USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1101 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 118 LYS NZ :NH3+ 141:sc= 0.473 (180deg=0) USER MOD Set 1.2: A 141 THR OG1 : rot 151:sc= -0.117 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0186 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot 92:sc= -1.18 USER MOD Single : A 14 TYR OH : rot 48:sc= 0.664 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -119:sc= -1.06 USER MOD Single : A 30 LYS NZ :NH3+ -172:sc= -0.0999 (180deg=-0.188) USER MOD Single : A 31 TYR OH : rot 180:sc=0.000149 USER MOD Single : A 34 SER OG : rot -94:sc= 0.0582 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.123 X(o=-0.12,f=-0.27) USER MOD Single : A 45 TYR OH : rot -80:sc= 1.59 USER MOD Single : A 46 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 47 HIS : no HD1:sc= -0.0687 X(o=-0.069,f=-0.26) USER MOD Single : A 50 GLN : amide:sc= -0.441 X(o=-0.44,f=-0.44) USER MOD Single : A 51 GLN : amide:sc= -0.287 X(o=-0.29,f=-0.29) USER MOD Single : A 52 CYS SG : rot 138:sc= -1.49! USER MOD Single : A 53 THR OG1 : rot -69:sc= 0.00201 USER MOD Single : A 65 THR OG1 : rot 180:sc=0.000966 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.0145 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= -0.162 (180deg=-0.162) USER MOD Single : A 74 SER OG : rot 180:sc= 0.0134 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -146:sc= -1.91 USER MOD Single : A 85 ASN : amide:sc= -0.667 X(o=-0.67,f=-0.33) USER MOD Single : A 87 SER OG : rot 180:sc= -0.015 USER MOD Single : A 90 GLN : amide:sc= -0.69 K(o=-0.69,f=-3.3!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0.0105 USER MOD Single : A 96 THR OG1 : rot 81:sc= 0.526 USER MOD Single : A 98 LYS NZ :NH3+ -120:sc= 1.21 (180deg=-1.35) USER MOD Single : A 99 THR OG1 : rot 70:sc= 0.0552 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= -1.47 K(o=-1.5,f=-4.9!) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 172:sc= -1.39 (180deg=-1.41) USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 -4.089 -19.713 -12.320 1.00 0.00 N ATOM 2 CA ALA A 2 -4.163 -20.075 -10.877 1.00 0.00 C ATOM 3 C ALA A 2 -4.409 -18.844 -10.012 1.00 0.00 C ATOM 4 O ALA A 2 -5.329 -18.822 -9.192 1.00 0.00 O ATOM 5 CB ALA A 2 -2.887 -20.783 -10.442 1.00 0.00 C ATOM 0 HA ALA A 2 -5.005 -20.754 -10.743 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -2.956 -21.041 -9.385 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -2.757 -21.692 -11.030 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -2.033 -20.124 -10.599 1.00 0.00 H new ATOM 13 N THR A 3 -3.585 -17.820 -10.209 1.00 0.00 N ATOM 14 CA THR A 3 -3.704 -16.576 -9.457 1.00 0.00 C ATOM 15 C THR A 3 -4.841 -15.722 -10.012 1.00 0.00 C ATOM 16 O THR A 3 -4.898 -15.457 -11.214 1.00 0.00 O ATOM 17 CB THR A 3 -2.388 -15.791 -9.507 1.00 0.00 C ATOM 18 OG1 THR A 3 -1.287 -16.658 -9.725 1.00 0.00 O ATOM 19 CG2 THR A 3 -2.111 -15.009 -8.242 1.00 0.00 C ATOM 0 H THR A 3 -2.823 -17.828 -10.887 1.00 0.00 H new ATOM 0 HA THR A 3 -3.926 -16.825 -8.419 1.00 0.00 H new ATOM 0 HB THR A 3 -2.505 -15.090 -10.334 1.00 0.00 H new ATOM 0 HG1 THR A 3 -0.459 -16.134 -9.755 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.165 -14.476 -8.343 1.00 0.00 H new ATOM 0 HG22 THR A 3 -2.915 -14.292 -8.074 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.053 -15.694 -7.396 1.00 0.00 H new ATOM 27 N LYS A 4 -5.744 -15.297 -9.131 1.00 0.00 N ATOM 28 CA LYS A 4 -6.880 -14.475 -9.534 1.00 0.00 C ATOM 29 C LYS A 4 -7.134 -13.365 -8.520 1.00 0.00 C ATOM 30 O LYS A 4 -6.842 -13.517 -7.333 1.00 0.00 O ATOM 31 CB LYS A 4 -8.137 -15.337 -9.687 1.00 0.00 C ATOM 32 CG LYS A 4 -8.069 -16.322 -10.845 1.00 0.00 C ATOM 33 CD LYS A 4 -8.920 -15.865 -12.019 1.00 0.00 C ATOM 34 CE LYS A 4 -8.289 -16.252 -13.348 1.00 0.00 C ATOM 35 NZ LYS A 4 -8.669 -15.314 -14.442 1.00 0.00 N ATOM 0 H LYS A 4 -5.710 -15.509 -8.134 1.00 0.00 H new ATOM 0 HA LYS A 4 -6.642 -14.020 -10.495 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.302 -15.889 -8.762 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -8.999 -14.685 -9.827 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.034 -16.435 -11.167 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.407 -17.303 -10.510 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -9.913 -16.308 -11.944 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.049 -14.783 -11.977 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -7.204 -16.266 -13.243 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -8.597 -17.263 -13.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -8.218 -15.615 -15.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -9.702 -15.319 -14.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -8.353 -14.353 -14.201 1.00 0.00 H new ATOM 49 N ILE A 5 -7.684 -12.250 -8.995 1.00 0.00 N ATOM 50 CA ILE A 5 -7.984 -11.114 -8.131 1.00 0.00 C ATOM 51 C ILE A 5 -9.492 -10.896 -8.019 1.00 0.00 C ATOM 52 O ILE A 5 -10.192 -10.801 -9.030 1.00 0.00 O ATOM 53 CB ILE A 5 -7.310 -9.817 -8.639 1.00 0.00 C ATOM 54 CG1 ILE A 5 -7.532 -8.674 -7.644 1.00 0.00 C ATOM 55 CG2 ILE A 5 -7.830 -9.437 -10.020 1.00 0.00 C ATOM 56 CD1 ILE A 5 -6.256 -8.163 -7.013 1.00 0.00 C ATOM 0 H ILE A 5 -7.931 -12.110 -9.975 1.00 0.00 H new ATOM 0 HA ILE A 5 -7.582 -11.349 -7.145 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.239 -10.000 -8.722 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -8.030 -7.850 -8.155 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.205 -9.014 -6.857 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.341 -8.522 -10.354 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.615 -10.241 -10.724 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -8.907 -9.275 -9.972 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.491 -7.355 -6.320 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.767 -8.974 -6.473 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.589 -7.792 -7.791 1.00 0.00 H new ATOM 68 N ASP A 6 -9.986 -10.816 -6.785 1.00 0.00 N ATOM 69 CA ASP A 6 -11.409 -10.606 -6.543 1.00 0.00 C ATOM 70 C ASP A 6 -11.766 -9.129 -6.697 1.00 0.00 C ATOM 71 O ASP A 6 -11.396 -8.299 -5.864 1.00 0.00 O ATOM 72 CB ASP A 6 -11.797 -11.105 -5.146 1.00 0.00 C ATOM 73 CG ASP A 6 -13.301 -11.116 -4.908 1.00 0.00 C ATOM 74 OD1 ASP A 6 -14.067 -10.867 -5.866 1.00 0.00 O ATOM 75 OD2 ASP A 6 -13.712 -11.374 -3.759 1.00 0.00 O ATOM 0 H ASP A 6 -9.421 -10.894 -5.939 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.970 -11.177 -7.283 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -11.406 -12.113 -5.006 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -11.322 -10.472 -4.396 1.00 0.00 H new ATOM 80 N LYS A 7 -12.484 -8.813 -7.773 1.00 0.00 N ATOM 81 CA LYS A 7 -12.894 -7.439 -8.051 1.00 0.00 C ATOM 82 C LYS A 7 -13.872 -6.929 -6.993 1.00 0.00 C ATOM 83 O LYS A 7 -13.822 -5.761 -6.608 1.00 0.00 O ATOM 84 CB LYS A 7 -13.533 -7.348 -9.441 1.00 0.00 C ATOM 85 CG LYS A 7 -12.993 -6.207 -10.289 1.00 0.00 C ATOM 86 CD LYS A 7 -13.609 -4.875 -9.892 1.00 0.00 C ATOM 87 CE LYS A 7 -12.603 -3.990 -9.174 1.00 0.00 C ATOM 88 NZ LYS A 7 -13.039 -2.567 -9.141 1.00 0.00 N ATOM 0 H LYS A 7 -12.794 -9.492 -8.468 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.004 -6.811 -8.023 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -13.371 -8.288 -9.968 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.610 -7.227 -9.329 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -11.910 -6.154 -10.181 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.200 -6.405 -11.341 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -13.977 -4.363 -10.781 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -14.469 -5.049 -9.246 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -12.464 -4.351 -8.155 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -11.636 -4.062 -9.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -12.326 -1.997 -8.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -13.147 -2.214 -10.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -13.949 -2.494 -8.644 1.00 0.00 H new ATOM 102 N GLU A 8 -14.758 -7.813 -6.529 1.00 0.00 N ATOM 103 CA GLU A 8 -15.750 -7.453 -5.517 1.00 0.00 C ATOM 104 C GLU A 8 -15.079 -7.042 -4.207 1.00 0.00 C ATOM 105 O GLU A 8 -15.342 -5.957 -3.685 1.00 0.00 O ATOM 106 CB GLU A 8 -16.709 -8.622 -5.271 1.00 0.00 C ATOM 107 CG GLU A 8 -18.168 -8.206 -5.181 1.00 0.00 C ATOM 108 CD GLU A 8 -19.116 -9.378 -5.351 1.00 0.00 C ATOM 109 OE1 GLU A 8 -19.013 -10.081 -6.379 1.00 0.00 O ATOM 110 OE2 GLU A 8 -19.963 -9.591 -4.458 1.00 0.00 O ATOM 0 H GLU A 8 -14.808 -8.783 -6.839 1.00 0.00 H new ATOM 0 HA GLU A 8 -16.316 -6.600 -5.892 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -16.596 -9.348 -6.076 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -16.426 -9.124 -4.346 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -18.349 -7.733 -4.216 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -18.378 -7.459 -5.946 1.00 0.00 H new ATOM 117 N ALA A 9 -14.213 -7.912 -3.683 1.00 0.00 N ATOM 118 CA ALA A 9 -13.507 -7.634 -2.434 1.00 0.00 C ATOM 119 C ALA A 9 -12.619 -6.400 -2.566 1.00 0.00 C ATOM 120 O ALA A 9 -12.700 -5.479 -1.751 1.00 0.00 O ATOM 121 CB ALA A 9 -12.683 -8.841 -2.010 1.00 0.00 C ATOM 0 H ALA A 9 -13.985 -8.813 -4.104 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.251 -7.431 -1.664 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.163 -8.618 -1.078 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -13.341 -9.697 -1.862 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -11.953 -9.074 -2.785 1.00 0.00 H new ATOM 127 N CYS A 10 -11.777 -6.383 -3.601 1.00 0.00 N ATOM 128 CA CYS A 10 -10.879 -5.259 -3.846 1.00 0.00 C ATOM 129 C CYS A 10 -11.658 -3.945 -3.920 1.00 0.00 C ATOM 130 O CYS A 10 -11.238 -2.933 -3.357 1.00 0.00 O ATOM 131 CB CYS A 10 -10.106 -5.481 -5.145 1.00 0.00 C ATOM 132 SG CYS A 10 -8.671 -6.568 -4.975 1.00 0.00 S ATOM 0 H CYS A 10 -11.700 -7.138 -4.283 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.176 -5.195 -3.016 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -10.781 -5.903 -5.889 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -9.774 -4.516 -5.527 1.00 0.00 H new ATOM 0 HG CYS A 10 -9.021 -7.792 -5.236 1.00 0.00 H new ATOM 138 N ARG A 11 -12.797 -3.976 -4.613 1.00 0.00 N ATOM 139 CA ARG A 11 -13.645 -2.792 -4.761 1.00 0.00 C ATOM 140 C ARG A 11 -14.268 -2.400 -3.422 1.00 0.00 C ATOM 141 O ARG A 11 -14.320 -1.218 -3.079 1.00 0.00 O ATOM 142 CB ARG A 11 -14.746 -3.047 -5.798 1.00 0.00 C ATOM 143 CG ARG A 11 -15.488 -1.790 -6.235 1.00 0.00 C ATOM 144 CD ARG A 11 -16.526 -2.097 -7.306 1.00 0.00 C ATOM 145 NE ARG A 11 -17.857 -2.315 -6.740 1.00 0.00 N ATOM 146 CZ ARG A 11 -18.852 -2.932 -7.383 1.00 0.00 C ATOM 147 NH1 ARG A 11 -18.672 -3.401 -8.615 1.00 0.00 N ATOM 148 NH2 ARG A 11 -20.031 -3.080 -6.791 1.00 0.00 N ATOM 0 H ARG A 11 -13.154 -4.809 -5.081 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.019 -1.969 -5.106 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.303 -3.518 -6.675 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -15.464 -3.755 -5.384 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -15.977 -1.337 -5.373 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -14.775 -1.060 -6.617 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -16.566 -1.272 -8.017 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -16.220 -2.983 -7.862 1.00 0.00 H new ATOM 0 HE ARG A 11 -18.037 -1.975 -5.795 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -17.769 -3.291 -9.076 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -19.437 -3.871 -9.099 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -20.176 -2.723 -5.847 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -20.792 -3.551 -7.281 1.00 0.00 H new ATOM 162 N ALA A 12 -14.734 -3.401 -2.669 1.00 0.00 N ATOM 163 CA ALA A 12 -15.348 -3.167 -1.363 1.00 0.00 C ATOM 164 C ALA A 12 -14.411 -2.378 -0.452 1.00 0.00 C ATOM 165 O ALA A 12 -14.799 -1.352 0.111 1.00 0.00 O ATOM 166 CB ALA A 12 -15.734 -4.489 -0.713 1.00 0.00 C ATOM 0 H ALA A 12 -14.696 -4.382 -2.944 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.251 -2.575 -1.514 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -16.190 -4.297 0.258 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.446 -5.014 -1.350 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.843 -5.103 -0.581 1.00 0.00 H new ATOM 172 N ALA A 13 -13.174 -2.859 -0.318 1.00 0.00 N ATOM 173 CA ALA A 13 -12.178 -2.194 0.517 1.00 0.00 C ATOM 174 C ALA A 13 -11.889 -0.786 0.004 1.00 0.00 C ATOM 175 O ALA A 13 -11.783 0.158 0.789 1.00 0.00 O ATOM 176 CB ALA A 13 -10.897 -3.012 0.572 1.00 0.00 C ATOM 0 H ALA A 13 -12.840 -3.706 -0.778 1.00 0.00 H new ATOM 0 HA ALA A 13 -12.582 -2.112 1.526 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.166 -2.501 1.199 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.111 -3.995 0.991 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.495 -3.127 -0.435 1.00 0.00 H new ATOM 182 N TYR A 14 -11.772 -0.655 -1.319 1.00 0.00 N ATOM 183 CA TYR A 14 -11.506 0.638 -1.948 1.00 0.00 C ATOM 184 C TYR A 14 -12.567 1.663 -1.553 1.00 0.00 C ATOM 185 O TYR A 14 -12.243 2.803 -1.214 1.00 0.00 O ATOM 186 CB TYR A 14 -11.470 0.487 -3.471 1.00 0.00 C ATOM 187 CG TYR A 14 -10.593 1.503 -4.169 1.00 0.00 C ATOM 188 CD1 TYR A 14 -10.899 2.859 -4.129 1.00 0.00 C ATOM 189 CD2 TYR A 14 -9.464 1.106 -4.873 1.00 0.00 C ATOM 190 CE1 TYR A 14 -10.102 3.788 -4.770 1.00 0.00 C ATOM 191 CE2 TYR A 14 -8.663 2.030 -5.515 1.00 0.00 C ATOM 192 CZ TYR A 14 -8.987 3.368 -5.462 1.00 0.00 C ATOM 193 OH TYR A 14 -8.192 4.290 -6.102 1.00 0.00 O ATOM 0 H TYR A 14 -11.858 -1.431 -1.976 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.536 0.992 -1.600 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -11.117 -0.514 -3.718 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -12.485 0.571 -3.858 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -11.773 3.191 -3.589 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -9.208 0.058 -4.919 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -10.352 4.838 -4.729 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -7.787 1.705 -6.056 1.00 0.00 H new ATOM 0 HH TYR A 14 -8.002 5.036 -5.495 1.00 0.00 H new ATOM 203 N ASN A 15 -13.834 1.247 -1.599 1.00 0.00 N ATOM 204 CA ASN A 15 -14.949 2.121 -1.247 1.00 0.00 C ATOM 205 C ASN A 15 -14.802 2.653 0.177 1.00 0.00 C ATOM 206 O ASN A 15 -15.034 3.836 0.432 1.00 0.00 O ATOM 207 CB ASN A 15 -16.275 1.370 -1.385 1.00 0.00 C ATOM 208 CG ASN A 15 -16.773 1.325 -2.818 1.00 0.00 C ATOM 209 OD1 ASN A 15 -16.946 2.361 -3.459 1.00 0.00 O ATOM 210 ND2 ASN A 15 -17.006 0.120 -3.331 1.00 0.00 N ATOM 0 H ASN A 15 -14.112 0.306 -1.878 1.00 0.00 H new ATOM 0 HA ASN A 15 -14.942 2.968 -1.934 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -16.152 0.352 -1.015 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -17.027 1.849 -0.758 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -17.341 0.030 -4.290 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -16.850 -0.714 -2.765 1.00 0.00 H new ATOM 217 N LEU A 16 -14.409 1.773 1.101 1.00 0.00 N ATOM 218 CA LEU A 16 -14.225 2.156 2.499 1.00 0.00 C ATOM 219 C LEU A 16 -13.098 3.180 2.640 1.00 0.00 C ATOM 220 O LEU A 16 -13.241 4.177 3.349 1.00 0.00 O ATOM 221 CB LEU A 16 -13.923 0.921 3.357 1.00 0.00 C ATOM 222 CG LEU A 16 -14.439 0.982 4.798 1.00 0.00 C ATOM 223 CD1 LEU A 16 -13.773 2.121 5.557 1.00 0.00 C ATOM 224 CD2 LEU A 16 -15.953 1.138 4.818 1.00 0.00 C ATOM 0 H LEU A 16 -14.213 0.792 0.904 1.00 0.00 H new ATOM 0 HA LEU A 16 -15.151 2.612 2.849 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -14.355 0.047 2.871 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -12.844 0.771 3.381 1.00 0.00 H new ATOM 0 HG LEU A 16 -14.185 0.045 5.294 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -14.152 2.148 6.579 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -12.694 1.965 5.574 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -13.995 3.067 5.062 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -16.301 1.179 5.850 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -16.231 2.058 4.304 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -16.413 0.288 4.314 1.00 0.00 H new ATOM 236 N VAL A 17 -11.983 2.928 1.953 1.00 0.00 N ATOM 237 CA VAL A 17 -10.832 3.830 1.992 1.00 0.00 C ATOM 238 C VAL A 17 -11.192 5.201 1.417 1.00 0.00 C ATOM 239 O VAL A 17 -10.684 6.228 1.872 1.00 0.00 O ATOM 240 CB VAL A 17 -9.631 3.248 1.210 1.00 0.00 C ATOM 241 CG1 VAL A 17 -8.399 4.131 1.362 1.00 0.00 C ATOM 242 CG2 