USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 753 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 43 THR OG1 : rot -120:sc= -0.486 USER MOD Set 1.2: A 45 LYS NZ :NH3+ 150:sc= -0.652 (180deg=-1.78!) USER MOD Single : A 1 MET CE :methyl -172:sc= -0.503 (180deg=-0.668) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 126:sc= 0.0726 USER MOD Single : A -1 SER OG : rot -22:sc= 0.585 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -4 SER OG : rot 180:sc= 0 USER MOD Single : A -5 SER OG : rot 180:sc= 0 USER MOD Single : A -6 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 163:sc= -0.0286 (180deg=-0.273) USER MOD Single : A 23 HIS : no HD1:sc= -5.62! C(o=-5.6!,f=-6.3!) USER MOD Single : A 33 THR OG1 : rot 109:sc= 1.23 USER MOD Single : A 36 GLN : amide:sc= -4.83! C(o=-4.8!,f=-4.1!) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -4.51! C(o=-4.5!,f=-11!) USER MOD Single : A 66 ASN : amide:sc= 1.2 K(o=1.2,f=-0.083) USER MOD Single : A 67 MET CE :methyl -143:sc= -2.64! (180deg=-4.59!) USER MOD Single : A 68 ASN : amide:sc= -0.169 X(o=-0.17,f=0) USER MOD Single : A 70 SER OG : rot 60:sc= 0.31 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0.0521 K(o=0.052,f=-3.7!) USER MOD Single : A 83 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0405) USER MOD Single : A 85 MET CE :methyl -119:sc= -0.446 (180deg=-3.54!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 7:sc= 0.249 USER MOD Single : A 93 SER OG : rot 16:sc= 0.472 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 -14.065 -22.957 19.039 1.00 0.00 N ATOM 2 CA GLY A -6 -14.741 -22.263 17.958 1.00 0.00 C ATOM 3 C GLY A -6 -14.527 -20.763 18.010 1.00 0.00 C ATOM 4 O GLY A -6 -13.415 -20.280 17.796 1.00 0.00 O ATOM 0 H1 GLY A -6 -14.242 -23.979 18.960 1.00 0.00 H new ATOM 0 H2 GLY A -6 -13.042 -22.777 18.981 1.00 0.00 H new ATOM 0 H3 GLY A -6 -14.426 -22.613 19.952 1.00 0.00 H new ATOM 0 HA2 GLY A -6 -14.381 -22.646 17.003 1.00 0.00 H new ATOM 0 HA3 GLY A -6 -15.809 -22.477 18.005 1.00 0.00 H new ATOM 8 N SER A -5 -15.595 -20.024 18.294 1.00 0.00 N ATOM 9 CA SER A -5 -15.520 -18.570 18.368 1.00 0.00 C ATOM 10 C SER A -5 -16.614 -18.015 19.275 1.00 0.00 C ATOM 11 O SER A -5 -17.465 -18.757 19.765 1.00 0.00 O ATOM 12 CB SER A -5 -15.644 -17.960 16.970 1.00 0.00 C ATOM 13 OG SER A -5 -15.032 -16.683 16.914 1.00 0.00 O ATOM 0 H SER A -5 -16.522 -20.408 18.477 1.00 0.00 H new ATOM 0 HA SER A -5 -14.551 -18.302 18.790 1.00 0.00 H new ATOM 0 HB2 SER A -5 -15.180 -18.622 16.239 1.00 0.00 H new ATOM 0 HB3 SER A -5 -16.696 -17.874 16.699 1.00 0.00 H new ATOM 0 HG SER A -5 -15.124 -16.316 16.010 1.00 0.00 H new ATOM 19 N SER A -4 -16.584 -16.704 19.495 1.00 0.00 N ATOM 20 CA SER A -4 -17.569 -16.049 20.347 1.00 0.00 C ATOM 21 C SER A -4 -18.482 -15.145 19.524 1.00 0.00 C ATOM 22 O SER A -4 -18.803 -14.030 19.934 1.00 0.00 O ATOM 23 CB SER A -4 -16.871 -15.233 21.436 1.00 0.00 C ATOM 24 OG SER A -4 -16.163 -16.075 22.330 1.00 0.00 O ATOM 0 H SER A -4 -15.888 -16.075 19.095 1.00 0.00 H new ATOM 0 HA SER A -4 -18.178 -16.821 20.817 1.00 0.00 H new ATOM 0 HB2 SER A -4 -16.182 -14.523 20.978 1.00 0.00 H new ATOM 0 HB3 SER A -4 -17.609 -14.650 21.988 1.00 0.00 H new ATOM 0 HG SER A -4 -15.724 -15.529 23.016 1.00 0.00 H new ATOM 30 N GLY A -3 -18.898 -15.635 18.360 1.00 0.00 N ATOM 31 CA GLY A -3 -19.770 -14.859 17.498 1.00 0.00 C ATOM 32 C GLY A -3 -19.200 -13.492 17.176 1.00 0.00 C ATOM 33 O GLY A -3 -18.051 -13.198 17.504 1.00 0.00 O ATOM 0 H GLY A -3 -18.647 -16.555 17.999 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -19.940 -15.406 16.571 1.00 0.00 H new ATOM 0 HA3 GLY A -3 -20.740 -14.740 17.980 1.00 0.00 H new ATOM 37 N SER A -2 -20.005 -12.654 16.530 1.00 0.00 N ATOM 38 CA SER A -2 -19.572 -11.312 16.159 1.00 0.00 C ATOM 39 C SER A -2 -20.769 -10.434 15.807 1.00 0.00 C ATOM 40 O SER A -2 -21.679 -10.860 15.097 1.00 0.00 O ATOM 41 CB SER A -2 -18.606 -11.375 14.974 1.00 0.00 C ATOM 42 OG SER A -2 -19.216 -11.984 13.850 1.00 0.00 O ATOM 0 H SER A -2 -20.960 -12.881 16.253 1.00 0.00 H new ATOM 0 HA SER A -2 -19.059 -10.872 17.014 1.00 0.00 H new ATOM 0 HB2 SER A -2 -18.279 -10.368 14.713 1.00 0.00 H new ATOM 0 HB3 SER A -2 -17.715 -11.936 15.257 1.00 0.00 H new ATOM 0 HG SER A -2 -18.579 -12.010 13.106 1.00 0.00 H new ATOM 48 N SER A -1 -20.760 -9.203 16.310 1.00 0.00 N ATOM 49 CA SER A -1 -21.845 -8.264 16.054 1.00 0.00 C ATOM 50 C SER A -1 -21.375 -6.825 16.240 1.00 0.00 C ATOM 51 O SER A -1 -20.345 -6.573 16.865 1.00 0.00 O ATOM 52 CB SER A -1 -23.026 -8.551 16.983 1.00 0.00 C ATOM 53 OG SER A -1 -23.451 -9.898 16.868 1.00 0.00 O ATOM 0 H SER A -1 -20.013 -8.833 16.897 1.00 0.00 H new ATOM 0 HA SER A -1 -22.166 -8.392 15.020 1.00 0.00 H new ATOM 0 HB2 SER A -1 -22.740 -8.344 18.014 1.00 0.00 H new ATOM 0 HB3 SER A -1 -23.853 -7.884 16.741 1.00 0.00 H new ATOM 0 HG SER A -1 -23.161 -10.260 16.005 1.00 0.00 H new ATOM 59 N GLY A 0 -22.137 -5.884 15.692 1.00 0.00 N ATOM 60 CA GLY A 0 -21.782 -4.481 15.808 1.00 0.00 C ATOM 61 C GLY A 0 -21.764 -3.775 14.467 1.00 0.00 C ATOM 62 O GLY A 0 -20.790 -3.105 14.124 1.00 0.00 O ATOM 0 H GLY A 0 -22.994 -6.068 15.170 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -22.492 -3.983 16.468 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -20.800 -4.395 16.274 1.00 0.00 H new ATOM 66 N MET A 1 -22.843 -3.926 13.705 1.00 0.00 N ATOM 67 CA MET A 1 -22.946 -3.297 12.394 1.00 0.00 C ATOM 68 C MET A 1 -23.626 -1.936 12.495 1.00 0.00 C ATOM 69 O MET A 1 -24.622 -1.677 11.819 1.00 0.00 O ATOM 70 CB MET A 1 -23.724 -4.198 11.432 1.00 0.00 C ATOM 71 CG MET A 1 -25.156 -4.460 11.869 1.00 0.00 C ATOM 72 SD MET A 1 -26.263 -4.762 10.478 1.00 0.00 S ATOM 73 CE MET A 1 -26.294 -3.143 9.712 1.00 0.00 C ATOM 0 H MET A 1 -23.658 -4.478 13.973 1.00 0.00 H new ATOM 0 HA MET A 1 -21.937 -3.151 12.009 1.00 0.00 H new ATOM 0 HB2 MET A 1 -23.733 -3.739 10.444 1.00 0.00 H new ATOM 0 HB3 MET A 1 -23.202 -5.150 11.336 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.176 -5.321 12.538 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.520 -3.605 12.439 1.00 0.00 H new ATOM 0 HE1 MET A 1 -27.045 -3.128 8.922 1.00 0.00 H new ATOM 0 HE2 MET A 1 -26.541 -2.391 10.461 1.00 0.00 H new ATOM 0 HE3 MET A 1 -25.315 -2.923 9.286 1.00 0.00 H new ATOM 83 N ALA A 2 -23.083 -1.070 13.345 1.00 0.00 N ATOM 84 CA ALA A 2 -23.637 0.265 13.533 1.00 0.00 C ATOM 85 C ALA A 2 -23.004 1.263 12.569 1.00 0.00 C ATOM 86 O ALA A 2 -23.701 2.045 11.921 1.00 0.00 O ATOM 87 CB ALA A 2 -23.440 0.720 14.972 1.00 0.00 C ATOM 0 H ALA A 2 -22.260 -1.269 13.914 1.00 0.00 H new ATOM 0 HA ALA A 2 -24.705 0.222 13.320 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -23.858 1.719 15.098 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -23.945 0.027 15.645 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -22.375 0.741 15.205 1.00 0.00 H new ATOM 93 N THR A 3 -21.678 1.233 12.480 1.00 0.00 N ATOM 94 CA THR A 3 -20.950 2.136 11.597 1.00 0.00 C ATOM 95 C THR A 3 -21.022 1.665 10.149 1.00 0.00 C ATOM 96 O THR A 3 -21.271 0.490 9.878 1.00 0.00 O ATOM 97 CB THR A 3 -19.472 2.258 12.012 1.00 0.00 C ATOM 98 OG1 THR A 3 -18.838 0.975 11.949 1.00 0.00 O ATOM 99 CG2 THR A 3 -19.350 2.821 13.420 1.00 0.00 C ATOM 0 H THR A 3 -21.086 0.593 13.009 1.00 0.00 H new ATOM 0 HA THR A 3 -21.425 3.113 11.683 1.00 0.00 H new ATOM 0 HB THR A 3 -18.978 2.941 11.321 1.00 0.00 H new ATOM 0 HG1 THR A 3 -17.898 1.061 12.213 1.00 0.00 H new ATOM 0 HG21 THR A 3 -18.297 2.898 13.691 1.00 0.00 H new ATOM 0 HG22 THR A 3 -19.808 3.810 13.457 1.00 0.00 H new ATOM 0 HG23 THR A 3 -19.858 2.159 14.122 1.00 0.00 H new ATOM 107 N THR A 4 -20.803 2.590 9.219 1.00 0.00 N ATOM 108 CA THR A 4 -20.844 2.270 7.798 1.00 0.00 C ATOM 109 C THR A 4 -19.873 1.144 7.460 1.00 0.00 C ATOM 110 O THR A 4 -18.697 1.194 7.823 1.00 0.00 O ATOM 111 CB THR A 4 -20.506 3.500 6.935 1.00 0.00 C ATOM 112 OG1 THR A 4 -21.274 4.628 7.368 1.00 0.00 O ATOM 113 CG2 THR A 4 -20.785 3.223 5.465 1.00 0.00 C ATOM 0 H THR A 4 -20.595 3.567 9.425 1.00 0.00 H new ATOM 0 HA THR A 4 -21.861 1.948 7.576 1.00 0.00 H new ATOM 0 HB THR A 4 -19.444 3.718 7.052 1.00 0.00 H new ATOM 0 HG1 THR A 4 -21.052 5.406 6.815 1.00 0.00 H new ATOM 0 HG21 THR A 4 -20.539 4.106 4.875 1.00 0.00 H new ATOM 0 HG22 THR A 4 -20.177 2.382 5.131 1.00 0.00 H new ATOM 0 HG23 THR A 4 -21.840 2.982 5.334 1.00 0.00 H new ATOM 121 N LYS A 5 -20.371 0.129 6.762 1.00 0.00 N ATOM 122 CA LYS A 5 -19.548 -1.010 6.373 1.00 0.00 C ATOM 123 C LYS A 5 -19.159 -0.922 4.900 1.00 0.00 C ATOM 124 O LYS A 5 -19.196 -1.918 4.178 1.00 0.00 O ATOM 125 CB LYS A 5 -20.294 -2.319 6.637 1.00 0.00 C ATOM 126 CG LYS A 5 -20.517 -2.605 8.112 1.00 0.00 C ATOM 127 CD LYS A 5 -21.675 -3.567 8.324 1.00 0.00 C ATOM 128 CE LYS A 5 -21.329 -4.969 7.848 1.00 0.00 C ATOM 129 NZ LYS A 5 -22.167 -6.004 8.514 1.00 0.00 N ATOM 0 H LYS A 5 -21.342 0.072 6.454 1.00 0.00 H new ATOM 0 HA LYS A 5 -18.638 -0.991 6.973 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -21.259 -2.286 6.132 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -19.732 -3.143 6.197 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -19.609 -3.026 8.543 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -20.717 -1.672 8.639 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -21.937 -3.595 9.382 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -22.552 -3.206 7.788 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -21.466 -5.030 6.768 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -20.277 -5.171 8.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -21.900 -6.946 8.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -22.017 -5.963 9.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -23.170 -5.827 8.303 1.00 0.00 H new ATOM 143 N ARG A 6 -18.785 0.276 4.462 1.00 0.00 N ATOM 144 CA ARG A 6 -18.390 0.493 3.076 1.00 0.00 C ATOM 145 C ARG A 6 -16.877 0.655 2.962 1.00 0.00 C ATOM 146 O ARG A 6 -16.245 0.079 2.076 1.00 0.00 O ATOM 147 CB ARG A 6 -19.090 1.731 2.511 1.00 0.00 C ATOM 148 CG ARG A 6 -20.508 1.464 2.035 1.00 0.00 C ATOM 149 CD ARG A 6 -20.534 1.025 0.579 1.00 0.00 C ATOM 150 NE ARG A 6 -21.870 1.129 0.000 1.00 0.00 N ATOM 151 CZ ARG A 6 -22.378 2.258 -0.481 1.00 0.00 C ATOM 152 NH1 ARG A 6 -21.663 3.375 -0.451 1.00 0.00 N ATOM 153 NH2 ARG A 6 -23.602 2.272 -0.992 1.00 0.00 N ATOM 0 H ARG A 6 -18.747 1.111 5.047 1.00 0.00 H new ATOM 0 HA ARG A 6 -18.690 -0.381 2.498 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -19.113 2.506 3.277 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -18.504 2.122 1.679 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -20.962 0.693 2.657 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -21.109 2.365 2.155 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -19.841 1.638 0.003 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -20.186 -0.005 0.505 1.00 0.00 H new ATOM 0 HE ARG A 6 -22.445 0.288 -0.037 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -20.722 3.368 -0.058 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -22.055 4.241 -0.821 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -24.155 1.415 -1.016 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -23.991 3.140 -1.361 1.00 0.00 H new ATOM 167 N VAL A 7 -16.301 1.444 3.863 1.00 0.00 N ATOM 168 CA VAL A 7 -14.862 1.681 3.864 1.00 0.00 C ATOM 169 C VAL A 7 -14.134 0.641 4.708 1.00 0.00 C ATOM 170 O VAL A 7 -14.187 0.675 5.938 1.00 0.00 O ATOM 171 CB VAL A 7 -14.526 3.086 4.399 1.00 0.00 C ATOM 172 CG1 VAL A 7 -13.020 3.296 4.439 