 72 17.997 6.723 -4.023 1.00 0.00 H new ATOM 0 HB1 ALA A 72 18.053 4.649 -2.658 1.00 0.00 H new ATOM 0 HB2 ALA A 72 18.335 6.081 -1.640 1.00 0.00 H new ATOM 0 HB3 ALA A 72 16.744 5.284 -1.634 1.00 0.00 H new ATOM 1112 N PRO A 73 16.478 4.993 -5.313 1.00 0.00 N ATOM 1113 CA PRO A 73 15.524 4.164 -6.083 1.00 0.00 C ATOM 1114 C PRO A 73 15.147 2.859 -5.355 1.00 0.00 C ATOM 1115 O PRO A 73 15.444 1.748 -5.783 1.00 0.00 O ATOM 1116 CB PRO A 73 16.225 3.946 -7.431 1.00 0.00 C ATOM 1117 CG PRO A 73 17.713 3.984 -7.070 1.00 0.00 C ATOM 1118 CD PRO A 73 17.791 5.048 -5.984 1.00 0.00 C ATOM 0 HA PRO A 73 14.556 4.648 -6.212 1.00 0.00 H new ATOM 0 HB2 PRO A 73 15.945 2.993 -7.880 1.00 0.00 H new ATOM 0 HB3 PRO A 73 15.966 4.724 -8.149 1.00 0.00 H new ATOM 0 HG2 PRO A 73 18.063 3.017 -6.709 1.00 0.00 H new ATOM 0 HG3 PRO A 73 18.328 4.245 -7.931 1.00 0.00 H new ATOM 0 HD2 PRO A 73 18.602 4.842 -5.285 1.00 0.00 H new ATOM 0 HD3 PRO A 73 17.978 6.034 -6.408 1.00 0.00 H new ATOM 1126 N GLY A 74 14.423 3.041 -4.246 1.00 0.00 N ATOM 1127 CA GLY A 74 13.928 1.956 -3.382 1.00 0.00 C ATOM 1128 C GLY A 74 12.846 1.093 -4.052 1.00 0.00 C ATOM 1129 O GLY A 74 11.785 1.601 -4.403 1.00 0.00 O ATOM 0 H GLY A 74 14.157 3.968 -3.913 1.00 0.00 H new ATOM 0 HA2 GLY A 74 14.765 1.319 -3.094 1.00 0.00 H new ATOM 0 HA3 GLY A 74 13.524 2.386 -2.465 1.00 0.00 H new ATOM 1133 N ASN A 75 13.133 -0.199 -4.123 1.00 0.00 N ATOM 1134 CA ASN A 75 12.287 -1.203 -4.800 1.00 0.00 C ATOM 1135 C ASN A 75 11.924 -2.421 -3.936 1.00 0.00 C ATOM 1136 O ASN A 75 12.685 -2.836 -3.058 1.00 0.00 O ATOM 1137 CB ASN A 75 12.953 -1.643 -6.112 1.00 0.00 C ATOM 1138 CG ASN A 75 12.642 -0.662 -7.248 1.00 0.00 C ATOM 1139 OD1 ASN A 75 11.646 -0.776 -7.936 1.00 0.00 O ATOM 1140 ND2 ASN A 75 13.459 0.356 -7.422 1.00 0.00 N ATOM 0 H ASN A 75 13.974 -0.598 -3.707 1.00 0.00 H new ATOM 0 HA ASN A 75 11.337 -0.710 -5.005 1.00 0.00 H new ATOM 0 HB2 ASN A 75 14.032 -1.710 -5.971 1.00 0.00 H new ATOM 0 HB3 ASN A 75 12.605 -2.640 -6.383 1.00 0.00 H new ATOM 0 HD21 ASN A 75 13.258 1.055 -8.137 1.00 0.00 H new ATOM 0 HD22 ASN A 75 14.293 0.446 -6.841 1.00 0.00 H new ATOM 1147 N VAL A 76 10.781 -2.999 -4.269 1.00 0.00 N ATOM 1148 CA VAL A 76 10.177 -4.179 -3.604 1.00 0.00 C ATOM 1149 C VAL A 76 11.053 -5.451 -3.693 1.00 0.00 C ATOM 1150 O VAL A 76 11.026 -6.210 -4.656 1.00 0.00 O ATOM 1151 CB VAL A 76 8.720 -4.368 -4.122 1.00 0.00 C ATOM 1152 CG1 VAL A 76 8.599 -4.534 -5.643 1.00 0.00 C ATOM 1153 CG2 VAL A 76 7.997 -5.511 -3.407 1.00 0.00 C ATOM 0 H VAL A 76 10.211 -2.655 -5.042 1.00 0.00 H new ATOM 0 HA VAL A 76 10.128 -3.990 -2.532 1.00 0.00 H new ATOM 0 HB VAL A 76 8.228 -3.427 -3.877 1.00 0.00 H new ATOM 0 HG11 VAL A 76 7.550 -4.660 -5.913 1.00 0.00 H new ATOM 0 HG12 VAL A 76 8.998 -3.649 -6.138 1.00 0.00 H new ATOM 0 HG13 VAL A 76 9.163 -5.412 -5.959 1.00 0.00 H new ATOM 0 HG21 VAL A 76 6.985 -5.605 -3.801 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.538 -6.443 -3.571 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.952 -5.301 -2.338 1.00 0.00 H new ATOM 1163 N ASP A 77 11.950 -5.563 -2.713 1.00 0.00 N ATOM 1164 CA ASP A 77 12.833 -6.746 -2.606 1.00 0.00 C ATOM 1165 C ASP A 77 12.884 -7.476 -1.248 1.00 0.00 C ATOM 1166 O ASP A 77 13.711 -8.364 -1.063 1.00 0.00 O ATOM 1167 CB ASP A 77 14.240 -6.337 -3.078 1.00 0.00 C ATOM 1168 CG ASP A 77 14.276 -6.004 -4.574 1.00 0.00 C ATOM 1169 OD1 ASP A 77 14.066 -4.812 -4.895 1.00 0.00 O ATOM 1170 OD2 ASP A 77 14.538 -6.942 -5.358 1.00 0.00 O ATOM 0 H ASP A 77 12.091 -4.863 -1.985 1.00 0.00 H new ATOM 0 HA ASP A 77 12.384 -7.504 -3.248 1.00 0.00 H new ATOM 0 HB2 ASP A 77 14.575 -5.471 -2.507 1.00 0.00 H new ATOM 0 HB3 ASP A 77 14.940 -7.146 -2.871 1.00 0.00 H new ATOM 1175 N ASP A 78 11.857 -7.297 -0.419 1.00 0.00 N ATOM 1176 CA ASP A 78 11.830 -7.938 0.917 1.00 0.00 C ATOM 1177 C ASP A 78 11.006 -9.230 0.912 1.00 0.00 C ATOM 1178 O ASP A 78 9.930 -9.300 1.507 1.00 0.00 O ATOM 1179 CB ASP A 78 11.333 -6.918 1.955 1.00 0.00 C ATOM 1180 CG ASP A 78 11.271 -7.442 3.400 1.00 0.00 C ATOM 1181 OD1 ASP A 78 12.167 -8.219 3.772 1.00 0.00 O ATOM 1182 OD2 ASP A 78 10.326 -7.009 4.096 1.00 0.00 O ATOM 0 H ASP A 78 11.040 -6.725 -0.633 1.00 0.00 H new ATOM 0 HA ASP A 78 12.840 -8.241 1.192 1.00 0.00 H new ATOM 0 HB2 ASP A 78 11.987 -6.046 1.928 1.00 0.00 H new ATOM 0 HB3 ASP A 78 10.339 -6.580 1.664 1.00 0.00 H new ATOM 1187 N LYS A 79 11.500 -10.205 0.158 1.00 0.00 N ATOM 1188 CA LYS A 79 10.895 -11.557 -0.004 1.00 0.00 C ATOM 1189 C LYS A 79 9.377 -11.554 -0.295 1.00 0.00 C ATOM 1190 O LYS A 79 8.641 -12.461 0.080 1.00 0.00 O ATOM 1191 CB LYS A 79 11.249 -12.429 1.219 1.00 0.00 C ATOM 1192 CG LYS A 79 12.764 -12.652 1.355 1.00 0.00 C ATOM 1193 CD LYS A 79 13.132 -13.426 2.629 1.00 0.00 C ATOM 1194 CE LYS A 79 12.843 -14.930 2.545 1.00 0.00 C ATOM 1195 NZ LYS A 79 13.780 -15.631 1.648 1.00 0.00 N ATOM 0 H LYS A 79 12.358 -10.091 -0.381 1.00 0.00 H new ATOM 0 HA LYS A 79 11.332 -11.991 -0.903 1.00 0.00 H new ATOM 0 HB2 LYS A 79 10.871 -11.953 2.124 1.00 0.00 H new ATOM 0 HB3 LYS A 79 10.748 -13.393 1.133 1.00 0.00 H new ATOM 0 HG2 LYS A 79 13.127 -13.198 0.484 1.00 0.00 H new ATOM 0 HG3 LYS A 79 13.271 -11.687 1.361 1.00 0.00 H new ATOM 0 HD2 LYS A 79 14.192 -13.280 2.838 1.00 0.00 H new ATOM 0 HD3 LYS A 79 12.581 -13.006 3.470 1.00 0.00 H new ATOM 0 HE2 LYS A 79 12.904 -15.366 3.542 1.00 0.00 H new ATOM 0 HE3 LYS A 79 11.823 -15.083 2.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 13.588 -16.653 1.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 13.657 -15.282 0.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 14.757 -15.453 1.959 1.00 0.00 H new ATOM 1209 N GLY A 80 8.968 -10.564 -1.091 1.00 0.00 N ATOM 1210 CA GLY A 80 7.546 -10.262 -1.383 1.00 0.00 C ATOM 1211 C GLY A 80 7.126 -8.852 -0.925 1.00 0.00 C ATOM 1212 O GLY A 80 6.588 -8.080 -1.719 1.00 0.00 O ATOM 0 H GLY A 80 9.617 -9.934 -1.563 1.00 0.00 H new ATOM 0 HA2 GLY A 80 7.372 -10.357 -2.455 1.00 0.00 H new ATOM 0 HA3 GLY A 80 6.914 -11.002 -0.891 1.00 0.00 H new ATOM 1216 N GLU A 81 7.506 -8.490 0.296 1.00 0.00 N ATOM 1217 CA GLU A 81 7.152 -7.204 0.934 1.00 0.00 C ATOM 1218 C GLU A 81 7.754 -5.987 0.222 1.00 0.00 C ATOM 1219 O GLU A 81 8.923 -5.970 -0.166 1.00 0.00 O ATOM 1220 CB GLU A 81 7.533 -7.130 2.417 1.00 0.00 C ATOM 1221 CG GLU A 81 6.889 -8.174 3.333 1.00 0.00 C ATOM 1222 CD GLU A 81 7.698 -9.479 3.389 1.00 0.00 C ATOM 1223 OE1 GLU A 81 8.603 -9.542 4.259 1.00 0.00 O ATOM 1224 OE2 GLU A 81 7.413 -10.371 2.560 1.00 0.00 O ATOM 0 H GLU A 81 8.081 -9.087 0.891 1.00 0.00 H new ATOM 0 HA GLU A 81 6.066 -7.170 0.846 1.00 0.00 H new ATOM 0 HB2 GLU A 81 8.616 -7.225 2.498 1.00 0.00 H new ATOM 0 HB3 GLU A 81 7.271 -6.140 2.789 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.796 -7.764 4.338 1.00 0.00 H new ATOM 0 HG3 GLU A 81 5.880 -8.389 2.982 1.00 0.00 H new ATOM 1231 N LEU A 82 6.960 -4.918 0.235 1.00 0.00 N ATOM 1232 CA LEU A 82 7.255 -3.622 -0.396 1.00 0.00 C ATOM 1233 C LEU A 82 8.223 -2.790 0.459 1.00 0.00 C ATOM 1234 O LEU A 82 7.870 -2.328 1.542 1.00 0.00 O ATOM 1235 CB LEU A 82 5.944 -2.868 -0.604 1.00 0.00 C ATOM 1236 CG LEU A 82 6.061 -1.653 -1.537 1.00 0.00 C ATOM 1237 CD1 LEU A 82 6.010 -2.083 -3.012 1.00 0.00 C ATOM 1238 CD2 LEU A 82 4.967 -0.629 -1.235 1.00 0.00 C ATOM 0 H LEU A 82 6.054 -4.926 0.704 1.00 0.00 H new ATOM 0 HA LEU A 82 7.740 -3.797 -1.356 1.00 0.00 H new ATOM 0 HB2 LEU A 82 5.203 -3.555 -1.011 1.00 0.00 H new ATOM 0 HB3 LEU A 82 5.571 -2.534 0.365 1.00 0.00 H new ATOM 0 HG LEU A 82 7.028 -1.183 -1.356 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.095 -1.204 -3.650 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.835 -2.764 -3.221 1.00 0.00 H new ATOM 0 HD13 LEU A 82 5.064 -2.586 -3.212 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.070 0.222 -1.908 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.989 -1.089 -1.378 1.00 0.00 H new ATOM 0 HD23 LEU A 82 5.061 -0.290 -0.203 1.00 0.00 H new ATOM 1250 N VAL A 83 9.472 -2.733 -0.009 1.00 0.00 N ATOM 1251 CA VAL A 83 10.528 -1.910 0.610 1.00 0.00 C ATOM 1252 C VAL A 83 10.966 -0.730 -0.272 1.00 0.00 