USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 821 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 75 LYS NZ :NH3+ 176:sc= 0.766 (180deg=-0.0634) USER MOD Set 1.2: A 85 ASN : amide:sc= 0.782 K(o=1.5,f=-6!) USER MOD Set 2.1: A 38 HIS : no HD1:sc= -2.19 X(o=-4.3,f=-4.5!) USER MOD Set 2.2: A 89 THR OG1 : rot 170:sc= -2.09! USER MOD Set 3.1: A 24 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 28 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Set 4.1: A 23 ASN : amide:sc= 0.862 K(o=0.43,f=-0.65) USER MOD Set 4.2: A 66 MET CE :methyl -132:sc= -0.434 (180deg=-0.36) USER MOD Set 5.1: A 19 GLN : amide:sc= -0.192 K(o=-0.21,f=-1.8) USER MOD Set 5.2: A 62 LYS NZ :NH3+ -164:sc= -0.0129 (180deg=-0.228) USER MOD Set 6.1: A 12 LYS NZ :NH3+ 144:sc= 1.11 (180deg=0) USER MOD Set 6.2: A 83 TYR OH : rot 30:sc= 0.943 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -115:sc= 1.29 (180deg=-0.771) USER MOD Single : A 14 SER OG : rot 112:sc= 0.0211 USER MOD Single : A 16 LYS NZ :NH3+ 171:sc= 0.708 (180deg=0.658) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ -179:sc= 0.881 (180deg=0.877) USER MOD Single : A 35 GLN : amide:sc= 0.0027 K(o=0.0027,f=-0.63) USER MOD Single : A 37 LYS NZ :NH3+ 151:sc= 1.16 (180deg=1.1) USER MOD Single : A 46 LYS NZ :NH3+ -168:sc= -0.0119 (180deg=-0.167) USER MOD Single : A 50 MET CE :methyl -158:sc= -0.123 (180deg=-0.708) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 66:sc= 0.99 USER MOD Single : A 69 ASN : amide:sc= 0.768 K(o=0.77,f=-0.092) USER MOD Single : A 72 ASN : amide:sc= -0.0483 X(o=-0.048,f=-0.038) USER MOD Single : A 78 ASN : amide:sc= -0.0579 K(o=-0.058,f=-2) USER MOD Single : A 86 MET CE :methyl -127:sc= -0.599 (180deg=-1.34) USER MOD Single : A 91 LYS NZ :NH3+ 144:sc= -0.875 (180deg=-1.34!) USER MOD Single : A 92 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0536) USER MOD Single : A 96 HIS : no HD1:sc= 0.625 K(o=0.63,f=-2.6!) USER MOD Single : A 97 HIS : no HD1:sc= -0.446 K(o=-0.45,f=-1.5!) USER MOD Single : A 98 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 99 HIS : no HD1:sc= -0.147 X(o=-0.15,f=-0.54) USER MOD Single : A 100 HIS : no HD1:sc= 0.104 K(o=0.1,f=-0.96) USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 4 -7.659 -45.893 14.829 1.00 0.00 N ATOM 2 CA LYS A 4 -8.828 -46.655 14.410 1.00 0.00 C ATOM 3 C LYS A 4 -9.996 -46.361 15.338 1.00 0.00 C ATOM 4 O LYS A 4 -11.000 -47.069 15.333 1.00 0.00 O ATOM 5 CB LYS A 4 -8.527 -48.153 14.409 1.00 0.00 C ATOM 6 CG LYS A 4 -7.483 -48.581 13.385 1.00 0.00 C ATOM 7 CD LYS A 4 -7.182 -50.069 13.490 1.00 0.00 C ATOM 8 CE LYS A 4 -8.406 -50.908 13.140 1.00 0.00 C ATOM 9 NZ LYS A 4 -8.124 -52.364 13.204 1.00 0.00 N ATOM 0 HA LYS A 4 -9.090 -46.356 13.395 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.185 -48.444 15.402 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -9.452 -48.698 14.218 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.839 -48.350 12.381 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -6.566 -48.011 13.537 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -6.360 -50.324 12.821 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -6.854 -50.305 14.502 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -9.218 -50.666 13.826 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -8.747 -50.649 12.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -8.984 -52.895 12.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -7.367 -52.601 12.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -7.823 -52.617 14.167 1.00 0.00 H new ATOM 23 N VAL A 5 -9.848 -45.280 16.108 1.00 0.00 N ATOM 24 CA VAL A 5 -10.826 -44.861 17.108 1.00 0.00 C ATOM 25 C VAL A 5 -10.782 -45.801 18.305 1.00 0.00 C ATOM 26 O VAL A 5 -11.405 -46.868 18.307 1.00 0.00 O ATOM 27 CB VAL A 5 -12.270 -44.775 16.539 1.00 0.00 C ATOM 28 CG1 VAL A 5 -13.275 -44.459 17.635 1.00 0.00 C ATOM 29 CG2 VAL A 5 -12.344 -43.729 15.436 1.00 0.00 C ATOM 0 H VAL A 5 -9.035 -44.666 16.052 1.00 0.00 H new ATOM 0 HA VAL A 5 -10.553 -43.854 17.422 1.00 0.00 H new ATOM 0 HB VAL A 5 -12.524 -45.748 16.119 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -14.276 -44.405 17.206 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -13.246 -45.243 18.392 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -13.025 -43.502 18.093 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -13.361 -43.681 15.048 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -12.063 -42.756 15.838 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -11.661 -44.000 14.631 1.00 0.00 H new ATOM 39 N ILE A 6 -10.017 -45.411 19.308 1.00 0.00 N ATOM 40 CA ILE A 6 -9.864 -46.218 20.500 1.00 0.00 C ATOM 41 C ILE A 6 -10.637 -45.605 21.659 1.00 0.00 C ATOM 42 O ILE A 6 -10.437 -44.433 22.013 1.00 0.00 O ATOM 43 CB ILE A 6 -8.366 -46.362 20.899 1.00 0.00 C ATOM 44 CG1 ILE A 6 -7.547 -46.954 19.743 1.00 0.00 C ATOM 45 CG2 ILE A 6 -8.216 -47.222 22.154 1.00 0.00 C ATOM 46 CD1 ILE A 6 -7.986 -48.344 19.313 1.00 0.00 C ATOM 0 H ILE A 6 -9.491 -44.537 19.319 1.00 0.00 H new ATOM 0 HA ILE A 6 -10.262 -47.208 20.278 1.00 0.00 H new ATOM 0 HB ILE A 6 -7.981 -45.366 21.118 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -7.613 -46.284 18.886 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -6.498 -46.992 20.038 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -7.161 -47.308 22.412 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -8.755 -46.758 22.980 