1.00 0.00 C ATOM 173 CG2 VAL A 7 -15.199 4.154 3.550 1.00 0.00 C ATOM 0 H VAL A 7 -16.809 1.930 4.602 1.00 0.00 H new ATOM 0 HA VAL A 7 -14.528 1.604 2.829 1.00 0.00 H new ATOM 0 HB VAL A 7 -14.908 3.169 5.417 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -12.802 4.294 4.819 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -12.566 2.551 5.093 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -12.612 3.194 3.434 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -14.951 5.140 3.942 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -14.849 4.074 2.521 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -16.280 4.014 3.578 1.00 0.00 H new ATOM 183 N LEU A 8 -13.454 -0.284 4.039 1.00 0.00 N ATOM 184 CA LEU A 8 -12.714 -1.336 4.726 1.00 0.00 C ATOM 185 C LEU A 8 -11.301 -0.874 5.067 1.00 0.00 C ATOM 186 O LEU A 8 -10.679 -0.132 4.306 1.00 0.00 O ATOM 187 CB LEU A 8 -12.655 -2.596 3.860 1.00 0.00 C ATOM 188 CG LEU A 8 -13.988 -3.076 3.283 1.00 0.00 C ATOM 189 CD1 LEU A 8 -13.787 -4.333 2.451 1.00 0.00 C ATOM 190 CD2 LEU A 8 -14.992 -3.327 4.398 1.00 0.00 C ATOM 0 H LEU A 8 -13.400 -0.326 3.021 1.00 0.00 H new ATOM 0 HA LEU A 8 -13.236 -1.565 5.655 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.969 -2.413 3.033 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.228 -3.403 4.456 1.00 0.00 H new ATOM 0 HG LEU A 8 -14.384 -2.295 2.634 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.746 -4.660 2.049 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -13.102 -4.120 1.630 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -13.369 -5.121 3.077 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -15.934 -3.668 3.969 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -14.603 -4.090 5.073 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.159 -2.403 4.952 1.00 0.00 H new ATOM 202 N TYR A 9 -10.799 -1.318 6.214 1.00 0.00 N ATOM 203 CA TYR A 9 -9.459 -0.950 6.655 1.00 0.00 C ATOM 204 C TYR A 9 -8.484 -2.107 6.462 1.00 0.00 C ATOM 205 O TYR A 9 -8.670 -3.190 7.019 1.00 0.00 O ATOM 206 CB TYR A 9 -9.482 -0.527 8.125 1.00 0.00 C ATOM 207 CG TYR A 9 -8.106 -0.391 8.738 1.00 0.00 C ATOM 208 CD1 TYR A 9 -7.367 -1.514 9.090 1.00 0.00 C ATOM 209 CD2 TYR A 9 -7.545 0.860 8.963 1.00 0.00 C ATOM 210 CE1 TYR A 9 -6.110 -1.394 9.651 1.00 0.00 C ATOM 211 CE2 TYR A 9 -6.288 0.989 9.522 1.00 0.00 C ATOM 212 CZ TYR A 9 -5.575 -0.141 9.864 1.00 0.00 C ATOM 213 OH TYR A 9 -4.323 -0.017 10.421 1.00 0.00 O ATOM 0 H TYR A 9 -11.300 -1.933 6.855 1.00 0.00 H new ATOM 0 HA TYR A 9 -9.122 -0.110 6.047 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -10.005 0.425 8.212 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -10.054 -1.258 8.696 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -7.782 -2.497 8.922 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -8.101 1.747 8.696 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -5.550 -2.277 9.921 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -5.866 1.969 9.690 1.00 0.00 H new ATOM 0 HH TYR A 9 -3.763 0.545 9.845 1.00 0.00 H new ATOM 223 N VAL A 10 -7.444 -1.870 5.670 1.00 0.00 N ATOM 224 CA VAL A 10 -6.437 -2.891 5.403 1.00 0.00 C ATOM 225 C VAL A 10 -5.151 -2.608 6.171 1.00 0.00 C ATOM 226 O VAL A 10 -4.715 -1.462 6.271 1.00 0.00 O ATOM 227 CB VAL A 10 -6.116 -2.984 3.900 1.00 0.00 C ATOM 228 CG1 VAL A 10 -5.115 -4.098 3.635 1.00 0.00 C ATOM 229 CG2 VAL A 10 -7.389 -3.197 3.095 1.00 0.00 C ATOM 0 H VAL A 10 -7.276 -0.980 5.202 1.00 0.00 H new ATOM 0 HA VAL A 10 -6.854 -3.841 5.736 1.00 0.00 H new ATOM 0 HB VAL A 10 -5.667 -2.042 3.584 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -4.901 -4.148 2.567 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -4.193 -3.897 4.181 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.533 -5.049 3.966 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -7.143 -3.260 2.035 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -7.869 -4.123 3.412 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -8.068 -2.361 3.260 1.00 0.00 H new ATOM 239 N GLY A 11 -4.546 -3.662 6.712 1.00 0.00 N ATOM 240 CA GLY A 11 -3.315 -3.506 7.463 1.00 0.00 C ATOM 241 C GLY A 11 -2.282 -4.557 7.108 1.00 0.00 C ATOM 242 O GLY A 11 -2.590 -5.537 6.432 1.00 0.00 O ATOM 0 H GLY A 11 -4.887 -4.621 6.643 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -2.901 -2.516 7.274 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -3.534 -3.562 8.529 1.00 0.00 H new ATOM 246 N GLY A 12 -1.050 -4.352 7.564 1.00 0.00 N ATOM 247 CA GLY A 12 0.014 -5.297 7.279 1.00 0.00 C ATOM 248 C GLY A 12 0.318 -5.397 5.797 1.00 0.00 C ATOM 249 O GLY A 12 0.553 -6.488 5.276 1.00 0.00 O ATOM 0 H GLY A 12 -0.770 -3.548 8.126 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.916 -4.996 7.812 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.267 -6.280 7.657 1.00 0.00 H new ATOM 253 N LEU A 13 0.314 -4.256 5.116 1.00 0.00 N ATOM 254 CA LEU A 13 0.590 -4.220 3.684 1.00 0.00 C ATOM 255 C LEU A 13 2.091 -4.152 3.421 1.00 0.00 C ATOM 256 O LEU A 13 2.862 -3.714 4.274 1.00 0.00 O ATOM 257 CB LEU A 13 -0.106 -3.019 3.040 1.00 0.00 C ATOM 258 CG LEU A 13 -1.625 -3.122 2.898 1.00 0.00 C ATOM 259 CD1 LEU A 13 -2.197 -1.830 2.334 1.00 0.00 C ATOM 260 CD2 LEU A 13 -2.000 -4.303 2.015 1.00 0.00 C ATOM 0 H LEU A 13 0.123 -3.344 5.532 1.00 0.00 H new ATOM 0 HA LEU A 13 0.202 -5.138 3.241 1.00 0.00 H new ATOM 0 HB2 LEU A 13 0.125 -2.132 3.629 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.322 -2.864 2.050 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.053 -3.284 3.887 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.279 -1.922 2.240 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.960 -1.004 3.004 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.763 -1.637 1.353 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -3.085 -4.360 1.925 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.561 -4.172 1.026 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.623 -5.224 2.460 1.00 0.00 H new ATOM 272 N ALA A 14 2.499 -4.588 2.233 1.00 0.00 N ATOM 273 CA ALA A 14 3.906 -4.573 1.855 1.00 0.00 C ATOM 274 C ALA A 14 4.357 -3.167 1.473 1.00 0.00 C ATOM 275 O ALA A 14 3.573 -2.220 1.519 1.00 0.00 O ATOM 276 CB ALA A 14 4.155 -5.540 0.707 1.00 0.00 C ATOM 0 H ALA A 14 1.874 -4.956 1.516 1.00 0.00 H new ATOM 0 HA ALA A 14 4.492 -4.892 2.717 1.00 0.00 H new ATOM 0 HB1 ALA A 14 5.210 -5.518 0.435 1.00 0.00 H new ATOM 0 HB2 ALA A 14 3.880 -6.549 1.015 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.553 -5.247 -0.153 1.00 0.00 H new ATOM 282 N GLU A 15 5.626 -3.039 1.096 1.00 0.00 N ATOM 283 CA GLU A 15 6.180 -1.748 0.707 1.00 0.00 C ATOM 284 C GLU A 15 5.938 -1.476 -0.775 1.00 0.00 C ATOM 285 O GLU A 15 6.179 -0.371 -1.261 1.00 0.00 O ATOM 286 CB GLU A 15 7.680 -1.701 1.007 1.00 0.00 C ATOM 287 CG GLU A 15 8.495 -2.690 0.192 1.00 0.00 C ATOM 288 CD GLU A 15 9.950 -2.738 0.618 1.00 0.00 C ATOM 289 OE1 GLU A 15 10.607 -1.677 0.608 1.00 0.00 O ATOM 290 OE2 GLU A 15 10.430 -3.839 0.962 1.00 0.00 O ATOM 0 H GLU A 15 6.289 -3.813 1.052 1.00 0.00 H new ATOM 0 HA GLU A 15 5.676 -0.975 1.287 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.049 -0.694 0.815 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.836 -1.901 2.067 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.058 -3.684 0.291 1.00 0.00 H new ATOM 0 HG3 GLU A 15 8.438 -2.420 -0.863 1.00 0.00 H new ATOM 297 N GLU A 16 5.461 -2.492 -1.487 1.00 0.00 N ATOM 298 CA GLU A 16 5.188 -2.362 -2.914 1.00 0.00 C ATOM 299 C GLU A 16 3.698 -2.147 -3.165 1.00 0.00 C ATOM 300 O GLU A 16 3.305 -1.571 -4.180 1.00 0.00 O ATOM 301 CB GLU A 16 5.667 -3.608 -3.662 1.00 0.00 C ATOM 302 CG GLU A 16 7.149 -3.583 -3.997 1.00 0.00 C ATOM 303 CD GLU A 16 7.486 -4.419 -5.216 1.00 0.00 C ATOM 304 OE1 GLU A 16 7.004 -5.568 -5.300 1.00 0.00 O ATOM 305 OE2 GLU A 16 8.231 -3.924 -6.087 1.00 0.00 O ATOM 0 H GLU A 16 5.256 -3.413 -1.100 1.00 0.00 H new ATOM 0 HA GLU A 16 5.731 -1.492 -3.285 1.00 0.00 H new ATOM 0 HB2 GLU A 16 5.454 -4.489 -3.057 1.00 0.00 H new ATOM 0 HB3 GLU A 16 5.096 -3.710 -4.585 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.461 -2.553 -4.170 1.00 0.00 H new ATOM 0 HG3 GLU A 16 7.717 -3.949 -3.142 1.00 0.00 H new ATOM 312 N VAL A 17 2.873 -2.613 -2.233 1.00 0.00 N ATOM 313 CA VAL A 17 1.427 -2.472 -2.352 1.00 0.00 C ATOM 314 C VAL A 17 1.006 -1.011 -2.240 1.00 0.00 C ATOM 315 O VAL A 17 1.523 -0.268 -1.405 1.00 0.00 O ATOM 316 CB VAL A 17 0.692 -3.291 -1.274 1.00 0.00 C ATOM 317 CG1 VAL A 17 -0.815 -3.149 -1.430 1.00 0.00 C ATOM 318 CG2 VAL A 17 1.108 -4.752 -1.340 1.00 0.00 C ATOM 0 H VAL A 17 3.182 -3.092 -1.387 1.00 0.00 H new ATOM 0 HA VAL A 17 1.152 -2.852 -3.336 1.00 0.00 H new ATOM 0 HB VAL A 17 0.970 -2.902 -0.294 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.317 -3.734 -0.660 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -1.094 -2.100 -1.328 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -1.115 -3.510 -2.414 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.579 -5.316 -0.572 1.00 0.00 H new ATOM 0 HG22 VAL A 17 0.861 -5.157 -2.322 1.00 0.00 H new ATOM 0 HG23 VAL A 17 2.182 -4.832 -1.174 1.00 0.00 H new ATOM 328 N ASP A 18 0.066 -0.605 -3.085 1.00 0.00 N ATOM 329 CA ASP A 18 -0.426 0.768 -3.080 1.00 0.00 C ATOM 330 C ASP A 18 -1.818 0.849 -3.700 1.00 0.00 C ATOM 331 O ASP A 18 -2.328 -0.135 -4.235 1.00 0.00 O ATOM 332 CB ASP A 18 0.538 1.681 -3.840 1.00 0.00 C ATOM 333 CG ASP A 18 0.097 3.131 -3.823 1.00 0.00 C ATOM 334 OD1 ASP A 18 -0.111 3.675 -2.718 1.00 0.00 O ATOM 335 OD2 ASP A 18 -0.041 3.722 -4.914 1.00 0.00 O ATOM 0 H ASP A 18 -0.371 -1.207 -3.783 1.00 0.00 H new ATOM 0 HA ASP A 18 -0.489 1.101 -2.044 1.00 0.00 H new ATOM 0 HB2 ASP A 18 1.532 1.601 -3.400 1.00 0.00 H new ATOM 0 HB3 ASP A 18 0.618 1.341 -4.872 1.00 0.00 H new ATOM 340 N ASP A 19 -2.426 2.027 -3.622 1.00 0.00 N ATOM 341 CA ASP A 19 -3.759 2.237 -4.176 1.00 0.00 C ATOM 342 C ASP A 19 -3.943 1.443 -5.465 1.00 0.00 C ATOM 343 O ASP A 19 -5.015 0.893 -5.721 1.00 0.00 O ATOM 344 CB ASP A 19 -3.997 3.725 -4.440 1.00 0.00 C ATOM 345 CG ASP A 19 -4.947 3.963 -5.597 1.00 0.00 C ATOM 346 OD1 ASP A 19 -6.028 3.339 -5.614 1.00 0.00 O ATOM 347 OD2 ASP A 19 -4.609 4.773 -6.485 1.00 0.00 O ATOM 0 H ASP A 19 -2.018 2.851 -3.181 1.00 0.00 H new ATOM 0 HA ASP A 19 -4.488 1.885 -3.446 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -4.400 4.191 -3.541 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -3.044 4.211 -4.650 1.00 0.00 H new ATOM 352 N LYS A 20 -2.892 1.388 -6.275 1.00 0.00 N ATOM 353 CA LYS A 20 -2.936 0.661 -7.539 1.00 0.00 C ATOM 354 C LYS A 20 -3.151 -0.830 -7.302 1.00 0.00 C ATOM 355 O LYS A 20 -4.145 -1.403 -7.748 1.00 0.00 O ATOM 356 CB LYS A 20 -1.641 0.882 -8.323 1.00 0.00 C ATOM 357 CG LYS A 20 -1.522 2.273 -8.922 1.00 0.00 C ATOM 358 CD LYS A 20 -0.141 2.510 -9.510 1.00 0.00 C ATOM 359 CE LYS A 20 0.062 3.970 -9.885 1.00 0.00 C ATOM 360 NZ LYS A 20 0.098 4.851 -8.685 1.00 0.00 N ATOM 0 H LYS A 20 -1.998 1.838 -6.079 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.775 1.043 -8.120 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -0.792 0.706 -7.663 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -1.580 0.145 -9.123 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.276 2.402 -9.698 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -1.725 3.020 -8.154 1.00 0.00 H new ATOM 0 HD2 LYS A 20 0.619 2.209 -8.789 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -0.008 1.885 -10.393 1.00 0.00 H new ATOM 0 HE2 LYS A 20 0.993 4.076 -10.441 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -0.743 4.290 -10.