VAL A 17 -9.329 1.828 1.669 1.00 0.00 C ATOM 0 H VAL A 17 -11.853 2.106 1.363 1.00 0.00 H new ATOM 0 HA VAL A 17 -10.549 3.941 3.039 1.00 0.00 H new ATOM 0 HB VAL A 17 -9.900 3.221 0.154 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -7.570 3.698 0.802 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -8.616 5.127 0.977 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.129 4.200 2.416 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -8.481 1.437 1.107 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -9.089 1.833 2.732 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.201 1.197 1.497 1.00 0.00 H new ATOM 252 N ARG A 18 -12.076 5.210 0.415 1.00 0.00 N ATOM 253 CA ARG A 18 -12.512 6.451 -0.220 1.00 0.00 C ATOM 254 C ARG A 18 -13.180 7.385 0.792 1.00 0.00 C ATOM 255 O ARG A 18 -13.038 8.606 0.704 1.00 0.00 O ATOM 256 CB ARG A 18 -13.471 6.148 -1.375 1.00 0.00 C ATOM 257 CG ARG A 18 -12.765 5.694 -2.645 1.00 0.00 C ATOM 258 CD ARG A 18 -13.426 6.266 -3.889 1.00 0.00 C ATOM 259 NE ARG A 18 -12.884 7.576 -4.251 1.00 0.00 N ATOM 260 CZ ARG A 18 -13.536 8.476 -4.992 1.00 0.00 C ATOM 261 NH1 ARG A 18 -14.763 8.222 -5.440 1.00 0.00 N ATOM 262 NH2 ARG A 18 -12.960 9.636 -5.287 1.00 0.00 N ATOM 0 H ARG A 18 -12.503 4.369 0.028 1.00 0.00 H new ATOM 0 HA ARG A 18 -11.630 6.956 -0.614 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.172 5.374 -1.062 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -14.058 7.040 -1.594 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -11.721 6.004 -2.612 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -12.772 4.605 -2.697 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -13.289 5.576 -4.721 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -14.499 6.353 -3.721 1.00 0.00 H new ATOM 0 HE ARG A 18 -11.951 7.817 -3.917 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -15.213 7.334 -5.218 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -15.253 8.915 -6.005 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -12.020 9.839 -4.948 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -13.458 10.323 -5.853 1.00 0.00 H new ATOM 276 N ASP A 19 -13.896 6.803 1.756 1.00 0.00 N ATOM 277 CA ASP A 19 -14.571 7.584 2.788 1.00 0.00 C ATOM 278 C ASP A 19 -13.570 8.074 3.830 1.00 0.00 C ATOM 279 O ASP A 19 -12.878 7.273 4.463 1.00 0.00 O ATOM 280 CB ASP A 19 -15.663 6.750 3.468 1.00 0.00 C ATOM 281 CG ASP A 19 -16.878 7.579 3.838 1.00 0.00 C ATOM 282 OD1 ASP A 19 -16.777 8.394 4.780 1.00 0.00 O ATOM 283 OD2 ASP A 19 -17.929 7.414 3.185 1.00 0.00 O ATOM 0 H ASP A 19 -14.022 5.794 1.841 1.00 0.00 H new ATOM 0 HA ASP A 19 -15.034 8.447 2.310 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -15.967 5.942 2.802 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -15.256 6.286 4.366 1.00 0.00 H new ATOM 288 N ASP A 20 -13.503 9.392 4.008 1.00 0.00 N ATOM 289 CA ASP A 20 -12.589 9.989 4.979 1.00 0.00 C ATOM 290 C ASP A 20 -13.341 10.428 6.239 1.00 0.00 C ATOM 291 O ASP A 20 -12.943 11.379 6.916 1.00 0.00 O ATOM 292 CB ASP A 20 -11.854 11.177 4.350 1.00 0.00 C ATOM 293 CG ASP A 20 -10.515 11.450 5.012 1.00 0.00 C ATOM 294 OD1 ASP A 20 -9.632 10.567 4.957 1.00 0.00 O ATOM 295 OD2 ASP A 20 -10.349 12.548 5.583 1.00 0.00 O ATOM 0 H ASP A 20 -14.070 10.066 3.493 1.00 0.00 H new ATOM 0 HA ASP A 20 -11.856 9.237 5.270 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -11.698 10.983 3.289 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.480 12.067 4.423 1.00 0.00 H new ATOM 300 N GLY A 21 -14.433 9.723 6.547 1.00 0.00 N ATOM 301 CA GLY A 21 -15.231 10.042 7.718 1.00 0.00 C ATOM 302 C GLY A 21 -15.052 9.040 8.847 1.00 0.00 C ATOM 303 O GLY A 21 -15.187 9.396 10.018 1.00 0.00 O ATOM 0 H GLY A 21 -14.777 8.933 6.001 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -14.962 11.036 8.075 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -16.283 10.079 7.435 1.00 0.00 H new ATOM 307 N SER A 22 -14.753 7.784 8.499 1.00 0.00 N ATOM 308 CA SER A 22 -14.564 6.734 9.498 1.00 0.00 C ATOM 309 C SER A 22 -13.097 6.604 9.897 1.00 0.00 C ATOM 310 O SER A 22 -12.218 7.213 9.285 1.00 0.00 O ATOM 311 CB SER A 22 -15.081 5.394 8.966 1.00 0.00 C ATOM 312 OG SER A 22 -16.120 4.888 9.789 1.00 0.00 O ATOM 0 H SER A 22 -14.637 7.473 7.534 1.00 0.00 H new ATOM 0 HA SER A 22 -15.134 7.012 10.384 1.00 0.00 H new ATOM 0 HB2 SER A 22 -15.448 5.520 7.947 1.00 0.00 H new ATOM 0 HB3 SER A 22 -14.263 4.675 8.924 1.00 0.00 H new ATOM 0 HG SER A 22 -16.436 4.033 9.429 1.00 0.00 H new ATOM 318 N ALA A 23 -12.840 5.798 10.927 1.00 0.00 N ATOM 319 CA ALA A 23 -11.481 5.579 11.412 1.00 0.00 C ATOM 320 C ALA A 23 -10.762 4.520 10.573 1.00 0.00 C ATOM 321 O ALA A 23 -10.290 3.509 11.097 1.00 0.00 O ATOM 322 CB ALA A 23 -11.507 5.180 12.881 1.00 0.00 C ATOM 0 H ALA A 23 -13.557 5.286 11.441 1.00 0.00 H new ATOM 0 HA ALA A 23 -10.926 6.512 11.314 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -10.488 5.019 13.232 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -11.971 5.974 13.466 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.081 4.261 12.998 1.00 0.00 H new ATOM 328 N VAL A 24 -10.687 4.764 9.266 1.00 0.00 N ATOM 329 CA VAL A 24 -10.031 3.843 8.342 1.00 0.00 C ATOM 330 C VAL A 24 -9.241 4.613 7.281 1.00 0.00 C ATOM 331 O VAL A 24 -9.802 5.442 6.563 1.00 0.00 O ATOM 332 CB VAL A 24 -11.059 2.923 7.645 1.00 0.00 C ATOM 333 CG1 VAL A 24 -10.356 1.884 6.780 1.00 0.00 C ATOM 334 CG2 VAL A 24 -11.959 2.242 8.669 1.00 0.00 C ATOM 0 H VAL A 24 -11.075 5.596 8.822 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.347 3.227 8.927 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.682 3.543 7.000 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -11.099 1.248 6.299 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.762 2.387 6.018 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -9.704 1.273 7.404 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -12.674 1.600 8.155 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -11.351 1.640 9.345 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.496 2.998 9.241 1.00 0.00 H new ATOM 344 N ILE A 25 -7.939 4.337 7.189 1.00 0.00 N ATOM 345 CA ILE A 25 -7.078 5.013 6.215 1.00 0.00 C ATOM 346 C ILE A 25 -6.312 4.017 5.340 1.00 0.00 C ATOM 347 O ILE A 25 -6.149 4.239 4.138 1.00 0.00 O ATOM 348 CB ILE A 25 -6.068 5.962 6.898 1.00 0.00 C ATOM 349 CG1 ILE A 25 -5.352 5.261 8.059 1.00 0.00 C ATOM 350 CG2 ILE A 25 -6.770 7.221 7.387 1.00 0.00 C ATOM 351 CD1 ILE A 25 -3.847 5.242 7.916 1.00 0.00 C ATOM 0 H ILE A 25 -7.459 3.653 7.774 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.746 5.600 5.584 1.00 0.00 H new ATOM 0 HB ILE A 25 -5.317 6.245 6.161 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.614 5.760 8.992 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -5.715 4.236 8.133 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.045 7.879 7.866 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -7.224 7.736 6.541 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.544 6.950 8.105 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.407 4.731 8.772 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.575 4.717 7.000 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.473 6.265 7.872 1.00 0.00 H new ATOM 363 N TRP A 26 -5.841 2.924 5.944 1.00 0.00 N ATOM 364 CA TRP A 26 -5.095 1.906 5.209 1.00 0.00 C ATOM 365 C TRP A 26 -5.826 0.566 5.227 1.00 0.00 C ATOM 366 O TRP A 26 -6.605 0.282 6.139 1.00 0.00 O ATOM 367 CB TRP A 26 -3.683 1.741 5.794 1.00 0.00 C ATOM 368 CG TRP A 26 -3.657 1.146 7.173 1.00 0.00 C ATOM 369 CD1 TRP A 26 -3.470 1.813 8.348 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.817 -0.237 7.519 1.00 0.00 C ATOM 371 NE1 TRP A 26 -3.510 0.932 9.402 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.724 -0.328 8.920 1.00 0.00 C ATOM 373 CE3 TRP A 26 -4.035 -1.406 6.785 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.839 -1.537 9.599 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -4.150 -2.606 7.461 1.00 0.00 C ATOM 376 CH2 TRP A 26 -4.054 -2.662 8.854 1.00 0.00 C ATOM 0 H TRP A 26 -5.963 2.723 6.937 1.00 0.00 H new ATOM 0 HA TRP A 26 -5.013 2.239 4.174 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -3.096 1.110 5.126 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -3.196 2.716 5.821 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -3.313 2.878 8.437 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.398 1.179 10.385 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -4.112 -1.372 5.708 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.761 -1.584 10.675 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.317 -3.516 6.903 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -4.152 -3.615 9.352 1.00 0.00 H new ATOM 387 N VAL A 27 -5.554 -0.256 4.218 1.00 0.00 N ATOM 388 CA VAL A 27 -6.161 -1.577 4.105 1.00 0.00 C ATOM 389 C VAL A 27 -5.139 -2.580 3.574 1.00 0.00 C ATOM 390 O VAL A 27 -4.271 -2.217 2.775 1.00 0.00 O ATOM 391 CB VAL A 27 -7.396 -1.563 3.177 1.00 0.00 C ATOM 392 CG1 VAL A 27 -8.541 -0.797 3.823 1.00 0.00 C ATOM 393 CG2 VAL A 27 -7.051 -0.965 1.819 1.00 0.00 C ATOM 0 H VAL A 27 -4.911 -0.027 3.460 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.488 -1.873 5.102 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.714 -2.594 3.021 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.402 -0.798 3.155 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -8.812 -1.274 4.765 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.230 0.230 4.013 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -7.938 -0.967 1.185 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -6.701 0.059 1.951 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -6.267 -1.559 1.349 1.00 0.00 H new ATOM 403 N THR A 28 -5.229 -3.835 4.016 1.00 0.00 N ATOM 404 CA THR A 28 -4.282 -4.855 3.563 1.00 0.00 C ATOM 405 C THR A 28 -4.766 -5.528 2.284 1.00 0.00 C ATOM 406 O THR A 28 -5.916 -5.357 1.880 1.00 0.00 O ATOM 407 CB THR A 28 -4.043 -5.915 4.645 1.00 0.00 C ATOM 408 OG1 THR A 28 -4.433 -5.447 5.923 1.00 0.00 O ATOM 409 CG2 THR A 28 -2.596 -6.348 4.737 1.00 0.00 C ATOM 0 H THR A 28 -5.934 -4.166 4.675 1.00 0.00 H new ATOM 0 HA THR A 28 -3.340 -4.347 3.358 1.00 0.00 H new ATOM 0 HB THR A 28 -4.652 -6.768 4.346 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.656 -5.440 6.520 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.490 -7.099 5.520 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.282 -6.771 3.783 1.00 0.00 H new ATOM 0 HG23 THR A 28 -1.973 -5.486 4.974 1.00 0.00 H new ATOM 417 N PHE A 29 -3.880 -6.299 1.657 1.00 0.00 N ATOM 418 CA PHE A 29 -4.208 -7.014 0.428 1.00 0.00 C ATOM 419 C PHE A 29 -3.425 -8.323 0.352 1.00 0.00 C ATOM 420 O PHE A 29 -2.242 -8.333 0.009 1.00 0.00 O ATOM 421 CB PHE A 29 -3.911 -6.146 -0.799 1.00 0.00 C ATOM 422 CG PHE A 29 -5.026 -5.200 -1.150 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.185 -4.006 -0.462 1.00 0.00 C ATOM 424 CD2 PHE A 29 -5.915 -5.504 -2.170 1.00 0.00 C ATOM 425 CE1 PHE A 29 -6.209 -3.137 -0.783 1.00 0.00 C ATOM 426 CE2 PHE A 29 -6.940 -4.636 -2.495 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.087 -3.451 -1.801 1.00 0.00 C ATOM 0 H PHE A 29 -2.925 -6.444 1.983 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.274 -7.242 0.438 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -3.002 -5.572 -0.617 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.713 -6.794 -1.653 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.500 -3.753 0.334 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -5.805 -6.429 -2.716 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -6.323 -2.212 -0.238 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -7.626 -4.884 -3.291 1.00 0.00 H new ATOM 0 HZ PHE A 29 -7.887 -2.771 -2.054 1.00 0.00 H new ATOM 437 N LYS A 30 -4.094 -9.424 0.682 1.00 0.00 N ATOM 438 CA LYS A 30 -3.467 -10.744 0.659 1.00 0.00 C ATOM 439 C LYS A 30 -4.379 -11.762 -0.018 1.00 0.00 C ATOM 440 O LYS A 30 -5.598 -11.587 -0.056 1.00 0.00 O ATOM 441 CB LYS A 30 -3.123 -11.202 2.082 1.00 0.00 C ATOM 442 CG LYS A 30 -4.265 -11.045 3.079 1.00 0.00 C ATOM 443 CD LYS A 30 -3.849 -10.206 4.281 1.00 0.00 C ATOM 444 CE LYS A 30 -4.462 -10.731 5.572 1.00 0.00 C ATOM 445 NZ LYS A 30 -5.458 -9.783 6.147 1.00 0.00 N ATOM 0 H LYS A 30 -5.073 -9.429 0.969 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.544 -10.672 0.084 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.822 -12.249 2.052 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.264 -10.633 2.438 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.117 -10.578 2.586 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.592 -12.029 3.417 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.762 -10.207 4.367 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -4.156 -9.171 4.127 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -4.944 -11.690 5.380 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -3.672 -10.912 6.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -5.749 -10.114 7.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.031 -8.838 6.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.290 -9.734 5.525 1.00 0.00 H new ATOM 459 N TYR A 31 -3.786 -12.822 -0.561 1.00 0.00 N ATOM 460 CA TYR A 31 -4.557 -13.856 -1.242 1.00 0.00 C ATOM 461 C TYR A 31 -4.654 -15.127 -0.401 1.00 0.00 C ATOM 462 O TYR A 31 -3.655 -15.611 0.137 1.00 0.00 O ATOM 463 CB TYR A 31 -3.948 -14.168 -2.614 1.00 0.00 C ATOM 464 CG TYR A 31 -2.617 -14.890 -2.557 1.00 0.00 C ATOM 465 CD1 TYR A 31 -1.434 -14.189 -2.361 1.00 0.00 C ATOM 466 CD2 TYR A 31 -2.546 -16.270 -2.701 1.00 0.00 C ATOM 467 CE1 TYR A 31 -0.218 -14.842 -2.311 1.00 0.00 C ATOM 468 CE2 TYR A 31 -1.334 -16.931 -2.651 1.00 0.00 C ATOM 469 CZ TYR A 31 -0.173 -16.213 -2.456 1.00 0.00 C ATOM 470 OH TYR A 31 1.037 -16.868 -2.408 1.00 0.00 O ATOM 0 H TYR A 31 -2.780 -12.986 -0.543 1.00 0.00 H new ATOM 0 HA TYR A 31 -5.567 -13.473 -1.386 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -4.653 -14.775 -3.182 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -3.818 -13.234 -3.161 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -1.466 -13.116 -2.246 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -3.453 -16.835 -2.855 1.00 0.00 H new ATOM 0 HE1 TYR A 31 0.693 -14.282 -2.159 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -1.296 -18.004 -2.764 1.00 0.00 H new ATOM 0 HH TYR A 31 0.893 -17.830 -2.526 1.00 0.00 H new ATOM 480 N ASP A 32 -5.870 -15.663 -0.302 1.00 0.00 N ATOM 481 CA ASP A 32 -6.121 -16.881 0.460 1.00 0.00 C ATOM 482 C ASP A 32 -6.422 -18.041 -0.485 1.00 0.00 C ATOM 483 O ASP A 32 -7.373 -17.983 -1.269 1.00 0.00 O ATOM 484 CB ASP A 32 -7.289 -16.672 1.429 1.00 0.00 C ATOM 485 CG ASP A 32 -7.014 -17.254 2.802 1.00 0.00 C ATOM 486 OD1 ASP A 32 -7.110 -18.490 2.954 1.00 0.00 O ATOM 487 OD2 ASP A 32 -6.701 -16.473 3.724 1.00 0.00 O ATOM 0 H ASP A 32 -6.700 -15.268 -0.744 1.00 0.00 H new ATOM 0 HA ASP A 32 -5.228 -17.121 1.037 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.492 -15.605 1.524 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.187 -17.132 1.016 1.00 0.00 H new ATOM 492 N GLY A 33 -5.602 -19.089 -0.417 1.00 0.00 N ATOM 493 CA GLY A 33 -5.791 -20.241 -1.281 1.00 0.00 C ATOM 494 C GLY A 33 -5.321 -19.978 -2.699 1.00 0.00 C ATOM 495 O GLY A 33 -4.267 -20.464 -3.109 1.00 0.00 O ATOM 0 H GLY A 33 -4.810 -19.159 0.222 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -5.247 -21.093 -0.872 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.846 -20.513 -1.295 1.00 0.00 H new ATOM 499 N SER A 34 -6.103 -19.200 -3.447 1.00 0.00 N ATOM 500 CA SER A 34 -5.761 -18.864 -4.828 1.00 0.00 C ATOM 501 C SER A 34 -6.575 -17.666 -5.325 1.00 0.00 C ATOM 502 O SER A 34 -6.981 -17.618 -6.488 1.00 0.00 O ATOM 503 CB SER A 34 -5.988 -20.073 -5.741 1.00 0.00 C ATOM 504 OG SER A 34 -4.801 -20.417 -6.437 1.00 0.00 O ATOM 0 H SER A 34 -6.978 -18.791 -3.119 1.00 0.00 H new ATOM 0 HA SER A 34 -4.706 -18.591 -4.856 1.00 0.00 H new ATOM 0 HB2 SER A 34 -6.324 -20.923 -5.147 1.00 0.00 H new ATOM 0 HB3 SER A 34 -6.780 -19.850 -6.455 1.00 0.00 H new ATOM 0 HG SER A 34 -4.801 -19.985 -7.317 1.00 0.00 H new ATOM 510 N THR A 35 -6.807 -16.699 -4.438 1.00 0.00 N ATOM 511 CA THR A 35 -7.566 -15.502 -4.787 1.00 0.00 C ATOM 512 C THR A 35 -7.172 -14.329 -3.891 1.00 0.00 C ATOM 513 O THR A 35 -7.106 -14.466 -2.667 1.00 0.00 O ATOM 514 CB THR A 35 -9.072 -15.772 -4.682 1.00 0.00 C ATOM 515 OG1 THR A 35 -9.819 -14.648 -5.120 1.00 0.00 O ATOM 516 CG2 THR A 35 -9.529 -16.114 -3.278 1.00 0.00 C ATOM 0 H THR A 35 -6.479 -16.723 -3.472 1.00 0.00 H new ATOM 0 HA THR