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -8.625 -48.215 21.966 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -7.356 -48.687 18.493 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -7.893 -49.031 20.154 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -9.025 -48.312 18.984 1.00 0.00 H new ATOM 58 N ASP A 7 -11.517 -46.392 22.236 1.00 0.00 N ATOM 59 CA ASP A 7 -12.311 -45.952 23.365 1.00 0.00 C ATOM 60 C ASP A 7 -11.494 -46.039 24.639 1.00 0.00 C ATOM 61 O ASP A 7 -11.059 -47.113 25.039 1.00 0.00 O ATOM 62 CB ASP A 7 -13.582 -46.791 23.480 1.00 0.00 C ATOM 63 CG ASP A 7 -14.472 -46.360 24.625 1.00 0.00 C ATOM 64 OD1 ASP A 7 -14.610 -45.154 24.861 1.00 0.00 O ATOM 65 OD2 ASP A 7 -15.056 -47.240 25.292 1.00 0.00 O ATOM 0 H ASP A 7 -11.703 -47.350 21.939 1.00 0.00 H new ATOM 0 HA ASP A 7 -12.602 -44.913 23.209 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -14.141 -46.723 22.547 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -13.309 -47.838 23.613 1.00 0.00 H new ATOM 70 N ILE A 8 -11.275 -44.907 25.256 1.00 0.00 N ATOM 71 CA ILE A 8 -10.460 -44.830 26.444 1.00 0.00 C ATOM 72 C ILE A 8 -11.267 -44.320 27.613 1.00 0.00 C ATOM 73 O ILE A 8 -12.015 -43.349 27.491 1.00 0.00 O ATOM 74 CB ILE A 8 -9.214 -43.963 26.204 1.00 0.00 C ATOM 75 CG1 ILE A 8 -8.360 -44.627 25.129 1.00 0.00 C ATOM 76 CG2 ILE A 8 -8.415 -43.765 27.493 1.00 0.00 C ATOM 77 CD1 ILE A 8 -7.173 -43.822 24.702 1.00 0.00 C ATOM 0 H ILE A 8 -11.656 -44.012 24.950 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.118 -45.836 26.687 1.00 0.00 H new ATOM 0 HB ILE A 8 -9.523 -42.973 25.869 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -8.015 -45.592 25.500 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -8.983 -44.825 24.257 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.541 -43.147 27.288 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -9.041 -43.272 28.237 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -8.093 -44.734 27.874 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.621 -44.366 23.936 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.508 -42.866 24.298 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -6.525 -43.646 25.560 1.00 0.00 H new ATOM 89 N LYS A 9 -11.134 -44.992 28.734 1.00 0.00 N ATOM 90 CA LYS A 9 -11.918 -44.679 29.897 1.00 0.00 C ATOM 91 C LYS A 9 -11.297 -43.557 30.687 1.00 0.00 C ATOM 92 O LYS A 9 -10.150 -43.636 31.128 1.00 0.00 O ATOM 93 CB LYS A 9 -12.093 -45.922 30.748 1.00 0.00 C ATOM 94 CG LYS A 9 -12.680 -47.078 29.948 1.00 0.00 C ATOM 95 CD LYS A 9 -14.056 -46.731 29.413 1.00 0.00 C ATOM 96 CE LYS A 9 -14.494 -47.678 28.313 1.00 0.00 C ATOM 97 NZ LYS A 9 -15.850 -47.344 27.826 1.00 0.00 N ATOM 0 H LYS A 9 -10.482 -45.766 28.861 1.00 0.00 H new ATOM 0 HA LYS A 9 -12.902 -44.337 29.574 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -11.129 -46.218 31.161 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.745 -45.696 31.592 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -12.016 -47.324 29.119 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -12.745 -47.964 30.579 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -14.780 -46.762 30.227 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -14.049 -45.710 29.031 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -13.786 -47.630 27.486 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -14.481 -48.702 28.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -16.501 -48.123 28.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -16.180 -46.473 28.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -15.824 -47.201 26.796 1.00 0.00 H new ATOM 111 N GLU A 10 -12.066 -42.520 30.850 1.00 0.00 N ATOM 112 CA GLU A 10 -11.643 -41.343 31.555 1.00 0.00 C ATOM 113 C GLU A 10 -12.055 -41.432 33.016 1.00 0.00 C ATOM 114 O GLU A 10 -13.239 -41.295 33.349 1.00 0.00 O ATOM 115 CB GLU A 10 -12.300 -40.145 30.916 1.00 0.00 C ATOM 116 CG GLU A 10 -11.946 -39.989 29.454 1.00 0.00 C ATOM 117 CD GLU A 10 -10.506 -39.596 29.225 1.00 0.00 C ATOM 118 OE1 GLU A 10 -10.121 -38.488 29.635 1.00 0.00 O ATOM 119 OE2 GLU A 10 -9.756 -40.372 28.603 1.00 0.00 O ATOM 0 H GLU A 10 -13.019 -42.467 30.492 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.558 -41.252 31.505 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -13.382 -40.234 31.015 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -12.004 -39.245 31.454 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.145 -40.928 28.937 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.596 -39.236 29.009 1.00 0.00 H new ATOM 126 N ILE A 11 -11.102 -41.686 33.878 1.00 0.00 N ATOM 127 CA ILE A 11 -11.377 -41.744 35.295 1.00 0.00 C ATOM 128 C ILE A 11 -10.785 -40.525 36.000 1.00 0.00 C ATOM 129 O ILE A 11 -9.567 -40.367 36.094 1.00 0.00 O ATOM 130 CB ILE A 11 -10.897 -43.093 35.952 1.00 0.00 C ATOM 131 CG1 ILE A 11 -11.782 -44.260 35.460 1.00 0.00 C ATOM 132 CG2 ILE A 11 -10.913 -43.008 37.486 1.00 0.00 C ATOM 133 CD1 ILE A 11 -11.411 -45.617 36.047 1.00 0.00 C ATOM 0 H ILE A 11 -10.129 -41.856 33.625 1.00 0.00 H new ATOM 0 HA ILE A 11 -12.460 -41.722 35.421 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.866 -43.274 35.647 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -12.821 -44.042 35.707 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -11.717 -44.317 34.373 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.576 -43.956 37.906 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.248 -42.209 37.813 