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 0.516 5.768 -8.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -0.869 4.997 -8.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.673 4.403 -7.943 1.00 0.00 H new ATOM 374 N VAL A 21 -2.214 -1.454 -6.594 1.00 0.00 N ATOM 375 CA VAL A 21 -2.303 -2.878 -6.296 1.00 0.00 C ATOM 376 C VAL A 21 -3.600 -3.206 -5.564 1.00 0.00 C ATOM 377 O VAL A 21 -4.309 -4.147 -5.925 1.00 0.00 O ATOM 378 CB VAL A 21 -1.111 -3.348 -5.441 1.00 0.00 C ATOM 379 CG1 VAL A 21 -1.192 -4.846 -5.189 1.00 0.00 C ATOM 380 CG2 VAL A 21 0.203 -2.981 -6.113 1.00 0.00 C ATOM 0 H VAL A 21 -1.385 -0.995 -6.217 1.00 0.00 H new ATOM 0 HA VAL A 21 -2.285 -3.403 -7.251 1.00 0.00 H new ATOM 0 HB VAL A 21 -1.154 -2.840 -4.478 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -0.342 -5.160 -4.583 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -2.118 -5.077 -4.662 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -1.175 -5.377 -6.141 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.035 -3.320 -5.496 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.258 -3.460 -7.091 1.00 0.00 H new ATOM 0 HG23 VAL A 21 0.260 -1.899 -6.235 1.00 0.00 H new ATOM 390 N LEU A 22 -3.905 -2.425 -4.534 1.00 0.00 N ATOM 391 CA LEU A 22 -5.118 -2.631 -3.750 1.00 0.00 C ATOM 392 C LEU A 22 -6.357 -2.570 -4.638 1.00 0.00 C ATOM 393 O LEU A 22 -7.341 -3.270 -4.398 1.00 0.00 O ATOM 394 CB LEU A 22 -5.218 -1.582 -2.642 1.00 0.00 C ATOM 395 CG LEU A 22 -4.333 -1.813 -1.417 1.00 0.00 C ATOM 396 CD1 LEU A 22 -4.283 -0.564 -0.551 1.00 0.00 C ATOM 397 CD2 LEU A 22 -4.835 -3.002 -0.612 1.00 0.00 C ATOM 0 H LEU A 22 -3.329 -1.643 -4.222 1.00 0.00 H new ATOM 0 HA LEU A 22 -5.065 -3.622 -3.299 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.969 -0.609 -3.067 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.255 -1.530 -2.311 1.00 0.00 H new ATOM 0 HG LEU A 22 -3.322 -2.033 -1.760 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.648 -0.748 0.316 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.875 0.264 -1.130 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.290 -0.312 -0.217 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -4.193 -3.151 0.256 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -5.856 -2.812 -0.280 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -4.817 -3.897 -1.235 1.00 0.00 H new ATOM 409 N HIS A 23 -6.301 -1.728 -5.665 1.00 0.00 N ATOM 410 CA HIS A 23 -7.418 -1.577 -6.591 1.00 0.00 C ATOM 411 C HIS A 23 -7.549 -2.803 -7.489 1.00 0.00 C ATOM 412 O HIS A 23 -8.642 -3.341 -7.666 1.00 0.00 O ATOM 413 CB HIS A 23 -7.234 -0.322 -7.445 1.00 0.00 C ATOM 414 CG HIS A 23 -8.168 -0.251 -8.614 1.00 0.00 C ATOM 415 ND1 HIS A 23 -8.230 -1.225 -9.588 1.00 0.00 N ATOM 416 CD2 HIS A 23 -9.082 0.685 -8.961 1.00 0.00 C ATOM 417 CE1 HIS A 23 -9.140 -0.890 -10.485 1.00 0.00 C ATOM 418 NE2 HIS A 23 -9.673 0.265 -10.127 1.00 0.00 N ATOM 0 H HIS A 23 -5.495 -1.140 -5.877 1.00 0.00 H new ATOM 0 HA HIS A 23 -8.332 -1.478 -6.006 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -7.381 0.558 -6.819 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -6.207 -0.287 -7.808 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -9.305 1.593 -8.421 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -9.404 -1.463 -11.362 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -10.404 0.763 -10.634 1.00 0.00 H new ATOM 426 N ALA A 24 -6.428 -3.240 -8.054 1.00 0.00 N ATOM 427 CA ALA A 24 -6.417 -4.403 -8.933 1.00 0.00 C ATOM 428 C ALA A 24 -6.489 -5.697 -8.130 1.00 0.00 C ATOM 429 O ALA A 24 -6.696 -6.774 -8.689 1.00 0.00 O ATOM 430 CB ALA A 24 -5.174 -4.391 -9.809 1.00 0.00 C ATOM 0 H ALA A 24 -5.515 -2.806 -7.918 1.00 0.00 H new ATOM 0 HA ALA A 24 -7.298 -4.353 -9.573 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.179 -5.265 -10.460 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.166 -3.486 -10.417 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.285 -4.413 -9.179 1.00 0.00 H new ATOM 436 N ALA A 25 -6.316 -5.585 -6.817 1.00 0.00 N ATOM 437 CA ALA A 25 -6.363 -6.747 -5.938 1.00 0.00 C ATOM 438 C ALA A 25 -7.741 -6.900 -5.304 1.00 0.00 C ATOM 439 O ALA A 25 -8.084 -7.965 -4.790 1.00 0.00 O ATOM 440 CB ALA A 25 -5.293 -6.637 -4.862 1.00 0.00 C ATOM 0 H ALA A 25 -6.142 -4.701 -6.339 1.00 0.00 H new ATOM 0 HA ALA A 25 -6.169 -7.635 -6.539 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.339 -7.511 -4.212 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -4.310 -6.584 -5.330 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.462 -5.737 -4.271 1.00 0.00 H new ATOM 446 N PHE A 26 -8.527 -5.829 -5.342 1.00 0.00 N ATOM 447 CA PHE A 26 -9.868 -5.844 -4.769 1.00 0.00 C ATOM 448 C PHE A 26 -10.923 -5.617 -5.847 1.00 0.00 C ATOM 449 O PHE A 26 -12.121 -5.584 -5.562 1.00 0.00 O ATOM 450 CB PHE A 26 -9.993 -4.774 -3.682 1.00 0.00 C ATOM 451 CG PHE A 26 -9.399 -5.183 -2.365 1.00 0.00 C ATOM 452 CD1 PHE A 26 -8.113 -5.695 -2.300 1.00 0.00 C ATOM 453 CD2 PHE A 26 -10.126 -5.057 -1.193 1.00 0.00 C ATOM 454 CE1 PHE A 26 -7.563 -6.073 -1.090 1.00 0.00 C ATOM 455 CE2 PHE A 26 -9.581 -5.432 0.020 1.00 0.00 C ATOM 456 CZ PHE A 26 -8.298 -5.942 0.072 1.00 0.00 C ATOM 0 H PHE A 26 -8.258 -4.940 -5.764 1.00 0.00 H new ATOM 0 HA PHE A 26 -10.035 -6.825 -4.324 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.504 -3.862 -4.024 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -11.047 -4.536 -3.538 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.534 -5.800 -3.206 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -11.130 -4.661 -1.228 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.559 -6.470 -1.053 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -10.158 -5.327 0.927 1.00 0.00 H new ATOM 0 HZ PHE A 26 -7.871 -6.237 1.019 1.00 0.00 H new ATOM 466 N ILE A 27 -10.470 -5.459 -7.086 1.00 0.00 N ATOM 467 CA ILE A 27 -11.374 -5.235 -8.207 1.00 0.00 C ATOM 468 C ILE A 27 -12.349 -6.396 -8.367 1.00 0.00 C ATOM 469 O ILE A 27 -13.491 -6.226 -8.795 1.00 0.00 O ATOM 470 CB ILE A 27 -10.600 -5.044 -9.525 1.00 0.00 C ATOM 471 CG1 ILE A 27 -11.478 -4.335 -10.559 1.00 0.00 C ATOM 472 CG2 ILE A 27 -10.123 -6.386 -10.058 1.00 0.00 C ATOM 473 CD1 ILE A 27 -11.788 -2.898 -10.204 1.00 0.00 C ATOM 0 H ILE A 27 -9.482 -5.482 -7.339 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.930 -4.324 -7.987 1.00 0.00 H new ATOM 0 HB ILE A 27 -9.727 -4.422 -9.330 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -10.979 -4.362 -11.528 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.413 -4.884 -10.667 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -9.578 -6.235 -10.990 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -9.466 -6.856 -9.326 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -10.982 -7.031 -10.241 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -12.414 -2.458 -10.981 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -12.315 -2.864 -9.251 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.859 -2.334 -10.124 1.00 0.00 H new ATOM 485 N PRO A 28 -11.891 -7.606 -8.014 1.00 0.00 N ATOM 486 CA PRO A 28 -12.708 -8.820 -8.107 1.00 0.00 C ATOM 487 C PRO A 28 -13.968 -8.739 -7.251 1.00 0.00 C ATOM 488 O PRO A 28 -15.085 -8.812 -7.764 1.00 0.00 O ATOM 489 CB PRO A 28 -11.776 -9.916 -7.584 1.00 0.00 C ATOM 490 CG PRO A 28 -10.405 -9.359 -7.753 1.00 0.00 C ATOM 491 CD PRO A 28 -10.541 -7.883 -7.495 1.00 0.00 C ATOM 0 HA PRO A 28 -13.065 -8.993 -9.122 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -11.984 -10.147 -6.539 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -11.899 -10.842 -8.146 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -9.705 -9.818 -7.054 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.024 -9.549 -8.756 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.454 -7.644 -6.435 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -9.777 -7.305 -8.016 1.00 0.00 H new ATOM 499 N PHE A 29 -13.780 -8.586 -5.945 1.00 0.00 N ATOM 500 CA PHE A 29 -14.902 -8.495 -5.017 1.00 0.00 C ATOM 501 C PHE A 29 -16.061 -7.723 -5.640 1.00 0.00 C ATOM 502 O PHE A 29 -17.120 -8.286 -5.916 1.00 0.00 O ATOM 503 CB PHE A 29 -14.463 -7.817 -3.717 1.00 0.00 C ATOM 504 CG PHE A 29 -13.543 -8.661 -2.882 1.00 0.00 C ATOM 505 CD1 PHE A 29 -14.002 -9.823 -2.282 1.00 0.00 C ATOM 506 CD2 PHE A 29 -12.221 -8.293 -2.696 1.00 0.00 C ATOM 507 CE1 PHE A 29 -13.159 -10.603 -1.513 1.00 0.00 C ATOM 508 CE2 PHE A 29 -11.373 -9.069 -1.929 1.00 0.00 C ATOM 509 CZ PHE A 29 -11.843 -10.224 -1.335 1.00 0.00 C ATOM 0 H PHE A 29 -12.862 -8.522 -5.505 1.00 0.00 H new ATOM 0 HA PHE A 29 -15.240 -9.507 -4.794 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -13.964 -6.878 -3.957 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -15.347 -7.568 -3.130 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -15.031 -10.123 -2.417 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -11.849 -7.389 -3.156 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -13.529 -11.507 -1.052 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -10.343 -8.773 -1.794 1.00 0.00 H new ATOM 0 HZ PHE A 29 -11.182 -10.830 -0.732 1.00 0.00 H new ATOM 519 N GLY A 30 -15.853 -6.428 -5.858 1.00 0.00 N ATOM 520 CA GLY A 30 -16.889 -5.598 -6.445 1.00 0.00 C ATOM 521 C GLY A 30 -16.326 -4.532 -7.364 1.00 0.00 C ATOM 522 O GLY A 30 -15.393 -4.788 -8.125 1.00 0.00 O ATOM 0 H GLY A 30 -14.985 -5.939 -5.639 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -17.581 -6.227 -7.005 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -17.463 -5.122 -5.650 1.00 0.00 H new ATOM 526 N ASP A 31 -16.895 -3.333 -7.295 1.00 0.00 N ATOM 527 CA ASP A 31 -16.445 -2.224 -8.128 1.00 0.00 C ATOM 528 C ASP A 31 -15.934 -1.072 -7.268 1.00 0.00 C ATOM 529 O ASP A 31 -16.671 -0.130 -6.974 1.00 0.00 O ATOM 530 CB ASP A 31 -17.583 -1.740 -9.028 1.00 0.00 C ATOM 531 CG ASP A 31 -18.184 -2.860 -9.854 1.00 0.00 C ATOM 532 OD1 ASP A 31 -17.473 -3.853 -10.116 1.00 0.00 O ATOM 533 OD2 ASP A 31 -19.367 -2.745 -10.237 1.00 0.00 O ATOM 0 H ASP A 31 -17.669 -3.105 -6.671 1.00 0.00 H new ATOM 0 HA ASP A 31 -15.625 -2.579 -8.752 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -18.361 -1.288 -8.413 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -17.210 -0.961 -9.694 1.00 0.00 H new ATOM 538 N ILE A 32 -14.670 -1.154 -6.869 1.00 0.00 N ATOM 539 CA ILE A 32 -14.061 -0.118 -6.044 1.00 0.00 C ATOM 540 C ILE A 32 -14.424 1.273 -6.551 1.00 0.00 C ATOM 541 O ILE A 32 -14.265 1.576 -7.735 1.00 0.00 O ATOM 542 CB ILE A 32 -12.527 -0.255 -6.008 1.00 0.00 C ATOM 543 CG1 ILE A 32 -12.128 -1.600 -5.396 1.00 0.00 C ATOM 544 CG2 ILE A 32 -11.911 0.894 -5.224 1.00 0.00 C ATOM 545 CD1 ILE A 32 -10.677 -1.960 -5.622 1.00 0.00 C ATOM 0 H ILE A 32 -14.047 -1.927 -7.103 1.00 0.00 H new ATOM 0 HA ILE A 32 -14.453 -0.248 -5.035 1.00 0.00 H new ATOM 0 HB ILE A 32 -12.149 -0.215 -7.030 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -12.325 -1.575 -4.324 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -12.758 -2.383 -5.818 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -10.827 0.783 -5.207 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -12.172 1.840 -5.699 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -12.292 0.883 -4.203 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.466 -2.925 -5.161 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -10.479 -2.018 -6.692 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -10.039 -1.197 -5.176 1.00 0.00 H new ATOM 557 N THR A 33 -14.911 2.119 -5.648 1.00 0.00 N ATOM 558 CA THR A 33 -15.296 3.479 -6.004 1.00 0.00 C ATOM 559 C THR A 33 -14.125 4.442 -5.841 1.00 0.00 C ATOM 560 O THR A 33 -13.929 5.340 -6.660 1.00 0.00 O ATOM 561 CB THR A 33 -16.475 3.972 -5.144 1.00 0.00 C ATOM 562 OG1 THR A 33 -16.091 4.016 -3.765 1.00 0.00 O ATOM 563 CG2 THR A 33 -17.683 3.063 -5.311 1.00 0.00 C ATOM 0 H THR A 33 -15.048 1.886 -4.665 1.00 0.00 H new ATOM 0 HA THR A 33 -15.603 3.458 -7.050 1.00 0.00 H new ATOM 0 HB THR A 33 -16.745 4.974 -5.477 1.00 0.00 H new ATOM 0 HG1 THR A 33 -16.013 4.949 -3.477 1.00 0.00 H new ATOM 0 HG21 THR A 33 -18.503 3.431 -4.694 1.00 0.00 H new ATOM 0 HG22 THR A 33 -17.991 3.055 -6.357 1.00 0.00 H new ATOM 0 HG23 THR A 33 -17.422 2.051 -5.002 1.00 0.00 H new ATOM 571 N ASP A 34 -13.350 4.249 -4.780 1.00 0.00 N ATOM 572 CA ASP A 34 -12.196 5.100 -4.511 1.00 0.00 C ATOM 573 C ASP A 34 -11.317 4.494 -3.421 1.00 0.00 C ATOM 574 O ASP A 34 -11.804 3.786 -2.539 1.00 0.00 O ATOM 575 CB ASP A 34 -12.654 6.499 -4.096 1.00 0.00 C ATOM 576 CG ASP A 34 -12.823 7.428 -5.282 1.00 0.00 C ATOM 577 OD1 ASP A 34 -11.802 7.946 -5.779 1.00 0.00 O ATOM 578 OD2 ASP A 34 -13.977 7.639 -5.711 1.00 0.00 O ATOM 0 H ASP A 34 -13.499 3.511 -4.092 1.00 0.00 H new ATOM 0 HA ASP A 34 -11.609 5.175 -5.426 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -13.600 6.424 -3.559 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -11.928 6.926 -3.404 1.00 0.00 H new ATOM 583 N ILE A 35 -10.020 4.777 -3.489 1.00 0.00 N ATOM 584 CA ILE A 35 -9.074 4.261 -2.509 1.00 0.00 C ATOM 585 C ILE A 35 -8.227 5.383 -1.918 1.00 0.00 C ATOM 586 O ILE A 35 -7.878 6.339 -2.610 1.00 0.00 O ATOM 587 CB ILE A 35 -8.143 3.202 -3.129 1.00 0.00 C ATOM 588 CG1 ILE A 35 -8.960 2.025 -3.667 1.00 0.00 C ATOM 589 CG2 ILE A 35 -7.128 2.723 -2.102 1.00 0.00 C ATOM 590 CD1 ILE A 35 -8.156 1.075 -4.527 1.00 0.00 C ATOM 0 H ILE A 35 -9.601 5.361 -4.213 1.00 0.00 H new ATOM 0 HA ILE A 35 -9.662 3.797 -1.717 1.00 0.00 H new ATOM 0 HB ILE A 35 -7.604 3.656 -3.960 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.383 1.473 -2.828 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -9.797 2.410 -4.250 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.477 1.975 -2.555 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -6.528 3.567 -1.762 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -7.650 2.283 -1.252 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -8.798 0.266 -4.874 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.755 1.613 -5.386 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -7.335 0.661 -3.942 1.00 0.00 H new ATOM 602 N GLN A 36 -7.899 5.257 -0.637 1.00 0.00 N ATOM 603 CA GLN A 36 -7.091 6.261 0.047 1.00 0.00 C ATOM 604 C GLN A 36 -5.853 5.628 0.675 1.00 0.00 C ATOM 605 O GLN A 36 -5.943 4.601 1.347 1.00 0.00 O ATOM 606 CB GLN A 36 -7.919 6.967 1.122 1.00 0.00 C ATOM 607 CG GLN A 36 -8.776 8.101 0.583 1.00 0.00 C ATOM 608 CD GLN A 36 -9.505 7.727 -0.692 1.00 0.00 C ATOM 609 OE1 GLN A 36 -9.348 8.378 -1.725 1.00 0.00 O ATOM 610 NE2 GLN A 36 -10.310 6.672 -0.626 1.00 0.00 N ATOM 0 H GLN A 36 -8.180 4.470 -0.051 1.00 0.00 H new ATOM 0 HA GLN A 36 -6.767 6.994 -0.691 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -8.564 6.236 1.611 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.248 7.361 1.885 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -9.503 8.393 1.340 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -8.145 8.970 0.395 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -10.410 6.161 0.251 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -10.828 6.373 -1.452 1.00 0.00 H new ATOM 619 N ILE A 37 -4.700 6.249 0.451 1.00 0.00 N ATOM 620 CA ILE A 37 -3.445 5.746 0.995 1.00 0.00 C ATOM 621 C ILE A 37 -2.795 6.774 1.916 1.00 0.00 C ATOM 622 O ILE A 37 -2.338 7.832 1.482 1.00 0.00 O ATOM 623 CB ILE A 37 -2.453 5.376 -0.124 1.00 0.00 C ATOM 624 CG1 ILE A 37 -3.030 4.260 -0.997 1.00 0.00 C ATOM 625 CG2 ILE A 37 -1.117 4.955 0.470 1.00 0.00 C ATOM 626 CD1 ILE A 37 -3.124 2.927 -0.289 1.00 0.00 C ATOM 0 H ILE A 37 -4.609 7.101 -0.103 1.00 0.00 H new ATOM 0 HA ILE A 37 -3.686 4.849 1.566 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.289 6.253 -0.750 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -4.023 4.553 -1.337 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.409 4.147 -1.886 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.427 4.697 -0.333 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.703 5.777 1.054 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.263 4.089 1.116 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.542 2.183 -0.968 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.130 2.612 0.027 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -3.769 3.024 0.584 1.00 0.00 H new ATOM 638 N PRO A 38 -2.749 6.456 3.218 1.00 0.00 N ATOM 639 CA PRO A 38 -2.154 7.338 4.227 1.00 0.00 C ATOM 640 C PRO A 38 -0.638 7.429 4.096 1.00 0.00 C ATOM 641 O PRO A 38 0.061 6.415 4.124 1.00 0.00 O ATOM 642 CB PRO A 38 -2.537 6.671 5.551 1.00 0.00 C ATOM 643 CG PRO A 38 -2.731 5.234 5.208 1.00 0.00 C ATOM 644 CD PRO A 38 -3.273 5.212 3.806 1.00 0.00 C ATOM 0 HA PRO A 38 -2.509 8.364 4.132 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -1.754 6.797 6.299 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -3.447 7.106 5.965 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -1.790 4.687 5.271 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -3.424 4.757 5.902 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -2.933 4.334 3.257 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -4.363 5.191 3.797 1.00 0.00 H new ATOM 652 N LEU A 39 -0.134 8.650 3.952 1.00 0.00 N ATOM 653 CA LEU A 39 1.301 8.874 3.816 1.00 0.00 C ATOM 654 C LEU A 39 1.744 10.081 4.637 1.00 0.00 C ATOM 655 O LEU A 39 0.916 10.867 5.100 1.00 0.00 O ATOM 656 CB LEU A 39 1.668 9.081 2.346 1.00 0.00 C ATOM 657 CG LEU A 39 1.204 7.992 1.378 1.00 0.00 C ATOM 658 CD1 LEU A 39 1.467 8.408 -0.060 1.00 0.00 C ATOM 659 CD2 LEU A 39 1.896 6.673 1.689 1.00 0.00 C ATOM 0 H LEU A 39 -0.698 9.500 3.926 1.00 0.00 H new ATOM 0 HA LEU A 39 1.818 7.992 4.193 1.00 0.00 H new ATOM 0 HB2 LEU A 39 1.249 10.033 2.018 1.00 0.00 H new ATOM 0 HB3 LEU A 39 2.752 9.167 2.272 1.00 0.00 H new ATOM 0 HG LEU A 39 0.130 7.855 1.503 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.130 7.620 -0.734 1.00 0.00 H new ATOM 0 HD12 LEU A 39 0.925 9.328 -0.278 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.535 8.574 -0.201 1.00 0.00 H new ATOM 0 HD21 LEU A 39 1.554 5.909 0.991 1.00 0.00 H new ATOM 0 HD22 LEU A 39 2.975 6.796 1.592 1.00 0.00 H new ATOM 0 HD23 LEU A 39 1.656 6.367 2.707 1.00 0.00 H new ATOM 671 N ASP A 40 3.053 10.223 4.813 1.00 0.00 N ATOM 672 CA ASP A 40 3.606 11.337 5.575 1.00 0.00 C ATOM 673 C ASP A 40 3.998 12.486 4.652 1.00 0.00 C ATOM 674 O ASP A 40 3.818 12.408 3.436 1.00 0.00 O ATOM 675 CB ASP A 40 4.821 10.876 6.382 1.00 0.00 C ATOM 676 CG ASP A 40 5.051 11.725 7.617 1.00 0.00 C ATOM 677 OD1 ASP A 40 4.087 11.931 8.383 1.00 0.00 O ATOM 678 OD2 ASP A 40 6.196 12.184 7.817 1.00 0.00 O ATOM 0 H ASP A 40 3.751 9.581 4.438 1.00 0.00 H new ATOM 0 HA ASP A 40 2.838 11.693 6.261 1.00 0.00 H new ATOM 0 HB2 ASP A 40 4.683 9.837 6.680 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.708 10.911 5.750 1.00 0.00 H new ATOM 683 N TYR A 41 4.535 13.551 5.237 1.00 0.00 N ATOM 684 CA TYR A 41 4.950 14.718 4.467 1.00 0.00 C ATOM 685 C TYR A 41 6.458 14.712 4.239 1.00 0.00 C ATOM 686 O TYR A 41 6.975 15.468 3.417 1.00 0.00 O ATOM 687 CB TYR A 41 4.536 16.003 5.187 1.00 0.00 C ATOM 688 CG TYR A 41 4.956 16.046 6.638 1.00 0.00 C ATOM 689 CD1 TYR A 41 4.253 15.339 7.606 1.00 0.00 C ATOM 690 CD2 TYR A 41 6.055 16.793 7.043 1.00 0.00 C ATOM 691 CE1 TYR A 41 4.633 15.375 8.934 1.00 0.00 C ATOM 692 CE2 TYR A 41 6.443 16.835 8.368 1.00 0.00 C ATOM 693 CZ TYR A 41 5.728 16.124 9.310 1.00 0.00 C ATOM 694 OH TYR A 41 6.110 16.164 10.631 1.00 0.00 O ATOM 0 H TYR A 41 4.693 13.630 6.242 1.00 0.00 H new ATOM 0 HA TYR A 41 4.455 14.677 3.497 1.00 0.00 H new ATOM 0 HB2 TYR A 41 4.970 16.857 4.667 1.00 0.00 H new ATOM 0 HB3 TYR A 41 3.453 16.110 5.128 1.00 0.00 H new ATOM 0 HD1 TYR A 41 3.395 14.751 7.315 1.00 0.00 H new ATOM 0 HD2 TYR A 41 6.616 17.351 6.308 1.00 0.00 H new ATOM 0 HE1 TYR A 41 4.075 14.819 9.674 1.00 0.00 H new ATOM 0 HE2 TYR A 41 7.301 17.421 8.665 1.00 0.00 H new ATOM 0 HH TYR A 41 6.900 16.736 10.726 1.00 0.00 H new ATOM 704 N GLU A 42 7.158 13.853 4.974 1.00 0.00 N ATOM 705 CA GLU A 42 8.607 13.749 4.852 1.00 0.00 C ATOM 706 C GLU A 42 8.997 12.524 4.030 1.00 0.00 C ATOM 707 O GLU A 42 9.846 12.602 3.141 1.00 0.00 O ATOM 708 CB GLU A 42 9.253 13.673 6.237 1.00 0.00 C ATOM 709 CG GLU A 42 9.417 15.027 6.907 1.00 0.00 C ATOM 710 CD GLU A 42 10.489 15.022 7.980 1.00 0.00 C ATOM 711 OE1 GLU A 42 10.662 13.975 8.639 1.00 0.00 O ATOM 712 OE2 GLU A 42 11.153 16.064 8.161 1.00 0.00 O ATOM 0 H GLU A 42 6.745 13.220 5.659 1.00 0.00 H new ATOM 0 HA GLU A 42 8.968 14.640 4.338 1.00 0.00 H new ATOM 0 HB2 GLU A 42 8.647 13.032 6.877 1.00 0.00 H new ATOM 0 HB3 GLU A 42 10.231 13.201 6.147 1.00 0.00 H new ATOM 0 HG2 GLU A 42 9.667 15.773 6.153 1.00 0.00 H new ATOM 0 HG3 GLU A 42 8.467 15.327 7.349 1.00 0.00 H new ATOM 719 N THR A 43 8.371 11.391 4.333 1.00 0.00 N ATOM 720 CA THR A 43 8.653 10.149 3.624 1.00 0.00 C ATOM 721 C THR A 43 7.554 9.829 2.618 1.00 0.00 C ATOM 722 O THR A 43 7.808 9.213 1.583 1.00 0.00 O ATOM 723 CB THR A 43 8.800 8.966 4.600 1.00 0.00 C ATOM 724 OG1 THR A 43 7.621 8.844 5.404 1.00 0.00 O ATOM 725 CG2 THR A 43 10.014 9.153 5.497 1.00 0.00 C ATOM 0 H THR A 43 7.665 11.308 5.065 1.00 0.00 H new ATOM 0 HA THR A 43 9.595 10.294 3.095 1.00 0.00 H new ATOM 0 HB THR A 43 8.936 8.056 4.015 1.00 0.00 H new ATOM 0 HG1 THR A 43 7.859 8.941 6.350 1.00 0.00 H new ATOM 0 HG21 THR A 43 10.097 8.306 6.178 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.913 9.216 4.884 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.903 10.072 6.073 1.00 0.00 H new ATOM 733 N GLU A 44 6.332 10.251 2.928 1.00 0.00 N ATOM 734 CA GLU A 44 5.194 10.008 2.049 1.00 0.00 C ATOM 735 C GLU A 44 4.995 8.513 1.817 1.00 0.00 C ATOM 736 O GLU A 44 4.569 8.091 0.741 1.00 0.00 O ATOM 737 CB GLU A 44 5.395 10.721 0.710 1.00 0.00 C ATOM 738 CG GLU A 44 4.884 12.152 0.700 1.00 0.00 C ATOM 739 CD GLU A 44 5.074 12.830 -0.643 1.00 0.00 C ATOM 740 OE1 GLU A 44 6.210 13.258 -0.937 1.00 0.00 O ATOM 741 OE2 GLU A 44 4.087 12.933 -1.401 1.00 0.00 O ATOM 0 H GLU A 44 6.105 10.763 3.781 1.00 0.00 H new ATOM 0 HA GLU A 44 4.302 10.404 2.534 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.457 10.722 0.464 1.00 0.00 H new ATOM 0 HB3 GLU A 44 4.887 10.157 -0.072 1.00 0.00 H new ATOM 0 HG2 GLU A 44 3.825 12.158 0.959 1.00 0.00 H new ATOM 0 HG3 GLU A 44 5.403 12.725 1.469 1.00 0.00 H new ATOM 748 N LYS A 45 5.308 7.716 2.833 1.00 0.00 N ATOM 749 CA LYS A 45 5.164 6.268 2.742 1.00 0.00 C ATOM 750 C LYS A 45 4.082 5.768 3.694 1.00 0.00 C ATOM 751 O LYS A 45 3.866 6.343 4.761 1.00 0.00 O ATOM 752 CB LYS A 45 6.495 5.582 3.060 1.00 0.00 C ATOM 753 CG LYS A 45 6.897 5.683 4.521 1.00 0.00 C ATOM 754 CD LYS A 45 8.270 5.079 4.765 1.00 0.00 C ATOM 755 CE LYS A 45 8.568 4.952 6.251 1.00 0.00 C ATOM 756 NZ LYS A 45 8.923 6.264 6.859 1.00 0.00 N ATOM 0 H LYS A 45 5.663 8.049 3.729 1.00 0.00 H new ATOM 0 HA LYS A 45 4.869 6.020 1.722 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.428 4.530 2.782 1.00 0.00 H new ATOM 0 HB3 LYS A 45 7.278 6.025 2.445 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.899 6.729 4.827 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.159 5.172 5.139 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.325 4.096 4.297 1.00 0.00 H new ATOM 0 HD3 LYS A 45 9.031 5.700 4.292 1.00 0.00 H new ATOM 0 HE2 LYS A 45 7.698 4.538 6.762 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.388 4.250 6.