A 35 -7.331 -15.239 -5.818 1.00 0.00 H new ATOM 0 HB THR A 35 -9.251 -16.636 -5.321 1.00 0.00 H new ATOM 0 HG1 THR A 35 -10.777 -14.843 -5.046 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.604 -16.292 -3.279 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.013 -17.011 -2.936 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.299 -15.285 -2.609 1.00 0.00 H new ATOM 524 N ILE A 36 -6.908 -13.181 -4.510 1.00 0.00 N ATOM 525 CA ILE A 36 -6.514 -11.980 -3.777 1.00 0.00 C ATOM 526 C ILE A 36 -7.725 -11.307 -3.131 1.00 0.00 C ATOM 527 O ILE A 36 -8.794 -11.215 -3.738 1.00 0.00 O ATOM 528 CB ILE A 36 -5.798 -10.969 -4.700 1.00 0.00 C ATOM 529 CG1 ILE A 36 -4.630 -11.648 -5.421 1.00 0.00 C ATOM 530 CG2 ILE A 36 -5.305 -9.769 -3.902 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.217 -10.954 -6.700 1.00 0.00 C ATOM 0 H ILE A 36 -6.960 -13.057 -5.521 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.823 -12.295 -2.995 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.511 -10.614 -5.444 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.774 -11.689 -4.748 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.905 -12.678 -5.650 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.804 -9.069 -4.570 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -6.153 -9.274 -3.428 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.605 -10.104 -3.136 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.385 -11.492 -7.154 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.059 -10.936 -7.393 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.910 -9.932 -6.477 1.00 0.00 H new ATOM 543 N VAL A 37 -7.549 -10.843 -1.894 1.00 0.00 N ATOM 544 CA VAL A 37 -8.622 -10.181 -1.156 1.00 0.00 C ATOM 545 C VAL A 37 -8.054 -9.209 -0.119 1.00 0.00 C ATOM 546 O VAL A 37 -7.055 -9.507 0.538 1.00 0.00 O ATOM 547 CB VAL A 37 -9.536 -11.217 -0.455 1.00 0.00 C ATOM 548 CG1 VAL A 37 -8.736 -12.093 0.500 1.00 0.00 C ATOM 549 CG2 VAL A 37 -10.685 -10.533 0.275 1.00 0.00 C ATOM 0 H VAL A 37 -6.670 -10.914 -1.381 1.00 0.00 H new ATOM 0 HA VAL A 37 -9.217 -9.620 -1.877 1.00 0.00 H new ATOM 0 HB VAL A 37 -9.962 -11.858 -1.227 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -9.401 -12.811 0.979 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -7.965 -12.627 -0.055 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -8.268 -11.469 1.261 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -11.309 -11.285 0.757 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -10.285 -9.856 1.030 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -11.284 -9.968 -0.439 1.00 0.00 H new ATOM 559 N PRO A 38 -8.686 -8.027 0.048 1.00 0.00 N ATOM 560 CA PRO A 38 -8.235 -7.018 1.016 1.00 0.00 C ATOM 561 C PRO A 38 -8.173 -7.568 2.440 1.00 0.00 C ATOM 562 O PRO A 38 -8.775 -8.601 2.743 1.00 0.00 O ATOM 563 CB PRO A 38 -9.288 -5.906 0.911 1.00 0.00 C ATOM 564 CG PRO A 38 -10.453 -6.531 0.224 1.00 0.00 C ATOM 565 CD PRO A 38 -9.882 -7.581 -0.684 1.00 0.00 C ATOM 0 HA PRO A 38 -7.223 -6.676 0.798 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.566 -5.534 1.897 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -8.907 -5.056 0.345 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -11.141 -6.971 0.945 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.016 -5.789 -0.342 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.584 -8.399 -0.849 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.629 -7.175 -1.664 1.00 0.00 H new ATOM 573 N GLY A 39 -7.438 -6.874 3.307 1.00 0.00 N ATOM 574 CA GLY A 39 -7.298 -7.300 4.678 1.00 0.00 C ATOM 575 C GLY A 39 -7.584 -6.188 5.666 1.00 0.00 C ATOM 576 O GLY A 39 -8.364 -5.281 5.383 1.00 0.00 O ATOM 0 H GLY A 39 -6.935 -6.017 3.075 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -7.976 -8.132 4.867 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.286 -7.671 4.838 1.00 0.00 H new ATOM 580 N GLU A 40 -6.940 -6.279 6.825 1.00 0.00 N ATOM 581 CA GLU A 40 -7.092 -5.314 7.916 1.00 0.00 C ATOM 582 C GLU A 40 -7.304 -3.887 7.413 1.00 0.00 C ATOM 583 O GLU A 40 -6.687 -3.457 6.440 1.00 0.00 O ATOM 584 CB GLU A 40 -5.869 -5.364 8.838 1.00 0.00 C ATOM 585 CG GLU A 40 -5.871 -6.543 9.801 1.00 0.00 C ATOM 586 CD GLU A 40 -5.649 -7.873 9.100 1.00 0.00 C ATOM 587 OE1 GLU A 40 -4.486 -8.184 8.765 1.00 0.00 O ATOM 588 OE2 GLU A 40 -6.641 -8.598 8.873 1.00 0.00 O ATOM 0 H GLU A 40 -6.288 -7.034 7.039 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.987 -5.598 8.470 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.967 -5.408 8.227 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.821 -4.439 9.412 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -5.092 -6.397 10.549 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.822 -6.571 10.332 1.00 0.00 H new ATOM 595 N GLN A 41 -8.186 -3.166 8.101 1.00 0.00 N ATOM 596 CA GLN A 41 -8.504 -1.780 7.755 1.00 0.00 C ATOM 597 C GLN A 41 -8.602 -0.926 9.018 1.00 0.00 C ATOM 598 O GLN A 41 -9.634 -0.919 9.694 1.00 0.00 O ATOM 599 CB GLN A 41 -9.820 -1.711 6.971 1.00 0.00 C ATOM 600 CG GLN A 41 -10.012 -2.856 5.988 1.00 0.00 C ATOM 601 CD GLN A 41 -11.257 -2.700 5.137 1.00 0.00 C ATOM 602 OE1 GLN A 41 -12.289 -2.219 5.607 1.00 0.00 O ATOM 603 NE2 GLN A 41 -11.168 -3.105 3.874 1.00 0.00 N ATOM 0 H GLN A 41 -8.698 -3.521 8.909 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.702 -1.390 7.128 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.652 -1.707 7.676 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.858 -0.767 6.427 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.139 -2.920 5.338 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -10.069 -3.795 6.538 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.294 -3.498 3.525 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.974 -3.023 3.254 1.00 0.00 H new ATOM 612 N GLY A 42 -7.520 -0.220 9.341 1.00 0.00 N ATOM 613 CA GLY A 42 -7.505 0.611 10.536 1.00 0.00 C ATOM 614 C GLY A 42 -6.813 1.944 10.339 1.00 0.00 C ATOM 615 O GLY A 42 -6.093 2.145 9.360 1.00 0.00 O ATOM 0 H GLY A 42 -6.656 -0.208 8.799 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.531 0.788 10.858 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.008 0.068 11.340 1.00 0.00 H new ATOM 619 N ALA A 43 -7.026 2.853 11.289 1.00 0.00 N ATOM 620 CA ALA A 43 -6.409 4.175 11.245 1.00 0.00 C ATOM 621 C ALA A 43 -4.988 4.126 11.805 1.00 0.00 C ATOM 622 O ALA A 43 -4.157 4.978 11.485 1.00 0.00 O ATOM 623 CB ALA A 43 -7.250 5.182 12.020 1.00 0.00 C ATOM 0 H ALA A 43 -7.623 2.696 12.101 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.358 4.494 10.204 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.775 6.162 11.977 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.245 5.241 11.579 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.332 4.864 13.059 1.00 0.00 H new ATOM 629 N GLU A 44 -4.714 3.119 12.641 1.00 0.00 N ATOM 630 CA GLU A 44 -3.392 2.956 13.242 1.00 0.00 C ATOM 631 C GLU A 44 -2.471 2.161 12.320 1.00 0.00 C ATOM 632 O GLU A 44 -2.629 0.948 12.165 1.00 0.00 O ATOM 633 CB GLU A 44 -3.510 2.258 14.603 1.00 0.00 C ATOM 634 CG GLU A 44 -4.128 0.868 14.528 1.00 0.00 C ATOM 635 CD GLU A 44 -5.250 0.671 15.527 1.00 0.00 C ATOM 636 OE1 GLU A 44 -6.285 1.358 15.399 1.00 0.00 O ATOM 637 OE2 GLU A 44 -5.094 -0.171 16.436 1.00 0.00 O ATOM 0 H GLU A 44 -5.391 2.407 12.915 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.959 3.945 13.389 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.518 2.181 15.049 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -4.111 2.878 15.268 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.510 0.699 13.521 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -3.354 0.121 14.705 1.00 0.00 H new ATOM 644 N TYR A 45 -1.511 2.846 11.700 1.00 0.00 N ATOM 645 CA TYR A 45 -0.576 2.186 10.790 1.00 0.00 C ATOM 646 C TYR A 45 0.369 1.249 11.540 1.00 0.00 C ATOM 647 O TYR A 45 0.940 0.336 10.943 1.00 0.00 O ATOM 648 CB TYR A 45 0.233 3.210 9.999 1.00 0.00 C ATOM 649 CG TYR A 45 0.949 2.614 8.806 1.00 0.00 C ATOM 650 CD1 TYR A 45 0.269 2.342 7.627 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.307 2.327 8.861 1.00 0.00 C ATOM 652 CE1 TYR A 45 0.922 1.801 6.535 1.00 0.00 C ATOM 653 CE2 TYR A 45 2.968 1.788 7.774 1.00 0.00 C ATOM 654 CZ TYR A 45 2.272 1.527 6.613 1.00 0.00 C ATOM 655 OH TYR A 45 2.932 0.993 5.526 1.00 0.00 O ATOM 0 H TYR A 45 -1.361 3.849 11.810 1.00 0.00 H new ATOM 0 HA TYR A 45 -1.170 1.592 10.096 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -0.432 4.002 9.656 1.00 0.00 H new ATOM 0 HB3 TYR A 45 0.966 3.673 10.660 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.787 2.556 7.562 1.00 0.00 H new ATOM 0 HD2 TYR A 45 2.856 2.529 9.769 1.00 0.00 H new ATOM 0 HE1 TYR A 45 0.378 1.594 5.625 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.025 1.572 7.834 1.00 0.00 H new ATOM 0 HH TYR A 45 2.768 0.028 5.486 1.00 0.00 H new ATOM 665 N GLN A 46 0.529 1.470 12.850 1.00 0.00 N ATOM 666 CA GLN A 46 1.402 0.629 13.670 1.00 0.00 C ATOM 667 C GLN A 46 1.123 -0.851 13.412 1.00 0.00 C ATOM 668 O GLN A 46 2.045 -1.669 13.365 1.00 0.00 O ATOM 669 CB GLN A 46 1.206 0.947 15.156 1.00 0.00 C ATOM 670 CG GLN A 46 2.472 0.803 15.987 1.00 0.00 C ATOM 671 CD GLN A 46 2.255 1.147 17.450 1.00 0.00 C ATOM 672 OE1 GLN A 46 1.142 1.047 17.966 1.00 0.00 O ATOM 673 NE2 GLN A 46 3.322 1.553 18.129 1.00 0.00 N ATOM 0 H GLN A 46 0.066 2.222 13.361 1.00 0.00 H new ATOM 0 HA GLN A 46 2.435 0.841 13.396 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.833 1.966 15.254 1.00 0.00 H new ATOM 0 HB3 GLN A 46 0.439 0.286 15.561 1.00 0.00 H new ATOM 0 HG2 GLN A 46 2.838 -0.221 15.909 1.00 0.00 H new ATOM 0 HG3 GLN A 46 3.247 1.451 15.577 1.00 0.00 H new ATOM 0 HE21 GLN A 46 4.227 1.622 17.663 1.00 0.00 H new ATOM 0 HE22 GLN A 46 3.236 1.796 19.116 1.00 0.00 H new ATOM 682 N HIS A 47 -0.158 -1.180 13.234 1.00 0.00 N ATOM 683 CA HIS A 47 -0.577 -2.553 12.967 1.00 0.00 C ATOM 684 C HIS A 47 0.027 -3.072 11.664 1.00 0.00 C ATOM 685 O HIS A 47 0.452 -4.225 11.588 1.00 0.00 O ATOM 686 CB HIS A 47 -2.103 -2.628 12.888 1.00 0.00 C ATOM 687 CG HIS A 47 -2.764 -2.944 14.193 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.116 -2.878 15.408 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.036 -3.316 14.467 1.00 0.00 C ATOM 690 CE1 HIS A 47 -2.959 -3.196 16.372 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.135 -3.465 15.830 1.00 0.00 N ATOM 0 H HIS A 47 -0.925 -0.509 13.271 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.220 -3.178 13.785 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.485 -1.676 12.520 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.382 -3.387 12.157 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.827 -3.468 13.748 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.728 -3.231 17.426 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.976 -3.738 16.339 1.00 0.00 H new ATOM 700 N PHE A 48 0.064 -2.217 10.642 1.00 0.00 N ATOM 701 CA PHE A 48 0.615 -2.601 9.349 1.00 0.00 C ATOM 702 C PHE A 48 2.113 -2.882 9.450 1.00 0.00 C ATOM 703 O PHE A 48 2.605 -3.863 8.892 1.00 0.00 O ATOM 704 CB PHE A 48 0.349 -1.510 8.309 1.00 0.00 C ATOM 705 CG PHE A 48 0.690 -1.935 6.911 1.00 0.00 C ATOM 706 CD1 PHE A 48 1.964 -1.741 6.404 1.00 0.00 C ATOM 707 CD2 PHE A 48 -0.263 -2.540 6.108 1.00 0.00 C ATOM 708 CE1 PHE A 48 2.283 -2.142 5.122 1.00 0.00 C ATOM 709 CE2 PHE A 48 0.049 -2.942 4.824 1.00 0.00 C ATOM 710 CZ PHE A 48 1.324 -2.742 4.331 1.00 0.00 C ATOM 0 H PHE A 48 -0.280 -1.258 10.687 1.00 0.00 H new ATOM 0 HA PHE A 48 0.119 -3.518 9.032 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.703 -1.226 8.350 1.00 0.00 H new ATOM 0 HB3 PHE A 48 0.929 -0.623 8.565 1.00 0.00 H new ATOM 0 HD1 PHE A 48 2.717 -1.270 7.019 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -1.261 -2.699 6.490 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.281 -1.987 4.739 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.702 -3.412 4.207 1.00 0.00 H new ATOM 0 HZ PHE A 48 1.570 -3.055 3.327 1.00 0.00 H new ATOM 720 N ILE A 49 2.830 -2.018 10.167 1.00 0.00 N ATOM 721 CA ILE A 49 4.273 -2.173 10.346 1.00 0.00 C ATOM 722 C ILE A 49 4.611 -3.503 11.024 1.00 0.00 C ATOM 723 O ILE A 49 5.556 -4.188 10.628 1.00 0.00 O ATOM 724 CB ILE A 49 4.864 -1.020 11.186 1.00 0.00 C ATOM 725 CG1 ILE A 49 4.489 0.334 10.579 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.377 -1.156 11.288 1.00 0.00 C ATOM 727 CD1 ILE A 49 4.183 1.397 11.611 1.00 0.00 C ATOM 0 H ILE A 49 2.434 -1.202 10.634 1.00 0.00 H new ATOM 0 HA ILE A 49 4.715 -2.154 9.350 1.00 0.00 H new ATOM 0 HB ILE A 49 4.443 -1.076 12.190 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.307 0.678 9.947 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.620 0.205 9.934 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.777 -0.335 11.883 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.626 -2.104 11.764 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.813 -1.126 10.290 1.00 0.00 H new ATOM 0 HD11 ILE A 49 3.926 2.329 11.108 1.00 0.00 H new ATOM 0 HD12 ILE A 49 3.345 1.074 12.228 1.00 0.00 H new ATOM 0 HD13 ILE A 49 5.058 1.555 12.241 1.00 0.00 H new ATOM 739 N GLN A 50 3.836 -3.855 12.051 1.00 0.00 N ATOM 740 CA GLN A 50 4.051 -5.096 12.793 1.00 0.00 C ATOM 741 C GLN A 50 3.644 -6.321 11.972 1.00 0.00 C ATOM 742 O GLN A 50 4.300 -7.362 12.037 1.00 0.00 O ATOM 743 CB GLN A 50 3.267 -5.068 14.110 1.00 0.00 C ATOM 744 CG GLN A 50 4.007 -5.708 15.276 1.00 0.00 C ATOM 745 CD GLN A 50 5.416 -5.168 15.450 1.00 0.00 C ATOM 746 OE1 GLN A 50 6.393 -5.907 15.330 1.00 0.00 O ATOM 747 NE2 GLN A 50 5.531 -3.874 15.732 1.00 0.00 N ATOM 0 H GLN A 50 3.052 -3.296 12.388 1.00 0.00 H new ATOM 0 HA GLN A 50 5.117 -5.173 13.006 1.00 0.00 H new ATOM 0 HB2 GLN A 50 3.035 -4.033 14.362 1.00 0.00 H new ATOM 0 HB3 GLN A 50 2.317 -5.582 13.968 1.00 0.00 H new ATOM 0 HG2 GLN A 50 3.443 -5.540 16.194 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.053 -6.786 15.123 1.00 0.00 H new ATOM 0 HE21 GLN A 50 4.696 -3.296 15.823 1.00 0.00 H new ATOM 0 HE22 GLN A 50 6.455 -3.459 15.857 1.00 0.00 H new ATOM 756 N GLN A 51 2.561 -6.195 11.208 1.00 0.00 N ATOM 757 CA GLN A 51 2.070 -7.298 10.386 1.00 0.00 C ATOM 758 C GLN A 51 2.979 -7.543 9.181 1.00 0.00 C ATOM 759 O GLN A 51 3.216 -8.691 8.801 1.00 0.00 O ATOM 760 CB GLN A 51 0.638 -7.017 9.917 1.00 0.00 C ATOM 761 CG GLN A 51 -0.426 -7.679 10.778 1.00 0.00 C ATOM 762 CD GLN A 51 -0.765 -6.868 12.015 1.00 0.00 C ATOM 763 OE1 GLN A 51 -1.766 -6.152 12.044 1.00 0.00 O ATOM 764 NE2 GLN A 51 0.065 -6.976 13.048 1.00 0.00 N ATOM 0 H GLN A 51 2.007 -5.341 11.141 1.00 0.00 H new ATOM 0 HA GLN A 51 2.074 -8.198 11.000 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.471 -5.940 9.912 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.527 -7.361 8.889 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.329 -7.824 10.185 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -0.080 -8.668 11.080 1.00 0.00 H new ATOM 0 HE21 GLN A 51 0.884 -7.581 12.983 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -0.117 -6.454 13.905 1.00 0.00 H new ATOM 773 N CYS A 52 3.477 -6.461 8.582 1.00 0.00 N ATOM 774 CA CYS A 52 4.351 -6.560 7.416 1.00 0.00 C ATOM 775 C CYS A 52 5.816 -6.729 7.822 1.00 0.00 C ATOM 776 O CYS A 52 6.591 -5.769 7.809 1.00 0.00 O ATOM 777 CB CYS A 52 4.194 -5.320 6.534 1.00 0.00 C ATOM 778 SG CYS A 52 2.836 -5.425 5.346 1.00 0.00 S ATOM 0 H CYS A 52 3.289 -5.506 8.886 1.00 0.00 H new ATOM 0 HA CYS A 52 4.055 -7.446 6.854 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.037 -4.451 7.173 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.125 -5.153 5.992 1.00 0.00 H new ATOM 0 HG CYS A 52 2.204 -4.290 5.308 1.00 0.00 H new ATOM 784 N THR A 53 6.194 -7.958 8.169 1.00 0.00 N ATOM 785 CA THR A 53 7.569 -8.257 8.566 1.00 0.00 C ATOM 786 C THR A 53 8.318 -8.940 7.422 1.00 0.00 C ATOM 787 O THR A 53 7.699 -9.459 6.489 1.00 0.00 O ATOM 788 CB THR A 53 7.597 -9.143 9.819 1.00 0.00 C ATOM 789 OG1 THR A 53 6.315 -9.212 10.423 1.00 0.00 O ATOM 790 CG2 THR A 53 8.570 -8.660 10.875 1.00 0.00 C ATOM 0 H THR A 53 5.568 -8.763 8.183 1.00 0.00 H new ATOM 0 HA THR A 53 8.066 -7.315 8.800 1.00 0.00 H new ATOM 0 HB THR A 53 7.920 -10.122 9.465 1.00 0.00 H new ATOM 0 HG1 THR A 53 6.089 -8.341 10.812 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.539 -9.332 11.733 1.00 0.00 H new ATOM 0 HG22 THR A 53 9.578 -8.646 10.461 1.00 0.00 H new ATOM 0 HG23 THR A 53 8.294 -7.654 11.192 1.00 0.00 H new ATOM 798 N ASP A 54 9.648 -8.931 7.493 1.00 0.00 N ATOM 799 CA ASP A 54 10.480 -9.544 6.459 1.00 0.00 C ATOM 800 C ASP A 54 10.421 -11.072 6.534 1.00 