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -11.927 -42.799 37.828 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -12.080 -46.380 35.650 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.383 -45.861 35.779 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.504 -45.582 37.132 1.00 0.00 H new ATOM 145 N LYS A 12 -11.667 -39.657 36.472 1.00 0.00 N ATOM 146 CA LYS A 12 -11.269 -38.420 37.127 1.00 0.00 C ATOM 147 C LYS A 12 -11.369 -38.541 38.631 1.00 0.00 C ATOM 148 O LYS A 12 -12.395 -38.966 39.168 1.00 0.00 O ATOM 149 CB LYS A 12 -12.124 -37.245 36.619 1.00 0.00 C ATOM 150 CG LYS A 12 -11.827 -35.913 37.301 1.00 0.00 C ATOM 151 CD LYS A 12 -12.644 -34.785 36.690 1.00 0.00 C ATOM 152 CE LYS A 12 -12.349 -33.447 37.356 1.00 0.00 C ATOM 153 NZ LYS A 12 -13.064 -32.334 36.685 1.00 0.00 N ATOM 0 H LYS A 12 -12.677 -39.790 36.412 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.226 -38.226 36.877 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -11.967 -37.134 35.546 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -13.177 -37.487 36.764 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -12.048 -35.990 38.366 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -10.765 -35.685 37.212 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -12.428 -34.716 35.624 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -13.706 -35.012 36.786 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -12.643 -33.489 38.405 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -11.276 -33.257 37.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -13.364 -31.636 37.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -12.430 -31.878 35.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -13.900 -32.706 36.190 1.00 0.00 H new ATOM 167 N LEU A 13 -10.302 -38.156 39.309 1.00 0.00 N ATOM 168 CA LEU A 13 -10.230 -38.237 40.757 1.00 0.00 C ATOM 169 C LEU A 13 -9.789 -36.909 41.340 1.00 0.00 C ATOM 170 O LEU A 13 -9.598 -35.928 40.610 1.00 0.00 O ATOM 171 CB LEU A 13 -9.268 -39.350 41.175 1.00 0.00 C ATOM 172 CG LEU A 13 -9.614 -40.740 40.647 1.00 0.00 C ATOM 173 CD1 LEU A 13 -8.602 -41.758 41.118 1.00 0.00 C ATOM 174 CD2 LEU A 13 -11.015 -41.145 41.070 1.00 0.00 C ATOM 0 H LEU A 13 -9.462 -37.779 38.871 1.00 0.00 H new ATOM 0 HA LEU A 13 -11.222 -38.470 41.144 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.266 -39.089 40.835 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -9.235 -39.390 42.264 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.584 -40.705 39.558 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -8.868 -42.741 40.730 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -7.612 -41.481 40.756 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -8.595 -41.787 42.208 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -11.239 -42.139 40.682 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -11.077 -41.158 42.158 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -11.736 -40.430 40.674 1.00 0.00 H new ATOM 186 N SER A 14 -9.634 -36.877 42.644 1.00 0.00 N ATOM 187 CA SER A 14 -9.233 -35.683 43.334 1.00 0.00 C ATOM 188 C SER A 14 -8.203 -36.025 44.392 1.00 0.00 C ATOM 189 O SER A 14 -8.109 -37.167 44.815 1.00 0.00 O ATOM 190 CB SER A 14 -10.463 -35.031 43.976 1.00 0.00 C ATOM 191 OG SER A 14 -11.202 -35.978 44.744 1.00 0.00 O ATOM 0 H SER A 14 -9.784 -37.682 43.252 1.00 0.00 H new ATOM 0 HA SER A 14 -8.787 -34.982 42.628 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.149 -34.205 44.615 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.102 -34.609 43.200 1.00 0.00 H new ATOM 0 HG SER A 14 -11.127 -35.757 45.696 1.00 0.00 H new ATOM 197 N VAL A 15 -7.425 -35.045 44.797 1.00 0.00 N ATOM 198 CA VAL A 15 -6.438 -35.231 45.847 1.00 0.00 C ATOM 199 C VAL A 15 -7.152 -35.562 47.152 1.00 0.00 C ATOM 200 O VAL A 15 -6.737 -36.444 47.913 1.00 0.00 O ATOM 201 CB VAL A 15 -5.551 -33.969 46.000 1.00 0.00 C ATOM 202 CG1 VAL A 15 -4.645 -34.054 47.210 1.00 0.00 C ATOM 203 CG2 VAL A 15 -4.720 -33.776 44.754 1.00 0.00 C ATOM 0 H VAL A 15 -7.455 -34.101 44.413 1.00 0.00 H new ATOM 0 HA VAL A 15 -5.781 -36.059 45.582 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.214 -33.116 46.143 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.042 -33.148 47.277 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.250 -34.155 48.111 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -3.990 -34.920 47.114 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.098 -32.888 44.865 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.084 -34.648 44.602 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.378 -33.653 43.894 1.00 0.00 H new ATOM 213 N LYS A 16 -8.231 -34.856 47.387 1.00 0.00 N ATOM 214 CA LYS A 16 -9.068 -35.066 48.548 1.00 0.00 C ATOM 215 C LYS A 16 -10.153 -36.091 48.213 1.00 0.00 C ATOM 216 O LYS A 16 -11.322 -35.743 48.014 1.00 0.00 O ATOM 217 CB LYS A 16 -9.695 -33.734 48.958 1.00 0.00 C ATOM 218 CG LYS A 16 -8.673 -32.708 49.413 1.00 0.00 C ATOM 219 CD LYS A 16 -9.296 -31.336 49.593 1.00 0.00 C ATOM 220 CE LYS A 16 -8.250 -30.315 49.996 1.00 0.00 C ATOM 221 NZ LYS A 16 -8.633 -28.945 49.589 1.00 0.00 N ATOM 0 H LYS A 16 -8.558 -34.111 46.772 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.472 -35.448 49.377 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.257 -33.329 48.116 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.409 -33.908 49.763 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -8.227 -33.031 50.354 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -7.867 -32.648 48.682 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -9.775 -31.025 48.664 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.076 -31.383 50.353 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -8.108 -30.347 51.076 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -7.294 -30.575 49.