C ATOM 1253 O VAL A 83 11.754 -0.868 -1.216 1.00 0.00 O ATOM 1254 CB VAL A 83 11.734 -2.707 1.142 1.00 0.00 C ATOM 1255 CG1 VAL A 83 11.369 -3.402 2.447 1.00 0.00 C ATOM 1256 CG2 VAL A 83 12.317 -3.707 0.142 1.00 0.00 C ATOM 0 H VAL A 83 9.786 -3.254 -0.828 1.00 0.00 H new ATOM 0 HA VAL A 83 10.048 -1.490 1.494 1.00 0.00 H new ATOM 0 HB VAL A 83 12.524 -1.977 1.317 1.00 0.00 H new ATOM 0 HG11 VAL A 83 12.229 -3.962 2.814 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.079 -2.657 3.187 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.537 -4.085 2.275 1.00 0.00 H new ATOM 0 HG21 VAL A 83 13.162 -4.225 0.596 1.00 0.00 H new ATOM 0 HG22 VAL A 83 11.552 -4.433 -0.135 1.00 0.00 H new ATOM 0 HG23 VAL A 83 12.653 -3.177 -0.749 1.00 0.00 H new ATOM 1266 N ILE A 84 10.400 0.424 0.044 1.00 0.00 N ATOM 1267 CA ILE A 84 10.577 1.659 -0.742 1.00 0.00 C ATOM 1268 C ILE A 84 11.425 2.664 0.048 1.00 0.00 C ATOM 1269 O ILE A 84 10.965 3.292 1.008 1.00 0.00 O ATOM 1270 CB ILE A 84 9.191 2.207 -1.156 1.00 0.00 C ATOM 1271 CG1 ILE A 84 8.342 1.188 -1.945 1.00 0.00 C ATOM 1272 CG2 ILE A 84 9.276 3.541 -1.906 1.00 0.00 C ATOM 1273 CD1 ILE A 84 8.960 0.587 -3.214 1.00 0.00 C ATOM 0 H ILE A 84 9.797 0.543 0.858 1.00 0.00 H new ATOM 0 HA ILE A 84 11.124 1.456 -1.663 1.00 0.00 H new ATOM 0 HB ILE A 84 8.675 2.392 -0.214 1.00 0.00 H new ATOM 0 HG12 ILE A 84 8.089 0.368 -1.273 1.00 0.00 H new ATOM 0 HG13 ILE A 84 7.406 1.673 -2.223 1.00 0.00 H new ATOM 0 HG21 ILE A 84 8.272 3.875 -2.170 1.00 0.00 H new ATOM 0 HG22 ILE A 84 9.751 4.287 -1.269 1.00 0.00 H new ATOM 0 HG23 ILE A 84 9.866 3.411 -2.814 1.00 0.00 H new ATOM 0 HD11 ILE A 84 8.256 -0.111 -3.666 1.00 0.00 H new ATOM 0 HD12 ILE A 84 9.185 1.385 -3.922 1.00 0.00 H new ATOM 0 HD13 ILE A 84 9.879 0.060 -2.957 1.00 0.00 H new ATOM 1285 N GLN A 85 12.693 2.689 -0.327 1.00 0.00 N ATOM 1286 CA GLN A 85 13.742 3.534 0.297 1.00 0.00 C ATOM 1287 C GLN A 85 13.749 4.952 -0.298 1.00 0.00 C ATOM 1288 O GLN A 85 14.119 5.158 -1.456 1.00 0.00 O ATOM 1289 CB GLN A 85 15.081 2.826 0.100 1.00 0.00 C ATOM 1290 CG GLN A 85 16.192 3.391 0.977 1.00 0.00 C ATOM 1291 CD GLN A 85 17.475 2.579 0.782 1.00 0.00 C ATOM 1292 OE1 GLN A 85 18.287 2.843 -0.092 1.00 0.00 O ATOM 1293 NE2 GLN A 85 17.657 1.543 1.572 1.00 0.00 N ATOM 0 H GLN A 85 13.048 2.114 -1.091 1.00 0.00 H new ATOM 0 HA GLN A 85 13.544 3.660 1.361 1.00 0.00 H new ATOM 0 HB2 GLN A 85 14.959 1.765 0.317 1.00 0.00 H new ATOM 0 HB3 GLN A 85 15.376 2.905 -0.946 1.00 0.00 H new ATOM 0 HG2 GLN A 85 16.371 4.436 0.724 1.00 0.00 H new ATOM 0 HG3 GLN A 85 15.890 3.364 2.024 1.00 0.00 H new ATOM 0 HE21 GLN A 85 16.974 1.330 2.299 1.00 0.00 H new ATOM 0 HE22 GLN A 85 18.481 0.953 1.458 1.00 0.00 H new ATOM 1302 N GLY A 86 13.249 5.884 0.503 1.00 0.00 N ATOM 1303 CA GLY A 86 13.195 7.325 0.161 1.00 0.00 C ATOM 1304 C GLY A 86 12.546 8.146 1.276 1.00 0.00 C ATOM 1305 O GLY A 86 12.923 8.036 2.442 1.00 0.00 O ATOM 0 H GLY A 86 12.861 5.672 1.422 1.00 0.00 H new ATOM 0 HA2 GLY A 86 14.204 7.694 -0.022 1.00 0.00 H new ATOM 0 HA3 GLY A 86 12.634 7.459 -0.764 1.00 0.00 H new ATOM 1309 N LYS A 87 11.658 9.053 0.866 1.00 0.00 N ATOM 1310 CA LYS A 87 10.866 9.891 1.798 1.00 0.00 C ATOM 1311 C LYS A 87 9.354 9.576 1.711 1.00 0.00 C ATOM 1312 O LYS A 87 8.490 10.362 2.094 1.00 0.00 O ATOM 1313 CB LYS A 87 11.141 11.366 1.488 1.00 0.00 C ATOM 1314 CG LYS A 87 12.595 11.760 1.704 1.00 0.00 C ATOM 1315 CD LYS A 87 12.866 13.174 1.195 1.00 0.00 C ATOM 1316 CE LYS A 87 14.338 13.571 1.342 1.00 0.00 C ATOM 1317 NZ LYS A 87 14.734 13.728 2.754 1.00 0.00 N ATOM 0 H LYS A 87 11.460 9.235 -0.118 1.00 0.00 H new ATOM 0 HA LYS A 87 11.170 9.668 2.821 1.00 0.00 H new ATOM 0 HB2 LYS A 87 10.865 11.571 0.454 1.00 0.00 H new ATOM 0 HB3 LYS A 87 10.505 11.988 2.117 1.00 0.00 H new ATOM 0 HG2 LYS A 87 12.837 11.700 2.765 1.00 0.00 H new ATOM 0 HG3 LYS A 87 13.246 11.054 1.188 1.00 0.00 H new ATOM 0 HD2 LYS A 87 12.576 13.242 0.146 1.00 0.00 H new ATOM 0 HD3 LYS A 87 12.244 13.881 1.744 1.00 0.00 H new ATOM 0 HE2 LYS A 87 14.966 12.813 0.872 1.00 0.00 H new ATOM 0 HE3 LYS A 87 14.515 14.506 0.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 15.723 14.046 2.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 14.120 14.433 3.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 14.639 12.816 3.245 1.00 0.00 H new ATOM 1331 N PHE A 88 9.057 8.370 1.218 1.00 0.00 N ATOM 1332 CA PHE A 88 7.696 7.812 1.121 1.00 0.00 C ATOM 1333 C PHE A 88 7.059 7.431 2.469 1.00 0.00 C ATOM 1334 O PHE A 88 5.859 7.651 2.679 1.00 0.00 O ATOM 1335 CB PHE A 88 7.730 6.589 0.199 1.00 0.00 C ATOM 1336 CG PHE A 88 7.115 6.854 -1.182 1.00 0.00 C ATOM 1337 CD1 PHE A 88 7.265 8.089 -1.829 1.00 0.00 C ATOM 1338 CD2 PHE A 88 6.101 5.980 -1.627 1.00 0.00 C ATOM 1339 CE1 PHE A 88 6.381 8.476 -2.836 1.00 0.00 C ATOM 1340 CE2 PHE A 88 5.215 6.368 -2.624 1.00 0.00 C ATOM 1341 CZ PHE A 88 5.341 7.624 -3.228 1.00 0.00 C ATOM 0 H PHE A 88 9.772 7.734 0.865 1.00 0.00 H new ATOM 0 HA PHE A 88 7.065 8.604 0.718 1.00 0.00 H new ATOM 0 HB2 PHE A 88 8.763 6.266 0.073 1.00 0.00 H new ATOM 0 HB3 PHE A 88 7.195 5.768 0.676 1.00 0.00 H new ATOM 0 HD1 PHE A 88 8.073 8.747 -1.545 1.00 0.00 H new ATOM 0 HD2 PHE A 88 6.013 4.998 -1.187 1.00 0.00 H new ATOM 0 HE1 PHE A 88 6.499 9.437 -3.315 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.426 5.698 -2.934 1.00 0.00 H new ATOM 0 HZ PHE A 88 4.642 7.934 -3.990 1.00 0.00 H new ATOM 1351 N SER A 89 7.908 7.002 3.401 1.00 0.00 N ATOM 1352 CA SER A 89 7.542 6.429 4.708 1.00 0.00 C ATOM 1353 C SER A 89 6.840 7.371 5.678 1.00 0.00 C ATOM 1354 O SER A 89 7.421 8.293 6.261 1.00 0.00 O ATOM 1355 CB SER A 89 8.756 5.746 5.350 1.00 0.00 C ATOM 1356 OG SER A 89 9.972 6.460 5.119 1.00 0.00 O ATOM 0 H SER A 89 8.918 7.044 3.265 1.00 0.00 H new ATOM 0 HA SER A 89 6.776 5.686 4.486 1.00 0.00 H new ATOM 0 HB2 SER A 89 8.591 5.654 6.423 1.00 0.00 H new ATOM 0 HB3 SER A 89 8.851 4.735 4.954 1.00 0.00 H new ATOM 0 HG SER A 89 10.724 5.956 5.495 1.00 0.00 H new ATOM 1362 N SER A 90 5.527 7.197 5.701 1.00 0.00 N ATOM 1363 CA SER A 90 4.528 7.967 6.480 1.00 0.00 C ATOM 1364 C SER A 90 4.503 9.495 6.277 1.00 0.00 C ATOM 1365 O SER A 90 3.905 10.239 7.051 1.00 0.00 O ATOM 1366 CB SER A 90 4.565 7.569 7.961 1.00 0.00 C ATOM 1367 OG SER A 90 4.181 6.196 8.053 1.00 0.00 O ATOM 0 H SER A 90 5.085 6.467 5.142 1.00 0.00 H new ATOM 0 HA SER A 90 3.573 7.669 6.048 1.00 0.00 H new ATOM 0 HB2 SER A 90 5.564 7.715 8.371 1.00 0.00 H new ATOM 0 HB3 SER A 90 3.888 8.195 8.542 1.00 0.00 H new ATOM 0 HG SER A 90 4.198 5.914 8.991 1.00 0.00 H new ATOM 1373 N GLN A 91 5.168 9.947 5.215 1.00 0.00 N ATOM 1374 CA GLN A 91 5.017 11.322 4.693 1.00 0.00 C ATOM 1375 C GLN A 91 3.981 11.471 3.571 1.00 0.00 C ATOM 1376 O GLN A 91 3.220 12.443 3.577 1.00 0.00 O ATOM 1377 CB GLN A 91 6.369 11.895 4.236 1.00 0.00 C ATOM 1378 CG GLN A 91 7.153 12.537 5.387 1.00 0.00 C ATOM 1379 CD GLN A 91 7.704 11.543 6.405 1.00 0.00 C ATOM 1380 OE1 GLN A 91 8.827 11.065 6.309 1.00 0.00 O ATOM 1381 NE2 GLN A 91 6.927 11.223 7.420 1.00 0.00 N ATOM 0 H GLN A 91 5.829 9.378 4.686 1.00 0.00 H new ATOM 0 HA GLN A 91 4.635 11.897 5.536 1.00 0.00 H new ATOM 0 HB2 GLN A 91 6.967 11.098 3.793 1.00 0.00 H new ATOM 0 HB3 GLN A 91 6.200 12.638 3.456 1.00 0.00 H new ATOM 0 HG2 GLN A 91 7.982 13.110 4.971 1.00 0.00 H new ATOM 0 HG3 GLN A 91 6.504 13.245 5.903 1.00 0.00 H new ATOM 0 HE21 GLN A 91 5.993 11.625 7.494 1.00 0.00 H new ATOM 0 HE22 GLN A 91 7.260 10.573 8.132 1.00 0.00 H new ATOM 1390 N VAL A 92 3.875 10.458 2.700 1.00 0.00 N ATOM 1391 CA VAL A 92 2.936 10.516 1.552 1.00 0.00 C ATOM 1392 C VAL A 92 1.793 9.497 1.513 1.00 0.00 C ATOM 1393 O VAL A 92 0.636 9.882 1.699 1.00 0.00 O ATOM 1394 CB VAL A 92 3.652 10.645 0.187 1.00 0.00 C ATOM 1395 CG1 VAL A 92 4.300 12.017 0.033 1.00 0.00 C ATOM 1396 CG2 VAL A 92 4.690 9.556 -0.046 1.00 0.00 C ATOM 0 H VAL A 92 4.417 9.596 2.759 1.00 0.00 H new ATOM 0 HA VAL A 92 2.411 11.449 1.754 1.00 0.00 H new ATOM 0 HB VAL A 92 2.877 10.524 -0.570 1.00 0.00 H new ATOM 0 HG11 VAL A 92 4.796 12.079 -0.936 1.00 0.00 H new ATOM 0 HG12 VAL A 92 3.535 12.790 0.099 