0.00 C ATOM 801 O ASP A 54 11.399 -11.726 6.901 1.00 0.00 O ATOM 802 CB ASP A 54 11.931 -9.059 6.581 1.00 0.00 C ATOM 803 CG ASP A 54 12.453 -9.086 8.008 1.00 0.00 C ATOM 804 OD1 ASP A 54 12.072 -8.195 8.799 1.00 0.00 O ATOM 805 OD2 ASP A 54 13.244 -9.996 8.333 1.00 0.00 O ATOM 0 H ASP A 54 10.173 -8.505 8.257 1.00 0.00 H new ATOM 0 HA ASP A 54 10.088 -9.239 5.489 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.570 -9.683 5.955 1.00 0.00 H new ATOM 0 HB3 ASP A 54 12.001 -8.042 6.194 1.00 0.00 H new ATOM 810 N ASP A 55 9.264 -11.635 6.181 1.00 0.00 N ATOM 811 CA ASP A 55 9.076 -13.084 6.209 1.00 0.00 C ATOM 812 C ASP A 55 7.784 -13.496 5.489 1.00 0.00 C ATOM 813 O ASP A 55 7.058 -14.369 5.964 1.00 0.00 O ATOM 814 CB ASP A 55 9.040 -13.574 7.661 1.00 0.00 C ATOM 815 CG ASP A 55 9.783 -14.881 7.856 1.00 0.00 C ATOM 816 OD1 ASP A 55 9.289 -15.924 7.375 1.00 0.00 O ATOM 817 OD2 ASP A 55 10.859 -14.863 8.491 1.00 0.00 O ATOM 0 H ASP A 55 8.446 -11.110 5.873 1.00 0.00 H new ATOM 0 HA ASP A 55 9.915 -13.544 5.686 1.00 0.00 H new ATOM 0 HB2 ASP A 55 9.476 -12.813 8.308 1.00 0.00 H new ATOM 0 HB3 ASP A 55 8.003 -13.700 7.972 1.00 0.00 H new ATOM 822 N VAL A 56 7.501 -12.858 4.345 1.00 0.00 N ATOM 823 CA VAL A 56 6.283 -13.150 3.564 1.00 0.00 C ATOM 824 C VAL A 56 6.160 -12.188 2.378 1.00 0.00 C ATOM 825 O VAL A 56 7.069 -11.411 2.116 1.00 0.00 O ATOM 826 CB VAL A 56 4.993 -13.028 4.426 1.00 0.00 C ATOM 827 CG1 VAL A 56 4.536 -14.391 4.931 1.00 0.00 C ATOM 828 CG2 VAL A 56 5.193 -12.061 5.587 1.00 0.00 C ATOM 0 H VAL A 56 8.096 -12.137 3.937 1.00 0.00 H new ATOM 0 HA VAL A 56 6.378 -14.178 3.213 1.00 0.00 H new ATOM 0 HB VAL A 56 4.208 -12.626 3.785 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.633 -14.273 5.530 1.00 0.00 H new ATOM 0 HG12 VAL A 56 4.326 -15.042 4.082 1.00 0.00 H new ATOM 0 HG13 VAL A 56 5.322 -14.835 5.543 1.00 0.00 H new ATOM 0 HG21 VAL A 56 4.274 -11.998 6.170 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.003 -12.419 6.223 1.00 0.00 H new ATOM 0 HG23 VAL A 56 5.445 -11.074 5.199 1.00 0.00 H new ATOM 838 N ARG A 57 5.029 -12.233 1.668 1.00 0.00 N ATOM 839 CA ARG A 57 4.804 -11.342 0.530 1.00 0.00 C ATOM 840 C ARG A 57 3.318 -11.014 0.392 1.00 0.00 C ATOM 841 O ARG A 57 2.484 -11.915 0.271 1.00 0.00 O ATOM 842 CB ARG A 57 5.330 -11.970 -0.763 1.00 0.00 C ATOM 843 CG ARG A 57 4.665 -13.288 -1.125 1.00 0.00 C ATOM 844 CD ARG A 57 3.995 -13.215 -2.486 1.00 0.00 C ATOM 845 NE ARG A 57 2.642 -12.658 -2.414 1.00 0.00 N ATOM 846 CZ ARG A 57 1.965 -12.194 -3.470 1.00 0.00 C ATOM 847 NH1 ARG A 57 2.512 -12.208 -4.682 1.00 0.00 N ATOM 848 NH2 ARG A 57 0.738 -11.712 -3.312 1.00 0.00 N ATOM 0 H ARG A 57 4.259 -12.874 1.861 1.00 0.00 H new ATOM 0 HA ARG A 57 5.350 -10.416 0.711 1.00 0.00 H new ATOM 0 HB2 ARG A 57 5.186 -11.265 -1.582 1.00 0.00 H new ATOM 0 HB3 ARG A 57 6.404 -12.131 -0.666 1.00 0.00 H new ATOM 0 HG2 ARG A 57 5.409 -14.084 -1.126 1.00 0.00 H new ATOM 0 HG3 ARG A 57 3.925 -13.544 -0.367 1.00 0.00 H new ATOM 0 HD2 ARG A 57 4.602 -12.603 -3.154 1.00 0.00 H new ATOM 0 HD3 ARG A 57 3.951 -14.214 -2.920 1.00 0.00 H new ATOM 0 HE ARG A 57 2.188 -12.622 -1.501 1.00 0.00 H new ATOM 0 HH11 ARG A 57 3.455 -12.575 -4.812 1.00 0.00 H new ATOM 0 HH12 ARG A 57 1.989 -11.852 -5.482 1.00 0.00 H new ATOM 0 HH21 ARG A 57 0.312 -11.696 -2.385 1.00 0.00 H new ATOM 0 HH22 ARG A 57 0.222 -11.358 -4.117 1.00 0.00 H new ATOM 862 N LEU A 58 2.990 -9.724 0.423 1.00 0.00 N ATOM 863 CA LEU A 58 1.598 -9.288 0.310 1.00 0.00 C ATOM 864 C LEU A 58 1.494 -7.875 -0.261 1.00 0.00 C ATOM 865 O LEU A 58 2.502 -7.193 -0.458 1.00 0.00 O ATOM 866 CB LEU A 58 0.912 -9.341 1.680 1.00 0.00 C ATOM 867 CG LEU A 58 1.638 -8.593 2.802 1.00 0.00 C ATOM 868 CD1 LEU A 58 1.107 -7.173 2.928 1.00 0.00 C ATOM 869 CD2 LEU A 58 1.493 -9.339 4.120 1.00 0.00 C ATOM 0 H LEU A 58 3.664 -8.965 0.525 1.00 0.00 H new ATOM 0 HA LEU A 58 1.096 -9.970 -0.377 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.093 -8.930 1.582 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.802 -10.385 1.973 1.00 0.00 H new ATOM 0 HG LEU A 58 2.698 -8.541 2.552 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.635 -6.657 3.730 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.264 -6.641 1.990 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.041 -7.202 3.155 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.015 -8.793 4.906 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.437 -9.423 4.376 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.923 -10.336 4.023 1.00 0.00 H new ATOM 881 N PHE A 59 0.261 -7.443 -0.514 1.00 0.00 N ATOM 882 CA PHE A 59 0.001 -6.112 -1.053 1.00 0.00 C ATOM 883 C PHE A 59 -0.602 -5.205 0.017 1.00 0.00 C ATOM 884 O PHE A 59 -0.946 -5.661 1.109 1.00 0.00 O ATOM 885 CB PHE A 59 -0.939 -6.203 -2.258 1.00 0.00 C ATOM 886 CG PHE A 59 -0.228 -6.479 -3.553 1.00 0.00 C ATOM 887 CD1 PHE A 59 0.643 -7.552 -3.665 1.00 0.00 C ATOM 888 CD2 PHE A 59 -0.427 -5.665 -4.656 1.00 0.00 C ATOM 889 CE1 PHE A 59 1.302 -7.806 -4.851 1.00 0.00 C ATOM 890 CE2 PHE A 59 0.229 -5.915 -5.845 1.00 0.00 C ATOM 891 CZ PHE A 59 1.095 -6.987 -5.942 1.00 0.00 C ATOM 0 H PHE A 59 -0.578 -8.000 -0.353 1.00 0.00 H new ATOM 0 HA PHE A 59 0.949 -5.681 -1.376 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -1.671 -6.991 -2.079 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -1.493 -5.268 -2.348 1.00 0.00 H new ATOM 0 HD1 PHE A 59 0.808 -8.197 -2.814 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -1.103 -4.826 -4.585 1.00 0.00 H new ATOM 0 HE1 PHE A 59 1.979 -8.645 -4.925 1.00 0.00 H new ATOM 0 HE2 PHE A 59 0.065 -5.273 -6.698 1.00 0.00 H new ATOM 0 HZ PHE A 59 1.610 -7.184 -6.871 1.00 0.00 H new ATOM 901 N ALA A 60 -0.726 -3.919 -0.303 1.00 0.00 N ATOM 902 CA ALA A 60 -1.283 -2.947 0.632 1.00 0.00 C ATOM 903 C ALA A 60 -1.877 -1.746 -0.100 1.00 0.00 C ATOM 904 O ALA A 60 -1.577 -1.509 -1.272 1.00 0.00 O ATOM 905 CB ALA A 60 -0.212 -2.488 1.608 1.00 0.00 C ATOM 0 H ALA A 60 -0.448 -3.527 -1.203 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.087 -3.434 1.183 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.638 -1.763 2.301 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.164 -3.346 2.166 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.608 -2.026 1.058 1.00 0.00 H new ATOM 911 N PHE A 61 -2.719 -0.991 0.603 1.00 0.00 N ATOM 912 CA PHE A 61 -3.357 0.188 0.028 1.00 0.00 C ATOM 913 C PHE A 61 -3.636 1.233 1.106 1.00 0.00 C ATOM 914 O PHE A 61 -4.535 1.063 1.932 1.00 0.00 O ATOM 915 CB PHE A 61 -4.656 -0.206 -0.679 1.00 0.00 C ATOM 916 CG PHE A 61 -4.970 0.643 -1.877 1.00 0.00 C ATOM 917 CD1 PHE A 61 -4.509 0.285 -3.134 1.00 0.00 C ATOM 918 CD2 PHE A 61 -5.723 1.798 -1.746 1.00 0.00 C ATOM 919 CE1 PHE A 61 -4.793 1.066 -4.239 1.00 0.00 C ATOM 920 CE2 PHE A 61 -6.011 2.582 -2.847 1.00 0.00 C ATOM 921 CZ PHE A 61 -5.545 2.215 -4.095 1.00 0.00 C ATOM 0 H PHE A 61 -2.975 -1.176 1.573 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.677 0.625 -0.703 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.589 -1.248 -0.991 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.481 -0.138 0.030 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.922 -0.614 -3.252 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -6.089 2.089 -0.773 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -4.427 0.778 -5.213 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -6.599 3.480 -2.732 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.769 2.826 -4.957 1.00 0.00 H new ATOM 931 N VAL A 62 -2.857 2.314 1.092 1.00 0.00 N ATOM 932 CA VAL A 62 -3.015 3.388 2.069 1.00 0.00 C ATOM 933 C VAL A 62 -3.184 4.737 1.377 1.00 0.00 C ATOM 934 O VAL A 62 -2.465 5.051 0.427 1.00 0.00 O ATOM 935 CB VAL A 62 -1.807 3.471 3.029 1.00 0.00 C ATOM 936 CG1 VAL A 62 -2.117 4.392 4.202 1.00 0.00 C ATOM 937 CG2 VAL A 62 -1.407 2.085 3.520 1.00 0.00 C ATOM 0 H VAL A 62 -2.110 2.468 0.414 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.910 3.155 2.645 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.964 3.889 2.479 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -1.254 4.437 4.867 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.342 5.392 3.830 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.977 4.007 4.750 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.555 2.170 4.194 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -2.245 1.631 4.049 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.135 1.462 2.668 1.00 0.00 H new ATOM 947 N ARG A 63 -4.132 5.535 1.865 1.00 0.00 N ATOM 948 CA ARG A 63 -4.388 6.856 1.298 1.00 0.00 C ATOM 949 C ARG A 63 -3.944 7.952 2.266 1.00 0.00 C ATOM 950 O ARG A 63 -4.190 7.865 3.471 1.00 0.00 O ATOM 951 CB ARG A 63 -5.872 7.019 0.957 1.00 0.00 C ATOM 952 CG ARG A 63 -6.113 7.853 -0.292 1.00 0.00 C ATOM 953 CD ARG A 63 -7.596 8.001 -0.596 1.00 0.00 C ATOM 954 NE ARG A 63 -7.846 9.022 -1.614 1.00 0.00 N ATOM 955 CZ ARG A 63 -9.061 9.356 -2.056 1.00 0.00 C ATOM 956 NH1 ARG A 63 -10.144 8.748 -1.580 1.00 0.00 N ATOM 957 NH2 ARG A 63 -9.192 10.303 -2.978 1.00 0.00 N ATOM 0 H ARG A 63 -4.734 5.290 2.651 1.00 0.00 H new ATOM 0 HA ARG A 63 -3.809 6.949 0.379 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.317 6.033 0.819 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.383 7.484 1.800 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.669 8.840 -0.161 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.613 7.388 -1.141 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.994 7.045 -0.936 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.130 8.262 0.318 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.042 9.509 -2.011 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -10.050 8.020 -0.872 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -11.068 9.010 -1.923 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.366 10.773 -3.347 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -10.119 10.560 -3.317 1.00 0.00 H new ATOM 971 N PHE A 64 -3.281 8.979 1.733 1.00 0.00 N ATOM 972 CA PHE A 64 -2.795 10.090 2.551 1.00 0.00 C ATOM 973 C PHE A 64 -3.370 11.422 2.077 1.00 0.00 C ATOM 974 O PHE A 64 -3.561 11.636 0.880 1.00 0.00 O ATOM 975 CB PHE A 64 -1.266 10.147 2.517 1.00 0.00 C ATOM 976 CG PHE A 64 -0.602 9.006 3.234 1.00 0.00 C ATOM 977 CD1 PHE A 64 -0.296 9.102 4.582 1.00 0.00 C ATOM 978 CD2 PHE A 64 -0.278 7.841 2.558 1.00 0.00 C ATOM 979 CE1 PHE A 64 0.320 8.058 5.242 1.00 0.00 C ATOM 980 CE2 PHE A 64 0.338 6.793 3.213 1.00 0.00 C ATOM 981 CZ PHE A 64 0.639 6.902 4.557 1.00 0.00 C ATOM 0 H PHE A 64 -3.068 9.064 0.739 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.128 9.917 3.574 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.935 10.154 1.479 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.936 11.085 2.963 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.542 10.004 5.122 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.510 7.751 1.507 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.552 8.145 6.293 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.584 5.889 2.675 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.123 6.085 5.071 1.00 0.00 H new ATOM 991 N THR A 65 -3.633 12.316 3.028 1.00 0.00 N ATOM 992 CA THR A 65 -4.176 13.635 2.717 1.00 0.00 C ATOM 993 C THR A 65 -3.123 14.716 2.943 1.00 0.00 C ATOM 994 O THR A 65 -2.642 14.905 4.063 1.00 0.00 O ATOM 995 CB THR A 65 -5.418 13.927 3.567 1.00 0.00 C ATOM 996 OG1 THR A 65 -5.386 13.196 4.784 1.00 0.00 O ATOM 997 CG2 THR A 65 -6.718 13.595 2.861 1.00 0.00 C ATOM 0 H THR A 65 -3.478 12.150 4.022 1.00 0.00 H new ATOM 0 HA THR A 65 -4.465 13.640 1.666 1.00 0.00 H new ATOM 0 HB THR A 65 -5.389 15.000 3.756 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.188 13.400 5.309 1.00 0.00 H new ATOM 0 HG21 THR A 65 -7.557 13.825 3.517 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.798 14.186 1.949 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.735 12.535 2.609 1.00 0.00 H new ATOM 1005 N THR A 66 -2.766 15.420 1.872 1.00 0.00 N ATOM 1006 CA THR A 66 -1.768 16.482 1.948 1.00 0.00 C ATOM 1007 C THR A 66 -2.438 17.853 1.935 1.00 0.00 C ATOM 1008 O THR A 66 -2.676 18.431 0.872 1.00 0.00 O ATOM 1009 CB THR A 66 -0.769 16.369 0.791 1.00 0.00 C ATOM 1010 OG1 THR A 66 -1.398 15.871 -0.381 1.00 0.00 O ATOM 1011 CG2 THR A 66 0.411 15.468 1.101 1.00 0.00 C ATOM 0 H THR A 66 -3.154 15.273 0.940 1.00 0.00 H new ATOM 0 HA THR A 66 -1.226 16.370 2.887 1.00 0.00 H new ATOM 0 HB THR A 66 -0.400 17.383 0.635 1.00 0.00 H new ATOM 0 HG1 THR A 66 -0.740 15.810 -1.105 1.00 0.00 H new ATOM 0 HG21 THR A 66 1.078 15.433 0.240 1.00 0.00 H new ATOM 0 HG22 THR A 66 0.951 15.860 1.963 1.00 0.00 H new ATOM 0 HG23 THR A 66 0.053 14.463 1.323 1.00 0.00 H new ATOM 1019 N GLY A 67 -2.741 18.366 3.124 1.00 0.00 N ATOM 1020 CA GLY A 67 -3.384 19.664 3.236 1.00 0.00 C ATOM 1021 C GLY A 67 -3.219 20.279 4.612 1.00 0.00 C ATOM 1022 O GLY A 67 -2.958 19.571 5.587 1.00 0.00 O ATOM 0 H GLY A 67 -2.552 17.905 4.014 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.966 20.338 2.488 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -4.446 19.560 3.013 1.00 0.00 H new ATOM 1026 N ASP A 68 -3.376 21.599 4.694 1.00 0.00 N ATOM 1027 CA ASP A 68 -3.246 22.307 5.967 1.00 0.00 C ATOM 1028 C ASP A 68 -3.935 23.671 5.914 1.00 0.00 C ATOM 1029 O ASP A 68 -3.284 24.703 5.739 1.00 0.00 O ATOM 1030 CB ASP A 68 -1.769 22.476 6.335 1.00 0.00 C ATOM 1031 CG ASP A 68 -1.551 22.538 7.834 1.00 0.00 C ATOM 1032 OD1 ASP A 68 -1.653 23.645 8.404 1.00 0.00 O ATOM 1033 OD2 ASP A 68 -1.280 21.480 8.439 1.00 0.00 O ATOM 0 H ASP A 68 -3.593 22.198 3.898 1.00 0.00 H new ATOM 0 HA ASP A 68 -3.737 21.709 6.735 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -1.197 21.646 5.921 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -1.385 23.387 5.877 1.00 0.00 H new ATOM 1038 N ALA A 69 -5.262 23.662 6.069 1.00 0.00 N ATOM 1039 CA ALA A 69 -6.065 24.888 6.044 1.00 0.00 C ATOM 1040 C ALA A 69 -5.683 25.802 4.882 1.00 0.00 C ATOM 1041 O ALA A 69 -5.725 27.029 4.992 1.00 0.00 O ATOM 1042 CB ALA A 69 -5.929 25.627 7.360 1.00 0.00 C ATOM 0 H ALA A 69 -5.807 22.812 6.214 1.00 0.00 H new ATOM 0 HA ALA A 69 -7.105 24.595 5.898 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -6.530 26.536 7.331 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -6.276 24.989 8.173 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -4.884 25.888 7.524 1.00 0.00 H new ATOM 1048 N MET A 70 -5.315 25.185 3.774 1.00 0.00 N ATOM 1049 CA MET A 70 -4.919 25.911 2.571 1.00 0.00 C ATOM 1050 C MET A 70 -5.298 25.125 1.318 1.00 0.00 C ATOM 1051 O MET A 70 -5.777 25.693 0.337 1.00 0.00 O ATOM 1052 CB MET A 70 -3.409 26.177 2.589 1.00 0.00 C ATOM 1053 CG MET A 70 -2.889 26.857 1.331 1.00 0.00 C ATOM 1054 SD MET A 70 -2.119 28.453 1.668 1.00 0.00 S ATOM 1055 CE MET A 70 -3.528 29.546 1.514 1.00 0.00 C ATOM 0 H MET A 70 -5.281 24.170 3.678 1.00 0.00 H new ATOM 0 HA MET A 70 -5.448 26.864 2.554 1.00 0.00 H new ATOM 0 HB2 MET A 70 -3.169 26.798 3.452 1.00 0.00 H new ATOM 0 HB3 MET A 70 -2.885 25.231 2.722 1.00 0.00 H new ATOM 0 HG2 MET A 70 -2.164 26.205 0.844 1.00 0.00 H new ATOM 0 HG3 MET A 70 -3.713 26.997 0.632 1.00 0.00 H new ATOM 0 HE1 MET A 70 -3.213 30.574 1.695 1.00 0.00 H new ATOM 0 HE2 MET A 70 -3.943 29.465 0.509 1.00 0.00 H new ATOM 0 HE3 MET A 70 -4.288 29.266 2.244 1.00 0.00 H new ATOM 1065 N SER A 71 -5.080 23.813 1.366 1.00 0.00 N ATOM 1066 CA SER A 71 -5.393 22.934 0.245 1.00 0.00 C ATOM 1067 C SER A 71 -5.554 21.493 0.722 1.00 0.00 C ATOM 1068 O SER A 71 -4.623 20.690 0.634 1.00 0.00 O ATOM 1069 CB SER A 71 -4.297 23.018 -0.824 1.00 0.00 C ATOM 1070 OG SER A 71 -4.754 22.511 -2.067 1.00 0.00 O ATOM 0 H SER A 71 -4.685 23.334 2.175 1.00 0.00 H new ATOM 0 HA SER A 71 -6.335 23.262 -0.194 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.982 24.054 -0.945 1.00 0.00 H new ATOM 0 HB3 SER A 71 -3.423 22.455 -0.498 1.00 0.00 H new ATOM 0 HG SER A 71 -4.036 22.578 -2.731 1.00 0.00 H new ATOM 1076 N LYS A 72 -6.740 21.172 1.234 1.00 0.00 N ATOM 1077 CA LYS A 72 -7.018 19.827 1.727 1.00 0.00 C ATOM 1078 C LYS A 72 -7.336 18.884 0.572 1.00 0.00 C ATOM 1079 O LYS A 72 -8.385 19.003 -0.066 1.00 0.00 O ATOM 1080 CB LYS A 72 -8.180 19.848 2.723 1.00 0.00 C ATOM 1081 CG LYS A 72 -7.813 20.434 4.077 1.00 0.00 C ATOM 1082 CD LYS A 72 -8.996 21.146 4.714 1.00 0.00 C ATOM 1083 CE LYS A 72 -8.976 22.639 4.421 1.00 0.00 C ATOM 1084 NZ LYS A 72 -9.406 23.443 5.599 1.00 0.00 N ATOM 0 H LYS A 72 -7.521 21.823 1.318 1.00 0.00 H new ATOM 0 HA LYS A 72 -6.126 19.463 2.237 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -9.001 20.425 2.298 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -8.545 18.831 2.864 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -7.467 19.639 4.737 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -6.986 21.134 3.960 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -9.925 20.714 4.341 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.980 20.986 5.792 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -7.970 22.937 4.126 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -9.632 22.852 3.