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -7.974 -28.260 50.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -8.595 -28.867 48.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -9.599 -28.743 49.916 1.00 0.00 H new ATOM 235 N ILE A 17 -9.736 -37.338 48.088 1.00 0.00 N ATOM 236 CA ILE A 17 -10.645 -38.441 47.776 1.00 0.00 C ATOM 237 C ILE A 17 -10.549 -39.544 48.834 1.00 0.00 C ATOM 238 O ILE A 17 -9.478 -39.774 49.421 1.00 0.00 O ATOM 239 CB ILE A 17 -10.324 -39.053 46.387 1.00 0.00 C ATOM 240 CG1 ILE A 17 -11.365 -40.110 46.004 1.00 0.00 C ATOM 241 CG2 ILE A 17 -8.922 -39.657 46.375 1.00 0.00 C ATOM 242 CD1 ILE A 17 -11.169 -40.690 44.622 1.00 0.00 C ATOM 0 H ILE A 17 -8.762 -37.621 48.198 1.00 0.00 H new ATOM 0 HA ILE A 17 -11.655 -38.032 47.766 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.361 -38.252 45.648 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -11.333 -40.918 46.734 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -12.359 -39.666 46.063 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.717 -40.081 45.392 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.189 -38.881 46.596 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -8.857 -40.442 47.129 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -11.944 -41.430 44.425 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -11.231 -39.893 43.881 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -10.190 -41.165 44.562 1.00 0.00 H new ATOM 254 N ALA A 18 -11.669 -40.196 49.096 1.00 0.00 N ATOM 255 CA ALA A 18 -11.715 -41.304 50.028 1.00 0.00 C ATOM 256 C ALA A 18 -10.988 -42.512 49.450 1.00 0.00 C ATOM 257 O ALA A 18 -11.064 -42.778 48.248 1.00 0.00 O ATOM 258 CB ALA A 18 -13.158 -41.660 50.357 1.00 0.00 C ATOM 0 H ALA A 18 -12.568 -39.971 48.669 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.214 -41.005 50.949 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -13.176 -42.494 51.058 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.652 -40.798 50.805 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.680 -41.943 49.443 1.00 0.00 H new ATOM 264 N GLN A 19 -10.298 -43.250 50.305 1.00 0.00 N ATOM 265 CA GLN A 19 -9.532 -44.411 49.870 1.00 0.00 C ATOM 266 C GLN A 19 -10.444 -45.511 49.317 1.00 0.00 C ATOM 267 O GLN A 19 -10.063 -46.247 48.401 1.00 0.00 O ATOM 268 CB GLN A 19 -8.673 -44.954 51.015 1.00 0.00 C ATOM 269 CG GLN A 19 -7.816 -46.149 50.614 1.00 0.00 C ATOM 270 CD GLN A 19 -6.823 -45.807 49.515 1.00 0.00 C ATOM 271 OE1 GLN A 19 -6.314 -44.685 49.443 1.00 0.00 O ATOM 272 NE2 GLN A 19 -6.546 -46.760 48.652 1.00 0.00 N ATOM 0 H GLN A 19 -10.252 -43.066 51.307 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.874 -44.087 49.064 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.025 -44.158 51.382 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.322 -45.243 51.841 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.276 -46.515 51.487 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.462 -46.959 50.277 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.987 -47.675 48.744 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -5.890 -46.584 47.891 1.00 0.00 H new ATOM 281 N ASN A 20 -11.643 -45.609 49.866 1.00 0.00 N ATOM 282 CA ASN A 20 -12.606 -46.610 49.423 1.00 0.00 C ATOM 283 C ASN A 20 -12.972 -46.379 47.950 1.00 0.00 C ATOM 284 O ASN A 20 -13.113 -47.329 47.175 1.00 0.00 O ATOM 285 CB ASN A 20 -13.864 -46.580 50.306 1.00 0.00 C ATOM 286 CG ASN A 20 -14.874 -47.660 49.940 1.00 0.00 C ATOM 287 OD1 ASN A 20 -15.754 -47.451 49.097 1.00 0.00 O ATOM 288 ND2 ASN A 20 -14.755 -48.818 50.572 1.00 0.00 N ATOM 0 H ASN A 20 -11.976 -45.008 50.620 1.00 0.00 H new ATOM 0 HA ASN A 20 -12.150 -47.596 49.516 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -13.572 -46.702 51.349 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -14.338 -45.602 50.220 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -15.404 -49.578 50.370 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -14.014 -48.949 51.261 1.00 0.00 H new ATOM 295 N ASP A 21 -13.108 -45.108 47.571 1.00 0.00 N ATOM 296 CA ASP A 21 -13.440 -44.750 46.190 1.00 0.00 C ATOM 297 C ASP A 21 -12.304 -45.148 45.243 1.00 0.00 C ATOM 298 O ASP A 21 -12.549 -45.625 44.143 1.00 0.00 O ATOM 299 CB ASP A 21 -13.727 -43.250 46.069 1.00 0.00 C ATOM 300 CG ASP A 21 -14.476 -42.891 44.795 1.00 0.00 C ATOM 301 OD1 ASP A 21 -13.833 -42.630 43.772 1.00 0.00 O ATOM 302 OD2 ASP A 21 -15.736 -42.861 44.831 1.00 0.00 O ATOM 0 H ASP A 21 -12.994 -44.311 48.198 1.00 0.00 H new ATOM 0 HA ASP A 21 -14.339 -45.297 45.907 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.311 -42.926 46.931 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -12.785 -42.702 46.098 1.00 0.00 H new ATOM 307 N ILE A 22 -11.060 -44.983 45.706 1.00 0.00 N ATOM 308 CA ILE A 22 -9.878 -45.338 44.906 1.00 0.00 C ATOM 309 C ILE A 22 -9.884 -46.837 44.603 1.00 0.00 C ATOM 310 O ILE A 22 -9.612 -47.260 43.477 1.00 0.00 O ATOM 311 CB ILE A 22 -8.559 -44.972 45.641 1.00 0.00 C ATOM 312 CG1 ILE A 22 -8.432 -43.454 45.781 1.00 0.00 C ATOM 313 