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 8.631 6.274 7.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.951 6.408 6.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 8.435 7.027 6.348 1.00 0.00 H new ATOM 770 N HIS A 46 3.405 4.694 3.301 1.00 0.00 N ATOM 771 CA HIS A 46 2.346 4.116 4.120 1.00 0.00 C ATOM 772 C HIS A 46 2.932 3.305 5.272 1.00 0.00 C ATOM 773 O HIS A 46 3.974 2.666 5.127 1.00 0.00 O ATOM 774 CB HIS A 46 1.438 3.229 3.267 1.00 0.00 C ATOM 775 CG HIS A 46 2.124 2.009 2.732 1.00 0.00 C ATOM 776 ND1 HIS A 46 2.739 1.076 3.540 1.00 0.00 N ATOM 777 CD2 HIS A 46 2.288 1.571 1.462 1.00 0.00 C ATOM 778 CE1 HIS A 46 3.253 0.118 2.790 1.00 0.00 C ATOM 779 NE2 HIS A 46 2.993 0.395 1.525 1.00 0.00 N ATOM 0 H HIS A 46 3.571 4.206 2.421 1.00 0.00 H new ATOM 0 HA HIS A 46 1.756 4.933 4.536 1.00 0.00 H new ATOM 0 HB2 HIS A 46 0.580 2.921 3.864 1.00 0.00 H new ATOM 0 HB3 HIS A 46 1.052 3.814 2.432 1.00 0.00 H new ATOM 0 HD2 HIS A 46 1.931 2.056 0.566 1.00 0.00 H new ATOM 0 HE1 HIS A 46 3.794 -0.745 3.150 1.00 0.00 H new ATOM 0 HE2 HIS A 46 3.271 -0.173 0.725 1.00 0.00 H new ATOM 787 N ARG A 47 2.256 3.337 6.416 1.00 0.00 N ATOM 788 CA ARG A 47 2.711 2.607 7.593 1.00 0.00 C ATOM 789 C ARG A 47 2.260 1.151 7.538 1.00 0.00 C ATOM 790 O ARG A 47 2.343 0.426 8.529 1.00 0.00 O ATOM 791 CB ARG A 47 2.180 3.268 8.866 1.00 0.00 C ATOM 792 CG ARG A 47 3.049 4.411 9.367 1.00 0.00 C ATOM 793 CD ARG A 47 4.327 3.899 10.012 1.00 0.00 C ATOM 794 NE ARG A 47 5.242 4.985 10.352 1.00 0.00 N ATOM 795 CZ ARG A 47 6.551 4.823 10.503 1.00 0.00 C ATOM 796 NH1 ARG A 47 7.097 3.625 10.344 1.00 0.00 N ATOM 797 NH2 ARG A 47 7.318 5.860 10.814 1.00 0.00 N ATOM 0 H ARG A 47 1.391 3.861 6.553 1.00 0.00 H new ATOM 0 HA ARG A 47 3.801 2.632 7.606 1.00 0.00 H new ATOM 0 HB2 ARG A 47 1.174 3.643 8.678 1.00 0.00 H new ATOM 0 HB3 ARG A 47 2.098 2.515 9.649 1.00 0.00 H new ATOM 0 HG2 ARG A 47 3.299 5.071 8.536 1.00 0.00 H new ATOM 0 HG3 ARG A 47 2.489 5.006 10.089 1.00 0.00 H new ATOM 0 HD2 ARG A 47 4.079 3.339 10.913 1.00 0.00 H new ATOM 0 HD3 ARG A 47 4.823 3.206 9.333 1.00 0.00 H new ATOM 0 HE ARG A 47 4.854 5.920 10.481 1.00 0.00 H new ATOM 0 HH11 ARG A 47 6.511 2.825 10.105 1.00 0.00 H new ATOM 0 HH12 ARG A 47 8.103 3.503 10.461 1.00 0.00 H new ATOM 0 HH21 ARG A 47 6.902 6.783 10.937 1.00 0.00 H new ATOM 0 HH22 ARG A 47 8.324 5.734 10.930 1.00 0.00 H new ATOM 811 N GLY A 48 1.782 0.728 6.371 1.00 0.00 N ATOM 812 CA GLY A 48 1.324 -0.639 6.208 1.00 0.00 C ATOM 813 C GLY A 48 -0.177 -0.771 6.366 1.00 0.00 C ATOM 814 O GLY A 48 -0.663 -1.719 6.984 1.00 0.00 O ATOM 0 H GLY A 48 1.704 1.308 5.536 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.616 -1.001 5.222 1.00 0.00 H new ATOM 0 HA3 GLY A 48 1.821 -1.275 6.941 1.00 0.00 H new ATOM 818 N PHE A 49 -0.915 0.183 5.809 1.00 0.00 N ATOM 819 CA PHE A 49 -2.371 0.172 5.893 1.00 0.00 C ATOM 820 C PHE A 49 -2.976 1.263 5.015 1.00 0.00 C ATOM 821 O PHE A 49 -2.280 2.178 4.576 1.00 0.00 O ATOM 822 CB PHE A 49 -2.820 0.361 7.344 1.00 0.00 C ATOM 823 CG PHE A 49 -2.298 1.621 7.973 1.00 0.00 C ATOM 824 CD1 PHE A 49 -2.784 2.859 7.584 1.00 0.00 C ATOM 825 CD2 PHE A 49 -1.321 1.567 8.955 1.00 0.00 C ATOM 826 CE1 PHE A 49 -2.306 4.020 8.161 1.00 0.00 C ATOM 827 CE2 PHE A 49 -0.840 2.725 9.536 1.00 0.00 C ATOM 828 CZ PHE A 49 -1.332 3.953 9.138 1.00 0.00 C ATOM 0 H PHE A 49 -0.529 0.974 5.294 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.723 -0.795 5.533 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -3.909 0.370 7.381 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -2.488 -0.494 7.933 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.546 2.917 6.821 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -0.932 0.610 9.269 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.693 4.978 7.848 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -0.080 2.670 10.301 1.00 0.00 H new ATOM 0 HZ PHE A 49 -0.956 4.859 9.590 1.00 0.00 H new ATOM 838 N ALA A 50 -4.276 1.158 4.762 1.00 0.00 N ATOM 839 CA ALA A 50 -4.976 2.136 3.938 1.00 0.00 C ATOM 840 C ALA A 50 -6.487 1.959 4.040 1.00 0.00 C ATOM 841 O ALA A 50 -6.971 1.045 4.707 1.00 0.00 O ATOM 842 CB ALA A 50 -4.526 2.023 2.489 1.00 0.00 C ATOM 0 H ALA A 50 -4.866 0.405 5.116 1.00 0.00 H new ATOM 0 HA ALA A 50 -4.728 3.131 4.308 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -5.057 2.759 1.885 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.453 2.207 2.426 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.745 1.022 2.117 1.00 0.00 H new ATOM 848 N PHE A 51 -7.227 2.841 3.376 1.00 0.00 N ATOM 849 CA PHE A 51 -8.684 2.783 3.393 1.00 0.00 C ATOM 850 C PHE A 51 -9.234 2.513 1.996 1.00 0.00 C ATOM 851 O PHE A 51 -8.856 3.175 1.029 1.00 0.00 O ATOM 852 CB PHE A 51 -9.261 4.091 3.937 1.00 0.00 C ATOM 853 CG PHE A 51 -8.770 4.436 5.314 1.00 0.00 C ATOM 854 CD1 PHE A 51 -9.234 3.746 6.423 1.00 0.00 C ATOM 855 CD2 PHE A 51 -7.845 5.451 5.501 1.00 0.00 C ATOM 856 CE1 PHE A 51 -8.784 4.061 7.691 1.00 0.00 C ATOM 857 CE2 PHE A 51 -7.391 5.771 6.766 1.00 0.00 C ATOM 858 CZ PHE A 51 -7.861 5.074 7.863 1.00 0.00 C ATOM 0 H PHE A 51 -6.842 3.604 2.820 1.00 0.00 H new ATOM 0 HA PHE A 51 -8.983 1.963 4.046 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -9.006 4.902 3.255 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.348 4.019 3.955 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -9.956 2.953 6.295 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.474 5.999 4.647 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -9.154 3.516 8.547 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -6.670 6.564 6.897 1.00 0.00 H new ATOM 0 HZ PHE A 51 -7.507 5.321 8.853 1.00 0.00 H new ATOM 868 N VAL A 52 -10.130 1.536 1.897 1.00 0.00 N ATOM 869 CA VAL A 52 -10.734 1.179 0.619 1.00 0.00 C ATOM 870 C VAL A 52 -12.255 1.261 0.688 1.00 0.00 C ATOM 871 O VAL A 52 -12.871 0.762 1.629 1.00 0.00 O ATOM 872 CB VAL A 52 -10.326 -0.241 0.184 1.00 0.00 C ATOM 873 CG1 VAL A 52 -10.821 -0.531 -1.225 1.00 0.00 C ATOM 874 CG2 VAL A 52 -8.818 -0.413 0.275 1.00 0.00 C ATOM 0 H VAL A 52 -10.454 0.978 2.687 1.00 0.00 H new ATOM 0 HA VAL A 52 -10.368 1.896 -0.116 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.791 -0.958 0.861 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -10.523 -1.539 -1.515 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -11.908 -0.452 -1.252 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -10.387 0.189 -1.919 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -8.547 -1.422 -0.036 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -8.329 0.311 -0.377 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.495 -0.251 1.303 1.00 0.00 H new ATOM 884 N GLU A 53 -12.854 1.893 -0.317 1.00 0.00 N ATOM 885 CA GLU A 53 -14.304 2.040 -0.369 1.00 0.00 C ATOM 886 C GLU A 53 -14.917 1.038 -1.344 1.00 0.00 C ATOM 887 O GLU A 53 -14.327 0.718 -2.375 1.00 0.00 O ATOM 888 CB GLU A 53 -14.679 3.465 -0.782 1.00 0.00 C ATOM 889 CG GLU A 53 -16.155 3.781 -0.605 1.00 0.00 C ATOM 890 CD GLU A 53 -16.477 5.236 -0.881 1.00 0.00 C ATOM 891 OE1 GLU A 53 -16.092 5.736 -1.959 1.00 0.00 O ATOM 892 OE2 GLU A 53 -17.115 5.876 -0.019 1.00 0.00 O ATOM 0 H GLU A 53 -12.358 2.311 -1.105 1.00 0.00 H new ATOM 0 HA GLU A 53 -14.701 1.842 0.627 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -14.092 4.171 -0.195 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.407 3.615 -1.827 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -16.741 3.150 -1.274 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -16.456 3.533 0.413 1.00 0.00 H new ATOM 899 N PHE A 54 -16.105 0.546 -1.007 1.00 0.00 N ATOM 900 CA PHE A 54 -16.799 -0.420 -1.851 1.00 0.00 C ATOM 901 C PHE A 54 -18.079 0.179 -2.425 1.00 0.00 C ATOM 902 O PHE A 54 -18.738 0.995 -1.781 1.00 0.00 O ATOM 903 CB PHE A 54 -17.128 -1.683 -1.051 1.00 0.00 C ATOM 904 CG PHE A 54 -15.958 -2.612 -0.889 1.00 0.00 C ATOM 905 CD1 PHE A 54 -14.788 -2.175 -0.290 1.00 0.00 C ATOM 906 CD2 PHE A 54 -16.029 -3.921 -1.337 1.00 0.00 C ATOM 907 CE1 PHE A 54 -13.710 -3.027 -0.140 1.00 0.00 C ATOM 908 CE2 PHE A 54 -14.955 -4.778 -1.189 1.00 0.00 C ATOM 909 CZ PHE A 54 -13.793 -4.330 -0.591 1.00 0.00 C ATOM 0 H PHE A 54 -16.607 0.800 -0.156 1.00 0.00 H new ATOM 0 HA PHE A 54 -16.139 -0.682 -2.678 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -17.492 -1.394 -0.065 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -17.939 -2.216 -1.547 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -14.717 -1.157 0.064 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -16.934 -4.276 -1.807 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -12.804 -2.674 0.329 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -15.024 -5.797 -1.540 1.00 0.00 H new ATOM 0 HZ PHE A 54 -12.951 -4.997 -0.476 1.00 0.00 H new ATOM 919 N GLU A 55 -18.423 -0.232 -3.642 1.00 0.00 N ATOM 920 CA GLU A 55 -19.623 0.266 -4.304 1.00 0.00 C ATOM 921 C GLU A 55 -20.863 0.000 -3.455 1.00 0.00 C ATOM 922 O GLU A 55 -21.781 0.820 -3.402 1.00 0.00 O ATOM 923 CB GLU A 55 -19.783 -0.388 -5.678 1.00 0.00 C ATOM 924 CG GLU A 55 -20.534 0.474 -6.679 1.00 0.00 C ATOM 925 CD GLU A 55 -19.822 1.779 -6.976 1.00 0.00 C ATOM 926 OE1 GLU A 55 -18.718 1.734 -7.558 1.00 0.00 O ATOM 927 OE2 GLU A 55 -20.369 2.846 -6.626 1.00 0.00 O ATOM 0 H GLU A 55 -17.888 -0.907 -4.188 1.00 0.00 H new ATOM 0 HA GLU A 55 -19.516 1.343 -4.432 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -18.796 -0.618 -6.078 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -20.309 -1.336 -5.561 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -20.665 -0.083 -7.607 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -21.531 0.688 -6.293 1.00 0.00 H new ATOM 934 N LEU A 56 -20.883 -1.151 -2.793 1.00 0.00 N ATOM 935 CA LEU A 56 -22.010 -1.527 -1.946 1.00 0.00 C ATOM 936 C LEU A 56 -21.532 -1.958 -0.563 1.00 0.00 C ATOM 937 O LEU A 56 -20.350 -2.235 -0.363 1.00 0.00 O ATOM 938 CB LEU A 56 -22.808 -2.658 -2.597 1.00 0.00 C ATOM 939 CG LEU A 56 -23.300 -2.398 -4.022 1.00 0.00 C ATOM 940 CD1 LEU A 56 -23.725 -3.699 -4.686 1.00 0.00 C ATOM 941 CD2 LEU A 56 -24.449 -1.401 -4.015 1.00 0.00 C ATOM 0 H LEU A 56 -20.132 -1.840 -2.826 1.00 0.00 H new ATOM 0 HA LEU A 56 -22.654 -0.655 -1.832 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -22.188 -3.555 -2.606 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -23.672 -2.874 -1.969 1.00 0.00 H new ATOM 0 HG LEU A 56 -22.478 -1.972 -4.598 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -24.072 -3.494 -5.699 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -22.876 -4.382 -4.724 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -24.532 -4.154 -4.111 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -24.787 -1.228 -5.037 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -25.273 -1.800 -3.423 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -24.112 -0.460 -3.580 1.00 0.00 H new ATOM 953 N ALA A 57 -22.460 -2.015 0.387 1.00 0.00 N ATOM 954 CA ALA A 57 -22.134 -2.416 1.750 1.00 0.00 C ATOM 955 C ALA A 57 -21.928 -3.924 1.843 1.00 0.00 C ATOM 956 O ALA A 