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -9.378 24.454 5.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -10.375 23.177 5.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -8.765 23.260 6.397 1.00 0.00 H new ATOM 1098 N ARG A 73 -6.425 17.951 0.304 1.00 0.00 N ATOM 1099 CA ARG A 73 -6.609 16.989 -0.779 1.00 0.00 C ATOM 1100 C ARG A 73 -6.074 15.611 -0.396 1.00 0.00 C ATOM 1101 O ARG A 73 -5.193 15.491 0.458 1.00 0.00 O ATOM 1102 CB ARG A 73 -5.918 17.482 -2.053 1.00 0.00 C ATOM 1103 CG ARG A 73 -6.847 17.559 -3.256 1.00 0.00 C ATOM 1104 CD ARG A 73 -6.175 17.035 -4.517 1.00 0.00 C ATOM 1105 NE ARG A 73 -5.812 18.114 -5.436 1.00 0.00 N ATOM 1106 CZ ARG A 73 -5.539 17.932 -6.728 1.00 0.00 C ATOM 1107 NH1 ARG A 73 -5.582 16.714 -7.263 1.00 0.00 N ATOM 1108 NH2 ARG A 73 -5.222 18.972 -7.491 1.00 0.00 N ATOM 0 H ARG A 73 -5.553 17.841 0.822 1.00 0.00 H new ATOM 0 HA ARG A 73 -7.679 16.899 -0.964 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -5.493 18.469 -1.868 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -5.087 16.816 -2.287 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -7.750 16.981 -3.057 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -7.158 18.592 -3.411 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -5.280 16.475 -4.245 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -6.845 16.339 -5.022 1.00 0.00 H new ATOM 0 HE ARG A 73 -5.765 19.063 -5.066 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -5.825 15.911 -6.683 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -5.372 16.584 -8.253 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -5.188 19.908 -7.088 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -5.013 18.834 -8.480 1.00 0.00 H new ATOM 1122 N SER A 74 -6.614 14.573 -1.035 1.00 0.00 N ATOM 1123 CA SER A 74 -6.197 13.200 -0.769 1.00 0.00 C ATOM 1124 C SER A 74 -5.319 12.663 -1.898 1.00 0.00 C ATOM 1125 O SER A 74 -5.206 13.280 -2.959 1.00 0.00 O ATOM 1126 CB SER A 74 -7.421 12.296 -0.592 1.00 0.00 C ATOM 1127 OG SER A 74 -8.522 12.757 -1.359 1.00 0.00 O ATOM 0 H SER A 74 -7.344 14.660 -1.743 1.00 0.00 H new ATOM 0 HA SER A 74 -5.614 13.201 0.152 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.169 11.278 -0.890 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.699 12.260 0.461 1.00 0.00 H new ATOM 0 HG SER A 74 -9.287 12.159 -1.226 1.00 0.00 H new ATOM 1133 N LYS A 75 -4.701 11.506 -1.658 1.00 0.00 N ATOM 1134 CA LYS A 75 -3.832 10.871 -2.646 1.00 0.00 C ATOM 1135 C LYS A 75 -3.708 9.373 -2.374 1.00 0.00 C ATOM 1136 O LYS A 75 -3.561 8.952 -1.224 1.00 0.00 O ATOM 1137 CB LYS A 75 -2.448 11.526 -2.639 1.00 0.00 C ATOM 1138 CG LYS A 75 -2.303 12.651 -3.653 1.00 0.00 C ATOM 1139 CD LYS A 75 -1.384 12.259 -4.798 1.00 0.00 C ATOM 1140 CE LYS A 75 -1.810 12.910 -6.105 1.00 0.00 C ATOM 1141 NZ LYS A 75 -0.663 13.546 -6.811 1.00 0.00 N ATOM 0 H LYS A 75 -4.788 10.989 -0.783 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.279 11.007 -3.631 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.245 11.918 -1.642 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.694 10.765 -2.842 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.284 12.914 -4.048 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.910 13.539 -3.158 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -0.361 12.552 -4.561 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.387 11.175 -4.913 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.264 12.160 -6.753 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -2.574 13.661 -5.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.997 13.978 -7.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.245 14.280 -6.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.055 12.825 -7.026 1.00 0.00 H new ATOM 1155 N PHE A 76 -3.778 8.574 -3.437 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.684 7.119 -3.319 1.00 0.00 C ATOM 1157 C PHE A 76 -2.229 6.655 -3.281 1.00 0.00 C ATOM 1158 O PHE A 76 -1.341 7.312 -3.827 1.00 0.00 O ATOM 1159 CB PHE A 76 -4.413 6.440 -4.485 1.00 0.00 C ATOM 1160 CG PHE A 76 -5.818 6.934 -4.696 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -6.852 6.487 -3.890 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -6.102 7.846 -5.701 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -8.144 6.939 -4.082 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -7.392 8.302 -5.897 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.414 7.848 -5.087 1.00 0.00 C ATOM 0 H PHE A 76 -3.900 8.910 -4.392 1.00 0.00 H new ATOM 0 HA PHE A 76 -4.159 6.834 -2.380 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -3.841 6.598 -5.400 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.439 5.365 -4.308 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -6.646 5.777 -3.102 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -5.306 8.204 -6.338 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -8.942 6.582 -3.447 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -7.600 9.013 -6.683 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.423 8.203 -5.239 1.00 0.00 H new ATOM 1175 N ALA A 77 -1.996 5.512 -2.636 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.655 4.947 -2.524 1.00 0.00 C ATOM 1177 C ALA A 77 -0.708 3.425 -2.410 1.00 0.00 C ATOM 1178 O ALA A 77 -1.242 2.885 -1.437 1.00 0.00 O ATOM 1179 CB ALA A 77 0.075 5.541 -1.328 1.00 0.00 C ATOM 0 H ALA A 77 -2.723 4.959 -2.182 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.107 5.201 -3.431 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.073 5.109 -1.260 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.155 6.621 -1.450 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.480 5.319 -0.416 1.00 0.00 H new ATOM 1185 N LEU A 78 -0.149 2.740 -3.406 1.00 0.00 N ATOM 1186 CA LEU A 78 -0.125 1.280 -3.419 1.00 0.00 C ATOM 1187 C LEU A 78 1.234 0.764 -2.955 1.00 0.00 C ATOM 1188 O LEU A 78 2.239 0.918 -3.654 1.00 0.00 O ATOM 1189 CB LEU A 78 -0.436 0.750 -4.822 1.00 0.00 C ATOM 1190 CG LEU A 78 -1.442 -0.401 -4.874 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -1.981 -0.578 -6.285 1.00 0.00 C ATOM 1192 CD2 LEU A 78 -0.802 -1.691 -4.381 1.00 0.00 C ATOM 0 H LEU A 78 0.294 3.174 -4.216 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.890 0.920 -2.731 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.817 1.572 -5.428 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.495 0.419 -5.283 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.277 -0.157 -4.217 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.695 -1.401 -6.301 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.477 0.339 -6.603 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.157 -0.799 -6.964 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.532 -2.499 -4.425 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.051 -1.938 -5.012 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.466 -1.561 -3.352 1.00 0.00 H new ATOM 1204 N ILE A 79 1.259 0.159 -1.771 1.00 0.00 N ATOM 1205 CA ILE A 79 2.497 -0.371 -1.211 1.00 0.00 C ATOM 1206 C ILE A 79 2.547 -1.893 -1.316 1.00 0.00 C ATOM 1207 O ILE A 79 1.637 -2.586 -0.863 1.00 0.00 O ATOM 1208 CB ILE A 79 2.671 0.041 0.267 1.00 0.00 C ATOM 1209 CG1 ILE A 79 2.451 1.549 0.436 1.00 0.00 C ATOM 1210 CG2 ILE A 79 4.052 -0.354 0.769 1.00 0.00 C ATOM 1211 CD1 ILE A 79 1.067 1.910 0.932 1.00 0.00 C ATOM 0 H ILE A 79 0.437 0.024 -1.182 1.00 0.00 H new ATOM 0 HA ILE A 79 3.313 0.054 -1.796 1.00 0.00 H new ATOM 0 HB ILE A 79 1.923 -0.484 0.861 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.191 1.939 1.135 1.00 0.00 H new ATOM 0 HG13 ILE A 79 2.625 2.042 -0.520 1.00 0.00 H new ATOM 0 HG21 ILE A 79 4.159 -0.057 1.812 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.175 -1.434 0.685 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.813 0.145 0.170 1.00 0.00 H new ATOM 0 HD11 ILE A 79 0.986 2.993 1.027 1.00 0.00 H new ATOM 0 HD12 ILE A 79 0.321 1.551 0.223 1.00 0.00 H new ATOM 0 HD13 ILE A 79 0.896 1.447 1.904 1.00 0.00 H new ATOM 1223 N THR A 80 3.624 -2.402 -1.910 1.00 0.00 N ATOM 1224 CA THR A 80 3.810 -3.843 -2.071 1.00 0.00 C ATOM 1225 C THR A 80 4.935 -4.338 -1.164 1.00 0.00 C ATOM 1226 O THR A 80 6.113 -4.079 -1.423 1.00 0.00 O ATOM 1227 CB THR A 80 4.121 -4.194 -3.534 1.00 0.00 C ATOM 1228 OG1 THR A 80 4.698 -3.091 -4.214 1.00 0.00 O ATOM 1229 CG2 THR A 80 2.904 -4.632 -4.321 1.00 0.00 C ATOM 0 H THR A 80 4.383 -1.836 -2.289 1.00 0.00 H new ATOM 0 HA THR A 80 2.882 -4.338 -1.787 1.00 0.00 H new ATOM 0 HB THR A 80 4.819 -5.029 -3.479 1.00 0.00 H new ATOM 0 HG1 THR A 80 4.407 -3.095 -5.150 1.00 0.00 H new ATOM 0 HG21 THR A 80 3.197 -4.864 -5.345 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.471 -5.518 -3.858 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.167 -3.829 -4.328 1.00 0.00 H new ATOM 1237 N TRP A 81 4.566 -5.043 -0.097 1.00 0.00 N ATOM 1238 CA TRP A 81 5.545 -5.567 0.853 1.00 0.00 C ATOM 1239 C TRP A 81 5.976 -6.982 0.479 1.00 0.00 C ATOM 1240 O TRP A 81 5.139 -7.841 0.195 1.00 0.00 O ATOM 1241 CB TRP A 81 4.968 -5.559 2.273 1.00 0.00 C ATOM 1242 CG TRP A 81 5.886 -6.168 3.288 1.00 0.00 C ATOM 1243 CD1 TRP A 81 5.656 -7.283 4.040 1.00 0.00 C ATOM 1244 CD2 TRP A 81 7.186 -5.696 3.656 1.00 0.00 C ATOM 1245 NE1 TRP A 81 6.734 -7.533 4.854 1.00 0.00 N ATOM 1246 CE2 TRP A 81 7.687 -6.571 4.635 1.00 0.00 C ATOM 1247 CE3 TRP A 81 7.974 -4.617 3.248 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 8.943 -6.398 5.216 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 9.217 -4.447 3.824 1.00 0.00 C ATOM 1250 CH2 TRP A 81 9.692 -5.333 4.797 1.00 0.00 C ATOM 0 H TRP A 81 3.597 -5.265 0.132 1.00 0.00 H new ATOM 0 HA TRP A 81 6.422 -4.920 0.817 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.748 -4.532 2.563 1.00 0.00 H new ATOM 0 HB3 TRP A 81 4.022 -6.101 2.277 1.00 0.00 H new ATOM 0 HD1 TRP A 81 4.758 -7.881 4.001 1.00 0.00 H new ATOM 0 HE1 TRP A 81 6.813 -8.307 5.513 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.617 -3.929 2.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 9.311 -7.080 5.969 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.834 -3.615 3.518 1.00 0.00 H new ATOM 0 HH2 TRP A 81 10.670 -5.173 5.226 1.00 0.00 H new ATOM 1261 N ILE A 82 7.287 -7.222 0.492 1.00 0.00 N ATOM 1262 CA ILE A 82 7.823 -8.538 0.163 1.00 0.00 C ATOM 1263 C ILE A 82 8.964 -8.930 1.103 1.00 0.00 C ATOM 1264 O ILE A 82 10.141 -8.746 0.785 1.00 0.00 O ATOM 1265 CB ILE A 82 8.309 -8.618 -1.304 1.00 0.00 C ATOM 1266 CG1 ILE A 82 9.040 -7.336 -1.715 1.00 0.00 C ATOM 1267 CG2 ILE A 82 7.134 -8.881 -2.235 1.00 0.00 C ATOM 1268 CD1 ILE A 82 9.740 -7.449 -3.054 1.00 0.00 C ATOM 0 H ILE A 82 7.993 -6.524 0.726 1.00 0.00 H new ATOM 0 HA ILE A 82 7.001 -9.243 0.291 1.00 0.00 H new ATOM 0 HB ILE A 82 9.013 -9.446 -1.383 1.00 0.00 H new ATOM 0 HG12 ILE A 82 8.324 -6.515 -1.755 1.00 0.00 H new ATOM 0 HG13 ILE A 82 9.773 -7.083 -0.949 1.00 0.00 H new ATOM 0 HG21 ILE A 82 7.490 -8.935 -3.264 1.00 0.00 H new ATOM 0 HG22 ILE A 82 6.660 -9.825 -1.965 1.00 0.00 H new ATOM 0 HG23 ILE A 82 6.409 -8.072 -2.144 1.00 0.00 H new ATOM 0 HD11 ILE A 82 10.238 -6.507 -3.285 1.00 0.00 H new ATOM 0 HD12 ILE A 82 10.479 -8.249 -3.012 1.00 0.00 H new ATOM 0 HD13 ILE A 82 9.008 -7.672 -3.830 1.00 0.00 H new ATOM 1280 N GLY A 83 8.600 -9.490 2.257 1.00 0.00 N ATOM 1281 CA GLY A 83 9.588 -9.929 3.229 1.00 0.00 C ATOM 1282 C GLY A 83 10.532 -10.969 2.650 1.00 0.00 C ATOM 1283 O GLY A 83 10.084 -11.932 2.028 1.00 0.00 O ATOM 0 H GLY A 83 7.632 -9.648 2.536 1.00 0.00 H new ATOM 0 HA2 GLY A 83 10.163 -9.070 3.575 1.00 0.00 H new ATOM 0 HA3 GLY A 83 9.081 -10.345 4.100 1.00 0.00 H new ATOM 1287 N GLU A 84 11.836 -10.743 2.847 1.00 0.00 N ATOM 1288 CA GLU A 84 12.913 -11.613 2.339 1.00 0.00 C ATOM 1289 C GLU A 84 12.551 -13.091 2.213 1.00 0.00 C ATOM 1290 O GLU A 84 13.087 -13.774 1.338 1.00 0.00 O ATOM 1291 CB GLU A 84 14.140 -11.507 3.226 1.00 0.00 C ATOM 1292 CG GLU A 84 14.885 -10.188 3.092 1.00 0.00 C ATOM 1293 CD GLU A 84 15.639 -9.818 4.354 1.00 0.00 C ATOM 1294 OE1 GLU A 84 14.987 -9.650 5.406 1.00 0.00 O ATOM 1295 OE2 GLU A 84 16.881 -9.699 4.292 1.00 0.00 O ATOM 0 H GLU A 84 12.182 -9.939 3.371 1.00 0.00 H new ATOM 0 HA GLU A 84 13.102 -11.246 1.330 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.838 -11.638 4.265 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.821 -12.324 2.987 1.00 0.00 H new ATOM 0 HG2 GLU A 84 15.586 -10.253 2.260 1.00 0.00 H new ATOM 0 HG3 GLU A 84 14.176 -9.396 2.851 1.00 0.00 H new ATOM 1302 N ASN A 85 11.667 -13.605 3.066 1.00 0.00 N ATOM 1303 CA ASN A 85 11.291 -15.015 2.997 1.00 0.00 C ATOM 1304 C ASN A 85 10.350 -15.293 1.824 1.00 0.00 C ATOM 1305 O ASN A 85 9.449 -16.130 1.919 1.00 0.00 O ATOM 1306 CB ASN A 85 10.655 -15.460 4.310 1.00 0.00 C ATOM 1307 CG ASN A 85 11.697 -15.710 5.380 1.00 0.00 C ATOM 1308 OD1 ASN A 85 11.871 -16.837 5.842 1.00 0.00 O ATOM 1309 ND2 ASN A 85 12.396 -14.654 5.782 1.00 0.00 N ATOM 0 H ASN A 85 11.203 -13.074 3.803 1.00 0.00 H new ATOM 0 HA ASN A 85 12.201 -15.592 2.831 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.957 -14.697 4.653 1.00 0.00 H new ATOM 0 HB3 ASN A 85 10.077 -16.369 4.145 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.111 -14.760 6.502 1.00 0.00 H new ATOM 0 HD22 ASN A 85 12.218 -13.738 5.371 1.00 0.00 H new ATOM 1316 N VAL A 86 10.581 -14.603 0.711 1.00 0.00 N ATOM 1317 CA VAL A 86 9.772 -14.788 -0.489 1.00 0.00 C ATOM 1318 C VAL A 86 10.357 -15.902 -1.356 1.00 0.00 C ATOM 1319 O VAL A 86 11.400 -15.725 -1.988 1.00 0.00 O ATOM 1320 CB VAL A 86 9.678 -13.490 -1.326 1.00 0.00 C ATOM 1321 CG1 VAL A 86 8.900 -13.730 -2.613 1.00 0.00 C ATOM 1322 CG2 VAL A 86 9.041 -12.369 -0.518 1.00 0.00 C ATOM 0 H VAL A 86 11.323 -13.910 0.615 1.00 0.00 H new ATOM 0 HA VAL A 86 8.768 -15.059 -0.162 1.00 0.00 H new ATOM 0 HB VAL A 86 10.691 -13.187 -1.591 1.00 0.00 H new ATOM 0 HG11 VAL A 86 8.847 -12.803 -3.184 1.00 0.00 H new ATOM 0 HG12 VAL A 86 9.404 -14.494 -3.206 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.891 -14.065 -2.371 1.00 0.00 H new ATOM 0 HG21 VAL A 86 8.986 -11.467 -1.128 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.036 -12.664 -0.215 1.00 0.00 H new ATOM 0 HG23 VAL A 86 9.644 -12.172 0.368 1.00 0.00 H new ATOM 1332 N SER A 87 9.680 -17.048 -1.380 1.00 0.00 N ATOM 1333 CA SER A 87 10.132 -18.190 -2.170 1.00 0.00 C ATOM 1334 C SER A 87 10.083 -17.870 -3.665 1.00 0.00 C ATOM 1335 O SER A 87 9.462 -16.891 -4.076 1.00 0.00 O ATOM 1336 CB SER A 87 9.271 -19.418 -1.859 1.00 0.00 C ATOM 1337 OG SER A 87 9.791 -20.583 -2.475 1.00 0.00 O ATOM 0 H SER A 87 8.817 -17.210 -0.861 1.00 0.00 H new ATOM 0 HA SER A 87 11.166 -18.407 -1.903 1.00 0.00 H new ATOM 0 HB2 SER A 87 9.222 -19.566 -0.780 1.00 0.00 H new ATOM 0 HB3 SER A 87 8.251 -19.246 -2.204 1.00 0.00 H new ATOM 0 HG SER A 87 9.222 -21.350 -2.257 1.00 0.00 H new ATOM 1343 N GLY A 88 10.745 -18.700 -4.474 1.00 0.00 N ATOM 1344 CA GLY A 88 10.766 -18.486 -5.915 1.00 0.00 C ATOM 1345 C GLY A 88 9.379 -18.303 -6.506 1.00 0.00 C ATOM 1346 O GLY A 88 9.148 -17.374 -7.282 1.00 0.00 O ATOM 0 H GLY A 88 11.267 -19.517 -4.157 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.369 -17.606 -6.138 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.251 -19.335 -6.396 1.00 0.00 H new ATOM 1350 N LEU A 89 8.454 -19.187 -6.133 1.00 0.00 N ATOM 1351 CA LEU A 89 7.081 -19.120 -6.622 1.00 0.00 C ATOM 1352 C LEU A 89 6.413 -17.810 -6.201 1.00 0.00 C ATOM 1353 O LEU A 89 5.719 -17.175 -6.998 1.00 0.00 O ATOM 1354 CB LEU A 89 6.277 -20.316 -6.103 1.00 0.00 C ATOM 1355 CG LEU A 89 6.447 -20.626 -4.611 1.00 0.00 C ATOM 1356 CD1 LEU A 89 5.109 -20.551 -3.892 1.00 0.00 C ATOM 1357 CD2 LEU A 89 7.081 -21.997 -4.416 1.00 0.00 C ATOM 0 H LEU A 89 8.633 -19.960 -5.492 1.00 0.00 H new ATOM 0 HA LEU A 89 7.105 -19.154 -7.711 1.00 0.00 H new ATOM 0 HB2 LEU A 89 5.220 -20.135 -6.301 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.562 -21.199 -6.675 1.00 0.00 H new ATOM 0 HG LEU A 89 7.111 -19.876 -4.181 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.251 -20.774 -2.835 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.694 -19.549 -3.999 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.421 -21.276 -4.327 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.193 -22.198 -3.351 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.444 -22.760 -4.864 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.061 -22.016 -4.894 1.00 0.00 H new ATOM 1369 N GLN A 90 6.634 -17.410 -4.949 1.00 0.00 N ATOM 1370 CA GLN A 90 6.063 -16.173 -4.420 1.00 0.00 C ATOM 1371 C GLN A 90 6.731 -14.946 -5.047 1.00 0.00 C ATOM 1372 O GLN A 90 6.076 -13.929 -5.280 1.00 0.00 O ATOM 1373 CB GLN A 90 6.206 -16.130 -2.895 1.00 0.00 C ATOM 1374 CG GLN A 90 4.955 -16.573 -2.149 1.00 0.00 C ATOM 1375 CD GLN A 90 5.004 -18.030 -1.721 1.00 0.00 C ATOM 1376 OE1 GLN A 90 6.077 -18.587 -1.487 1.00 0.00 O ATOM 1377 NE2 GLN A 90 3.837 -18.657 -1.614 1.00 0.00 N ATOM 0 H GLN A 90 7.206 -17.927 -4.281 1.00 0.00 H new ATOM 0 HA GLN A 90 5.004 -16.153 -4.678 1.00 0.00 H new ATOM 0 HB2 GLN A 90 7.039 -16.767 -2.599 1.00 0.00 H new ATOM 0 HB3 GLN A 90 6.458 -15.114 -2.591 1.00 0.00 H new ATOM 0 HG2 GLN A 90 4.823 -15.945 -1.268 1.00 0.00 H new ATOM 0 HG3 GLN A 90 4.084 -16.416 -2.786 1.00 0.00 H new ATOM 0 HE21 GLN A 90 2.970 -18.159 -1.817 1.00 0.00 H new ATOM 0 HE22 GLN A 90 3.808 -19.636 -1.329 1.00 0.00 H new ATOM 1386 N ARG A 91 8.034 -15.055 -5.321 1.00 0.00 N ATOM 1387 CA ARG A 91 8.797 -13.965 -5.930 1.00 0.00 C ATOM 1388 C ARG A 91 8.172 -13.549 -7.260 1.00 0.00 C ATOM 1389 O ARG A 91 7.858 -12.376 -7.468 1.00 0.00 O ATOM 1390 CB ARG A 91 10.254 -14.392 -6.144 1.00 0.00 C ATOM 1391 CG ARG A 91 11.260 -13.264 -5.973 1.00 0.00 C ATOM 1392 CD ARG A 91 12.478 -13.464 -6.864 1.00 0.00 C ATOM 1393 NE ARG A 91 12.347 -12.761 -8.140 1.00 0.00 N ATOM 1394 CZ ARG A 91 13.288 -12.749 -9.087 1.00 0.00 C ATOM 1395 NH1 ARG A 91 14.430 -13.409 -8.912 1.00 0.00 N ATOM 1396 NH2 ARG A 91 13.085 -12.077 -10.214 1.00 0.00 N ATOM 0 H ARG A 91 8.584 -15.892 -5.129 1.00 0.00 H new ATOM 0 HA ARG A 91 8.775 -13.110 -5.254 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.495 -15.190 -5.442 1.00 0.00 H new ATOM 0 HB3 ARG A 91 10.357 -14.808 -7.146 1.00 0.00 H new ATOM 0 HG2 ARG A 91 10.785 -12.312 -6.212 1.00 0.00 H new ATOM 0 HG3 ARG A 91 11.575 -13.211 -4.931 1.00 0.00 H new ATOM 0 HD2 ARG A 91 13.369 -13.110 -6.345 1.00 0.00 H new ATOM 0 HD3 ARG A 91 12.620 -14.529 -7.050 1.00 0.00 H new ATOM 0 HE ARG A 91 11.483 -12.248 -8.317 1.00 0.00 H new ATOM 0 HH11 ARG A 91 14.591 -13.929 -8.050 1.00 0.00 H new ATOM 0 HH12 ARG A 91 15.144 -13.395 -9.640 1.00 0.00 H new ATOM 0 HH21 ARG A 91 12.211 -11.571 -10.355 1.00 0.00 H new ATOM 0 HH22 ARG A 91 13.803 -12.067 -10.938 1.00 0.00 H new ATOM 1410 N ALA A 92 7.979 -14.524 -8.150 1.00 0.00 N ATOM 1411 CA ALA A 92 7.373 -14.265 -9.454 1.00 0.00 C ATOM 1412 C ALA A 92 5.923 -13.813 -9.292 1.00 0.00 C ATOM 1413 O ALA A 92 5.418 -13.016 -10.087 1.00 0.00 O ATOM 1414 CB ALA A 92 7.451 -15.507 -10.331 1.00 0.00 C ATOM 0 H ALA A 92 8.234 -15.499 -7.990 1.00 0.00 H new ATOM 0 HA ALA A 92 7.929 -13.463 -9.940 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.995 -15.298 -11.299 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.495 -15.787 -10.474 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.919 -16.327 -9.849 1.00 0.00 H new ATOM 1420 N LYS A 93 5.263 -14.322 -8.249 1.00 0.00 N ATOM 1421 CA LYS A 93 3.875 -13.973 -7.964 1.00 0.00 C ATOM 1422 C LYS A 93 3.727 -12.473 -7.701 1.00 0.00 C ATOM 1423 O LYS A 93 2.729 -11.871 -8.092 1.00 0.00 O ATOM 1424 CB LYS A 93 3.365 -14.771 -6.760 1.00 0.00 C ATOM 1425 CG LYS A 93 1.853 -14.930 -6.727 1.00 0.00 C ATOM 1426 CD LYS A 93 1.434 -16.141 -5.903 1.00 0.00 C ATOM 1427 CE LYS A 93 0.918 -17.271 -6.784 1.00 0.00 C ATOM 1428 NZ LYS A 93 -0.150 -18.067 -6.114 1.00 0.00 N ATOM 0 H LYS A 93 5.673 -14.980 -7.586 1.00 0.00 H new ATOM 0 HA LYS A 93 3.277 -14.226 -8.839 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.825 -15.759 -6.769 1.00 0.00 H new ATOM 0 HB3 LYS A 93 3.689 -14.277 -5.844 1.00 0.00 H new ATOM 0 HG2 LYS A 93 1.401 -14.031 -6.309 1.00 0.00 H new ATOM 0 HG3 LYS A 93 1.475 -15.033 -7.744 1.00 0.00 H new ATOM 0 HD2 LYS A 93 2.283 -16.494 -5.318 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.659 -15.849 -5.195 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.529 -16.856 -7.714 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.746 -17.929 -7.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -0.470 -18.824 -6.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.226 -18.486 -5.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -0.952 -17.447 -5.883 1.00 0.00 H new ATOM 1442 N THR A 94 4.723 -11.874 -7.039 1.00 0.00 N ATOM 1443 CA THR A 94 4.692 -10.444 -6.729 1.00 0.00 C ATOM 1444 C THR A 94 4.503 -9.612 -7.998 1.00 0.00 C ATOM 1445 O THR A 94 3.602 -8.775 -8.067 1.00 0.00 O ATOM 1446 CB THR A 94 5.977 -10.025 -6.008 1.00 0.00 C ATOM 1447 OG1 THR A 94 6.314 -10.964 -4.999 1.00 0.00 O ATOM 1448 CG2 THR A 94 5.884 -8.663 -5.353 1.00 0.00 C ATOM 0 H THR A 94 5.558 -12.358 -6.709 1.00 0.00 H new ATOM 0 HA THR A 94 3.843 -10.260 -6.071 1.00 0.00 H new ATOM 0 HB THR A 94 6.741 -9.984 -6.784 1.00 0.00 H new ATOM 0 HG1 THR A 94 7.138 -10.681 -4.551 1.00 0.00 H new ATOM 0 HG21 THR A 94 6.829 -8.430 -4.861 1.00 0.00 H new ATOM 0 HG22 THR A 94 5.674 -7.908 -6.111 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.082 -8.668 -4.615 1.00 0.00 H new ATOM 1456 N GLY A 95 5.348 -9.855 -9.001 1.00 0.00 N ATOM 1457 CA GLY A 95 5.243 -9.125 -10.255 1.00 0.00 C ATOM 1458 C GLY A 95 3.912 -9.358 -10.949 1.00 0.00 C ATOM 1459 O GLY A 95 3.287 -8.414 -11.436 1.00 0.00 O ATOM 0 H GLY A 95 6.101 -10.542 -8.967 1.00 0.00 H new ATOM 0 HA2 GLY A 95 5.369 -8.059 -10.064 1.00 0.00 H new ATOM 0 HA3 GLY A 95 6.054 -9.428 -10.918 1.00 0.00 H new ATOM 1463 N THR A 96 3.475 -10.617 -10.982 1.00 0.00 N ATOM 1464 CA THR A 96 2.205 -10.979 -11.608 1.00 0.00 C ATOM 1465 C THR A 96 1.036 -10.318 -10.877 1.00 0.00 C ATOM 1466 O THR A 96 0.154 -9.727 -11.503 1.00 0.00 O ATOM 1467 CB THR A 96 2.031 -12.502 -11.611 1.00 0.00 C ATOM 1468 OG1 THR A 96 3.221 -13.142 -12.040 1.00 0.00 O ATOM 1469 CG2 THR A 96 0.907 -12.979 -12.505 1.00 0.00 C ATOM 0 H THR A 96 3.984 -11.405 -10.581 1.00 0.00 H new ATOM 0 HA THR A 96 2.215 -10.622 -12.638 1.00 0.00 H new ATOM 0 HB THR A 96 1.788 -12.764 -10.581 1.00 0.00 H new ATOM 0 HG1 THR A 96 3.850 -13.200 -11.290 1.00 0.00 H new ATOM 0 HG21 THR A 96 0.841 -14.066 -12.458 1.00 0.00 H new ATOM 0 HG22 THR A 96 -0.034 -12.544 -12.170 1.00 0.00 H new ATOM 0 HG23 THR A 96 1.103 -12.671 -13.532 1.00 0.00 H new ATOM 1477 N ASP A 97 1.044 -10.418 -9.547 1.00 0.00 N ATOM 1478 CA ASP A 97 -0.008 -9.831 -8.718 1.00 0.00 C ATOM 1479 C ASP A 97 -0.079 -8.316 -8.903 1.00 0.00 C ATOM 1480 O ASP A 97 -1.168 -7.739 -8.916 1.00 0.00 O ATOM 1481 CB ASP A 97 0.232 -10.162 -7.240 1.00 0.00 C ATOM 1482 CG ASP A 97 -0.296 -11.532 -6.849 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -0.141 -12.484 -7.644 1.00 0.00 O ATOM 1484 OD2 ASP A 97 -0.858 -11.654 -5.740 1.00 0.00 O ATOM 0 H ASP A 97 1.771 -10.902 -9.020 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.959 -10.260 -9.034 1.00 0.00 H new ATOM 0 HB2 ASP A 97 1.301 -10.117 -7.031 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -0.246 -9.403 -6.620 1.00 0.00 H new ATOM 1489 N LYS A 98 1.085 -7.679 -9.055 1.00 0.00 N ATOM 1490 CA LYS A 98 1.152 -6.233 -9.248 1.00 0.00 C ATOM 1491 C LYS A 98 0.382 -5.818 -10.499 1.00 0.00 C ATOM 1492 O LYS A 98 -0.198 -4.731 -10.546 1.00 0.00 O ATOM 1493 CB LYS A 98 2.611 -5.780 -9.353 1.00 0.00 C ATOM 1494 CG LYS A 98 2.909 -4.485 -8.610 1.00 0.00 C ATOM 1495 CD LYS A 98 2.401 -3.270 -9.374 1.00 0.00 C ATOM 1496 CE LYS A 98 1.540 -2.373 -8.495 1.00 0.00 C ATOM 1497 NZ LYS A 98 0.085 -2.667 -8.645 1.00 0.00 N ATOM 0 H LYS A 98 1.993 -8.144 -9.048 1.00 0.00 H new ATOM 0 HA LYS A 98 0.693 -5.751 -8.385 1.00 0.00 H new ATOM 0 HB2 LYS A 98 3.255 -6.568 -8.963 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.867 -5.651 -10.405 1.00 0.00 H new ATOM 0 HG2 LYS A 98 2.445 -4.516 -7.624 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.984 -4.394 -8.454 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.248 -2.700 -9.757 1.00 0.00 H new ATOM 0 HD3 LYS A 98 1.822 -3.599 -10.237 1.00 0.00 H new ATOM 0 HE2 LYS A 98 1.830 -2.503 -7.452 1.00 0.00 H new ATOM 0 HE3 LYS A 98 1.726 -1.330 -8.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -0.408 -1.816 -8.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -0.044 -3.438 -9.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -0.308 -2.952 -7.725 1.00 0.00 H new ATOM 1511 N THR A 99 0.371 -6.697 -11.503 1.00 0.00 N ATOM 1512 CA THR A 99 -0.338 -6.434 -12.752 1.00 0.00 C ATOM 1513 C THR A 99 -1.848 -6.528 -12.539 1.00 0.00 C ATOM 1514 O THR A 99 -2.608 -5.706 -13.054 1.00 0.00 O ATOM 1515 CB THR A 99 0.108 -7.425 -13.835 1.00 0.00 C ATOM 1516 OG1 THR A 99 1.521 -7.437 -13.950 1.00 0.00 O ATOM 1517 CG2 THR A 99 -0.458 -7.118 -15.206 1.00 0.00 C ATOM 0 H THR A 99 0.847 -7.599 -11.473 1.00 0.00 H new ATOM 0 HA THR A 99 -0.097 -5.423 -13.081 1.00 0.00 H new ATOM 0 HB THR A 99 -0.275 -8.393 -13.512 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.910 -7.858 -13.155 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.101 -7.859 -15.921 1.00 0.00 H new ATOM 0 HG22 THR A 99 -1.547 -7.148 -15.165 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.134 -6.126 -15.519 1.00 0.00 H new ATOM 1525 N LEU A 100 -2.273 -7.533 -11.767 1.00 0.00 N ATOM 1526 CA LEU A 100 -3.686 -7.738 -11.469 1.00 0.00 C ATOM 1527 C LEU A 100 -4.270 -6.521 -10.752 1.00 0.00 C ATOM 1528 O LEU A 100 -5.311 -5.995 -11.150 1.00 0.00 O ATOM 1529 CB LEU A 100 -3.866 -8.989 -10.602 1.00 0.00 C ATOM 1530 CG LEU A 100 -3.195 -10.264 -11.129 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -3.302 -11.386 -10.109 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -3.814 -10.695 -12.450 1.00 0.00 C ATOM 0 H LEU A 100 -1.652 -8.218 -11.337 1.00 0.00 H new ATOM 0 HA LEU A 100 -4.218 -7.875 -12.410 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.474 -8.779 -9.607 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.933 -9.181 -10.490 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.141 -10.045 -11.297 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.820 -12.282 -10.501 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.810 -11.085 -9.184 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -4.353 -11.597 -9.909 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.322 -11.601 -12.804 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.877 -10.891 -12.307 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.688 -9.902 -13.187 1.00 0.00 H new ATOM 1544 N VAL A 101 -3.585 -6.078 -9.696 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.021 -4.919 -8.917 1.00 0.00 C ATOM 1546 C VAL A 101 -3.991 -3.647 -9.764 1.00 0.00 C ATOM 1547 O VAL A 101 -4.861 -2.784 -9.630 1.00 0.00 O ATOM 1548 CB VAL A 101 -3.138 -4.719 -7.665 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -3.691 -3.614 -6.778 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -3.015 -6.020 -6.885 1.00 0.00 C ATOM 0 H VAL A 101 -2.723 -6.507 -9.360 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.045 -5.114 -8.599 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.144 -4.419 -7.997 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.051 -3.494 -5.904 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -3.720 -2.679 -7.337 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.699 -3.876 -6.456 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.390 -5.860 -6.007 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.005 -6.351 -6.570 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.562 -6.783 -7.519 1.00 0.00 H new ATOM 1560 N LYS A 102 -2.988 -3.545 -10.639 1.00 0.00 N ATOM 1561 CA LYS A 102 -2.840 -2.386 -11.519 1.00 0.00 C ATOM 1562 C LYS A 102 -4.119 -2.140 -12.319 1.00 0.00 C ATOM 1563 O LYS A 102 -4.580 -1.003 -12.430 1.00 0.00 O ATOM 1564 CB LYS A 102 -1.659 -2.595 -12.472 1.00 0.00 C ATOM 1565 CG LYS A 102 -0.928 -1.313 -12.835 1.00 0.00 C ATOM 1566 CD LYS A 102 -1.627 -0.578 -13.967 1.00 0.00 C ATOM 1567 CE LYS A 102 -0.639 0.196 -14.825 1.00 0.00 C ATOM 1568 NZ LYS A 102 -1.220 0.568 -16.146 1.00 0.00 N ATOM 0 H LYS A 102 -2.264 -4.254 -10.756 1.00 0.00 H new ATOM 0 HA LYS A 102 -2.650 -1.510 -10.899 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.953 -3.287 -12.014 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.021 -3.067 -13.386 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -0.869 -0.666 -11.960 1.00 0.00 H new ATOM 0 HG3 LYS A 102 0.096 -1.546 -13.128 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.167 -1.293 -14.588 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.367 0.108 -13.554 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -0.330 1.098 -14.298 1.00 0.00 H new ATOM 0 HE3 LYS A 102 0.257 -0.406 -14.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -0.514 1.094 -16.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -1.492 -0.294 -16.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -2.060 1.164 -16.000 1.00 0.00 H new ATOM 1582 N GLU A 103 -4.692 -3.213 -12.866 1.00 0.00 N ATOM 1583 CA GLU A 103 -5.924 -3.110 -13.644 1.00 0.00 C ATOM 1584 C GLU A 103 -7.116 -2.816 -12.734 1.00 0.00 C ATOM 1585 O GLU A 103 -8.000 -2.037 -13.094 1.00 0.00 O ATOM 1586 CB GLU A 103 -6.166 -4.398 -14.438 1.00 0.00 C ATOM 1587 CG GLU A 103 -5.643 -4.337 -15.866 1.00 0.00 C ATOM 1588 CD GLU A 103 -4.127 -4.288 -15.934 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -3.564 -3.173 -15.873 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -3.501 -5.363 -16.048 1.00 0.00 O ATOM 0 H GLU A 103 -4.323 -4.160 -12.784 1.00 0.00 H new ATOM 0 HA GLU A 103 -5.815 -2.283 -14.346 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -5.689 -5.230 -13.920 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -7.236 -4.607 -14.460 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -5.999 -5.208 -16.416 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -6.053 -3.457 -16.361 1.00 0.00 H new ATOM 1597 N VAL A 104 -7.127 -3.436 -11.549 1.00 0.00 N ATOM 1598 CA VAL A 104 -8.204 -3.232 -10.580 1.00 0.00 C ATOM 1599 C VAL A 104 -8.315 -1.756 -10.194 1.00 0.00 C ATOM 1600 O VAL A 104 -9.412 -1.196 -10.161 1.00 0.00 O ATOM 1601 CB VAL A 104 -7.991 -4.079 -9.303 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -9.141 -3.887 -8.323 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -7.829 -5.552 -9.653 1.00 0.00 C ATOM 0 H VAL A 104 -6.401 -4.083 -11.240 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.129 -3.553 -11.059 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.074 -3.736 -8.823 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -8.967 -4.493 -7.434 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -9.205 -2.837 -8.039 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -10.075 -4.193 -8.794 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -7.680 -6.129 -8.740 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -8.725 -5.905 -10.164 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.966 -5.678 -10.306 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.170 -1.131 -9.910 1.00 0.00 N ATOM 1614 CA VAL A 105 -7.136 0.281 -9.537 1.00 0.00 C ATOM 1615 C VAL A 105 -6.826 1.150 -10.753 1.00 0.00 C ATOM 1616 O VAL A 105 -5.664 1.335 -11.118 1.00 0.00 O ATOM 1617 CB VAL A 105 -6.091 0.557 -8.434 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -6.162 2.009 -7.977 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -6.290 -0.388 -7.257 1.00 0.00 C ATOM 0 H VAL A 105 -6.255 -1.582 -9.932 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.123 0.533 -9.148 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.100 0.379 -8.850 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -5.418 2.183 -7.200 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -5.963 2.667 -8.823 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -7.156 2.218 -7.581 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -5.544 -0.177 -6.491 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -7.287 -0.246 -6.841 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -6.181 -1.418 -7.595 1.00 0.00 H new ATOM 1629 N GLN A 106 -7.877 1.678 -11.378 1.00 0.00 N ATOM 1630 CA GLN A 106 -7.725 2.526 -12.560 1.00 0.00 C ATOM 1631 C GLN A 106 -7.285 3.940 -12.180 1.00 0.00 C ATOM 1632 O GLN A 106 -6.550 4.588 -12.927 1.00 0.00 O ATOM 1633 CB GLN A 106 -9.039 2.580 -13.343 1.00 0.00 C ATOM 1634 CG GLN A 106 -9.475 1.231 -13.894 1.00 0.00 C ATOM 1635 CD