CG2 ILE A 22 -7.346 -45.537 44.901 1.00 0.00 C ATOM 314 CD1 ILE A 22 -7.260 -43.026 46.630 1.00 0.00 C ATOM 0 H ILE A 22 -10.844 -44.607 46.629 1.00 0.00 H new ATOM 0 HA ILE A 22 -9.925 -44.768 43.978 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.590 -45.417 46.636 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.333 -43.012 44.789 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.350 -43.059 46.216 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.435 -45.267 45.436 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.426 -46.623 44.846 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.310 -45.125 43.893 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.230 -41.938 46.687 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.367 -43.439 47.633 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.335 -43.392 46.184 1.00 0.00 H new ATOM 326 N ASN A 23 -10.223 -47.624 45.616 1.00 0.00 N ATOM 327 CA ASN A 23 -10.310 -49.083 45.485 1.00 0.00 C ATOM 328 C ASN A 23 -11.325 -49.461 44.431 1.00 0.00 C ATOM 329 O ASN A 23 -11.115 -50.375 43.630 1.00 0.00 O ATOM 330 CB ASN A 23 -10.730 -49.694 46.816 1.00 0.00 C ATOM 331 CG ASN A 23 -9.567 -49.953 47.754 1.00 0.00 C ATOM 332 OD1 ASN A 23 -8.970 -51.020 47.733 1.00 0.00 O ATOM 333 ND2 ASN A 23 -9.243 -48.983 48.589 1.00 0.00 N ATOM 0 H ASN A 23 -10.445 -47.277 46.549 1.00 0.00 H new ATOM 0 HA ASN A 23 -9.331 -49.461 45.192 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.440 -49.027 47.305 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -11.251 -50.633 46.628 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -8.472 -49.111 49.245 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -9.763 -48.106 48.578 1.00 0.00 H new ATOM 340 N TYR A 24 -12.420 -48.760 44.448 1.00 0.00 N ATOM 341 CA TYR A 24 -13.477 -48.934 43.488 1.00 0.00 C ATOM 342 C TYR A 24 -12.980 -48.587 42.062 1.00 0.00 C ATOM 343 O TYR A 24 -13.269 -49.305 41.097 1.00 0.00 O ATOM 344 CB TYR A 24 -14.648 -48.049 43.915 1.00 0.00 C ATOM 345 CG TYR A 24 -15.821 -47.992 42.974 1.00 0.00 C ATOM 346 CD1 TYR A 24 -16.756 -49.009 42.949 1.00 0.00 C ATOM 347 CD2 TYR A 24 -16.011 -46.904 42.134 1.00 0.00 C ATOM 348 CE1 TYR A 24 -17.854 -48.950 42.107 1.00 0.00 C ATOM 349 CE2 TYR A 24 -17.100 -46.834 41.288 1.00 0.00 C ATOM 350 CZ TYR A 24 -18.020 -47.858 41.281 1.00 0.00 C ATOM 351 OH TYR A 24 -19.117 -47.791 40.446 1.00 0.00 O ATOM 0 H TYR A 24 -12.610 -48.037 45.142 1.00 0.00 H new ATOM 0 HA TYR A 24 -13.803 -49.974 43.458 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -15.004 -48.398 44.884 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -14.275 -47.035 44.058 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -16.629 -49.864 43.597 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -15.294 -46.097 42.142 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -18.575 -49.754 42.097 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -17.229 -45.982 40.637 1.00 0.00 H new ATOM 0 HH TYR A 24 -19.086 -46.958 39.931 1.00 0.00 H new ATOM 361 N LYS A 25 -12.231 -47.487 41.951 1.00 0.00 N ATOM 362 CA LYS A 25 -11.708 -47.022 40.669 1.00 0.00 C ATOM 363 C LYS A 25 -10.689 -48.001 40.050 1.00 0.00 C ATOM 364 O LYS A 25 -10.764 -48.289 38.857 1.00 0.00 O ATOM 365 CB LYS A 25 -11.085 -45.636 40.819 1.00 0.00 C ATOM 366 CG LYS A 25 -12.066 -44.566 41.278 1.00 0.00 C ATOM 367 CD LYS A 25 -13.131 -44.294 40.232 1.00 0.00 C ATOM 368 CE LYS A 25 -14.076 -43.198 40.681 1.00 0.00 C ATOM 369 NZ LYS A 25 -15.118 -42.912 39.662 1.00 0.00 N ATOM 0 H LYS A 25 -11.973 -46.899 42.743 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.554 -46.968 39.984 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.264 -45.693 41.533 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.656 -45.336 39.863 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.541 -44.882 42.207 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.525 -43.645 41.494 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -12.657 -44.007 39.293 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.695 -45.206 40.038 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -14.554 -43.491 41.616 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.508 -42.290 40.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.744 -42.157 40.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.664 -42.608 38.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -15.677 -43.771 39.486 1.00 0.00 H new ATOM 383 N VAL A 26 -9.749 -48.518 40.858 1.00 0.00 N ATOM 384 CA VAL A 26 -8.751 -49.461 40.340 1.00 0.00 C ATOM 385 C VAL A 26 -9.391 -50.749 39.870 1.00 0.00 C ATOM 386 O VAL A 26 -8.938 -51.359 38.899 1.00 0.00 O ATOM 387 CB VAL A 26 -7.613 -49.783 41.341 1.00 0.00 C ATOM 388 CG1 VAL A 26 -6.572 -48.678 41.357 1.00 0.00 C ATOM 389 CG2 VAL A 26 -8.154 -50.029 42.736 1.00 0.00 C ATOM 0 H VAL A 26 -9.661 -48.304 41.851 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.297 -48.948 39.492 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.132 -50.701 41.003 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.785 -48.930 42.068 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.141 -48.570 40.362 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.042 -47.740 41.653 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.329 -50.252 43.412 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.679 -49.140 43.085 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.844 -50.873 