57 -20.990 -4.393 2.487 1.00 0.00 O ATOM 957 CB ALA A 57 -23.229 -1.971 2.707 1.00 0.00 C ATOM 0 H ALA A 57 -23.443 -1.789 0.238 1.00 0.00 H new ATOM 0 HA ALA A 57 -21.200 -1.930 2.033 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -22.972 -2.277 3.721 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -23.326 -0.886 2.669 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -24.174 -2.431 2.418 1.00 0.00 H new ATOM 963 N GLU A 58 -22.811 -4.679 1.197 1.00 0.00 N ATOM 964 CA GLU A 58 -22.726 -6.135 1.210 1.00 0.00 C ATOM 965 C GLU A 58 -21.382 -6.606 0.661 1.00 0.00 C ATOM 966 O GLU A 58 -20.702 -7.427 1.276 1.00 0.00 O ATOM 967 CB GLU A 58 -23.866 -6.742 0.389 1.00 0.00 C ATOM 968 CG GLU A 58 -23.890 -6.276 -1.057 1.00 0.00 C ATOM 969 CD GLU A 58 -25.086 -6.808 -1.821 1.00 0.00 C ATOM 970 OE1 GLU A 58 -25.273 -8.043 -1.848 1.00 0.00 O ATOM 971 OE2 GLU A 58 -25.837 -5.989 -2.392 1.00 0.00 O ATOM 0 H GLU A 58 -23.593 -4.307 0.658 1.00 0.00 H new ATOM 0 HA GLU A 58 -22.814 -6.470 2.244 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -23.779 -7.828 0.410 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -24.816 -6.489 0.859 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -23.902 -5.186 -1.084 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -22.974 -6.597 -1.554 1.00 0.00 H new ATOM 978 N ASP A 59 -21.008 -6.080 -0.500 1.00 0.00 N ATOM 979 CA ASP A 59 -19.746 -6.445 -1.133 1.00 0.00 C ATOM 980 C ASP A 59 -18.585 -6.305 -0.152 1.00 0.00 C ATOM 981 O ASP A 59 -17.727 -7.182 -0.062 1.00 0.00 O ATOM 982 CB ASP A 59 -19.497 -5.573 -2.364 1.00 0.00 C ATOM 983 CG ASP A 59 -20.394 -5.945 -3.528 1.00 0.00 C ATOM 984 OD1 ASP A 59 -21.481 -6.509 -3.283 1.00 0.00 O ATOM 985 OD2 ASP A 59 -20.009 -5.672 -4.684 1.00 0.00 O ATOM 0 H ASP A 59 -21.560 -5.400 -1.022 1.00 0.00 H new ATOM 0 HA ASP A 59 -19.812 -7.488 -1.443 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -19.660 -4.527 -2.104 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -18.454 -5.668 -2.668 1.00 0.00 H new ATOM 990 N ALA A 60 -18.566 -5.196 0.579 1.00 0.00 N ATOM 991 CA ALA A 60 -17.512 -4.941 1.554 1.00 0.00 C ATOM 992 C ALA A 60 -17.456 -6.047 2.602 1.00 0.00 C ATOM 993 O ALA A 60 -16.398 -6.623 2.855 1.00 0.00 O ATOM 994 CB ALA A 60 -17.724 -3.590 2.219 1.00 0.00 C ATOM 0 H ALA A 60 -19.268 -4.459 0.515 1.00 0.00 H new ATOM 0 HA ALA A 60 -16.558 -4.927 1.027 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -16.930 -3.413 2.944 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -17.706 -2.805 1.463 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -18.688 -3.582 2.727 1.00 0.00 H new ATOM 1000 N ALA A 61 -18.601 -6.338 3.211 1.00 0.00 N ATOM 1001 CA ALA A 61 -18.682 -7.375 4.232 1.00 0.00 C ATOM 1002 C ALA A 61 -18.020 -8.665 3.757 1.00 0.00 C ATOM 1003 O ALA A 61 -17.228 -9.269 4.479 1.00 0.00 O ATOM 1004 CB ALA A 61 -20.133 -7.632 4.610 1.00 0.00 C ATOM 0 H ALA A 61 -19.486 -5.870 3.015 1.00 0.00 H new ATOM 0 HA ALA A 61 -18.146 -7.025 5.114 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -20.178 -8.409 5.373 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -20.576 -6.715 4.999 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -20.686 -7.957 3.729 1.00 0.00 H new ATOM 1010 N ALA A 62 -18.353 -9.081 2.540 1.00 0.00 N ATOM 1011 CA ALA A 62 -17.790 -10.299 1.969 1.00 0.00 C ATOM 1012 C ALA A 62 -16.273 -10.197 1.846 1.00 0.00 C ATOM 1013 O ALA A 62 -15.551 -11.142 2.162 1.00 0.00 O ATOM 1014 CB ALA A 62 -18.414 -10.582 0.611 1.00 0.00 C ATOM 0 H ALA A 62 -19.009 -8.593 1.930 1.00 0.00 H new ATOM 0 HA ALA A 62 -18.019 -11.126 2.641 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -17.985 -11.494 0.196 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.491 -10.707 0.724 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.214 -9.748 -0.062 1.00 0.00 H new ATOM 1020 N ALA A 63 -15.798 -9.046 1.384 1.00 0.00 N ATOM 1021 CA ALA A 63 -14.367 -8.821 1.220 1.00 0.00 C ATOM 1022 C ALA A 63 -13.629 -8.998 2.542 1.00 0.00 C ATOM 1023 O ALA A 63 -12.532 -9.557 2.582 1.00 0.00 O ATOM 1024 CB ALA A 63 -14.112 -7.432 0.653 1.00 0.00 C ATOM 0 H ALA A 63 -16.383 -8.254 1.116 1.00 0.00 H new ATOM 0 HA ALA A 63 -13.986 -9.563 0.518 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -13.039 -7.278 0.536 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -14.600 -7.340 -0.317 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -14.514 -6.682 1.334 1.00 0.00 H new ATOM 1030 N ILE A 64 -14.236 -8.517 3.622 1.00 0.00 N ATOM 1031 CA ILE A 64 -13.635 -8.623 4.946 1.00 0.00 C ATOM 1032 C ILE A 64 -13.503 -10.080 5.375 1.00 0.00 C ATOM 1033 O ILE A 64 -12.410 -10.546 5.698 1.00 0.00 O ATOM 1034 CB ILE A 64 -14.460 -7.862 6.001 1.00 0.00 C ATOM 1035 CG1 ILE A 64 -14.565 -6.382 5.628 1.00 0.00 C ATOM 1036 CG2 ILE A 64 -13.836 -8.024 7.379 1.00 0.00 C ATOM 1037 CD1 ILE A 64 -15.475 -5.592 6.542 1.00 0.00 C ATOM 0 H ILE A 64 -15.143 -8.050 3.606 1.00 0.00 H new ATOM 0 HA ILE A 64 -12.643 -8.175 4.879 1.00 0.00 H new ATOM 0 HB ILE A 64 -15.465 -8.282 6.027 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -13.569 -5.939 5.648 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -14.930 -6.299 4.604 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -14.430 -7.481 8.114 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -13.809 -9.081 7.644 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -12.821 -7.627 7.368 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -15.502 -4.552 6.218 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -16.481 -6.010 6.504 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -15.099 -5.645 7.564 1.00 0.00 H new ATOM 1049 N ASP A 65 -14.622 -10.796 5.373 1.00 0.00 N ATOM 1050 CA ASP A 65 -14.631 -12.202 5.759 1.00 0.00 C ATOM 1051 C ASP A 65 -13.538 -12.974 5.027 1.00 0.00 C ATOM 1052 O ASP A 65 -13.045 -13.987 5.519 1.00 0.00 O ATOM 1053 CB ASP A 65 -15.997 -12.825 5.465 1.00 0.00 C ATOM 1054 CG ASP A 65 -15.994 -14.332 5.629 1.00 0.00 C ATOM 1055 OD1 ASP A 65 -15.177 -14.999 4.962 1.00 0.00 O ATOM 1056 OD2 ASP A 65 -16.809 -14.844 6.425 1.00 0.00 O ATOM 0 H ASP A 65 -15.535 -10.426 5.108 1.00 0.00 H new ATOM 0 HA ASP A 65 -14.437 -12.260 6.830 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -16.742 -12.391 6.132 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -16.296 -12.574 4.447 1.00 0.00 H new ATOM 1061 N ASN A 66 -13.165 -12.486 3.848 1.00 0.00 N ATOM 1062 CA ASN A 66 -12.131 -13.131 3.047 1.00 0.00 C ATOM 1063 C ASN A 66 -10.764 -12.514 3.324 1.00 0.00 C ATOM 1064 O ASN A 66 -9.918 -13.123 3.979 1.00 0.00 O ATOM 1065 CB ASN A 66 -12.464 -13.015 1.558 1.00 0.00 C ATOM 1066 CG ASN A 66 -13.563 -13.969 1.134 1.00 0.00 C ATOM 1067 OD1 ASN A 66 -13.309 -14.966 0.458 1.00 0.00 O ATOM 1068 ND2 ASN A 66 -14.794 -13.667 1.531 1.00 0.00 N ATOM 0 H ASN A 66 -13.563 -11.647 3.427 1.00 0.00 H new ATOM 0 HA ASN A 66 -12.096 -14.185 3.324 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -12.769 -11.992 1.336 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -11.567 -13.215 0.972 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -15.575 -14.272 1.277 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -14.959 -12.830 2.090 1.00 0.00 H new ATOM 1075 N MET A 67 -10.556 -11.302 2.821 1.00 0.00 N ATOM 1076 CA MET A 67 -9.292 -10.601 3.016 1.00 0.00 C ATOM 1077 C MET A 67 -8.804 -10.749 4.454 1.00 0.00 C ATOM 1078 O MET A 67 -7.602 -10.792 4.710 1.00 0.00 O ATOM 1079 CB MET A 67 -9.446 -9.119 2.668 1.00 0.00 C ATOM 1080 CG MET A 67 -9.814 -8.872 1.214 1.00 0.00 C ATOM 1081 SD MET A 67 -8.799 -9.826 0.069 1.00 0.00 S ATOM 1082 CE MET A 67 -7.157 -9.298 0.551 1.00 0.00 C ATOM 0 H MET A 67 -11.246 -10.785 2.276 1.00 0.00 H new ATOM 0 HA MET A 67 -8.552 -11.048 2.352 1.00 0.00 H new ATOM 0 HB2 MET A 67 -10.213 -8.682 3.308 1.00 0.00 H new ATOM 0 HB3 MET A 67 -8.512 -8.603 2.891 1.00 0.00 H new ATOM 0 HG2 MET A 67 -10.863 -9.125 1.061 1.00 0.00 H new ATOM 0 HG3 MET A 67 -9.706 -7.810 0.991 1.00 0.00 H new ATOM 0 HE1 MET A 67 -6.526 -9.217 -0.334 1.00 0.00 H new ATOM 0 HE2 MET A 67 -7.217 -8.327 1.044 1.00 0.00 H new ATOM 0 HE3 MET A 67 -6.727 -10.027 1.238 1.00 0.00 H new ATOM 1092 N ASN A 68 -9.746 -10.826 5.389 1.00 0.00 N ATOM 1093 CA ASN A 68 -9.412 -10.969 6.801 1.00 0.00 C ATOM 1094 C ASN A 68 -8.350 -12.045 7.003 1.00 0.00 C ATOM 1095 O ASN A 68 -8.615 -13.233 6.825 1.00 0.00 O ATOM 1096 CB ASN A 68 -10.664 -11.314 7.611 1.00 0.00 C ATOM 1097 CG ASN A 68 -10.332 -11.803 9.007 1.00 0.00 C ATOM 1098 OD1 ASN A 68 -10.141 -11.008 9.927 1.00 0.00 O ATOM 1099 ND2 ASN A 68 -10.262 -13.119 9.171 1.00 0.00 N ATOM 0 H ASN A 68 -10.747 -10.792 5.194 1.00 0.00 H new ATOM 0 HA ASN A 68 -9.011 -10.018 7.151 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -11.303 -10.434 7.680 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -11.233 -12.081 7.086 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -10.042 -13.508 10.088 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -10.428 -13.741 8.380 1.00 0.00 H new ATOM 1106 N GLU A 69 -7.147 -11.619 7.376 1.00 0.00 N ATOM 1107 CA GLU A 69 -6.045 -12.547 7.602 1.00 0.00 C ATOM 1108 C GLU A 69 -5.715 -13.320 6.328 1.00 0.00 C ATOM 1109 O GLU A 69 -5.418 -14.514 6.374 1.00 0.00 O ATOM 1110 CB GLU A 69 -6.393 -13.522 8.729 1.00 0.00 C ATOM 1111 CG GLU A 69 -6.585 -12.850 10.078 1.00 0.00 C ATOM 1112 CD GLU A 69 -7.141 -13.794 11.126 1.00 0.00 C ATOM 1113 OE1 GLU A 69 -6.680 -14.953 11.184 1.00 0.00 O ATOM 1114 OE2 GLU A 69 -8.038 -13.375 11.887 1.00 0.00 O ATOM 0 H GLU A 69 -6.911 -10.638 7.528 1.00 0.00 H new ATOM 0 HA GLU A 69 -5.169 -11.967 7.891 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.305 -14.057 8.466 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.600 -14.265 8.812 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.629 -12.454 10.422 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.260 -12.001 9.964 1.00 0.00 H new ATOM 1121 N SER A 70 -5.772 -12.631 5.193 1.00 0.00 N ATOM 1122 CA SER A 70 -5.484 -13.253 3.906 1.00 0.00 C ATOM 1123 C SER A 70 -4.001 -13.140 3.568 1.00 0.00 C ATOM 1124 O SER A 70 -3.220 -12.579 4.335 1.00 0.00 O ATOM 1125 CB SER A 70 -6.322 -12.604 2.803 1.00 0.00 C ATOM 1126 OG SER A 70 -7.612 -13.185 2.733 1.00 0.00 O ATOM 0 H SER A 70 -6.015 -11.642 5.138 1.00 0.00 H new ATOM 0 HA SER A 70 -5.743 -14.309 3.975 1.00 0.00 H new ATOM 0 HB2 SER A 70 -6.412 -11.534 2.992 1.00 0.00 H new ATOM 0 HB3 SER A 70 -5.816 -12.717 1.844 1.00 0.00 H new ATOM 0 HG SER A 70 -8.070 -13.069 3.591 1.00 0.00 H new ATOM 1132 N GLU A 71 -3.621 -13.678 2.413 1.00 0.00 N ATOM 1133 CA GLU A 71 -2.231 -13.638 1.972 1.00 0.00 C ATOM 1134 C GLU A 71 -2.056 -12.662 0.813 1.00 0.00 C ATOM 1135 O GLU A 71 -2.674 -12.815 -0.242 1.00 0.00 O ATOM 1136 CB GLU A 71 -1.766 -15.034 1.554 1.00 0.00 C ATOM 1137 CG GLU A 71 -0.305 -15.089 1.138 1.00 0.00 C ATOM 1138 CD GLU A 71 0.151 -16.493 0.793 1.00 0.00 C ATOM 1139 OE1 GLU A 71 0.258 -17.326 1.718 1.00 0.00 O ATOM 1140 OE2 GLU A 71 0.400 -16.760 -0.401 1.00 0.00 O ATOM 0 H GLU A 71 -4.256 -14.146 1.766 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.621 -13.295 2.807 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.926 -15.724 2.382 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.384 -15.381 0.726 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -0.152 -14.439 0.276 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.314 -14.698 1.946 1.00 0.00 H new ATOM 1147 N LEU A 72 -1.209 -11.658 1.015 1.00 0.00 N ATOM 1148 CA LEU A 72 -0.952 -10.656 -0.013 1.00 0.00 C ATOM 1149 C LEU A 72 0.532 -10.309 -0.076 1.00 0.00 C ATOM 1150 O LEU A 72 1.107 -9.817 0.895 1.00 0.00 O ATOM 1151 CB LEU A 72 -1.771 -9.393 0.261 1.00 0.00 C ATOM 1152 CG LEU A 72 -1.835 -8.374 -0.877 1.00 0.00 C ATOM 1153 CD1 LEU A 72 -2.671 -8.912 -2.028 1.00 0.00 C ATOM 1154 CD2 LEU A 72 -2.399 -7.052 -0.378 1.00 0.00 C ATOM 0 H LEU A 72 -0.689 -11.517 1.881 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.250 -11.074 -0.975 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.789 -9.692 0.512 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.357 -8.900 1.141 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.822 -8.200 -1.241 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.706 -8.173 -2.829 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -2.224 -9.833 -2.403 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -3.683 -9.116 -1.678 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.437 -6.339 -1.201 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.404 -7.210 0.013 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.760 -6.659 0.413 1.00 0.00 H new ATOM 1166 N PHE A 73 1.147 -10.567 -1.226 1.00 0.00 N ATOM 1167 CA PHE A 73 2.564 -10.281 -1.416 1.00 0.00 C ATOM 1168 C PHE A 73 3.419 -11.112 -0.463 1.00 0.00 C ATOM 1169 O PHE A 73 4.417 -10.631 0.072 1.00 0.00 O ATOM 1170 CB PHE A 73 2.839 -8.792 -1.200 1.00 0.00 C ATOM 1171 CG PHE A 73 2.706 -7.970 -2.450 1.00 0.00 C ATOM 1172 CD1 PHE A 73 1.582 -8.082 -3.252 1.00 0.00 C ATOM 1173 CD2 PHE A 73 3.705 -7.085 -2.823 1.00 0.00 C ATOM 1174 CE1 PHE A 73 1.456 -7.327 -4.403 1.00 0.00 C ATOM 1175 CE2 PHE A 73 3.584 -6.327 -3.972 1.00 0.00 C ATOM 1176 CZ PHE A 73 2.459 -6.449 -4.764 1.00 0.00 C ATOM 0 H PHE A 73 0.686 -10.974 -2.040 1.00 0.00 H new ATOM 0 HA PHE A 73 2.829 -10.547 -2.439 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.149 -8.409 -0.448 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.846 -8.671 -0.801 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.795 -8.767 -2.975 1.00 0.00 H new ATOM 0 HD2 PHE A 73 4.588 -6.987 -2.209 1.00 0.00 H new ATOM 0 HE1 PHE A 73 0.574 -7.424 -5.019 1.00 0.00 H new ATOM 0 HE2 PHE A 73 4.369 -5.639 -4.251 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.364 -5.859 -5.664 1.00 0.00 H new ATOM 1186 N GLY A 74 3.019 -12.363 -0.256 1.00 0.00 N ATOM 1187 CA GLY A 74 3.759 -13.240 0.632 1.00 0.00 C ATOM 1188 C GLY A 74 3.677 -12.801 2.081 1.00 0.00 C ATOM 1189 O GLY A 74 4.557 -13.117 2.883 1.00 0.00 O ATOM 0 H GLY A 74 2.196 -12.784 -0.687 1.00 0.00 H new ATOM 0 HA2 GLY A 74 3.372 -14.255 0.541 1.00 0.00 H new ATOM 0 HA3 GLY A 74 4.804 -13.268 0.323 1.00 0.00 H new ATOM 1193 N ARG A 75 2.620 -12.070 2.417 1.00 0.00 N ATOM 1194 CA ARG A 75 2.429 -11.584 3.779 1.00 0.00 C ATOM 1195 C ARG A 75 0.977 -11.751 4.217 1.00 0.00 C ATOM 1196 O ARG A 75 0.104 -12.063 3.406 1.00 0.00 O ATOM 1197 CB ARG A 75 2.838 -10.113 3.880 1.00 0.00 C ATOM 1198 CG ARG A 75 4.261 -9.843 3.420 1.00 0.00 C ATOM 1199 CD ARG A 75 4.458 -8.383 3.045 1.00 0.00 C ATOM 1200 NE ARG A 75 4.863 -7.574 4.190 1.00 0.00 N ATOM 1201 CZ ARG A 75 6.075 -7.623 4.733 1.00 0.00 C ATOM 1202 NH1 ARG A 75 6.994 -8.439 4.236 1.00 0.00 N ATOM 1203 NH2 ARG A 75 6.368 -6.855 5.775 1.00 0.00 N ATOM 0 H ARG A 75 1.883 -11.801 1.766 1.00 0.00 H new ATOM 0 HA ARG A 75 3.060 -12.176 4.442 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.152 -9.512 3.283 1.00 0.00 H new ATOM 0 HB3 ARG A 75 2.731 -9.785 4.914 1.00 0.00 H new ATOM 0 HG2 ARG A 75 4.958 -10.113 4.213 1.00 0.00 H new ATOM 0 HG3 ARG A 75 4.493 -10.474 2.562 1.00 0.00 H new ATOM 0 HD2 ARG A 75 5.214 -8.308 2.263 1.00 0.00 H new ATOM 0 HD3 ARG A 75 3.531 -7.987 2.631 1.00 0.00 H new ATOM 0 HE ARG A 75 4.178 -6.936 4.596 1.00 0.00 H new ATOM 0 HH11 ARG A 75 6.771 -9.031 3.435 1.00 0.00 H new ATOM 0 HH12 ARG A 75 7.924 -8.475 4.654 1.00 0.00 H new ATOM 0 HH21 ARG A 75 5.663 -6.227 6.160 1.00 0.00 H new ATOM 0 HH22 ARG A 75 7.298 -6.893 6.191 1.00 0.00 H new ATOM 1217 N THR A 76 0.725 -11.541 5.505 1.00 0.00 N ATOM 1218 CA THR A 76 -0.620 -11.670 6.051 1.00 0.00 C ATOM 1219 C THR A 76 -1.199 -10.307 6.414 1.00 0.00 C ATOM 1220 O THR A 76 -0.833 -9.717 7.430 1.00 0.00 O ATOM 1221 CB THR A 76 -0.635 -12.570 7.301 1.00 0.00 C ATOM 1222 OG1 THR A 76 -0.032 -13.834 7.002 1.00 0.00 O ATOM 1223 CG2 THR A 76 -2.057 -12.785 7.796 1.00 0.00 C ATOM 0 H THR A 76 1.435 -11.281 6.190 1.00 0.00 H new ATOM 0 HA THR A 76 -1.233 -12.128 5.275 1.00 0.00 H new ATOM 0 HB THR A 76 -0.065 -12.073 8.086 1.00 0.00 H new ATOM 0 HG1 THR A 76 -0.044 -14.400 7.802 1.00 0.00 H new ATOM 0 HG21 THR A 76 -2.042 -13.424 8.679 1.00 0.00 H new ATOM 0 HG22 THR A 76 -2.503 -11.824 8.051 1.00 0.00 H new ATOM 0 HG23 THR A 76 -2.647 -13.262 7.013 1.00 0.00 H new ATOM 1231 N ILE A 77 -2.105 -9.812 5.577 1.00 0.00 N ATOM 1232 CA ILE A 77 -2.736 -8.519 5.811 1.00 0.00 C ATOM 1233 C ILE A 77 -3.989 -8.666 6.666 1.00 0.00 C ATOM 1234 O ILE A 77 -4.627 -9.719 6.676 1.00 0.00 O ATOM 1235 CB ILE A 77 -3.109 -7.827 4.487 1.00 0.00 C ATOM 1236 CG1 ILE A 77 -4.029 -8.726 3.658 1.00 0.00 C ATOM 1237 CG2 ILE A 77 -1.855 -7.475 3.701 1.00 0.00 C ATOM 1238 CD1 ILE A 77 -4.807 -7.980 2.596 1.00 0.00 C ATOM 0 H ILE A 77 -2.418 -10.287 4.731 1.00 0.00 H new ATOM 0 HA ILE A 77 -2.008 -7.904 6.340 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.642 -6.904 4.715 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.431 -9.502 3.181 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.730 -9.228 4.325 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.136 -6.987 2.768 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.233 -6.801 4.291 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.296 -8.385 3.481 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.438 -8.680 2.048 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -5.432 -7.222 3.068 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.113 -7.500 1.906 1.00 0.00 H new ATOM 1250 N ARG A 78 -4.338 -7.602 7.382 1.00 0.00 N ATOM 1251 CA ARG A 78 -5.516 -7.612 8.241 1.00 0.00 C ATOM 1252 C ARG A 78 -6.594 -6.679 7.696 1.00 0.00 C ATOM 1253 O ARG A 78 -6.313 -5.540 7.324 1.00 0.00 O ATOM 1254 CB ARG A 78 -5.140 -7.197 9.664 1.00 0.00 C ATOM 1255 CG ARG A 78 -6.122 -7.680 10.719 1.00 0.00 C ATOM 1256 CD ARG A 78 -5.433 -7.920 12.053 1.00 0.00 C ATOM 1257 NE ARG A 78 -6.379 -7.917 13.166 1.00 0.00 N ATOM 1258 CZ ARG A 78 -6.951 -6.816 13.641 1.00 0.00 C ATOM 1259 NH1 ARG A 78 -6.676 -5.636 13.101 1.00 0.00 N ATOM 1260 NH2 ARG A 78 -7.802 -6.894 14.656 1.00 0.00 N ATOM 0 H ARG A 78 -3.822 -6.722 7.384 1.00 0.00 H new ATOM 0 HA ARG A 78 -5.913 -8.627 8.259 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -4.149 -7.586 9.897 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -5.075 -6.110 9.711 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -6.914 -6.942 10.845 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -6.596 -8.602 10.382 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -4.910 -8.876 12.024 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -4.679 -7.149 12.216 1.00 0.00 H new ATOM 0 HE ARG A 78 -6.613 -8.809 13.602 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -6.024 -5.572 12.319 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -7.117 -4.792 13.468 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -8.018 -7.800 15.072 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -8.241 -6.048 15.020 1.00 0.00 H new ATOM 1274 N VAL A 79 -7.828 -7.171 7.651 1.00 0.00 N ATOM 1275 CA VAL A 79 -8.948 -6.382 7.153 1.00 0.00 C ATOM 1276 C VAL A 79 -10.057 -6.283 8.194 1.00 0.00 C ATOM 1277 O VAL A 79 -10.368 -7.256 8.879 1.00 0.00 O ATOM 1278 CB VAL A 79 -9.527 -6.984 5.858 1.00 0.00 C ATOM 1279 CG1 VAL A 79 -10.680 -6.137 5.344 1.00 0.00 C ATOM 1280 CG2 VAL A 79 -8.440 -7.119 4.802 1.00 0.00 C ATOM 0 H VAL A 79 -8.077 -8.113 7.954 1.00 0.00 H new ATOM 0 HA VAL A 79 -8.563 -5.385 6.941 1.00 0.00 H new ATOM 0 HB VAL A 79 -9.911 -7.979 6.080 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -11.076 -6.578 4.429 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.467 -6.097 6.098 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.325 -5.127 5.136 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -8.866 -7.546 3.894 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -8.024 -6.136 4.581 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -7.650 -7.772 5.174 1.00 0.00 H new ATOM 1290 N ASN A 80 -10.651 -5.099 8.307 1.00 0.00 N ATOM 1291 CA ASN A 80 -11.727 -4.872 9.265 1.00 0.00 C ATOM 1292 C ASN A 80 -12.361 -3.500 9.056 1.00 0.00 C ATOM 1293 O ASN A 80 -11.798 -2.641 8.376 1.00 0.00 O ATOM 1294 CB ASN A 80 -11.196 -4.988 10.695 1.00 0.00 C ATOM 1295 CG ASN A 80 -12.295 -5.289 11.697 1.00 0.00 C ATOM 1296 OD1 ASN A 80 -13.406 -5.663 11.322 1.00 0.00 O ATOM 1297 ND2 ASN A 80 -11.988 -5.126 12.978 1.00 0.00 N ATOM 0 H ASN A 80 -10.405 -4.282 7.747 1.00 0.00 H new ATOM 0 HA ASN A 80 -12.490 -5.633 9.104 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -10.444 -5.775 10.738 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -10.700 -4.058 10.972 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -12.686 -5.313 13.698 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -11.054 -4.814 13.243 1.00 0.00 H new ATOM 1304 N LEU A 81 -13.536 -3.302 9.644 1.00 0.00 N ATOM 1305 CA LEU A 81 -14.248 -2.035 9.523 1.00 0.00 C ATOM 1306 C LEU A 81 -13.337 -0.863 9.875 1.00 0.00 C ATOM 1307 O LEU A 81 -12.659 -0.878 10.901 1.00 0.00 O ATOM 1308 CB LEU A 81 -15.478 -2.030 10.431 1.00 0.00 C ATOM 1309 CG LEU A 81 -16.707 -2.770 9.901 1.00 0.00 C ATOM 1310 CD1 LEU A 81 -17.811 -2.790 10.947 1.00 0.00 C ATOM 1311 CD2 LEU A 81 -17.202 -2.127 8.614 1.00 0.00 C ATOM 0 H LEU A 81 -14.015 -4.003 10.209 1.00 0.00 H new ATOM 0 HA LEU A 81 -14.569 -1.924 8.487 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -15.199 -2.469 11.389 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -15.758 -0.994 10.624 1.00 0.00 H new ATOM 0 HG LEU A 81 -16.422 -3.799 9.684 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -18.677 -3.321 10.552 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -17.453 -3.296 11.844 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -18.095 -1.767 11.196 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -18.077 -2.666 8.251 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -17.470 -1.088 8.806 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -16.414 -2.165 7.862 1.00 0.00 H new ATOM 1323 N ALA A 82 -13.329 0.152 9.016 1.00 0.00 N ATOM 1324 CA ALA A 82 -12.505 1.334 9.239 1.00 0.00 C ATOM 1325 C ALA A 82 -13.047 2.172 10.391 1.00 0.00 C ATOM 1326 O ALA A 82 -14.236 2.116 10.709 1.00 0.00 O ATOM 1327 CB ALA A 82 -12.425 2.168 7.969 1.00 0.00 C ATOM 0 H ALA A 82 -13.883 0.179 8.160 1.00 0.00 H new ATOM 0 HA ALA A 82 -11.502 1.002 9.507 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -11.807 3.047 8.150 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -11.984 1.572 7.170 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.427 2.483 7.677 1.00 0.00 H new ATOM 1333 N LYS A 83 -12.169 2.949 11.016 1.00 0.00 N ATOM 1334 CA LYS A 83 -12.559 3.800 12.134 1.00 0.00 C ATOM 1335 C LYS A 83 -12.804 5.232 11.668 1.00 0.00 C ATOM 1336 O LYS A 83 -12.165 5.726 10.738 1.00 0.00 O ATOM 1337 CB LYS A 83 -11.478 3.783 13.216 1.00 0.00 C ATOM 1338 CG LYS A 83 -10.270 4.643 12.883 1.00 0.00 C ATOM 1339 CD LYS A 83 -9.060 4.250 13.714 1.00 0.00 C ATOM 1340 CE LYS A 83 -7.786 4.886 13.178 1.00 0.00 C ATOM 1341 NZ LYS A 83 -7.311 4.215 11.937 1.00 0.00 N ATOM 0 H LYS A 83 -11.182 3.007 10.767 1.00 0.00 H new ATOM 0 HA LYS A 83 -13.487 3.408 12.550 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.911 4.127 14.155 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -11.150 2.756 13.374 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.033 4.544 11.824 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.509 5.692 13.060 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -9.213 4.556 14.749 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -8.954 3.165 13.714 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -7.965 5.942 12.974 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -7.007 4.836 13.