1.00 0.00 H new ATOM 0 HG13 VAL A 92 5.033 12.164 0.826 1.00 0.00 H new ATOM 0 HG21 VAL A 92 5.157 9.701 -1.020 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.451 9.606 0.733 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.206 8.580 -0.018 1.00 0.00 H new ATOM 1406 N ILE A 93 2.104 8.205 1.344 1.00 0.00 N ATOM 1407 CA ILE A 93 1.086 7.143 1.113 1.00 0.00 C ATOM 1408 C ILE A 93 0.012 7.146 2.217 1.00 0.00 C ATOM 1409 O ILE A 93 -1.150 7.456 1.934 1.00 0.00 O ATOM 1410 CB ILE A 93 1.663 5.717 0.966 1.00 0.00 C ATOM 1411 CG1 ILE A 93 2.961 5.673 0.129 1.00 0.00 C ATOM 1412 CG2 ILE A 93 0.602 4.831 0.293 1.00 0.00 C ATOM 1413 CD1 ILE A 93 3.753 4.383 0.345 1.00 0.00 C ATOM 0 H ILE A 93 3.062 7.856 1.362 1.00 0.00 H new ATOM 0 HA ILE A 93 0.641 7.400 0.152 1.00 0.00 H new ATOM 0 HB ILE A 93 1.915 5.358 1.964 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.712 5.770 -0.928 1.00 0.00 H new ATOM 0 HG13 ILE A 93 3.586 6.527 0.389 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.991 3.819 0.180 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.297 4.808 0.909 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.358 5.237 -0.689 1.00 0.00 H new ATOM 0 HD11 ILE A 93 4.655 4.403 -0.266 1.00 0.00 H new ATOM 0 HD12 ILE A 93 4.029 4.297 1.396 1.00 0.00 H new ATOM 0 HD13 ILE A 93 3.140 3.528 0.059 1.00 0.00 H new ATOM 1425 N ASN A 94 0.430 6.907 3.454 1.00 0.00 N ATOM 1426 CA ASN A 94 -0.449 6.920 4.655 1.00 0.00 C ATOM 1427 C ASN A 94 -1.301 8.196 4.738 1.00 0.00 C ATOM 1428 O ASN A 94 -2.518 8.098 4.742 1.00 0.00 O ATOM 1429 CB ASN A 94 0.415 6.782 5.911 1.00 0.00 C ATOM 1430 CG ASN A 94 -0.432 6.455 7.149 1.00 0.00 C ATOM 1431 OD1 ASN A 94 -0.883 5.338 7.354 1.00 0.00 O ATOM 1432 ND2 ASN A 94 -0.725 7.455 7.948 1.00 0.00 N ATOM 0 H ASN A 94 1.403 6.693 3.673 1.00 0.00 H new ATOM 0 HA ASN A 94 -1.139 6.080 4.577 1.00 0.00 H new ATOM 0 HB2 ASN A 94 1.156 5.997 5.759 1.00 0.00 H new ATOM 0 HB3 ASN A 94 0.963 7.709 6.079 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -1.336 7.304 8.751 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -0.342 8.383 7.766 1.00 0.00 H new ATOM 1439 N THR A 95 -0.643 9.334 4.550 1.00 0.00 N ATOM 1440 CA THR A 95 -1.233 10.694 4.621 1.00 0.00 C ATOM 1441 C THR A 95 -2.465 10.828 3.704 1.00 0.00 C ATOM 1442 O THR A 95 -3.559 11.061 4.197 1.00 0.00 O ATOM 1443 CB THR A 95 -0.168 11.719 4.214 1.00 0.00 C ATOM 1444 OG1 THR A 95 1.110 11.324 4.745 1.00 0.00 O ATOM 1445 CG2 THR A 95 -0.521 13.123 4.720 1.00 0.00 C ATOM 0 H THR A 95 0.354 9.351 4.335 1.00 0.00 H new ATOM 0 HA THR A 95 -1.563 10.875 5.644 1.00 0.00 H new ATOM 0 HB THR A 95 -0.126 11.750 3.125 1.00 0.00 H new ATOM 0 HG1 THR A 95 1.786 11.989 4.498 1.00 0.00 H new ATOM 0 HG21 THR A 95 0.254 13.826 4.414 1.00 0.00 H new ATOM 0 HG22 THR A 95 -1.477 13.432 4.298 1.00 0.00 H new ATOM 0 HG23 THR A 95 -0.591 13.111 5.808 1.00 0.00 H new ATOM 1453 N LEU A 96 -2.268 10.565 2.408 1.00 0.00 N ATOM 1454 CA LEU A 96 -3.359 10.641 1.408 1.00 0.00 C ATOM 1455 C LEU A 96 -4.397 9.510 1.568 1.00 0.00 C ATOM 1456 O LEU A 96 -5.591 9.768 1.524 1.00 0.00 O ATOM 1457 CB LEU A 96 -2.769 10.660 -0.001 1.00 0.00 C ATOM 1458 CG LEU A 96 -3.530 11.569 -0.984 1.00 0.00 C ATOM 1459 CD1 LEU A 96 -2.646 11.838 -2.205 1.00 0.00 C ATOM 1460 CD2 LEU A 96 -4.861 10.961 -1.451 1.00 0.00 C ATOM 0 H LEU A 96 -1.365 10.296 2.018 1.00 0.00 H new ATOM 0 HA LEU A 96 -3.901 11.571 1.581 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -1.732 10.990 0.055 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -2.760 9.643 -0.394 1.00 0.00 H new ATOM 0 HG LEU A 96 -3.764 12.493 -0.456 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -3.179 12.481 -2.905 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.727 12.330 -1.887 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.402 10.894 -2.693 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -5.352 11.647 -2.142 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -4.671 10.013 -1.954 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.506 10.791 -0.589 1.00 0.00 H new ATOM 1472 N MET A 97 -3.924 8.287 1.822 1.00 0.00 N ATOM 1473 CA MET A 97 -4.778 7.096 2.023 1.00 0.00 C ATOM 1474 C MET A 97 -5.761 7.244 3.200 1.00 0.00 C ATOM 1475 O MET A 97 -6.964 6.982 3.055 1.00 0.00 O ATOM 1476 CB MET A 97 -3.838 5.877 2.160 1.00 0.00 C ATOM 1477 CG MET A 97 -4.457 4.569 2.654 1.00 0.00 C ATOM 1478 SD MET A 97 -4.491 4.435 4.474 1.00 0.00 S ATOM 1479 CE MET A 97 -6.232 4.173 4.709 1.00 0.00 C ATOM 0 H MET A 97 -2.927 8.086 1.896 1.00 0.00 H new ATOM 0 HA MET A 97 -5.435 6.961 1.163 1.00 0.00 H new ATOM 0 HB2 MET A 97 -3.384 5.690 1.187 1.00 0.00 H new ATOM 0 HB3 MET A 97 -3.031 6.147 2.841 1.00 0.00 H new ATOM 0 HG2 MET A 97 -5.474 4.488 2.271 1.00 0.00 H new ATOM 0 HG3 MET A 97 -3.894 3.730 2.244 1.00 0.00 H new ATOM 0 HE1 MET A 97 -6.410 3.790 5.714 1.00 0.00 H new ATOM 0 HE2 MET A 97 -6.762 5.117 4.581 1.00 0.00 H new ATOM 0 HE3 MET A 97 -6.594 3.451 3.976 1.00 0.00 H new ATOM 1489 N GLU A 98 -5.237 7.665 4.354 1.00 0.00 N ATOM 1490 CA GLU A 98 -6.014 7.861 5.593 1.00 0.00 C ATOM 1491 C GLU A 98 -7.058 8.961 5.408 1.00 0.00 C ATOM 1492 O GLU A 98 -6.848 9.928 4.669 1.00 0.00 O ATOM 1493 CB GLU A 98 -5.091 8.208 6.770 1.00 0.00 C ATOM 1494 CG GLU A 98 -4.196 7.032 7.212 1.00 0.00 C ATOM 1495 CD GLU A 98 -4.907 5.901 7.969 1.00 0.00 C ATOM 1496 OE1 GLU A 98 -6.107 5.651 7.698 1.00 0.00 O ATOM 1497 OE2 GLU A 98 -4.242 5.323 8.848 1.00 0.00 O ATOM 0 H GLU A 98 -4.247 7.884 4.461 1.00 0.00 H new ATOM 0 HA GLU A 98 -6.526 6.925 5.817 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -4.459 9.051 6.491 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -5.698 8.531 7.616 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -3.721 6.609 6.327 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -3.400 7.424 7.845 1.00 0.00 H new ATOM 1504 N ARG A 99 -8.195 8.770 6.078 1.00 0.00 N ATOM 1505 CA ARG A 99 -9.421 9.596 5.984 1.00 0.00 C ATOM 1506 C ARG A 99 -10.163 9.412 4.639 1.00 0.00 C ATOM 1507 O ARG A 99 -11.329 9.030 4.645 1.00 0.00 O ATOM 1508 CB ARG A 99 -9.158 11.091 6.260 1.00 0.00 C ATOM 1509 CG ARG A 99 -8.371 11.336 7.555 1.00 0.00 C ATOM 1510 CD ARG A 99 -8.043 12.807 7.798 1.00 0.00 C ATOM 1511 NE ARG A 99 -7.238 13.363 6.692 1.00 0.00 N ATOM 1512 CZ ARG A 99 -6.908 14.642 6.508 1.00 0.00 C ATOM 1513 NH1 ARG A 99 -7.323 15.612 7.324 1.00 0.00 N ATOM 1514 NH2 ARG A 99 -6.193 14.990 5.453 1.00 0.00 N ATOM 0 H ARG A 99 -8.301 7.999 6.737 1.00 0.00 H new ATOM 0 HA ARG A 99 -10.075 9.227 6.774 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -8.608 11.518 5.421 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -10.111 11.617 6.316 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -8.947 10.956 8.399 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -7.443 10.766 7.520 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -8.967 13.376 7.901 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -7.498 12.911 8.736 1.00 0.00 H new ATOM 0 HE ARG A 99 -6.899 12.699 5.996 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -7.915 15.387 8.124 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -7.048 16.578 7.148 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -5.895 14.281 4.782 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -5.939 15.967 5.309 1.00 0.00 H new ATOM 1528 N PHE A 100 -9.396 9.451 3.549 1.00 0.00 N ATOM 1529 CA PHE A 100 -9.839 9.194 2.162 1.00 0.00 C ATOM 1530 C PHE A 100 -10.576 7.857 1.977 1.00 0.00 C ATOM 1531 O PHE A 100 -11.749 7.873 1.621 1.00 0.00 O ATOM 1532 CB PHE A 100 -8.597 9.325 1.265 1.00 0.00 C ATOM 1533 CG PHE A 100 -8.653 8.711 -0.142 1.00 0.00 C ATOM 1534 CD1 PHE A 100 -9.796 8.794 -0.958 1.00 0.00 C ATOM 1535 CD2 PHE A 100 -7.511 8.047 -0.622 1.00 0.00 C ATOM 1536 CE1 PHE A 100 -9.790 8.200 -2.229 1.00 0.00 C ATOM 1537 CE2 PHE A 100 -7.513 7.461 -1.886 1.00 0.00 C ATOM 1538 CZ PHE A 100 -8.660 7.531 -2.690 1.00 0.00 C ATOM 0 H PHE A 100 -8.402 9.672 3.602 1.00 0.00 H new ATOM 0 HA PHE A 100 -10.594 9.928 1.880 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -8.374 10.386 1.157 