42.715 1.00 0.00 H new ATOM 399 N LYS A 27 -10.446 -51.161 40.554 1.00 0.00 N ATOM 400 CA LYS A 27 -11.191 -52.335 40.156 1.00 0.00 C ATOM 401 C LYS A 27 -11.754 -52.133 38.750 1.00 0.00 C ATOM 402 O LYS A 27 -11.653 -53.012 37.897 1.00 0.00 O ATOM 403 CB LYS A 27 -12.314 -52.616 41.148 1.00 0.00 C ATOM 404 CG LYS A 27 -13.156 -53.822 40.794 1.00 0.00 C ATOM 405 CD LYS A 27 -14.210 -54.090 41.852 1.00 0.00 C ATOM 406 CE LYS A 27 -15.041 -55.305 41.492 1.00 0.00 C ATOM 407 NZ LYS A 27 -15.861 -55.065 40.279 1.00 0.00 N ATOM 0 H LYS A 27 -10.803 -50.696 41.389 1.00 0.00 H new ATOM 0 HA LYS A 27 -10.522 -53.196 40.150 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -11.883 -52.764 42.138 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -12.959 -51.740 41.209 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -13.639 -53.661 39.830 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -12.515 -54.697 40.687 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.730 -54.246 42.818 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -14.857 -53.219 41.955 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -14.385 -56.159 41.325 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -15.692 -55.562 42.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -16.430 -55.911 40.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -16.492 -54.255 40.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -15.237 -54.861 39.473 1.00 0.00 H new ATOM 421 N HIS A 28 -12.308 -50.947 38.513 1.00 0.00 N ATOM 422 CA HIS A 28 -12.840 -50.609 37.204 1.00 0.00 C ATOM 423 C HIS A 28 -11.742 -50.570 36.173 1.00 0.00 C ATOM 424 O HIS A 28 -11.891 -51.090 35.075 1.00 0.00 O ATOM 425 CB HIS A 28 -13.578 -49.266 37.235 1.00 0.00 C ATOM 426 CG HIS A 28 -14.946 -49.353 37.812 1.00 0.00 C ATOM 427 ND1 HIS A 28 -15.989 -48.553 37.402 1.00 0.00 N ATOM 428 CD2 HIS A 28 -15.445 -50.142 38.778 1.00 0.00 C ATOM 429 CE1 HIS A 28 -17.079 -48.873 38.075 1.00 0.00 C ATOM 430 NE2 HIS A 28 -16.774 -49.838 38.914 1.00 0.00 N ATOM 0 H HIS A 28 -12.398 -50.208 39.211 1.00 0.00 H new ATOM 0 HA HIS A 28 -13.553 -51.387 36.929 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -12.993 -48.552 37.815 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -13.645 -48.874 36.220 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -14.898 -50.881 39.344 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -18.052 -48.420 37.957 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -17.422 -50.287 39.561 1.00 0.00 H new ATOM 438 N ALA A 29 -10.613 -49.984 36.550 1.00 0.00 N ATOM 439 CA ALA A 29 -9.479 -49.865 35.655 1.00 0.00 C ATOM 440 C ALA A 29 -9.072 -51.232 35.118 1.00 0.00 C ATOM 441 O ALA A 29 -8.937 -51.408 33.913 1.00 0.00 O ATOM 442 CB ALA A 29 -8.307 -49.195 36.361 1.00 0.00 C ATOM 0 H ALA A 29 -10.462 -49.583 37.476 1.00 0.00 H new ATOM 0 HA ALA A 29 -9.773 -49.241 34.811 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -7.465 -49.115 35.673 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -8.602 -48.199 36.691 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.014 -49.791 37.225 1.00 0.00 H new ATOM 448 N LEU A 30 -8.936 -52.204 36.013 1.00 0.00 N ATOM 449 CA LEU A 30 -8.534 -53.559 35.621 1.00 0.00 C ATOM 450 C LEU A 30 -9.563 -54.189 34.694 1.00 0.00 C ATOM 451 O LEU A 30 -9.210 -54.825 33.698 1.00 0.00 O ATOM 452 CB LEU A 30 -8.347 -54.447 36.854 1.00 0.00 C ATOM 453 CG LEU A 30 -7.206 -54.062 37.794 1.00 0.00 C ATOM 454 CD1 LEU A 30 -7.176 -54.988 38.996 1.00 0.00 C ATOM 455 CD2 LEU A 30 -5.869 -54.093 37.061 1.00 0.00 C ATOM 0 H LEU A 30 -9.097 -52.084 37.013 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.585 -53.479 35.090 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.276 -54.443 37.423 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.183 -55.471 36.518 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.378 -53.044 38.144 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -6.358 -54.701 39.656 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.120 -54.915 39.535 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.028 -56.015 38.661 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.070 -53.816 37.749 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.687 -55.098 36.679 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -5.893 -53.388 36.230 1.00 0.00 H new ATOM 467 N GLU A 31 -10.837 -53.990 35.014 1.00 0.00 N ATOM 468 CA GLU A 31 -11.927 -54.556 34.239 1.00 0.00 C ATOM 469 C GLU A 31 -11.969 -53.984 32.817 1.00 0.00 C ATOM 470 O GLU A 31 -12.401 -54.661 31.885 1.00 0.00 O ATOM 471 CB GLU A 31 -13.267 -54.350 34.959 1.00 0.00 C ATOM 472 CG GLU A 31 -13.379 -55.132 36.268 1.00 0.00 C ATOM 473 CD GLU A 31 -14.705 -54.936 36.975 1.00 0.00 C ATOM 474 OE1 GLU A 31 -15.670 -55.664 36.653 1.00 0.00 O ATOM 475 OE2 GLU A 31 -14.795 -54.071 37.877 1.00 0.00 O ATOM 0 H GLU A 31 -11.139 -53.434 35.814 1.00 0.00 H new ATOM 0 HA GLU A 31 -11.748 -55.627 34.149 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -13.400 -53.288 35.166 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -14.078 -54.649 34.295 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -13.239 -56.193 36.062 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -12.572 -54.828 36.934 1.00 0.00 H new ATOM 482 N PHE A 32 -11.545 -52.732 32.654 1.00 0.00 N ATOM 483 CA PHE A 32 -11.484 -52.124 31.328 1.00 0.00 C ATOM 484 C PHE A 32 -10.163 -52.447 30.623 1.00 0.00 C ATOM 485 O PHE A 