GLN A 106 -9.280 1.124 -15.395 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -10.003 1.749 -16.171 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -8.297 0.333 -15.812 1.00 0.00 N ATOM 0 H GLN A 106 -8.844 1.534 -11.086 1.00 0.00 H new ATOM 0 HA GLN A 106 -6.949 2.088 -13.187 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -9.824 2.969 -12.694 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -8.931 3.283 -14.169 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -8.909 0.441 -13.400 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -10.526 1.067 -13.655 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -7.722 -0.167 -15.134 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -8.118 0.225 -16.810 1.00 0.00 H new ATOM 1646 N ASN A 107 -7.737 4.414 -11.018 1.00 0.00 N ATOM 1647 CA ASN A 107 -7.389 5.750 -10.546 1.00 0.00 C ATOM 1648 C ASN A 107 -6.471 5.673 -9.327 1.00 0.00 C ATOM 1649 O ASN A 107 -6.935 5.523 -8.196 1.00 0.00 O ATOM 1650 CB ASN A 107 -8.656 6.542 -10.206 1.00 0.00 C ATOM 1651 CG ASN A 107 -9.591 6.681 -11.395 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -10.676 6.099 -11.416 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -9.176 7.454 -12.395 1.00 0.00 N ATOM 0 H ASN A 107 -8.345 3.890 -10.388 1.00 0.00 H new ATOM 0 HA ASN A 107 -6.856 6.265 -11.345 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.182 6.047 -9.390 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.376 7.533 -9.850 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -9.764 7.582 -13.219 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -8.270 7.919 -12.338 1.00 0.00 H new ATOM 1660 N PHE A 108 -5.165 5.773 -9.570 1.00 0.00 N ATOM 1661 CA PHE A 108 -4.173 5.713 -8.496 1.00 0.00 C ATOM 1662 C PHE A 108 -3.249 6.931 -8.531 1.00 0.00 C ATOM 1663 O PHE A 108 -3.370 7.789 -9.408 1.00 0.00 O ATOM 1664 CB PHE A 108 -3.350 4.422 -8.603 1.00 0.00 C ATOM 1665 CG PHE A 108 -2.624 4.265 -9.912 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -1.469 4.985 -10.173 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -3.098 3.394 -10.881 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -0.800 4.838 -11.373 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -2.434 3.243 -12.083 1.00 0.00 C ATOM 1670 CZ PHE A 108 -1.283 3.967 -12.329 1.00 0.00 C ATOM 0 H PHE A 108 -4.768 5.896 -10.502 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.705 5.717 -7.545 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.623 4.398 -7.791 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.013 3.568 -8.462 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -1.087 5.669 -9.430 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -3.998 2.826 -10.694 1.00 0.00 H new ATOM 0 HE1 PHE A 108 0.100 5.404 -11.563 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -2.814 2.560 -12.829 1.00 0.00 H new ATOM 0 HZ PHE A 108 -0.762 3.852 -13.268 1.00 0.00 H new ATOM 1680 N ALA A 109 -2.324 6.998 -7.573 1.00 0.00 N ATOM 1681 CA ALA A 109 -1.377 8.108 -7.498 1.00 0.00 C ATOM 1682 C ALA A 109 0.064 7.611 -7.578 1.00 0.00 C ATOM 1683 O ALA A 109 0.835 8.063 -8.426 1.00 0.00 O ATOM 1684 CB ALA A 109 -1.591 8.909 -6.221 1.00 0.00 C ATOM 0 H ALA A 109 -2.211 6.298 -6.840 1.00 0.00 H new ATOM 0 HA ALA A 109 -1.558 8.759 -8.353 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.876 9.731 -6.183 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.605 9.309 -6.208 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -1.445 8.261 -5.357 1.00 0.00 H new ATOM 1690 N LYS A 110 0.425 6.685 -6.689 1.00 0.00 N ATOM 1691 CA LYS A 110 1.778 6.139 -6.662 1.00 0.00 C ATOM 1692 C LYS A 110 1.792 4.708 -6.131 1.00 0.00 C ATOM 1693 O LYS A 110 1.199 4.415 -5.092 1.00 0.00 O ATOM 1694 CB LYS A 110 2.683 7.019 -5.798 1.00 0.00 C ATOM 1695 CG LYS A 110 3.406 8.105 -6.579 1.00 0.00 C ATOM 1696 CD LYS A 110 4.816 8.319 -6.054 1.00 0.00 C ATOM 1697 CE LYS A 110 5.415 9.615 -6.576 1.00 0.00 C ATOM 1698 NZ LYS A 110 6.355 9.379 -7.708 1.00 0.00 N ATOM 0 H LYS A 110 -0.200 6.300 -5.981 1.00 0.00 H new ATOM 0 HA LYS A 110 2.152 6.125 -7.686 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.083 7.484 -5.016 1.00 0.00 H new ATOM 0 HB3 LYS A 110 3.421 6.389 -5.301 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.446 7.832 -7.633 1.00 0.00 H new ATOM 0 HG3 LYS A 110 2.846 9.038 -6.513 1.00 0.00 H new ATOM 0 HD2 LYS A 110 4.801 8.337 -4.964 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.447 7.481 -6.350 1.00 0.00 H new ATOM 0 HE2 LYS A 110 4.614 10.279 -6.902 1.00 0.00 H new ATOM 0 HE3 LYS A 110 5.941 10.123 -5.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 6.741 10.288 -8.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 7.133 8.766 -7.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 5.848 8.918 -8.490 1.00 0.00 H new ATOM 1712 N GLU A 111 2.485 3.825 -6.848 1.00 0.00 N ATOM 1713 CA GLU A 111 2.594 2.424 -6.453 1.00 0.00 C ATOM 1714 C GLU A 111 4.028 1.931 -6.622 1.00 0.00 C ATOM 1715 O GLU A 111 4.607 2.044 -7.704 1.00 0.00 O ATOM 1716 CB GLU A 111 1.636 1.552 -7.273 1.00 0.00 C ATOM 1717 CG GLU A 111 1.607 1.888 -8.757 1.00 0.00 C ATOM 1718 CD GLU A 111 0.791 0.896 -9.567 1.00 0.00 C ATOM 1719 OE1 GLU A 111 -0.406 0.711 -9.255 1.00 0.00 O ATOM 1720 OE2 GLU A 111 1.349 0.299 -10.512 1.00 0.00 O ATOM 0 H GLU A 111 2.981 4.057 -7.709 1.00 0.00 H new ATOM 0 HA GLU A 111 2.318 2.346 -5.401 1.00 0.00 H new ATOM 0 HB2 GLU A 111 1.921 0.507 -7.154 1.00 0.00 H new ATOM 0 HB3 GLU A 111 0.629 1.657 -6.868 1.00 0.00 H new ATOM 0 HG2 GLU A 111 1.193 2.887 -8.891 1.00 0.00 H new ATOM 0 HG3 GLU A 111 2.627 1.911 -9.140 1.00 0.00 H new ATOM 1727 N PHE A 112 4.599 1.391 -5.548 1.00 0.00 N ATOM 1728 CA PHE A 112 5.970 0.887 -5.583 1.00 0.00 C ATOM 1729 C PHE A 112 6.178 -0.235 -4.569 1.00 0.00 C ATOM 1730 O PHE A 112 5.394 -0.397 -3.631 1.00 0.00 O ATOM 1731 CB PHE A 112 6.972 2.018 -5.322 1.00 0.00 C ATOM 1732 CG PHE A 112 6.612 2.904 -4.160 1.00 0.00 C ATOM 1733 CD1 PHE A 112 5.757 3.981 -4.334 1.00 0.00 C ATOM 1734 CD2 PHE A 112 7.132 2.662 -2.898 1.00 0.00 C ATOM 1735 CE1 PHE A 112 5.427 4.799 -3.271 1.00 0.00 C ATOM 1736 CE2 PHE A 112 6.805 3.477 -1.831 1.00 0.00 C ATOM 1737 CZ PHE A 112 5.951 4.547 -2.018 1.00 0.00 C ATOM 0 H PHE A 112 4.135 1.291 -4.645 1.00 0.00 H new ATOM 0 HA PHE A 112 6.143 0.483 -6.581 1.00 0.00 H new ATOM 0 HB2 PHE A 112 7.955 1.583 -5.142 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.054 2.630 -6.220 1.00 0.00 H new ATOM 0 HD1 PHE A 112 5.344 4.183 -5.311 1.00 0.00 H new ATOM 0 HD2 PHE A 112 7.800 1.827 -2.747 1.00 0.00 H new ATOM 0 HE1 PHE A 112 4.760 5.635 -3.419 1.00 0.00 H new ATOM 0 HE2 PHE A 112 7.216 3.278 -0.852 1.00 0.00 H new ATOM 0 HZ PHE A 112 5.694 5.185 -1.186 1.00 0.00 H new ATOM 1747 N VAL A 113 7.247 -1.003 -4.769 1.00 0.00 N ATOM 1748 CA VAL A 113 7.578 -2.113 -3.882 1.00 0.00 C ATOM 1749 C VAL A 113 8.549 -1.665 -2.793 1.00 0.00 C ATOM 1750 O VAL A 113 9.366 -0.769 -3.009 1.00 0.00 O ATOM 1751 CB VAL A 113 8.200 -3.294 -4.661 1.00 0.00 C ATOM 1752 CG1 VAL A 113 8.373 -4.507 -3.758 1.00 0.00 C ATOM 1753 CG2 VAL A 113 7.350 -3.645 -5.876 1.00 0.00 C ATOM 0 H VAL A 113 7.901 -0.875 -5.542 1.00 0.00 H new ATOM 0 HA VAL A 113 6.646 -2.446 -3.425 1.00 0.00 H new ATOM 0 HB VAL A 113 9.186 -2.988 -5.010 1.00 0.00 H new ATOM 0 HG11 VAL A 113 8.812 -5.325 -4.328 1.00 0.00 H new ATOM 0 HG12 VAL A 113 9.029 -4.251 -2.926 1.00 0.00 H new ATOM 0 HG13 VAL A 113 7.401 -4.815 -3.372 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.806 -4.479 -6.410 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.349 -3.927 -5.550 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.287 -2.781 -6.538 1.00 0.00 H new ATOM 1763 N ILE A 114 8.453 -2.295 -1.625 1.00 0.00 N ATOM 1764 CA ILE A 114 9.324 -1.964 -0.501 1.00 0.00 C ATOM 1765 C ILE A 114 9.814 -3.232 0.194 1.00 0.00 C ATOM 1766 O ILE A 114 9.056 -4.190 0.358 1.00 0.00 O ATOM 1767 CB ILE A 114 8.604 -1.064 0.530 1.00 0.00 C ATOM 1768 CG1 ILE A 114 7.961 0.140 -0.164 1.00 0.00 C ATOM 1769 CG2 ILE A 114 9.574 -0.598 1.608 1.00 0.00 C ATOM 1770 CD1 ILE A 114 7.036 0.937 0.732 1.00 0.00 C ATOM 0 H ILE A 114 7.781 -3.038 -1.432 1.00 0.00 H new ATOM 0 HA ILE A 114 10.176 -1.418 -0.906 1.00 0.00 H new ATOM 0 HB ILE A 114 7.818 -1.652 1.005 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.748 0.797 -0.535 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.401 -0.208 -1.032 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.047 0.034 2.323 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.987 -1.464 2.125 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.383 -0.030 1.149 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.618 1.773 0.172 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.228 0.296 1.083 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.595 1.317 1.587 1.00 0.00 H new ATOM 1782 N SER A 115 11.082 -3.232 0.604 1.00 0.00 N ATOM 1783 CA SER A 115 11.667 -4.385 1.289 1.00 0.00 C ATOM 1784 C SER A 115 12.343 -3.971 2.601 1.00 0.00 C ATOM 1785 O SER A 115 13.226 -4.670 3.102 1.00 0.00 O ATOM 1786 CB SER A 115 12.667 -5.103 0.376 1.00 0.00 C ATOM 1787 OG SER A 115 13.591 -4.193 -0.199 1.00 0.00 O ATOM 0 H SER A 115 11.723 -2.449 0.474 1.00 0.00 H new ATOM 0 HA SER A 115 10.857 -5.073 1.532 1.00 0.00 H new ATOM 0 HB2 SER A 115 13.206 -5.858 0.948 1.00 0.00 H new ATOM 0 HB3 SER A 115 12.129 -5.626 -0.415 1.00 0.00 H new ATOM 0 HG SER A 115 14.216 -4.681 -0.774 1.00 0.00 H new ATOM 1793 N ASP A 116 11.911 -2.835 3.158 1.00 0.00 N ATOM 1794 CA ASP A 116 12.457 -2.325 4.415 1.00 0.00 C ATOM 1795 C ASP A 116 11.362 -1.665 5.251 1.00 0.00 C ATOM 1796 O ASP A 116 10.524 -0.930 4.724 1.00 0.00 O ATOM 1797 CB ASP A 116 13.583 -1.325 4.140 1.00 0.00 C ATOM 1798 CG ASP A 116 14.259 -0.850 5.411 1.00 0.00 C ATOM 1799 OD1 ASP A 116 14.913 -1.677 6.083 1.00 0.00 O ATOM 1800 OD2 ASP A 116 14.129 0.347 5.738 1.00 0.00 O ATOM 0 H ASP A 116 11.180 -2.250 2.753 1.00 0.00 H new ATOM 0 HA ASP A 116 12.862 -3.166 4.977 1.00 0.00 H new ATOM 0 HB2 ASP A 116 14.325 -1.787 3.489 1.00 0.00 H new ATOM 0 HB3 ASP A 116 13.179 -0.466 3.604 1.00 0.00 H new ATOM 1805 N ARG A 117 11.374 -1.932 6.558 1.00 0.00 N ATOM 1806 CA ARG A 117 10.382 -1.366 7.472 1.00 0.00 C ATOM 1807 C ARG A 117 10.458 0.161 7.499 1.00 0.00 C ATOM 1808 O ARG A 117 9.432 0.841 7.581 1.00 0.00 O ATOM 1809 CB ARG A 117 10.576 -1.930 8.882 1.00 0.00 C ATOM 1810 CG ARG A 117 9.304 -1.934 9.717 1.00 0.00 C ATOM 1811 CD ARG A 117 9.183 -3.203 10.549 1.00 0.00 C ATOM 1812 NE ARG A 117 10.064 -3.179 11.716 1.00 0.00 N ATOM 1813 CZ ARG A 117 9.990 -4.046 12.728 1.00 0.00 C ATOM 1814 NH1 ARG A 117 9.083 -5.019 12.720 1.00 0.00 N ATOM 1815 NH2 ARG A 117 10.829 -3.940 13.751 1.00 0.00 N ATOM 0 H ARG A 117 12.061 -2.538 7.007 1.00 0.00 H new ATOM 0 HA ARG A 117 9.394 -1.647 7.109 1.00 0.00 H new ATOM 0 HB2 ARG A 117 10.955 -2.949 8.808 1.00 0.00 H new ATOM 0 HB3 ARG A 117 11.337 -1.344 9.397 1.00 0.00 H new ATOM 0 HG2 ARG A 117 9.297 -1.065 10.375 1.00 0.00 H new ATOM 0 HG3 ARG A 117 8.438 -1.844 9.062 1.00 0.00 H new ATOM 0 HD2 ARG A 117 8.151 -3.325 10.877 1.00 0.00 H new ATOM 0 HD3 ARG A 117 9.425 -4.067 9.930 1.00 0.00 H new ATOM 0 HE ARG A 117 10.780 -2.454 11.759 1.00 0.00 H new ATOM 0 HH11 ARG A 117 8.437 -5.107 11.936 1.00 0.00 H new ATOM 0 HH12 ARG A 117 9.034 -5.677 13.498 1.00 0.00 H new ATOM 0 HH21 ARG A 117 11.528 -3.197 13.762 1.00 0.00 H new ATOM 0 HH22 ARG A 117 10.775 -4.601 14.526 1.00 0.00 H new ATOM 1829 N LYS A 118 11.676 0.696 7.414 1.00 0.00 N ATOM 1830 CA LYS A 118 11.877 2.142 7.414 1.00 0.00 C ATOM 1831 C LYS A 118 11.383 2.749 6.100 1.00 0.00 C ATOM 1832 O LYS A 118 10.870 3.869 6.079 1.00 0.00 O ATOM 1833 CB LYS A 118 13.356 2.482 7.635 1.00 0.00 C ATOM 1834 CG LYS A 118 13.580 3.671 8.558 1.00 0.00 C ATOM 1835 CD LYS A 118 13.888 4.934 7.771 1.00 0.00 C ATOM 1836 CE LYS A 118 13.765 6.178 8.636 1.00 0.00 C ATOM 1837 NZ LYS A 118 14.020 7.424 7.858 1.00 0.00 N ATOM 0 H LYS A 118 12.535 0.150 7.345 1.00 0.00 H new ATOM 0 HA LYS A 118 11.299 2.568 8.234 1.00 0.00 H new ATOM 0 HB2 LYS A 118 13.862 1.610 8.051 1.00 0.00 H new ATOM 0 HB3 LYS A 118 13.820 2.690 6.671 1.00 0.00 H new ATOM 0 HG2 LYS A 118 12.693 3.830 9.171 1.00 0.00 H new ATOM 0 HG3 LYS A 118 14.403 3.455 9.239 1.00 0.00 H new ATOM 0 HD2 LYS A 118 14.897 4.872 7.364 1.00 0.00 H new ATOM 0 HD3 LYS A 118 13.206 5.011 6.924 1.00 0.00 H new ATOM 0 HE2 LYS A 118 12.767 6.220 9.072 1.00 0.00 H new ATOM 0 HE3 LYS A 118 14.472 6.116 9.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 13.360 8.167 8.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 14.997 7.740 8.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 13.880 7.235 6.845 1.00 0.00 H new ATOM 1851 N GLU A 119 11.529 1.992 5.010 1.00 0.00 N ATOM 1852 CA GLU A 119 11.088 2.441 3.692 1.00 0.00 C ATOM 1853 C GLU A 119 9.569 2.325 3.551 1.00 0.00 C ATOM 1854 O GLU A 119 8.944 3.110 2.839 1.00 0.00 O ATOM 1855 CB GLU A 119 11.779 1.630 2.591 1.00 0.00 C ATOM 1856 CG GLU A 119 13.249 1.972 2.415 1.00 0.00 C ATOM 1857 CD GLU A 119 13.698 1.870 0.971 1.00 0.00 C ATOM 1858 OE1 GLU A 119 13.826 0.733 0.468 1.00 0.00 O ATOM 1859 OE2 GLU A 119 13.916 2.926 0.341 1.00 0.00 O ATOM 0 H GLU A 119 11.951 1.063 5.017 1.00 0.00 H new ATOM 0 HA GLU A 119 11.364 3.490 3.587 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.687 0.569 2.821 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.260 1.798 1.647 1.00 0.00 H new ATOM 0 HG2 GLU A 119 13.430 2.984 2.778 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.851 1.301 3.028 1.00 0.00 H new ATOM 1866 N LEU A 120 8.976 1.347 4.238 1.00 0.00 N ATOM 1867 CA LEU A 120 7.529 1.145 4.189 1.00 0.00 C ATOM 1868 C LEU A 120 6.818 1.974 5.260 1.00 0.00 C ATOM 1869 O LEU A 120 5.589 2.041 5.282 1.00 0.00 O ATOM 1870 CB LEU A 120 7.183 -0.341 4.349 1.00 0.00 C ATOM 1871 CG LEU A 120 7.281 -0.895 5.773 1.00 0.00 C ATOM 1872 CD1 LEU A 120 5.973 -0.689 6.522 1.00 0.00 C ATOM 1873 CD2 LEU A 120 7.653 -2.369 5.743 1.00 0.00 C ATOM 0 H LEU A 120 9.474 0.685 4.833 1.00 0.00 H new ATOM 0 HA LEU A 120 7.180 1.481 3.213 1.00 0.00 H new ATOM 0 HB2 LEU A 120 6.168 -0.500 3.986 1.00 0.00 H new ATOM 0 HB3 LEU A 120 7.846 -0.921 3.707 1.00 0.00 H new ATOM 0 HG LEU A 120 8.064 -0.351 6.300 1.00 0.00 H new ATOM 0 HD11 LEU A 120 6.065 -1.090 7.531 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.747 0.376 6.574 1.00 0.00 H new ATOM 0 HD13 LEU A 120 5.169 -1.205 5.998 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.719 -2.748 6.763 1.00 0.00 H new ATOM 0 HD22 LEU A 120 6.891 -2.926 5.197 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.616 -2.491 5.248 1.00 0.00 H new ATOM 1885 N GLU A 121 7.595 2.607 6.144 1.00 0.00 N ATOM 1886 CA GLU A 121 7.046 3.429 7.202 1.00 0.00 C ATOM 1887 C GLU A 121 6.115 4.495 6.631 1.00 0.00 C ATOM 1888 O GLU A 121 6.257 4.917 5.480 1.00 0.00 O ATOM 1889 CB GLU A 121 8.180 4.080 7.993 1.00 0.00 C ATOM 1890 CG GLU A 121 7.757 4.582 9.361 1.00 0.00 C ATOM 1891 CD GLU A 121 8.925 4.722 10.322 1.00 0.00 C ATOM 1892 OE1 GLU A 121 9.932 5.364 9.948 1.00 0.00 O ATOM 1893 OE2 GLU A 121 8.834 4.188 11.447 1.00 0.00 O ATOM 0 H GLU A 121 8.614 2.559 6.139 1.00 0.00 H new ATOM 0 HA GLU A 121 6.464 2.795 7.871 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.988 3.359 8.114 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.581 4.914 7.417 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.264 5.548 9.252 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.024 3.896 9.784 1.00 0.00 H new ATOM 1900 N GLU A 122 5.159 4.910 7.446 1.00 0.00 N ATOM 1901 CA GLU A 122 4.174 5.916 7.050 1.00 0.00 C ATOM 1902 C GLU A 122 4.830 7.210 6.564 1.00 0.00 C ATOM 1903 O GLU A 122 4.392 7.801 5.576 1.00 0.00 O ATOM 1904 CB GLU A 122 3.241 6.226 8.222 1.00 0.00 C ATOM 1905 CG GLU A 122 1.768 6.042 7.896 1.00 0.00 C ATOM 1906 CD GLU A 122 0.860 6.691 8.923 1.00 0.00 C ATOM 1907 OE1 GLU A 122 0.752 6.152 10.045 1.00 0.00 O ATOM 1908 OE2 GLU A 122 0.261 7.740 8.608 1.00 0.00 O ATOM 0 H GLU A 122 5.040 4.564 8.398 1.00 0.00 H new ATOM 0 HA GLU A 122 3.605 5.499 6.219 1.00 0.00 H new ATOM 0 HB2 GLU A 122 3.501 5.582 9.062 1.00 0.00 H new ATOM 0 HB3 GLU A 122 3.407 7.254 8.545 1.00 0.00 H new ATOM 0 HG2 GLU A 122 1.561 6.466 6.913 1.00 0.00 H new ATOM 0 HG3 GLU A 122 1.542 4.977 7.838 1.00 0.00 H new ATOM 1915 N ASN A 123 5.873 7.649 7.268 1.00 0.00 N ATOM 1916 CA ASN A 123 6.580 8.881 6.916 1.00 0.00 C ATOM 1917 C ASN A 123 7.252 8.775 5.552 1.00 0.00 C ATOM 1918 O ASN A 123 7.388 9.772 4.841 1.00 0.00 O ATOM 1919 CB ASN A 123 7.623 9.239 7.982 1.00 0.00 C ATOM 1920 CG ASN A 123 8.294 