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -7.756 8.875 1.792 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -10.675 9.313 -0.607 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -6.625 7.991 -0.006 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -10.668 8.262 -2.854 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -6.631 6.953 -2.247 1.00 0.00 H new ATOM 0 HZ PHE A 100 -8.666 7.067 -3.665 1.00 0.00 H new ATOM 1548 N LEU A 101 -9.921 6.748 2.341 1.00 0.00 N ATOM 1549 CA LEU A 101 -10.517 5.385 2.318 1.00 0.00 C ATOM 1550 C LEU A 101 -11.921 5.314 2.969 1.00 0.00 C ATOM 1551 O LEU A 101 -12.785 4.538 2.556 1.00 0.00 O ATOM 1552 CB LEU A 101 -9.584 4.432 3.068 1.00 0.00 C ATOM 1553 CG LEU A 101 -10.149 3.008 3.260 1.00 0.00 C ATOM 1554 CD1 LEU A 101 -10.075 2.191 1.965 1.00 0.00 C ATOM 1555 CD2 LEU A 101 -9.476 2.311 4.439 1.00 0.00 C ATOM 0 H LEU A 101 -8.954 6.760 2.664 1.00 0.00 H new ATOM 0 HA LEU A 101 -10.635 5.105 1.271 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -8.640 4.366 2.527 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -9.361 4.857 4.047 1.00 0.00 H new ATOM 0 HG LEU A 101 -11.208 3.091 3.503 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -10.482 1.195 2.140 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -10.655 2.688 1.187 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.036 2.108 1.646 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -9.890 1.310 4.554 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -8.404 2.241 4.256 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -9.652 2.884 5.349 1.00 0.00 H new ATOM 1567 N LYS A 102 -12.052 6.053 4.064 1.00 0.00 N ATOM 1568 CA LYS A 102 -13.281 6.145 4.868 1.00 0.00 C ATOM 1569 C LYS A 102 -14.330 6.972 4.119 1.00 0.00 C ATOM 1570 O LYS A 102 -15.346 6.414 3.689 1.00 0.00 O ATOM 1571 CB LYS A 102 -12.975 6.721 6.258 1.00 0.00 C ATOM 1572 CG LYS A 102 -12.028 5.874 7.120 1.00 0.00 C ATOM 1573 CD LYS A 102 -10.557 6.048 6.750 1.00 0.00 C ATOM 1574 CE LYS A 102 -9.616 5.101 7.501 1.00 0.00 C ATOM 1575 NZ LYS A 102 -9.566 5.370 8.948 1.00 0.00 N ATOM 0 H LYS A 102 -11.291 6.623 4.433 1.00 0.00 H new ATOM 0 HA LYS A 102 -13.690 5.146 5.020 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -12.540 7.713 6.135 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -13.914 6.849 6.796 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -12.166 6.140 8.168 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -12.299 4.823 7.020 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -10.440 5.888 5.678 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -10.260 7.077 6.953 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -9.939 4.073 7.339 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -8.612 5.189 7.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -8.683 4.987 9.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -9.602 6.396 9.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -10.378 4.917 9.414 1.00 0.00 H new ATOM 1589 N ALA A 103 -14.009 8.252 3.881 1.00 0.00 N ATOM 1590 CA ALA A 103 -14.848 9.309 3.273 1.00 0.00 C ATOM 1591 C ALA A 103 -16.197 9.609 3.955 1.00 0.00 C ATOM 1592 O ALA A 103 -16.632 10.753 4.002 1.00 0.00 O ATOM 1593 CB ALA A 103 -15.022 9.065 1.771 1.00 0.00 C ATOM 0 H ALA A 103 -13.085 8.608 4.126 1.00 0.00 H new ATOM 0 HA ALA A 103 -14.280 10.223 3.445 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -15.642 9.853 1.344 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -14.046 9.068 1.286 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -15.503 8.100 1.612 1.00 0.00 H new ATOM 1599 N TYR A 104 -16.854 8.569 4.451 1.00 0.00 N ATOM 1600 CA TYR A 104 -18.024 8.630 5.336 1.00 0.00 C ATOM 1601 C TYR A 104 -17.667 9.162 6.745 1.00 0.00 C ATOM 1602 O TYR A 104 -17.696 10.370 6.994 1.00 0.00 O ATOM 1603 CB TYR A 104 -18.674 7.236 5.316 1.00 0.00 C ATOM 1604 CG TYR A 104 -19.793 7.026 6.347 1.00 0.00 C ATOM 1605 CD1 TYR A 104 -21.062 7.599 6.144 1.00 0.00 C ATOM 1606 CD2 TYR A 104 -19.573 6.183 7.439 1.00 0.00 C ATOM 1607 CE1 TYR A 104 -22.101 7.330 7.048 1.00 0.00 C ATOM 1608 CE2 TYR A 104 -20.612 5.914 8.343 1.00 0.00 C ATOM 1609 CZ TYR A 104 -21.882 6.487 8.140 1.00 0.00 C ATOM 1610 OH TYR A 104 -22.893 6.209 8.989 1.00 0.00 O ATOM 0 H TYR A 104 -16.577 7.610 4.241 1.00 0.00 H new ATOM 0 HA TYR A 104 -18.753 9.358 4.981 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -19.079 7.055 4.320 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -17.899 6.488 5.486 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -21.236 8.244 5.295 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -18.601 5.737 7.588 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -23.073 7.776 6.899 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -20.438 5.269 9.192 1.00 0.00 H new ATOM 0 HH TYR A 104 -22.573 5.607 9.693 1.00 0.00 H new ATOM 1620 N VAL A 105 -17.140 8.276 7.585 1.00 0.00 N ATOM 1621 CA VAL A 105 -16.884 8.526 9.022 1.00 0.00 C ATOM 1622 C VAL A 105 -15.928 9.691 9.347 1.00 0.00 C ATOM 1623 O VAL A 105 -16.351 10.664 9.963 1.00 0.00 O ATOM 1624 CB VAL A 105 -16.586 7.202 9.758 1.00 0.00 C ATOM 1625 CG1 VAL A 105 -15.291 6.509 9.330 1.00 0.00 C ATOM 1626 CG2 VAL A 105 -16.663 7.362 11.285 1.00 0.00 C ATOM 0 H VAL A 105 -16.868 7.338 7.290 1.00 0.00 H new ATOM 0 HA VAL A 105 -17.814 8.919 9.433 1.00 0.00 H new ATOM 0 HB VAL A 105 -17.384 6.529 9.445 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -15.165 5.588 9.900 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -15.338 6.274 8.267 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -14.445 7.170 9.518 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -16.447 6.406 11.762 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -15.933 8.104 11.610 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -17.664 7.690 11.566 1.00 0.00 H new ATOM 1636 N GLU A 106 -14.688 9.658 8.839 1.00 0.00 N ATOM 1637 CA GLU A 106 -13.702 10.721 9.113 1.00 0.00 C ATOM 1638 C GLU A 106 -14.032 12.132 8.585 1.00 0.00 C ATOM 1639 O GLU A 106 -13.518 13.122 9.100 1.00 0.00 O ATOM 1640 CB GLU A 106 -12.272 10.309 8.728 1.00 0.00 C ATOM 1641 CG GLU A 106 -11.708 9.329 9.757 1.00 0.00 C ATOM 1642 CD GLU A 106 -10.186 9.215 9.681 1.00 0.00 C ATOM 1643 OE1 GLU A 106 -9.710 8.371 8.882 1.00 0.00 O ATOM 1644 OE2 GLU A 106 -9.519 9.944 10.438 1.00 0.00 O ATOM 0 H GLU A 106 -14.342 8.911 8.238 1.00 0.00 H new ATOM 0 HA GLU A 106 -13.769 10.823 10.196 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -12.272 9.849 7.740 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -11.635 11.192 8.669 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -11.996 9.652 10.758 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -12.151 8.346 9.599 1.00 0.00 H new ATOM 1651 N CYS A 107 -14.857 12.187 7.538 1.00 0.00 N ATOM 1652 CA CYS A 107 -15.432 13.448 7.025 1.00 0.00 C ATOM 1653 C CYS A 107 -16.605 13.984 7.869 1.00 0.00 C ATOM 1654 O CYS A 107 -16.966 15.157 7.743 1.00 0.00 O ATOM 1655 CB CYS A 107 -15.892 13.186 5.582 1.00 0.00 C ATOM 1656 SG CYS A 107 -16.488 14.629 4.632 1.00 0.00 S ATOM 0 H CYS A 107 -15.150 11.361 7.016 1.00 0.00 H new ATOM 0 HA CYS A 107 -14.665 14.221 7.075 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -15.061 12.740 5.036 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -16.690 12.444 5.609 1.00 0.00 H new ATOM 0 HG CYS A 107 -16.434 14.364 3.360 1.00 0.00 H new ATOM 1662 N SER A 108 -17.149 13.108 8.711 1.00 0.00 N ATOM 1663 CA SER A 108 -18.426 13.260 9.453 1.00 0.00 C ATOM 1664 C SER A 108 -19.609 13.551 8.514 1.00 0.00 C ATOM 1665 O SER A 108 -20.457 14.394 8.788 1.00 0.00 O ATOM 1666 CB SER A 108 -18.313 14.310 10.570 1.00 0.00 C ATOM 1667 OG SER A 108 -17.286 13.923 11.498 1.00 0.00 O ATOM 0 H SER A 108 -16.695 12.218 8.914 1.00 0.00 H new ATOM 0 HA SER A 108 -18.631 12.302 9.930 1.00 0.00 H new ATOM 0 HB2 SER A 108 -18.081 15.286 10.143 1.00 0.00 H new ATOM 0 HB3 SER A 108 -19.267 14.407 11.088 1.00 0.00 H new ATOM 0 HG SER A 108 -17.216 14.595 12.207 1.00 0.00 H new ATOM 1673 N THR A 109 -19.621 12.826 7.382 1.00 0.00 N