32 -10.120 -52.560 29.397 1.00 0.00 O ATOM 486 CB PHE A 32 -11.703 -50.612 31.392 1.00 0.00 C ATOM 487 CG PHE A 32 -13.109 -50.218 31.761 1.00 0.00 C ATOM 488 CD1 PHE A 32 -14.117 -50.260 30.817 1.00 0.00 C ATOM 489 CD2 PHE A 32 -13.420 -49.819 33.044 1.00 0.00 C ATOM 490 CE1 PHE A 32 -15.409 -49.905 31.145 1.00 0.00 C ATOM 491 CE2 PHE A 32 -14.709 -49.462 33.383 1.00 0.00 C ATOM 492 CZ PHE A 32 -15.706 -49.507 32.433 1.00 0.00 C ATOM 0 H PHE A 32 -11.242 -52.125 33.415 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.295 -52.557 30.742 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -11.013 -50.184 32.119 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.456 -50.177 30.424 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.890 -50.575 29.809 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -12.644 -49.785 33.794 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -16.186 -49.938 30.396 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -14.936 -49.148 34.391 1.00 0.00 H new ATOM 0 HZ PHE A 32 -16.717 -49.232 32.695 1.00 0.00 H new ATOM 502 N LEU A 33 -9.095 -52.596 31.401 1.00 0.00 N ATOM 503 CA LEU A 33 -7.778 -52.913 30.847 1.00 0.00 C ATOM 504 C LEU A 33 -7.786 -54.263 30.143 1.00 0.00 C ATOM 505 O LEU A 33 -7.293 -54.396 29.029 1.00 0.00 O ATOM 506 CB LEU A 33 -6.717 -52.903 31.953 1.00 0.00 C ATOM 507 CG LEU A 33 -6.368 -51.534 32.523 1.00 0.00 C ATOM 508 CD1 LEU A 33 -5.457 -51.673 33.729 1.00 0.00 C ATOM 509 CD2 LEU A 33 -5.711 -50.676 31.459 1.00 0.00 C ATOM 0 H LEU A 33 -9.113 -52.503 32.417 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.532 -52.147 30.111 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.063 -53.538 32.769 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.806 -53.356 31.561 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.289 -51.048 32.845 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.219 -50.684 34.121 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.960 -52.258 34.499 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.537 -52.177 33.434 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.466 -49.700 31.878 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.799 -51.161 31.113 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.395 -50.549 30.620 1.00 0.00 H new ATOM 521 N GLU A 34 -8.389 -55.248 30.783 1.00 0.00 N ATOM 522 CA GLU A 34 -8.494 -56.588 30.222 1.00 0.00 C ATOM 523 C GLU A 34 -9.301 -56.594 28.914 1.00 0.00 C ATOM 524 O GLU A 34 -9.221 -57.540 28.131 1.00 0.00 O ATOM 525 CB GLU A 34 -9.094 -57.559 31.248 1.00 0.00 C ATOM 526 CG GLU A 34 -10.414 -57.113 31.833 1.00 0.00 C ATOM 527 CD GLU A 34 -11.574 -57.973 31.383 1.00 0.00 C ATOM 528 OE1 GLU A 34 -12.159 -57.687 30.326 1.00 0.00 O ATOM 529 OE2 GLU A 34 -11.910 -58.941 32.090 1.00 0.00 O ATOM 0 H GLU A 34 -8.819 -55.146 31.702 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.486 -56.926 29.980 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -9.231 -58.531 30.774 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -8.380 -57.698 32.059 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -10.351 -57.136 32.921 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -10.602 -56.078 31.547 1.00 0.00 H new ATOM 536 N GLN A 35 -10.079 -55.537 28.691 1.00 0.00 N ATOM 537 CA GLN A 35 -10.859 -55.396 27.470 1.00 0.00 C ATOM 538 C GLN A 35 -9.962 -54.968 26.315 1.00 0.00 C ATOM 539 O GLN A 35 -10.354 -55.040 25.150 1.00 0.00 O ATOM 540 CB GLN A 35 -11.964 -54.360 27.657 1.00 0.00 C ATOM 541 CG GLN A 35 -13.003 -54.743 28.685 1.00 0.00 C ATOM 542 CD GLN A 35 -14.087 -53.692 28.850 1.00 0.00 C ATOM 543 OE1 GLN A 35 -14.377 -52.918 27.933 1.00 0.00 O ATOM 544 NE2 GLN A 35 -14.688 -53.654 30.017 1.00 0.00 N ATOM 0 H GLN A 35 -10.184 -54.763 29.346 1.00 0.00 H new ATOM 0 HA GLN A 35 -11.308 -56.363 27.242 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -11.512 -53.412 27.949 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.459 -54.196 26.700 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -13.462 -55.688 28.396 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -12.514 -54.907 29.645 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -14.420 -54.311 30.750 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -15.423 -52.968 30.190 1.00 0.00 H new ATOM 553 N GLY A 36 -8.754 -54.534 26.644 1.00 0.00 N ATOM 554 CA GLY A 36 -7.831 -54.082 25.633 1.00 0.00 C ATOM 555 C GLY A 36 -7.856 -52.576 25.463 1.00 0.00 C ATOM 556 O GLY A 36 -7.316 -52.046 24.490 1.00 0.00 O ATOM 0 H GLY A 36 -8.399 -54.488 27.599 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.822 -54.399 25.898 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.075 -54.557 24.683 1.00 0.00 H new ATOM 560 N LYS A 37 -8.484 -51.880 26.405 1.00 0.00 N ATOM 561 CA LYS A 37 -8.565 -50.433 26.333 1.00 0.00 C ATOM 562 C LYS A 37 -7.594 -49.782 27.294 1.00 0.00 C ATOM 563 O LYS A 37 -6.855 -50.457 28.002 1.00 0.00 O ATOM 564 CB LYS A 37 -9.980 -49.930 26.620 1.00 0.00 C ATOM 565 CG LYS A 37 -11.010 -50.428 25.635 1.00 0.00 C ATOM 566 CD LYS A 37 -12.363 -49.800 25.881 1.00 0.00 C ATOM 567 CE LYS A 37 -13.392 -50.389 24.942 1.00 0.00 C ATOM 568 NZ LYS A 37 -14.741 -49.813 25.121 1.00 0.00 N ATOM 0 H LYS A 37 -8.939 -52.294 27.219 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.298 -50.155 25.313 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.270 -50.240 27.624 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -9.978 -48.840 26.611 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -10.683 -50.203 24.620 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -11.092 -51.512 25.710 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.666 -49.966 26.915 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.303 -48.721 25.736 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.069 -50.229 23.913 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -13.441 -51.467 25.