8.024 8.586 1.00 0.00 C ATOM 1921 OD1 ASN A 123 7.983 7.625 9.706 1.00 0.00 O ATOM 1922 ND2 ASN A 123 9.219 7.428 7.849 1.00 0.00 N ATOM 0 H ASN A 123 6.248 7.169 8.087 1.00 0.00 H new ATOM 0 HA ASN A 123 5.834 9.674 6.868 1.00 0.00 H new ATOM 0 HB2 ASN A 123 8.382 9.883 7.538 1.00 0.00 H new ATOM 0 HB3 ASN A 123 7.142 9.813 8.774 1.00 0.00 H new ATOM 0 HD21 ASN A 123 9.704 6.605 8.207 1.00 0.00 H new ATOM 0 HD22 ASN A 123 9.447 7.792 6.924 1.00 0.00 H new ATOM 1929 N PHE A 124 7.669 7.567 5.191 1.00 0.00 N ATOM 1930 CA PHE A 124 8.327 7.335 3.915 1.00 0.00 C ATOM 1931 C PHE A 124 7.318 7.347 2.770 1.00 0.00 C ATOM 1932 O PHE A 124 7.546 7.982 1.739 1.00 0.00 O ATOM 1933 CB PHE A 124 9.072 6.003 3.953 1.00 0.00 C ATOM 1934 CG PHE A 124 10.061 5.837 2.836 1.00 0.00 C ATOM 1935 CD1 PHE A 124 9.632 5.599 1.540 1.00 0.00 C ATOM 1936 CD2 PHE A 124 11.422 5.929 3.081 1.00 0.00 C ATOM 1937 CE1 PHE A 124 10.541 5.455 0.511 1.00 0.00 C ATOM 1938 CE2 PHE A 124 12.336 5.784 2.055 1.00 0.00 C ATOM 1939 CZ PHE A 124 11.895 5.548 0.768 1.00 0.00 C ATOM 0 H PHE A 124 7.562 6.732 5.767 1.00 0.00 H new ATOM 0 HA PHE A 124 9.041 8.140 3.741 1.00 0.00 H new ATOM 0 HB2 PHE A 124 9.594 5.915 4.906 1.00 0.00 H new ATOM 0 HB3 PHE A 124 8.348 5.190 3.910 1.00 0.00 H new ATOM 0 HD1 PHE A 124 8.575 5.525 1.333 1.00 0.00 H new ATOM 0 HD2 PHE A 124 11.772 6.116 4.085 1.00 0.00 H new ATOM 0 HE1 PHE A 124 10.194 5.270 -0.495 1.00 0.00 H new ATOM 0 HE2 PHE A 124 13.394 5.855 2.259 1.00 0.00 H new ATOM 0 HZ PHE A 124 12.607 5.436 -0.036 1.00 0.00 H new ATOM 1949 N ILE A 125 6.202 6.646 2.962 1.00 0.00 N ATOM 1950 CA ILE A 125 5.150 6.575 1.951 1.00 0.00 C ATOM 1951 C ILE A 125 4.619 7.968 1.619 1.00 0.00 C ATOM 1952 O ILE A 125 4.583 8.367 0.454 1.00 0.00 O ATOM 1953 CB ILE A 125 3.977 5.685 2.418 1.00 0.00 C ATOM 1954 CG1 ILE A 125 4.482 4.297 2.824 1.00 0.00 C ATOM 1955 CG2 ILE A 125 2.924 5.567 1.325 1.00 0.00 C ATOM 1956 CD1 ILE A 125 3.574 3.587 3.805 1.00 0.00 C ATOM 0 H ILE A 125 6.003 6.118 3.812 1.00 0.00 H new ATOM 0 HA ILE A 125 5.594 6.134 1.059 1.00 0.00 H new ATOM 0 HB ILE A 125 3.519 6.155 3.289 1.00 0.00 H new ATOM 0 HG12 ILE A 125 4.589 3.682 1.930 1.00 0.00 H new ATOM 0 HG13 ILE A 125 5.474 4.395 3.265 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.106 4.936 1.674 1.00 0.00 H new ATOM 0 HG22 ILE A 125 2.540 6.558 1.082 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.371 5.123 0.436 1.00 0.00 H new ATOM 0 HD11 ILE A 125 3.993 2.611 4.048 1.00 0.00 H new ATOM 0 HD12 ILE A 125 3.486 4.181 4.715 1.00 0.00 H new ATOM 0 HD13 ILE A 125 2.588 3.457 3.360 1.00 0.00 H new ATOM 1968 N LYS A 126 4.207 8.700 2.655 1.00 0.00 N ATOM 1969 CA LYS A 126 3.674 10.050 2.485 1.00 0.00 C ATOM 1970 C LYS A 126 4.690 10.971 1.809 1.00 0.00 C ATOM 1971 O LYS A 126 4.315 11.842 1.023 1.00 0.00 O ATOM 1972 CB LYS A 126 3.261 10.633 3.839 1.00 0.00 C ATOM 1973 CG LYS A 126 2.124 11.640 3.751 1.00 0.00 C ATOM 1974 CD LYS A 126 2.091 12.555 4.967 1.00 0.00 C ATOM 1975 CE LYS A 126 1.254 11.962 6.090 1.00 0.00 C ATOM 1976 NZ LYS A 126 1.010 12.945 7.182 1.00 0.00 N ATOM 0 H LYS A 126 4.233 8.378 3.623 1.00 0.00 H new ATOM 0 HA LYS A 126 2.798 9.981 1.840 1.00 0.00 H new ATOM 0 HB2 LYS A 126 2.963 9.819 4.499 1.00 0.00 H new ATOM 0 HB3 LYS A 126 4.126 11.114 4.296 1.00 0.00 H new ATOM 0 HG2 LYS A 126 2.237 12.239 2.847 1.00 0.00 H new ATOM 0 HG3 LYS A 126 1.175 11.111 3.667 1.00 0.00 H new ATOM 0 HD2 LYS A 126 3.107 12.727 5.322 1.00 0.00 H new ATOM 0 HD3 LYS A 126 1.684 13.525 4.682 1.00 0.00 H new ATOM 0 HE2 LYS A 126 0.299 11.621 5.689 1.00 0.00 H new ATOM 0 HE3 LYS A 126 1.761 11.087 6.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 0.436 12.501 7.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 1.919 13.252 7.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 0.504 13.769 6.800 1.00 0.00 H new ATOM 1990 N SER A 127 5.976 10.772 2.114 1.00 0.00 N ATOM 1991 CA SER A 127 7.039 11.587 1.528 1.00 0.00 C ATOM 1992 C SER A 127 7.049 11.447 0.008 1.00 0.00 C ATOM 1993 O SER A 127 7.096 12.444 -0.715 1.00 0.00 O ATOM 1994 CB SER A 127 8.400 11.180 2.099 1.00 0.00 C ATOM 1995 OG SER A 127 9.426 12.046 1.645 1.00 0.00 O ATOM 0 H SER A 127 6.303 10.055 2.762 1.00 0.00 H new ATOM 0 HA SER A 127 6.847 12.630 1.781 1.00 0.00 H new ATOM 0 HB2 SER A 127 8.361 11.198 3.188 1.00 0.00 H new ATOM 0 HB3 SER A 127 8.629 10.156 1.805 1.00 0.00 H new ATOM 0 HG SER A 127 10.284 11.764 2.026 1.00 0.00 H new ATOM 2001 N GLU A 128 6.995 10.202 -0.466 1.00 0.00 N ATOM 2002 CA GLU A 128 6.987 9.920 -1.899 1.00 0.00 C ATOM 2003 C GLU A 128 5.774 10.558 -2.574 1.00 0.00 C ATOM 2004 O GLU A 128 5.885 11.118 -3.665 1.00 0.00 O ATOM 2005 CB GLU A 128 6.986 8.407 -2.136 1.00 0.00 C ATOM 2006 CG GLU A 128 7.194 8.012 -3.591 1.00 0.00 C ATOM 2007 CD GLU A 128 8.647 8.088 -4.016 1.00 0.00 C ATOM 2008 OE1 GLU A 128 9.413 7.161 -3.680 1.00 0.00 O ATOM 2009 OE2 GLU A 128 9.017 9.074 -4.687 1.00 0.00 O ATOM 0 H GLU A 128 6.956 9.371 0.125 1.00 0.00 H new ATOM 0 HA GLU A 128 7.887 10.350 -2.338 1.00 0.00 H new ATOM 0 HB2 GLU A 128 7.771 7.954 -1.531 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.038 7.995 -1.790 1.00 0.00 H new ATOM 0 HG2 GLU A 128 6.828 6.997 -3.743 1.00 0.00 H new ATOM 0 HG3 GLU A 128 6.598 8.665 -4.229 1.00 0.00 H new ATOM 2016 N LEU A 129 4.618 10.469 -1.914 1.00 0.00 N ATOM 2017 CA LEU A 129 3.378 11.037 -2.443 1.00 0.00 C ATOM 2018 C LEU A 129 3.429 12.563 -2.454 1.00 0.00 C ATOM 2019 O LEU A 129 3.013 13.199 -3.424 1.00 0.00 O ATOM 2020 CB LEU A 129 2.178 10.571 -1.611 1.00 0.00 C ATOM 2021 CG LEU A 129 2.063 9.056 -1.418 1.00 0.00 C ATOM 2022 CD1 LEU A 129 1.112 8.735 -0.278 1.00 0.00 C ATOM 2023 CD2 LEU A 129 1.599 8.387 -2.702 1.00 0.00 C ATOM 0 H LEU A 129 4.515 10.008 -1.010 1.00 0.00 H new ATOM 0 HA LEU A 129 3.266 10.686 -3.469 1.00 0.00 H new ATOM 0 HB2 LEU A 129 2.232 11.042 -0.630 1.00 0.00 H new ATOM 0 HB3 LEU A 129 1.266 10.930 -2.087 1.00 0.00 H new ATOM 0 HG LEU A 129 3.049 8.667 -1.165 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.043 7.654 -0.155 1.00 0.00 H new ATOM 0 HD12 LEU A 129 1.485 9.182 0.644 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.125 9.139 -0.503 1.00 0.00 H new ATOM 0 HD21 LEU A 129 1.523 7.311 -2.545 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.623 8.782 -2.986 1.00 0.00 H new ATOM 0 HD23 LEU A 129 2.317 8.588 -3.497 1.00 0.00 H new ATOM 2035 N LYS A 130 3.934 13.141 -1.364 1.00 0.00 N ATOM 2036 CA LYS A 130 4.037 14.589 -1.231 1.00 0.00 C ATOM 2037 C LYS A 130 4.994 15.177 -2.267 1.00 0.00 C ATOM 2038 O LYS A 130 4.666 16.158 -2.936 1.00 0.00 O ATOM 2039 CB LYS A 130 4.505 14.946 0.182 1.00 0.00 C ATOM 2040 CG LYS A 130 4.700 16.434 0.410 1.00 0.00 C ATOM 2041 CD LYS A 130 3.389 17.122 0.757 1.00 0.00 C ATOM 2042 CE LYS A 130 3.528 18.636 0.716 1.00 0.00 C ATOM 2043 NZ LYS A 130 3.935 19.195 2.036 1.00 0.00 N ATOM 0 H LYS A 130 4.280 12.622 -0.557 1.00 0.00 H new ATOM 0 HA LYS A 130 3.051 15.019 -1.407 1.00 0.00 H new ATOM 0 HB2 LYS A 130 3.776 14.571 0.901 1.00 0.00 H new ATOM 0 HB3 LYS A 130 5.445 14.432 0.383 1.00 0.00 H new ATOM 0 HG2 LYS A 130 5.417 16.589 1.216 1.00 0.00 H new ATOM 0 HG3 LYS A 130 5.124 16.888 -0.486 1.00 0.00 H new ATOM 0 HD2 LYS A 130 2.615 16.807 0.057 1.00 0.00 H new ATOM 0 HD3 LYS A 130 3.066 16.812 1.751 1.00 0.00 H new ATOM 0 HE2 LYS A 130 4.266 18.912 -0.038 1.00 0.00 H new ATOM 0 HE3 LYS A 130 2.580 19.079 0.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 4.018 20.229 1.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 3.219 18.954 2.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 4.852 18.792 2.316 1.00 0.00 H new ATOM 2057 N LYS A 131 6.178 14.578 -2.393 1.00 0.00 N ATOM 2058 CA LYS A 131 7.174 15.054 -3.346 1.00 0.00 C ATOM 2059 C LYS A 131 6.757 14.731 -4.779 1.00 0.00 C ATOM 2060 O LYS A 131 6.496 15.637 -5.572 1.00 0.00 O ATOM 2061 CB LYS A 131 8.545 14.447 -3.038 1.00 0.00 C ATOM 2062 CG LYS A 131 9.346 15.249 -2.021 1.00 0.00 C ATOM 2063 CD LYS A 131 10.277 14.361 -1.208 1.00 0.00 C ATOM 2064 CE LYS A 131 11.685 14.345 -1.785 1.00 0.00 C ATOM 2065 NZ LYS A 131 12.698 13.923 -0.777 1.00 0.00 N ATOM 0 H LYS A 131 6.468 13.766 -1.848 1.00 0.00 H new ATOM 0 HA LYS A 131 7.244 16.137 -3.249 1.00 0.00 H new ATOM 0 HB2 LYS A 131 8.409 13.432 -2.664 1.00 0.00 H new ATOM 0 HB3 LYS A 131 9.117 14.372 -3.963 1.00 0.00 H new ATOM 0 HG2 LYS A 131 9.930 16.011 -2.537 1.00 0.00 H new ATOM 0 HG3 LYS A 131 8.663 15.770 -1.350 1.00 0.00 H new ATOM 0 HD2 LYS A 131 10.310 14.715 -0.178 1.00 0.00 H new ATOM 0 HD3 LYS A 131 9.882 13.345 -1.184 1.00 0.00 H new ATOM 0 HE2 LYS A 131 11.719 13.668 -2.638 1.00 0.00 H new ATOM 0 HE3 LYS A 131 11.936 15.339 -2.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 13.619 13.795 -1.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 12.781 14.653 -0.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 12.402 13.026 -0.342 1.00 0.00 H new ATOM 2079 N ALA A 132 6.693 13.438 -5.105 1.00 0.00 N ATOM 2080 CA ALA A 132 6.305 12.994 -6.444 1.00 0.00 C ATOM 2081 C ALA A 132 7.150 13.673 -7.525 1.00 0.00 C ATOM 2082 O ALA A 132 6.644 14.026 -8.593 1.00 0.00 O ATOM 2083 CB ALA A 132 4.823 13.258 -6.677 1.00 0.00 C ATOM 0 H ALA A 132 6.906 12.679 -4.458 1.00 0.00 H new ATOM 0 HA ALA A 132 6.487 11.921 -6.509 1.00 0.00 H new ATOM 0 HB1 ALA A 132 4.547 12.923 -7.677 1.00 0.00 H new ATOM 0 HB2 ALA A 132 4.236 12.714 -5.937 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.625 14.326 -6.584 1.00 0.00 H new ATOM 2089 N GLY A 133 8.438 13.854 -7.236 1.00 0.00 N ATOM 2090 CA GLY A 133 9.335 14.489 -8.184 1.00 0.00 C ATOM 2091 C GLY A 133 10.121 15.628 -7.563 1.00 0.00 C ATOM 2092 O GLY A 133 10.085 16.755 -8.059 1.00 0.00 O ATOM 0 H GLY A 133 8.875 13.571 -6.359 1.00 0.00 H new ATOM 0 HA2 GLY A 133 10.028 13.746 -8.578 1.00 0.00 H new ATOM 0 HA3 GLY A 133 8.759 14.867 -9.028 1.00 0.00 H new ATOM 2096 N GLY A 134 10.833 15.331 -6.476 1.00 0.00 N ATOM 2097 CA GLY A 134 11.628 16.345 -5.802 1.00 0.00 C ATOM 2098 C GLY A 134 13.113 16.207 -6.094 1.00 0.00 C ATOM 2099 O GLY A 134 13.508 15.454 -6.986 1.00 0.00 O ATOM 0 H GLY A 134 10.873 14.405 -6.050 1.00 0.00 H new ATOM 0 HA2 GLY A 134 11.290 17.334 -6.113 1.00 0.00 H new ATOM 0 HA3 GLY A 134 11.464 16.276 -4.727 1.00 0.00 H new ATOM 2103 N ALA A 135 13.939 16.933 -5.339 1.00 0.00 N ATOM 2104 CA ALA A 135 15.389 16.885 -5.523 1.00 0.00 C ATOM 2105 C ALA A 135 16.057 16.000 -4.467 1.00 0.00 C ATOM 2106 O ALA A 135 17.179 16.273 -4.035 1.00 0.00 O ATOM 2107 CB ALA A 135 15.970 18.293 -5.485 1.00 0.00 C ATOM 0 H ALA A 135 13.629 17.560 -4.596 1.00 0.00 H new ATOM 0 HA ALA A 135 15.591 16.445 -6.499 1.00 0.00 H new ATOM 0 HB1 ALA A 135 17.050 18.245 -5.623 1.00 0.00 H new ATOM 0 HB2 ALA A 135 15.529 18.890 -6.283 1.00 0.00 H new ATOM 0 HB3 ALA A 135 15.747 18.753 -4.522 1.00 0.00 H new ATOM 2113 N ASN A 136 15.361 14.932 -4.062 1.00 0.00 N ATOM 2114 CA ASN A 136 15.878 13.996 -3.064 1.00 0.00 C ATOM 2115 C ASN A 136 16.423 14.729 -1.834 1.00 0.00 C ATOM 2116 O ASN A 136 17.477 14.373 -1.302 1.00 0.00 O ATOM 2117 CB ASN A 136 16.966 13.115 -3.685 1.00 0.00 C ATOM 2118 CG ASN A 136 16.396 12.095 -4.652 1.00 0.00 C ATOM 2119 OD1 ASN A 136 16.163 10.943 -4.289 1.00 0.00 O ATOM 2120 ND2 ASN A 136 16.161 12.514 -5.892 1.00 0.00 N ATOM 0 H ASN A 136 14.433 14.696 -4.414 1.00 0.00 H new ATOM 0 HA ASN A 136 15.052 13.366 -2.734 1.00 0.00 H new ATOM 0 HB2 ASN A 136 17.687 13.745 -4.207 1.00 0.00 H new ATOM 0 HB3 ASN A 136 17.509 12.599 -2.893 1.00 0.00 H new ATOM 0 HD21 ASN A 136 15.773 11.871 -6.583 1.00 0.00 H new ATOM 0 HD22 ASN A 136 16.368 13.478 -6.152 1.00 0.00 H new ATOM 2127 N TYR A 137 15.697 15.754 -1.387 1.00 0.00 N ATOM 2128 CA TYR A 137 16.104 16.536 -0.227 1.00 0.00 C ATOM 2129 C TYR A 137 15.480 15.986 1.056 1.00 0.00 C ATOM 2130 O TYR A 137 14.828 16.713 1.806 1.00 0.00 O ATOM 2131 CB TYR A 137 15.706 17.996 -0.424 1.00 0.00 C ATOM 2132 CG TYR A 137 16.802 18.975 -0.076 1.00 0.00 C ATOM 2133 CD1 TYR A 137 17.228 19.135 1.237 1.00 0.00 C ATOM 2134 CD2 TYR A 137 17.411 19.737 -1.062 1.00 0.00 C ATOM 2135 CE1 TYR A 137 18.232 20.029 1.556 1.00 0.00 C ATOM 2136 CE2 TYR A 137 18.416 20.633 -0.753 1.00 0.00 C ATOM 2137 CZ TYR A 137 18.823 20.776 0.558 1.00 0.00 C ATOM 2138 OH TYR A 137 19.824 21.667 0.871 1.00 0.00 O ATOM 0 H TYR A 137 14.823 16.060 -1.814 1.00 0.00 H new ATOM 0 HA TYR A 137 17.187 16.467 -0.129 1.00 0.00 H new ATOM 0 HB2 TYR A 137 15.413 18.147 -1.463 1.00 0.00 H new ATOM 0 HB3 TYR A 137 14.831 18.211 0.189 1.00 0.00 H new ATOM 0 HD1 TYR A 137 16.767 18.551 2.020 1.00 0.00 H new ATOM 0 HD2 TYR A 137 17.094 19.628 -2.089 1.00 0.00 H new ATOM 0 HE1 TYR A 137 18.552 20.142 2.581 1.00 0.00 H new ATOM 0 HE2 TYR A 137 18.881 21.218 -1.533 1.00 0.00 H new ATOM 0 HH TYR A 137 20.133 22.111 0.054 1.00 0.00 H new ATOM 2148 N ASP A 138 15.690 14.697 1.299 1.00 0.00 N ATOM 2149 CA ASP A 138 15.154 14.042 2.490 1.00 0.00 C ATOM 2150 C ASP A 138 16.275 13.491 3.368 1.00 0.00 C ATOM 2151 O ASP A 138 17.362 13.177 2.880 1.00 0.00 O ATOM 2152 CB ASP A 138 14.200 12.910 2.099 1.00 0.00 C ATOM 2153 CG ASP A 138 13.323 12.467 3.254 1.00 0.00 C ATOM 2154 OD1 ASP A 138 12.252 13.078 3.453 1.00 0.00 O ATOM 2155 OD2 ASP A 138 13.709 11.513 3.963 1.00 0.00 O ATOM 0 H ASP A 138 16.228 14.083 0.687 1.00 0.00 H new ATOM 0 HA ASP A 138 14.604 14.791 3.060 1.00 0.00 H new ATOM 0 HB2 ASP A 138 13.569 13.239 1.273 1.00 0.00 H new ATOM 0 HB3 ASP A 138 14.779 12.059 1.739 1.00 0.00 H new ATOM 2160 N ALA A 139 15.995 13.371 4.663 1.00 0.00 N ATOM 2161 CA ALA A 139 16.971 12.851 5.618 1.00 0.00 C ATOM 2162 C ALA A 139 16.282 12.086 6.746 1.00 0.00 C ATOM 2163 O ALA A 139 16.582 10.915 6.986 1.00 0.00 O ATOM 2164 CB ALA A 139 17.815 13.983 6.186 1.00 0.00 C ATOM 0 H ALA A 139 15.098 13.627 5.076 1.00 0.00 H new ATOM 0 HA ALA A 139 17.624 12.158 5.088 1.00 0.00 H new ATOM 0 HB1 ALA A 139 18.537 13.578 6.895 1.00 0.00 H new ATOM 0 HB2 ALA A 139 18.345 14.484 5.376 1.00 0.00 H new ATOM 0 HB3 ALA A 139 17.169 14.699 6.694 1.00 0.00 H new ATOM 2170 N GLN A 140 15.360 12.759 7.435 1.00 0.00 N ATOM 2171 CA GLN A 140 14.627 12.150 8.545 1.00 0.00 C ATOM 2172 C GLN A 140 13.173 11.862 8.178 1.00 0.00 C ATOM 2173 O GLN A 140 12.335 11.640 9.056 1.00 0.00 O ATOM 2174 CB GLN A 140 14.669 13.070 9.759 1.00 0.00 C ATOM 2175 CG GLN A 140 16.013 13.090 10.470 1.00 0.00 C ATOM 2176 CD GLN A 140 16.114 12.032 11.552 1.00 0.00 C ATOM 2177 OE1 GLN A 140 15.878 12.308 12.728 1.00 0.00 O ATOM 2178 NE2 GLN A 140 16.467 10.812 11.161 1.00 0.00 N ATOM 0 H GLN A 140 15.103 13.727 7.244 1.00 0.00 H new ATOM 0 HA GLN A 140 15.111 11.201 8.776 1.00 0.00 H new ATOM 0 HB2 GLN A 140 14.421 14.083 9.444 1.00 0.00 H new ATOM 0 HB3 GLN A 140 13.900 12.759 10.466 1.00 0.00 H new ATOM 0 HG2 GLN A 140 16.808 12.936 9.741 1.00 0.00 H new ATOM 0 HG3 GLN A 140 16.172 14.074 10.912 1.00 0.00 H new ATOM 0 HE21 GLN A 140 16.654 10.626 10.176 1.00 0.00 H new ATOM 0 HE22 GLN A 140 16.551 10.061 11.846 1.00 0.00 H new ATOM 2187 N THR A 141 12.882 11.867 6.881 1.00 0.00 N ATOM 2188 CA THR A 141 11.528 11.611 6.382 1.00 0.00 C ATOM 2189 C THR A 141 10.515 12.530 7.072 1.00 0.00 C ATOM 2190 O THR A 141 9.442 12.092 7.492 1.00 0.00 O ATOM 2191 CB THR A 141 11.142 10.133 6.576 1.00 0.00 C ATOM 2192 OG1 THR A 141 12.111 9.438 7.346 1.00 0.00 O ATOM 2193 CG2 THR A 141 10.979 9.384 5.271 1.00 0.00 C ATOM 0 H THR A 141 13.569 12.047 6.149 1.00 0.00 H new ATOM 0 HA THR A 141 11.514 11.827 5.314 1.00 0.00 H new ATOM 0 HB THR A 141 10.183 10.162 7.094 1.00 0.00 H new ATOM 0 HG1 THR A 141 11.678 8.708 7.836 1.00 0.00 H new ATOM 0 HG21 THR A 141 10.707 8.349 5.477 1.00 0.00 H new ATOM 0 HG22 THR A 141 10.195 9.854 4.677 1.00 0.00 H new ATOM 0 HG23 THR A 141 11.918 9.409 4.717 1.00 0.00 H new ATOM 2201 N GLU A 142 10.872 13.811 7.189 1.00 0.00 N ATOM 2202 CA GLU A 142 10.011 14.803 7.831 1.00 0.00 C ATOM 2203 C GLU A 142 9.328 15.699 6.798 1.00 0.00 C ATOM 2204 O GLU A 142 9.872 15.845 5.682 1.00 0.00 O ATOM 2205 CB GLU A 142 10.824 15.658 8.808 1.00 0.00 C ATOM 2206 CG GLU A 142 12.086 16.255 8.200 1.00 0.00 C ATOM 2207 CD GLU A 142 12.321 17.689 8.633 1.00 0.00 C ATOM 2208 OE1 GLU A 142 11.585 18.580 8.159 1.00 0.00 O ATOM 2209 OE2 GLU A 142 13.240 17.920 9.446 1.00 0.00 O ATOM 0 H GLU A 142 11.756 14.186 6.845 1.00 0.00 H new ATOM 0 HA GLU A 142 9.237 14.267 8.380 1.00 0.00 H new ATOM 0 HB2 GLU A 142 10.194 16.466 9.180 1.00 0.00 H new ATOM 0 HB3 GLU A 142 11.100 15.047 9.668 1.00 0.00 H new ATOM 0 HG2 GLU A 142 12.945 15.648 8.486 1.00 0.00 H new ATOM 0 HG3 GLU A 142 12.015 16.215 7.113 1.00 0.00 H new TER 2216 GLU A 142