ATOM 1674 CA THR A 109 -20.547 13.020 6.238 1.00 0.00 C ATOM 1675 C THR A 109 -20.848 14.508 5.934 1.00 0.00 C ATOM 1676 O THR A 109 -21.932 14.859 5.466 1.00 0.00 O ATOM 1677 CB THR A 109 -21.808 12.130 6.350 1.00 0.00 C ATOM 1678 OG1 THR A 109 -22.561 12.258 5.143 1.00 0.00 O ATOM 1679 CG2 THR A 109 -22.706 12.404 7.559 1.00 0.00 C ATOM 0 H THR A 109 -18.965 12.060 7.227 1.00 0.00 H new ATOM 0 HA THR A 109 -20.018 12.670 5.351 1.00 0.00 H new ATOM 0 HB THR A 109 -21.448 11.113 6.504 1.00 0.00 H new ATOM 0 HG1 THR A 109 -22.734 13.206 4.965 1.00 0.00 H new ATOM 0 HG21 THR A 109 -23.559 11.726 7.540 1.00 0.00 H new ATOM 0 HG22 THR A 109 -22.139 12.248 8.476 1.00 0.00 H new ATOM 0 HG23 THR A 109 -23.061 13.434 7.523 1.00 0.00 H new ATOM 1687 N CYS A 110 -19.733 15.242 5.852 1.00 0.00 N ATOM 1688 CA CYS A 110 -19.624 16.708 5.920 1.00 0.00 C ATOM 1689 C CYS A 110 -20.012 17.296 7.287 1.00 0.00 C ATOM 1690 O CYS A 110 -21.158 17.627 7.566 1.00 0.00 O ATOM 1691 CB CYS A 110 -20.338 17.434 4.768 1.00 0.00 C ATOM 1692 SG CYS A 110 -20.071 19.243 4.769 1.00 0.00 S ATOM 0 H CYS A 110 -18.821 14.801 5.728 1.00 0.00 H new ATOM 0 HA CYS A 110 -18.558 16.899 5.794 1.00 0.00 H new ATOM 0 HB2 CYS A 110 -19.990 17.024 3.820 1.00 0.00 H new ATOM 0 HB3 CYS A 110 -21.407 17.233 4.829 1.00 0.00 H new ATOM 0 HG CYS A 110 -19.906 19.658 3.548 1.00 0.00 H new ATOM 1698 N LYS A 111 -18.974 17.390 8.124 1.00 0.00 N ATOM 1699 CA LYS A 111 -18.996 18.056 9.443 1.00 0.00 C ATOM 1700 C LYS A 111 -19.528 19.506 9.359 1.00 0.00 C ATOM 1701 O LYS A 111 -20.603 19.790 9.870 1.00 0.00 O ATOM 1702 CB LYS A 111 -17.574 17.962 10.016 1.00 0.00 C ATOM 1703 CG LYS A 111 -17.455 18.454 11.467 1.00 0.00 C ATOM 1704 CD LYS A 111 -15.998 18.468 11.948 1.00 0.00 C ATOM 1705 CE LYS A 111 -15.160 19.554 11.260 1.00 0.00 C ATOM 1706 NZ LYS A 111 -13.765 19.518 11.713 1.00 0.00 N ATOM 0 H LYS A 111 -18.061 16.993 7.900 1.00 0.00 H new ATOM 0 HA LYS A 111 -19.695 17.558 10.115 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -17.240 16.926 9.965 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -16.900 18.545 9.388 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -17.873 19.458 11.546 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -18.046 17.810 12.118 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -15.977 18.626 13.026 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -15.548 17.493 11.760 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -15.197 19.415 10.180 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -15.588 20.534 11.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -13.224 20.264 11.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -13.730 19.675 12.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -13.351 18.590 11.490 1.00 0.00 H new ATOM 1720 N SER A 112 -18.677 20.417 8.876 1.00 0.00 N ATOM 1721 CA SER A 112 -19.013 21.823 8.576 1.00 0.00 C ATOM 1722 C SER A 112 -17.842 22.496 7.841 1.00 0.00 C ATOM 1723 O SER A 112 -16.780 22.699 8.429 1.00 0.00 O ATOM 1724 CB SER A 112 -19.321 22.635 9.846 1.00 0.00 C ATOM 1725 OG SER A 112 -19.764 23.956 9.491 1.00 0.00 O ATOM 0 H SER A 112 -17.702 20.194 8.675 1.00 0.00 H new ATOM 0 HA SER A 112 -19.907 21.808 7.952 1.00 0.00 H new ATOM 0 HB2 SER A 112 -20.089 22.131 10.432 1.00 0.00 H new ATOM 0 HB3 SER A 112 -18.431 22.697 10.472 1.00 0.00 H new ATOM 0 HG SER A 112 -19.959 24.465 10.305 1.00 0.00 H new ATOM 1731 N LEU A 113 -18.014 22.605 6.526 1.00 0.00 N ATOM 1732 CA LEU A 113 -17.041 23.195 5.570 1.00 0.00 C ATOM 1733 C LEU A 113 -15.678 22.477 5.484 1.00 0.00 C ATOM 1734 O LEU A 113 -15.250 21.796 6.415 1.00 0.00 O ATOM 1735 CB LEU A 113 -16.800 24.688 5.820 1.00 0.00 C ATOM 1736 CG LEU A 113 -17.879 25.681 5.342 1.00 0.00 C ATOM 1737 CD1 LEU A 113 -18.141 25.566 3.841 1.00 0.00 C ATOM 1738 CD2 LEU A 113 -19.178 25.594 6.155 1.00 0.00 C ATOM 0 H LEU A 113 -18.863 22.276 6.065 1.00 0.00 H new ATOM 0 HA LEU A 113 -17.535 23.052 4.609 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -16.665 24.830 6.892 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -15.859 24.960 5.342 1.00 0.00 H new ATOM 0 HG LEU A 113 -17.471 26.675 5.525 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -18.908 26.284 3.549 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -17.222 25.775 3.294 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -18.481 24.557 3.607 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -19.897 26.317 5.770 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -19.593 24.590 6.071 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -18.968 25.814 7.202 1.00 0.00 H new ATOM 1750 N ASP A 114 -15.108 22.509 4.275 1.00 0.00 N ATOM 1751 CA ASP A 114 -13.740 22.043 3.924 1.00 0.00 C ATOM 1752 C ASP A 114 -13.316 20.578 4.151 1.00 0.00 C ATOM 1753 O ASP A 114 -12.295 20.145 3.618 1.00 0.00 O ATOM 1754 CB ASP A 114 -12.679 23.001 4.492 1.00 0.00 C ATOM 1755 CG ASP A 114 -12.739 24.370 3.806 1.00 0.00 C ATOM 1756 OD1 ASP A 114 -13.539 25.211 4.268 1.00 0.00 O ATOM 1757 OD2 ASP A 114 -12.025 24.521 2.780 1.00 0.00 O ATOM 0 H ASP A 114 -15.605 22.878 3.464 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.805 22.063 2.836 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -12.833 23.122 5.564 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -11.687 22.569 4.359 1.00 0.00 H new ATOM 1762 N THR A 115 -14.028 19.885 5.029 1.00 0.00 N ATOM 1763 CA THR A 115 -13.854 18.457 5.388 1.00 0.00 C ATOM 1764 C THR A 115 -13.574 17.501 4.205 1.00 0.00 C ATOM 1765 O THR A 115 -13.958 17.751 3.068 1.00 0.00 O ATOM 1766 CB THR A 115 -15.020 17.984 6.291 1.00 0.00 C ATOM 1767 OG1 THR A 115 -14.782 16.652 6.765 1.00 0.00 O ATOM 1768 CG2 THR A 115 -16.390 18.105 5.633 1.00 0.00 C ATOM 0 H THR A 115 -14.792 20.317 5.549 1.00 0.00 H new ATOM 0 HA THR A 115 -12.927 18.404 5.959 1.00 0.00 H new ATOM 0 HB THR A 115 -15.045 18.663 7.144 1.00 0.00 H new ATOM 0 HG1 THR A 115 -15.625 16.259 7.073 1.00 0.00 H new ATOM 0 HG21 THR A 115 -17.157 17.756 6.324 1.00 0.00 H new ATOM 0 HG22 THR A 115 -16.580 19.147 5.377 1.00 0.00 H new ATOM 0 HG23 THR A 115 -16.414 17.499 4.728 1.00 0.00 H new ATOM 1776 N ILE A 116 -13.067 16.344 4.603 1.00 0.00 N ATOM 1777 CA ILE A 116 -12.361 15.317 3.803 1.00 0.00 C ATOM 1778 C ILE A 116 -12.782 15.211 2.326 1.00 0.00 C ATOM 1779 O ILE A 116 -13.810 14.627 1.969 1.00 0.00 O ATOM 1780 CB ILE A 116 -12.390 13.938 4.521 1.00 0.00 C ATOM 1781 CG1 ILE A 116 -12.003 14.021 6.015 1.00 0.00 C ATOM 1782 CG2 ILE A 116 -11.544 12.881 3.801 1.00 0.00 C ATOM 1783 CD1 ILE A 116 -10.723 14.789 6.362 1.00 0.00 C ATOM 0 H ILE A 116 -13.138 16.061 5.580 1.00 0.00 H new ATOM 0 HA ILE A 116 -11.331 15.668 3.746 1.00 0.00 H new ATOM 0 HB ILE A 116 -13.431 13.619 4.476 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -12.831 14.482 6.554 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -11.901 13.005 6.395 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -11.600 11.938 4.345 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -11.923 12.739 2.789 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -10.507 13.213 3.757 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -10.569 14.770 7.441 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -9.872 14.322 5.866 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -10.816 15.822 6.027 1.00 0.00 H new ATOM 1795 N LEU A 117 -11.949 15.837 1.507 1.00 0.00 N ATOM 1796 CA LEU A 117 -11.992 15.743 0.035 1.00 0.00 C ATOM 1797 C LEU A 117 -11.668 14.305 -0.421 1.00 0.00 C ATOM 1798 O LEU A 117 -10.736 13.670 0.074 1.00 0.00 O ATOM 1799 CB LEU A 117 -11.034 16.752 -0.624 1.00 0.00 C ATOM 1800 CG LEU A 117 -11.285 18.255 -0.388 1.00 0.00 C ATOM 1801 CD1 LEU A 117 -12.750 18.671 -0.604 1.00 0.00 C ATOM 1802 CD2 LEU A 117 -10.756 18.737 0.965 1.00 0.00 C ATOM 0 H LEU A 117 -11.201 16.443 1.846 1.00 0.00 H new ATOM 0 HA LEU A 117 -13.003 15.993 -0.287 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -10.024 16.525 -0.282 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -11.053 16.576 -1.700 1.00 0.00 H new ATOM 0 HG LEU A 117 -10.705 18.763 -1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -12.855 19.740 -0.421 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -13.044 18.447 -1.629 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -13.390 18.120 0.085 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -10.960 19.802 1.077 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -11.250 18.187 1.766 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -9.681 18.566 1.017 1.00 0.00 H new ATOM 1814 N LYS A 118 -12.352 13.917 -1.482 1.00 0.00 N ATOM 1815 CA LYS A 118 -12.413 12.522 -1.964 1.00 0.00 C ATOM 1816 C LYS A 118 -11.793 12.432 -3.371 1.00 0.00 C ATOM 1817 O LYS A 118 -11.565 13.444 -4.029 1.00 0.00 O ATOM 1818 CB LYS A 118 -13.910 12.180 -1.970 1.00 0.00 C ATOM 1819 CG LYS A 118 -14.245 10.687 -1.952 1.00 0.00 C ATOM 1820 CD LYS A 118 -15.752 10.449 -2.101 1.00 0.00 C ATOM 1821 CE LYS A 118 -16.583 11.017 -0.951 1.00 0.00 C ATOM 1822 NZ LYS A 118 -18.019 10.748 -1.130 1.00 0.00 N ATOM 0 H LYS A 118 -12.896 14.564 -2.053 1.00 0.00 H new ATOM 0 HA LYS A 118 -11.854 11.824 -1.341 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -14.376 12.649 -1.103 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -14.363 12.626 -2.856 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -13.714 10.184 -2.760 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -13.896 10.246 -1.018 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -16.090 10.895 -3.036 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -15.936 9.377 -2.175 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -16.246 10.582 -0.010 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -16.420 12.093 -0.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -18.550 11.149 -0.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -18.346 11.184 -2.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -18.177 9.721 -1.171 1.00 0.00 H new ATOM 1836 N LYS A 119 -11.537 11.206 -3.834 1.00 0.00 N ATOM 1837 CA LYS A 119 -10.877 10.982 -5.138 1.00 0.00 C ATOM 1838 C LYS A 119 -11.788 10.270 -6.144 1.00 0.00 C ATOM 1839 O LYS A 119 -12.586 9.392 -5.809 1.00 0.00 O ATOM 1840 CB LYS A 119 -9.594 10.168 -4.918 1.00 0.00 C ATOM 1841 CG LYS A 119 -8.653 10.206 -6.122 1.00 0.00 C ATOM 1842 CD LYS A 119 -7.456 9.276 -5.904 1.00 0.00 C ATOM 1843 CE LYS A 119 -6.396 9.498 -6.993 1.00 0.00 C ATOM 1844 NZ LYS A 119 -5.638 10.731 -6.767 1.00 0.00 N ATOM 0 H LYS A 119 -11.773 10.350 -3.332 1.00 0.00 H new ATOM 0 HA LYS A 119 -10.640 11.957 -5.564 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -9.071 10.552 -4.042 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -9.859 9.133 -4.702 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -9.193 9.908 -7.021 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -8.303 11.225 -6.284 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -7.020 9.459 -4.922 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.788 8.238 -5.917 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -5.713 8.649 -7.014 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.880 9.542 -7.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -4.846 10.780 -7.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -6.261 11.552 -6.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -5.268 10.738 -5.795 1.00 0.00 H new ATOM 1858 N GLU A 120 -11.697 10.768 -7.381 1.00 0.00 N ATOM 1859 CA GLU A 120 -12.306 10.176 -8.581 1.00 0.00 C ATOM 1860 C GLU A 120 -11.292 9.364 -9.402 1.00 0.00 C ATOM 1861 O GLU A 120 -10.157 9.806 -9.622 1.00 0.00 O ATOM 1862 CB GLU A 120 -12.871 11.278 -9.494 1.00 0.00 C ATOM 1863 CG GLU A 120 -14.125 11.955 -8.939 1.00 0.00 C ATOM 1864 CD GLU A 120 -15.396 11.103 -8.929 1.00 0.00 C ATOM 1865 OE1 GLU A 120 -15.299 9.854 -8.844 1.00 0.00 O ATOM 1866 OE2 GLU A 120 -16.471 11.742 -8.991 1.00 0.00 O ATOM 0 H GLU A 120 -11.180 11.624 -7.584 1.00 0.00 H new ATOM 0 HA GLU A 120 -13.098 9.514 -8.232 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -12.102 12.034 -9.655 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -13.103 10.847 -10.468 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -13.919 12.277 -7.918 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -14.318 12.854 -9.524 1.00 0.00 H new ATOM 1873 N LYS A 121 -11.829 8.343 -10.064 1.00 0.00 N ATOM 1874 CA LYS A 121 -11.080 7.410 -10.930 1.00 0.00 C ATOM 1875 C LYS A 121 -10.371 8.139 -12.084 1.00 0.00 C ATOM 1876 O LYS A 121 -11.001 8.848 -12.871 1.00 0.00 O ATOM 1877 CB LYS A 121 -11.998 6.284 -11.428 1.00 0.00 C ATOM 1878 CG LYS A 121 -13.119 6.649 -12.426 1.00 0.00 C ATOM 1879 CD LYS A 121 -14.231 7.597 -11.951 1.00 0.00 C ATOM 1880 CE LYS A 121 -15.229 6.970 -10.964 1.00 0.00 C ATOM 1881 NZ LYS A 121 -14.712 6.876 -9.590 1.00 0.00 N ATOM 0 H LYS A 121 -12.825 8.128 -10.018 1.00 0.00 H new ATOM 0 HA LYS A 121 -10.291 6.954 -10.332 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -11.371 5.524 -11.894 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -12.464 5.823 -10.557 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -12.652 7.096 -13.303 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -13.589 5.722 -12.753 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -13.772 8.467 -11.480 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -14.779 7.958 -12.821 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -16.145 7.561 -10.960 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -15.495 5.972 -11.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -15.493 6.656 -8.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -13.996 6.123 -9.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -14.281 7.783 -9.319 1.00 0.00 H new ATOM 1895 N LYS A 122 -9.048 8.236 -11.928 1.00 0.00 N ATOM 1896 CA LYS A 122 -8.098 8.909 -12.861 1.00 0.00 C ATOM 1897 C LYS A 122 -8.310 10.434 -13.045 1.00 0.00 C ATOM 1898 O LYS A 122 -7.606 11.077 -13.814 1.00 0.00 O ATOM 1899 CB LYS A 122 -8.087 8.216 -14.230 1.00 0.00 C ATOM 1900 CG LYS A 122 -7.704 6.737 -14.136 1.00 0.00 C ATOM 1901 CD LYS A 122 -7.817 6.047 -15.504 1.00 0.00 C ATOM 1902 CE LYS A 122 -7.643 4.529 -15.402 1.00 0.00 C ATOM 1903 NZ LYS A 122 -8.773 3.891 -14.705 1.00 0.00 N ATOM 0 H LYS A 122 -8.575 7.835 -11.118 1.00 0.00 H new ATOM 0 HA LYS A 122 -7.129 8.807 -12.373 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.073 8.304 -14.686 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -7.385 8.729 -14.887 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -6.684 6.646 -13.763 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -8.353 6.235 -13.418 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -8.789 6.271 -15.943 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.062 6.453 -16.177 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -7.549 4.107 -16.402 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -6.717 4.305 -14.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -8.713 2.859 -14.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.737 4.131 -13.