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -6.367 4.573 11.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -7.262 3.188 12.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -7.972 4.414 11.160 1.00 0.00 H new ATOM 1355 N PRO A 84 -13.750 5.917 12.328 1.00 0.00 N ATOM 1356 CA PRO A 84 -14.099 7.302 12.000 1.00 0.00 C ATOM 1357 C PRO A 84 -12.992 8.282 12.371 1.00 0.00 C ATOM 1358 O PRO A 84 -12.782 8.579 13.547 1.00 0.00 O ATOM 1359 CB PRO A 84 -15.350 7.562 12.844 1.00 0.00 C ATOM 1360 CG PRO A 84 -15.238 6.614 13.988 1.00 0.00 C ATOM 1361 CD PRO A 84 -14.551 5.391 13.446 1.00 0.00 C ATOM 0 HA PRO A 84 -14.254 7.441 10.930 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -15.388 8.595 13.188 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -16.259 7.384 12.270 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -14.665 7.054 14.805 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -16.222 6.365 14.386 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -13.924 4.915 14.200 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -15.269 4.643 13.109 1.00 0.00 H new ATOM 1369 N MET A 85 -12.288 8.782 11.361 1.00 0.00 N ATOM 1370 CA MET A 85 -11.203 9.731 11.583 1.00 0.00 C ATOM 1371 C MET A 85 -11.682 11.164 11.371 1.00 0.00 C ATOM 1372 O MET A 85 -11.330 12.065 12.133 1.00 0.00 O ATOM 1373 CB MET A 85 -10.032 9.429 10.645 1.00 0.00 C ATOM 1374 CG MET A 85 -8.942 10.488 10.672 1.00 0.00 C ATOM 1375 SD MET A 85 -8.246 10.726 12.318 1.00 0.00 S ATOM 1376 CE MET A 85 -8.345 12.508 12.473 1.00 0.00 C ATOM 0 H MET A 85 -12.449 8.546 10.382 1.00 0.00 H new ATOM 0 HA MET A 85 -10.869 9.627 12.615 1.00 0.00 H new ATOM 0 HB2 MET A 85 -9.599 8.466 10.917 1.00 0.00 H new ATOM 0 HB3 MET A 85 -10.409 9.333 9.627 1.00 0.00 H new ATOM 0 HG2 MET A 85 -8.147 10.203 9.983 1.00 0.00 H new ATOM 0 HG3 MET A 85 -9.350 11.433 10.314 1.00 0.00 H new ATOM 0 HE1 MET A 85 -7.343 12.918 12.601 1.00 0.00 H new ATOM 0 HE2 MET A 85 -8.796 12.927 11.574 1.00 0.00 H new ATOM 0 HE3 MET A 85 -8.956 12.765 13.339 1.00 0.00 H new ATOM 1386 N ARG A 86 -12.485 11.367 10.332 1.00 0.00 N ATOM 1387 CA ARG A 86 -13.010 12.691 10.020 1.00 0.00 C ATOM 1388 C ARG A 86 -13.222 13.505 11.292 1.00 0.00 C ATOM 1389 O ARG A 86 -13.848 13.038 12.244 1.00 0.00 O ATOM 1390 CB ARG A 86 -14.328 12.571 9.253 1.00 0.00 C ATOM 1391 CG ARG A 86 -14.152 12.520 7.744 1.00 0.00 C ATOM 1392 CD ARG A 86 -14.112 13.915 7.140 1.00 0.00 C ATOM 1393 NE ARG A 86 -14.140 13.880 5.680 1.00 0.00 N ATOM 1394 CZ ARG A 86 -13.065 13.668 4.929 1.00 0.00 C ATOM 1395 NH1 ARG A 86 -11.884 13.471 5.497 1.00 0.00 N ATOM 1396 NH2 ARG A 86 -13.172 13.651 3.606 1.00 0.00 N ATOM 0 H ARG A 86 -12.786 10.632 9.692 1.00 0.00 H new ATOM 0 HA ARG A 86 -12.280 13.207 9.397 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -14.848 11.671 9.580 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -14.965 13.418 9.508 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -13.230 11.991 7.502 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -14.971 11.954 7.300 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -14.961 14.493 7.505 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -13.210 14.429 7.473 1.00 0.00 H new ATOM 0 HE ARG A 86 -15.034 14.026 5.211 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -11.799 13.482 6.513 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -11.060 13.308 4.918 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -14.080 13.801 3.166 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -12.346 13.488 3.030 1.00 0.00 H new ATOM 1410 N ILE A 87 -12.696 14.725 11.302 1.00 0.00 N ATOM 1411 CA ILE A 87 -12.827 15.605 12.457 1.00 0.00 C ATOM 1412 C ILE A 87 -13.794 16.748 12.170 1.00 0.00 C ATOM 1413 O ILE A 87 -14.045 17.089 11.013 1.00 0.00 O ATOM 1414 CB ILE A 87 -11.467 16.191 12.877 1.00 0.00 C ATOM 1415 CG1 ILE A 87 -10.958 17.167 11.814 1.00 0.00 C ATOM 1416 CG2 ILE A 87 -10.457 15.076 13.106 1.00 0.00 C ATOM 1417 CD1 ILE A 87 -10.199 16.496 10.691 1.00 0.00 C ATOM 0 H ILE A 87 -12.175 15.127 10.523 1.00 0.00 H new ATOM 0 HA ILE A 87 -13.218 14.997 13.273 1.00 0.00 H new ATOM 0 HB ILE A 87 -11.596 16.735 13.812 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -11.805 17.710 11.395 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -10.311 17.904 12.289 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.501 15.507 13.402 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -10.817 14.415 13.894 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -10.329 14.506 12.185 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -9.868 17.248 9.975 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -9.332 15.976 11.098 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -10.849 15.779 10.190 1.00 0.00 H new ATOM 1429 N LYS A 88 -14.334 17.340 13.230 1.00 0.00 N ATOM 1430 CA LYS A 88 -15.272 18.448 13.093 1.00 0.00 C ATOM 1431 C LYS A 88 -15.457 19.171 14.424 1.00 0.00 C ATOM 1432 O LYS A 88 -15.343 18.567 15.489 1.00 0.00 O ATOM 1433 CB LYS A 88 -16.623 17.941 12.584 1.00 0.00 C ATOM 1434 CG LYS A 88 -17.403 18.977 11.794 1.00 0.00 C ATOM 1435 CD LYS A 88 -18.839 18.537 11.564 1.00 0.00 C ATOM 1436 CE LYS A 88 -19.695 19.681 11.041 1.00 0.00 C ATOM 1437 NZ LYS A 88 -21.097 19.252 10.784 1.00 0.00 N ATOM 0 H LYS A 88 -14.138 17.071 14.194 1.00 0.00 H new ATOM 0 HA LYS A 88 -14.860 19.152 12.370 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -16.460 17.065 11.956 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -17.224 17.617 13.434 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -17.394 19.927 12.329 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -16.915 19.147 10.834 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -18.858 17.712 10.852 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -19.260 18.163 12.497 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -19.692 20.497 11.764 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -19.259 20.069 10.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -21.648 20.060 10.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -21.103 18.491 10.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -21.522 18.905 11.668 1.00 0.00 H new ATOM 1451 N GLU A 89 -15.744 20.467 14.353 1.00 0.00 N ATOM 1452 CA GLU A 89 -15.945 21.271 15.553 1.00 0.00 C ATOM 1453 C GLU A 89 -16.754 22.526 15.238 1.00 0.00 C ATOM 1454 O GLU A 89 -16.241 23.475 14.645 1.00 0.00 O ATOM 1455 CB GLU A 89 -14.598 21.660 16.165 1.00 0.00 C ATOM 1456 CG GLU A 89 -14.712 22.264 17.555 1.00 0.00 C ATOM 1457 CD GLU A 89 -13.366 22.656 18.133 1.00 0.00 C ATOM 1458 OE1 GLU A 89 -12.596 21.748 18.508 1.00 0.00 O ATOM 1459 OE2 GLU A 89 -13.084 23.870 18.211 1.00 0.00 O ATOM 0 H GLU A 89 -15.842 20.982 13.478 1.00 0.00 H new ATOM 0 HA GLU A 89 -16.503 20.671 16.272 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -13.962 20.776 16.213 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -14.102 22.374 15.507 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -15.355 23.143 17.513 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -15.194 21.547 18.220 1.00 0.00 H new ATOM 1466 N SER A 90 -18.021 22.522 15.639 1.00 0.00 N ATOM 1467 CA SER A 90 -18.903 23.658 15.396 1.00 0.00 C ATOM 1468 C SER A 90 -19.945 23.783 16.503 1.00 0.00 C ATOM 1469 O SER A 90 -19.981 22.977 17.432 1.00 0.00 O ATOM 1470 CB SER A 90 -19.597 23.511 14.040 1.00 0.00 C ATOM 1471 OG SER A 90 -18.691 23.743 12.976 1.00 0.00 O ATOM 0 H SER A 90 -18.460 21.745 16.133 1.00 0.00 H new ATOM 0 HA SER A 90 -18.296 24.563 15.389 1.00 0.00 H new ATOM 0 HB2 SER A 90 -20.019 22.510 13.951 1.00 0.00 H new ATOM 0 HB3 SER A 90 -20.427 24.214 13.975 1.00 0.00 H new ATOM 0 HG SER A 90 -17.784 23.844 13.334 1.00 0.00 H new ATOM 1477 N GLY A 91 -20.794 24.801 16.396 1.00 0.00 N ATOM 1478 CA GLY A 91 -21.826 25.014 17.394 1.00 0.00 C ATOM 1479 C GLY A 91 -23.155 25.406 16.779 1.00 0.00 C ATOM 1480 O GLY A 91 -23.499 26.585 16.691 1.00 0.00 O ATOM 0 H GLY A 91 -20.785 25.482 15.636 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -21.954 24.104 17.979 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -21.504 25.794 18.084 1.00 0.00 H new ATOM 1484 N PRO A 92 -23.927 24.401 16.339 1.00 0.00 N ATOM 1485 CA PRO A 92 -25.237 24.622 15.720 1.00 0.00 C ATOM 1486 C PRO A 92 -26.276 25.111 16.723 1.00 0.00 C ATOM 1487 O PRO A 92 -25.968 25.331 17.894 1.00 0.00 O ATOM 1488 CB PRO A 92 -25.617 23.237 15.189 1.00 0.00 C ATOM 1489 CG PRO A 92 -24.866 22.282 16.052 1.00 0.00 C ATOM 1490 CD PRO A 92 -23.580 22.972 16.412 1.00 0.00 C ATOM 0 HA PRO A 92 -25.199 25.393 14.950 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -26.692 23.069 15.255 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -25.340 23.125 14.141 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -25.438 22.031 16.946 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -24.673 21.348 15.524 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -23.239 22.692 17.409 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -22.779 22.717 15.718 1.00 0.00 H new ATOM 1498 N SER A 93 -27.509 25.280 16.256 1.00 0.00 N ATOM 1499 CA SER A 93 -28.594 25.746 17.111 1.00 0.00 C ATOM 1500 C SER A 93 -29.943 25.581 16.418 1.00 0.00 C ATOM 1501 O SER A 93 -30.149 26.078 15.311 1.00 0.00 O ATOM 1502 CB SER A 93 -28.379 27.213 17.489 1.00 0.00 C ATOM 1503 OG SER A 93 -28.562 28.061 16.368 1.00 0.00 O ATOM 0 H SER A 93 -27.781 25.101 15.289 1.00 0.00 H new ATOM 0 HA SER A 93 -28.595 25.140 18.017 1.00 0.00 H new ATOM 0 HB2 SER A 93 -29.075 27.494 18.279 1.00 0.00 H new ATOM 0 HB3 SER A 93 -27.374 27.345 17.889 1.00 0.00 H new ATOM 0 HG SER A 93 -29.034 27.572 15.662 1.00 0.00 H new ATOM 1509 N SER A 94 -30.858 24.877 17.078 1.00 0.00 N ATOM 1510 CA SER A 94 -32.186 24.642 16.524 1.00 0.00 C ATOM 1511 C SER A 94 -33.201 25.615 17.115 1.00 0.00 C ATOM 1512 O SER A 94 -33.076 26.039 18.264 1.00 0.00 O ATOM 1513 CB SER A 94 -32.626 23.202 16.794 1.00 0.00 C ATOM 1514 OG SER A 94 -32.820 22.979 18.180 1.00 0.00 O ATOM 0 H SER A 94 -30.704 24.460 17.996 1.00 0.00 H new ATOM 0 HA SER A 94 -32.138 24.804 15.447 1.00 0.00 H new ATOM 0 HB2 SER A 94 -33.551 22.994 16.256 1.00 0.00 H new ATOM 0 HB3 SER A 94 -31.874 22.511 16.413 1.00 0.00 H new ATOM 0 HG SER A 94 -33.102 22.052 18.326 1.00 0.00 H new ATOM 1520 N GLY A 95 -34.208 25.966 16.321 1.00 0.00 N ATOM 1521 CA GLY A 95 -35.231 26.887 16.781 1.00 0.00 C ATOM 1522 C GLY A 95 -36.576 26.633 16.129 1.00 0.00 C ATOM 1523 O GLY A 95 -37.401 25.892 16.662 1.00 0.00 O ATOM 0 H GLY A 95 -34.334 25.629 15.367 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -35.333 26.801 17.863 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -34.916 27.909 16.571 1.00 0.00 H new TER 1527 GLY A 95