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -9.668 4.232 -15.110 1.00 0.00 H new ATOM 1917 N SER A 123 -9.182 10.994 -12.205 1.00 0.00 N ATOM 1918 CA SER A 123 -9.621 12.411 -12.262 1.00 0.00 C ATOM 1919 C SER A 123 -9.320 13.217 -10.980 1.00 0.00 C ATOM 1920 O SER A 123 -9.103 14.428 -11.046 1.00 0.00 O ATOM 1921 CB SER A 123 -11.122 12.411 -12.559 1.00 0.00 C ATOM 1922 OG SER A 123 -11.679 13.725 -12.545 1.00 0.00 O ATOM 0 H SER A 123 -9.619 10.473 -11.445 1.00 0.00 H new ATOM 0 HA SER A 123 -9.052 12.913 -13.045 1.00 0.00 H new ATOM 0 HB2 SER A 123 -11.297 11.956 -13.534 1.00 0.00 H new ATOM 0 HB3 SER A 123 -11.636 11.794 -11.822 1.00 0.00 H new ATOM 0 HG SER A 123 -11.770 14.051 -13.465 1.00 0.00 H new ATOM 1928 N TRP A 124 -9.296 12.526 -9.832 1.00 0.00 N ATOM 1929 CA TRP A 124 -9.102 13.081 -8.466 1.00 0.00 C ATOM 1930 C TRP A 124 -10.282 13.955 -7.995 1.00 0.00 C ATOM 1931 O TRP A 124 -11.118 13.462 -7.249 1.00 0.00 O ATOM 1932 CB TRP A 124 -7.754 13.800 -8.344 1.00 0.00 C ATOM 1933 CG TRP A 124 -7.158 13.898 -6.927 1.00 0.00 C ATOM 1934 CD1 TRP A 124 -7.745 13.619 -5.759 1.00 0.00 C ATOM 1935 CD2 TRP A 124 -5.826 14.181 -6.651 1.00 0.00 C ATOM 1936 NE1 TRP A 124 -6.853 13.693 -4.777 1.00 0.00 N ATOM 1937 CE2 TRP A 124 -5.670 14.039 -5.273 1.00 0.00 C ATOM 1938 CE3 TRP A 124 -4.754 14.641 -7.440 1.00 0.00 C ATOM 1939 CZ2 TRP A 124 -4.440 14.366 -4.664 1.00 0.00 C ATOM 1940 CZ3 TRP A 124 -3.538 14.969 -6.834 1.00 0.00 C ATOM 1941 CH2 TRP A 124 -3.384 14.842 -5.448 1.00 0.00 C ATOM 0 H TRP A 124 -9.417 11.513 -9.820 1.00 0.00 H new ATOM 0 HA TRP A 124 -9.081 12.232 -7.783 1.00 0.00 H new ATOM 0 HB2 TRP A 124 -7.034 13.288 -8.983 1.00 0.00 H new ATOM 0 HB3 TRP A 124 -7.868 14.810 -8.738 1.00 0.00 H new ATOM 0 HD1 TRP A 124 -8.788 13.371 -5.632 1.00 0.00 H new ATOM 0 HE1 TRP A 124 -7.047 13.512 -3.792 1.00 0.00 H new ATOM 0 HE3 TRP A 124 -4.871 14.740 -8.509 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 -4.314 14.249 -3.598 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 -2.714 15.322 -7.437 1.00 0.00 H new ATOM 0 HH2 TRP A 124 -2.447 15.112 -4.983 1.00 0.00 H new ATOM 1952 N TYR A 125 -10.455 15.100 -8.654 1.00 0.00 N ATOM 1953 CA TYR A 125 -11.441 16.174 -8.396 1.00 0.00 C ATOM 1954 C TYR A 125 -12.550 15.966 -7.342 1.00 0.00 C ATOM 1955 O TYR A 125 -12.514 16.599 -6.296 1.00 0.00 O ATOM 1956 CB TYR A 125 -12.035 16.651 -9.732 1.00 0.00 C ATOM 1957 CG TYR A 125 -11.008 17.117 -10.781 1.00 0.00 C ATOM 1958 CD1 TYR A 125 -9.750 17.639 -10.423 1.00 0.00 C ATOM 1959 CD2 TYR A 125 -11.346 16.978 -12.130 1.00 0.00 C ATOM 1960 CE1 TYR A 125 -8.827 17.990 -11.429 1.00 0.00 C ATOM 1961 CE2 TYR A 125 -10.432 17.338 -13.128 1.00 0.00 C ATOM 1962 CZ TYR A 125 -9.166 17.837 -12.775 1.00 0.00 C ATOM 1963 OH TYR A 125 -8.290 18.220 -13.734 1.00 0.00 O ATOM 0 H TYR A 125 -9.863 15.329 -9.452 1.00 0.00 H new ATOM 0 HA TYR A 125 -10.836 16.932 -7.899 1.00 0.00 H new ATOM 0 HB2 TYR A 125 -12.623 15.839 -10.160 1.00 0.00 H new ATOM 0 HB3 TYR A 125 -12.723 17.472 -9.532 1.00 0.00 H new ATOM 0 HD1 TYR A 125 -9.493 17.770 -9.382 1.00 0.00 H new ATOM 0 HD2 TYR A 125 -12.316 16.591 -12.404 1.00 0.00 H new ATOM 0 HE1 TYR A 125 -7.856 18.378 -11.158 1.00 0.00 H new ATOM 0 HE2 TYR A 125 -10.700 17.232 -14.169 1.00 0.00 H new ATOM 0 HH TYR A 125 -8.676 18.046 -14.618 1.00 0.00 H new ATOM 1973 N ILE A 126 -13.581 15.208 -7.725 1.00 0.00 N ATOM 1974 CA ILE A 126 -14.777 14.868 -6.911 1.00 0.00 C ATOM 1975 C ILE A 126 -15.774 16.022 -6.709 1.00 0.00 C ATOM 1976 O ILE A 126 -15.451 17.207 -6.798 1.00 0.00 O ATOM 1977 CB ILE A 126 -14.327 14.164 -5.597 1.00 0.00 C ATOM 1978 CG1 ILE A 126 -14.869 12.726 -5.502 1.00 0.00 C ATOM 1979 CG2 ILE A 126 -14.500 14.955 -4.292 1.00 0.00 C ATOM 1980 CD1 ILE A 126 -16.394 12.548 -5.477 1.00 0.00 C ATOM 0 H ILE A 126 -13.617 14.789 -8.654 1.00 0.00 H new ATOM 0 HA ILE A 126 -15.375 14.161 -7.485 1.00 0.00 H new ATOM 0 HB ILE A 126 -13.242 14.116 -5.694 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -14.477 12.161 -6.348 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -14.462 12.271 -4.599 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -14.150 14.354 -3.453 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -13.920 15.876 -4.345 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -15.553 15.197 -4.150 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -16.635 11.487 -5.408 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -16.807 13.071 -4.614 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -16.823 12.959 -6.390 1.00 0.00 H new ATOM 1992 N VAL A 127 -17.027 15.623 -6.503 1.00 0.00 N ATOM 1993 CA VAL A 127 -18.103 16.499 -6.008 1.00 0.00 C ATOM 1994 C VAL A 127 -17.795 16.806 -4.536 1.00 0.00 C ATOM 1995 O VAL A 127 -18.042 15.998 -3.643 1.00 0.00 O ATOM 1996 CB VAL A 127 -19.498 15.850 -6.162 1.00 0.00 C ATOM 1997 CG1 VAL A 127 -20.612 16.824 -5.763 1.00 0.00 C ATOM 1998 CG2 VAL A 127 -19.760 15.365 -7.596 1.00 0.00 C ATOM 0 H VAL A 127 -17.335 14.666 -6.676 1.00 0.00 H new ATOM 0 HA VAL A 127 -18.136 17.416 -6.597 1.00 0.00 H new ATOM 0 HB VAL A 127 -19.504 14.989 -5.494 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -21.580 16.338 -5.882 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -20.481 17.120 -4.722 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -20.568 17.707 -6.400 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -20.752 14.917 -7.653 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -19.704 16.210 -8.282 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -19.011 14.623 -7.872 1.00 0.00 H new ATOM 2008 N CYS A 128 -16.989 17.856 -4.364 1.00 0.00 N ATOM 2009 CA CYS A 128 -16.522 18.337 -3.057 1.00 0.00 C ATOM 2010 C CYS A 128 -17.657 18.807 -2.141 1.00 0.00 C ATOM 2011 O CYS A 128 -18.036 19.981 -2.106 1.00 0.00 O ATOM 2012 CB CYS A 128 -15.470 19.430 -3.280 1.00 0.00 C ATOM 2013 SG CYS A 128 -14.018 18.883 -4.253 1.00 0.00 S ATOM 0 H CYS A 128 -16.634 18.409 -5.144 1.00 0.00 H new ATOM 0 HA CYS A 128 -16.071 17.498 -2.527 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -15.939 20.272 -3.789 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -15.128 19.794 -2.311 1.00 0.00 H new ATOM 0 HG CYS A 128 -14.420 18.225 -5.300 1.00 0.00 H new ATOM 2019 N LEU A 129 -18.144 17.831 -1.375 1.00 0.00 N ATOM 2020 CA LEU A 129 -19.268 17.920 -0.410 1.00 0.00 C ATOM 2021 C LEU A 129 -19.108 18.878 0.794 1.00 0.00 C ATOM 2022 O LEU A 129 -19.837 18.780 1.777 1.00 0.00 O ATOM 2023 CB LEU A 129 -19.594 16.495 0.088 1.00 0.00 C ATOM 2024 CG LEU A 129 -18.561 15.844 1.025 1.00 0.00 C ATOM 2025 CD1 LEU A 129 -19.238 14.755 1.856 1.00 0.00 C ATOM 2026 CD2 LEU A 129 -17.385 15.219 0.267 1.00 0.00 C ATOM 0 H LEU A 129 -17.747 16.892 -1.405 1.00 0.00 H new ATOM 0 HA LEU A 129 -20.082 18.375 -0.974 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -20.553 16.525 0.605 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -19.721 15.850 -0.781 1.00 0.00 H new ATOM 0 HG LEU A 129 -18.167 16.637 1.661 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -18.505 14.295 2.519 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -20.039 15.196 2.450 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -19.654 13.997 1.193 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -16.688 14.775 0.978 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -17.756 14.447 -0.408 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -16.873 15.989 -0.309 1.00 0.00 H new ATOM 2038 N ALA A 130 -18.338 19.939 0.582 1.00 0.00 N ATOM 2039 CA ALA A 130 -17.920 20.898 1.629 1.00 0.00 C ATOM 2040 C ALA A 130 -17.260 22.167 1.079 1.00 0.00 C ATOM 2041 O ALA A 130 -17.493 23.255 1.598 1.00 0.00 O ATOM 2042 CB ALA A 130 -16.958 20.230 2.614 1.00 0.00 C ATOM 0 H ALA A 130 -17.972 20.173 -0.341 1.00 0.00 H new ATOM 0 HA ALA A 130 -18.840 21.201 2.129 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -16.661 20.949 3.377 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -17.453 19.382 3.088 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -16.074 19.882 2.080 1.00 0.00 H new ATOM 2048 N CYS A 131 -16.333 22.010 0.129 1.00 0.00 N ATOM 2049 CA CYS A 131 -15.621 23.152 -0.484 1.00 0.00 C ATOM 2050 C CYS A 131 -15.443 22.984 -2.006 1.00 0.00 C ATOM 2051 O CYS A 131 -14.507 22.338 -2.475 1.00 0.00 O ATOM 2052 CB CYS A 131 -14.279 23.342 0.235 1.00 0.00 C ATOM 2053 SG CYS A 131 -13.383 24.862 -0.214 1.00 0.00 S ATOM 0 H CYS A 131 -16.052 21.101 -0.238 1.00 0.00 H new ATOM 0 HA CYS A 131 -16.225 24.051 -0.360 1.00 0.00 H new ATOM 0 HB2 CYS A 131 -14.456 23.345 1.311 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -13.642 22.484 0.019 1.00 0.00 H new ATOM 0 HG CYS A 131 -12.615 25.221 0.772 1.00 0.00 H new ATOM 2059 N GLY A 132 -16.450 23.460 -2.734 1.00 0.00 N ATOM 2060 CA GLY A 132 -16.453 23.534 -4.210 1.00 0.00 C ATOM 2061 C GLY A 132 -17.508 22.659 -4.904 1.00 0.00 C ATOM 2062 O GLY A 132 -17.613 21.464 -4.636 1.00 0.00 O ATOM 0 H GLY A 132 -17.309 23.815 -2.314 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -16.612 24.571 -4.506 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -15.467 23.246 -4.575 1.00 0.00 H new ATOM 2066 N ALA A 133 -18.095 23.230 -5.950 1.00 0.00 N ATOM 2067 CA ALA A 133 -19.174 22.607 -6.760 1.00 0.00 C ATOM 2068 C ALA A 133 -18.656 21.629 -7.851 1.00 0.00 C ATOM 2069 O ALA A 133 -19.276 21.424 -8.894 1.00 0.00 O ATOM 2070 CB ALA A 133 -20.012 23.736 -7.358 1.00 0.00 C ATOM 0 H ALA A 133 -17.839 24.161 -6.279 1.00 0.00 H new ATOM 0 HA ALA A 133 -19.781 21.979 -6.108 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -20.816 23.313 -7.961 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -20.439 24.337 -6.555 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -19.380 24.365 -7.986 1.00 0.00 H new ATOM 2076 N GLN A 134 -17.671 20.837 -7.424 1.00 0.00 N ATOM 2077 CA GLN A 134 -16.777 19.960 -8.212 1.00 0.00 C ATOM 2078 C GLN A 134 -15.968 20.689 -9.301 1.00 0.00 C ATOM 2079 O GLN A 134 -16.412 21.638 -9.934 1.00 0.00 O ATOM 2080 CB GLN A 134 -17.429 18.698 -8.814 1.00 0.00 C ATOM 2081 CG GLN A 134 -18.127 18.829 -10.185 1.00 0.00 C ATOM 2082 CD GLN A 134 -18.162 17.497 -10.940 1.00 0.00 C ATOM 2083 OE1 GLN A 134 -17.277 17.157 -11.727 1.00 0.00 O ATOM 2084 NE2 GLN A 134 -19.211 16.736 -10.745 1.00 0.00 N ATOM 0 H GLN A 134 -17.452 20.782 -6.429 1.00 0.00 H new ATOM 0 HA GLN A 134 -16.089 19.620 -7.438 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -16.657 17.933 -8.903 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -18.164 18.328 -8.099 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -19.145 19.191 -10.041 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -17.607 19.574 -10.787 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -19.938 17.027 -10.091 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -19.301 15.853 -11.247 1.00 0.00 H new ATOM 2093 N THR A 135 -14.731 20.224 -9.445 1.00 0.00 N ATOM 2094 CA THR A 135 -13.917 20.451 -10.656 1.00 0.00 C ATOM 2095 C THR A 135 -14.403 19.415 -11.677 1.00 0.00 C ATOM 2096 O THR A 135 -14.366 18.221 -11.366 1.00 0.00 O ATOM 2097 CB THR A 135 -12.422 20.231 -10.348 1.00 0.00 C ATOM 2098 OG1 THR A 135 -12.084 20.816 -9.087 1.00 0.00 O ATOM 2099 CG2 THR A 135 -11.538 20.832 -11.442 1.00 0.00 C ATOM 0 H THR A 135 -14.255 19.676 -8.728 1.00 0.00 H new ATOM 0 HA THR A 135 -14.023 21.470 -11.027 1.00 0.00 H new ATOM 0 HB THR A 135 -12.245 19.156 -10.310 1.00 0.00 H new ATOM 0 HG1 THR A 135 -11.133 20.668 -8.902 1.00 0.00 H new ATOM 0 HG21 THR A 135 -10.490 20.661 -11.197 1.00 0.00 H new ATOM 0 HG22 THR A 135 -11.769 20.360 -12.397 1.00 0.00 H new ATOM 0 HG23 THR A 135 -11.724 21.904 -11.512 1.00 0.00 H new ATOM 2107 N PRO A 136 -14.868 19.836 -12.869 1.00 0.00 N ATOM 2108 CA PRO A 136 -15.461 18.932 -13.874 1.00 0.00 C ATOM 2109 C PRO A 136 -14.530 17.751 -14.223 1.00 0.00 C ATOM 2110 O PRO A 136 -13.445 17.911 -14.777 1.00 0.00 O ATOM 2111 CB PRO A 136 -15.788 19.819 -15.082 1.00 0.00 C ATOM 2112 CG PRO A 136 -14.832 21.005 -14.926 1.00 0.00 C ATOM 2113 CD PRO A 136 -14.752 21.201 -13.409 1.00 0.00 C ATOM 0 HA PRO A 136 -16.361 18.448 -13.496 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -15.624 19.293 -16.022 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -16.830 20.140 -15.074 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -13.853 20.791 -15.355 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -15.212 21.896 -15.427 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -13.812 21.668 -13.116 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -15.554 21.844 -13.046 1.00 0.00 H new ATOM 2121 N VAL A 137 -14.980 16.589 -13.763 1.00 0.00 N ATOM 2122 CA VAL A 137 -14.218 15.318 -13.806 1.00 0.00 C ATOM 2123 C VAL A 137 -13.476 14.959 -15.113 1.00 0.00 C ATOM 2124 O VAL A 137 -12.305 14.590 -15.058 1.00 0.00 O ATOM 2125 CB VAL A 137 -15.017 14.116 -13.268 1.00 0.00 C ATOM 2126 CG1 VAL A 137 -15.265 14.274 -11.761 1.00 0.00 C ATOM 2127 CG2 VAL A 137 -16.350 13.889 -13.999 1.00 0.00 C ATOM 0 H VAL A 137 -15.902 16.488 -13.339 1.00 0.00 H new ATOM 0 HA VAL A 137 -13.404 15.547 -13.118 1.00 0.00 H new ATOM 0 HB VAL A 137 -14.405 13.234 -13.456 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -15.831 13.418 -11.394 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -14.310 14.329 -11.239 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -15.831 15.188 -11.579 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -16.859 13.027 -13.568 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -16.979 14.773 -13.892 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -16.159 13.706 -15.056 1.00 0.00 H new ATOM 2137 N LYS A 138 -14.158 15.149 -16.239 1.00 0.00 N ATOM 2138 CA LYS A 138 -13.658 14.887 -17.608 1.00 0.00 C ATOM 2139 C LYS A 138 -14.652 15.434 -18.665 1.00 0.00 C ATOM 2140 O LYS A 138 -15.797 15.710 -18.315 1.00 0.00 O ATOM 2141 CB LYS A 138 -13.411 13.390 -17.855 1.00 0.00 C ATOM 2142 CG LYS A 138 -14.666 12.503 -17.826 1.00 0.00 C ATOM 2143 CD LYS A 138 -14.384 11.190 -18.560 1.00 0.00 C ATOM 2144 CE LYS A 138 -15.646 10.324 -18.650 1.00 0.00 C ATOM 2145 NZ LYS A 138 -15.417 9.162 -19.523 1.00 0.00 N ATOM 0 H LYS A 138 -15.114 15.504 -16.235 1.00 0.00 H new ATOM 0 HA LYS A 138 -12.704 15.405 -17.704 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -12.927 13.274 -18.824 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -12.711 13.025 -17.103 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -14.956 12.300 -16.795 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -15.501 13.022 -18.296 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -14.013 11.403 -19.563 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -13.599 10.641 -18.040 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -15.933 9.986 -17.654 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -16.474 10.918 -19.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -16.283 8.588 -19.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -15.165 9.489 -20.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -14.641 8.586 -19.138 1.00 0.00 H new ATOM 2159 N PRO A 139 -14.208 15.672 -19.914 1.00 0.00 N ATOM 2160 CA PRO A 139 -15.128 15.873 -21.048 1.00 0.00 C ATOM 2161 C PRO A 139 -15.909 14.584 -21.343 1.00 0.00 C ATOM 2162 O PRO A 139 -15.353 13.491 -21.307 1.00 0.00 O ATOM 2163 CB PRO A 139 -14.248 16.307 -22.221 1.00 0.00 C ATOM 2164 CG PRO A 139 -12.870 15.746 -21.860 1.00 0.00 C ATOM 2165 CD PRO A 139 -12.810 15.873 -20.337 1.00 0.00 C ATOM 0 HA PRO A 139 -15.884 16.630 -20.840 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -14.611 15.903 -23.166 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -14.225 17.392 -22.326 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -12.764 14.709 -22.179 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -12.070 16.310 -22.340 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -12.148 15.126 -19.899 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -12.436 16.850 -20.031 1.00 0.00 H new ATOM 2173 N LEU A 140 -17.231 14.733 -21.422 1.00 0.00 N ATOM 2174 CA LEU A 140 -18.199 13.631 -21.656 1.00 0.00 C ATOM 2175 C LEU A 140 -18.066 12.472 -20.630 1.00 0.00 C ATOM 2176 O LEU A 140 -18.282 11.297 -21.005 1.00 0.00 O ATOM 2177 CB LEU A 140 -18.098 13.181 -23.133 1.00 0.00 C ATOM 2178 CG LEU A 140 -19.293 12.365 -23.630 1.00 0.00 C ATOM 2179 CD1 LEU A 140 -20.572 13.208 -23.740 1.00 0.00 C ATOM 2180 CD2 LEU A 140 -18.955 11.726 -24.981 1.00 0.00 C ATOM 2181 OXT LEU A 140 -17.896 12.819 -19.447 1.00 0.00 O ATOM 0 H LEU A 140 -17.683 15.642 -21.324 1.00 0.00 H new ATOM 0 HA LEU A 140 -19.209 14.002 -21.484 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -17.990 14.064 -23.762 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -17.192 12.588 -23.258 1.00 0.00 H new ATOM 0 HG LEU A 140 -19.491 11.586 -22.894 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -21.390 12.583 -24.097 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -20.826 13.614 -22.761 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -20.409 14.027 -24.441 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -19.808 11.145 -25.332 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -18.724 12.507 -25.705 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -18.092 11.070 -24.868 1.00 0.00 H new TER 2193 LEU A 140