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -15.256 -49.849 24.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -15.260 -50.360 25.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -14.658 -48.824 25.433 1.00 0.00 H new ATOM 582 N HIS A 38 -7.599 -48.466 27.309 1.00 0.00 N ATOM 583 CA HIS A 38 -6.711 -47.704 28.173 1.00 0.00 C ATOM 584 C HIS A 38 -7.525 -46.901 29.173 1.00 0.00 C ATOM 585 O HIS A 38 -8.701 -46.605 28.932 1.00 0.00 O ATOM 586 CB HIS A 38 -5.842 -46.730 27.347 1.00 0.00 C ATOM 587 CG HIS A 38 -4.885 -47.377 26.377 1.00 0.00 C ATOM 588 ND1 HIS A 38 -3.797 -46.713 25.847 1.00 0.00 N ATOM 589 CD2 HIS A 38 -4.863 -48.616 25.824 1.00 0.00 C ATOM 590 CE1 HIS A 38 -3.153 -47.515 25.015 1.00 0.00 C ATOM 591 NE2 HIS A 38 -3.779 -48.668 24.985 1.00 0.00 N ATOM 0 H HIS A 38 -8.212 -47.894 26.729 1.00 0.00 H new ATOM 0 HA HIS A 38 -6.063 -48.409 28.695 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -6.502 -46.065 26.790 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -5.269 -46.108 28.035 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -5.568 -49.413 26.010 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -2.264 -47.264 24.456 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -3.503 -49.475 24.426 1.00 0.00 H new ATOM 599 N VAL A 39 -6.914 -46.571 30.288 1.00 0.00 N ATOM 600 CA VAL A 39 -7.544 -45.718 31.283 1.00 0.00 C ATOM 601 C VAL A 39 -6.698 -44.492 31.508 1.00 0.00 C ATOM 602 O VAL A 39 -5.479 -44.593 31.687 1.00 0.00 O ATOM 603 CB VAL A 39 -7.768 -46.443 32.651 1.00 0.00 C ATOM 604 CG1 VAL A 39 -8.126 -45.436 33.741 1.00 0.00 C ATOM 605 CG2 VAL A 39 -8.882 -47.459 32.545 1.00 0.00 C ATOM 0 H VAL A 39 -5.974 -46.881 30.534 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.524 -45.446 30.892 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.838 -46.949 32.910 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.278 -45.960 34.685 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.315 -44.716 33.852 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.041 -44.912 33.466 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -9.019 -47.950 33.508 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.806 -46.957 32.259 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.625 -48.203 31.791 1.00 0.00 H new ATOM 615 N ARG A 40 -7.324 -43.341 31.473 1.00 0.00 N ATOM 616 CA ARG A 40 -6.634 -42.116 31.748 1.00 0.00 C ATOM 617 C ARG A 40 -7.096 -41.560 33.069 1.00 0.00 C ATOM 618 O ARG A 40 -8.274 -41.223 33.244 1.00 0.00 O ATOM 619 CB ARG A 40 -6.823 -41.090 30.619 1.00 0.00 C ATOM 620 CG ARG A 40 -6.216 -39.732 30.922 1.00 0.00 C ATOM 621 CD ARG A 40 -6.083 -38.874 29.673 1.00 0.00 C ATOM 622 NE ARG A 40 -7.321 -38.763 28.909 1.00 0.00 N ATOM 623 CZ ARG A 40 -7.435 -38.071 27.773 1.00 0.00 C ATOM 624 NH1 ARG A 40 -6.435 -37.286 27.353 1.00 0.00 N ATOM 625 NH2 ARG A 40 -8.551 -38.136 27.076 1.00 0.00 N ATOM 0 H ARG A 40 -8.315 -43.233 31.255 1.00 0.00 H new ATOM 0 HA ARG A 40 -5.567 -42.329 31.806 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.377 -41.482 29.705 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -7.889 -40.967 30.426 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.836 -39.213 31.653 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -5.234 -39.867 31.375 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -5.752 -37.876 29.961 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -5.307 -39.295 29.034 1.00 0.00 H new ATOM 0 HE ARG A 40 -8.148 -39.242 29.264 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -5.578 -37.214 27.902 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -6.530 -36.760 26.484 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -9.325 -38.714 27.405 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -8.641 -37.609 26.208 1.00 0.00 H new ATOM 639 N PHE A 41 -6.180 -41.477 34.003 1.00 0.00 N ATOM 640 CA PHE A 41 -6.481 -40.939 35.306 1.00 0.00 C ATOM 641 C PHE A 41 -6.248 -39.458 35.286 1.00 0.00 C ATOM 642 O PHE A 41 -5.141 -38.998 34.996 1.00 0.00 O ATOM 643 CB PHE A 41 -5.620 -41.595 36.390 1.00 0.00 C ATOM 644 CG PHE A 41 -5.899 -43.059 36.598 1.00 0.00 C ATOM 645 CD1 PHE A 41 -6.936 -43.472 37.424 1.00 0.00 C ATOM 646 CD2 PHE A 41 -5.125 -44.015 35.978 1.00 0.00 C ATOM 647 CE1 PHE A 41 -7.191 -44.810 37.620 1.00 0.00 C ATOM 648 CE2 PHE A 41 -5.372 -45.357 36.169 1.00 0.00 C ATOM 649 CZ PHE A 41 -6.407 -45.758 36.993 1.00 0.00 C ATOM 0 H PHE A 41 -5.213 -41.778 33.883 1.00 0.00 H new ATOM 0 HA PHE A 41 -7.524 -41.149 35.542 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -4.569 -41.471 36.128 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.778 -41.069 37.332 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -7.550 -42.734 37.919 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -4.314 -43.709 35.334 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -8.002 -45.118 38.263 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -4.757 -46.095 35.675 1.00 0.00 H new ATOM 0 HZ PHE A 41 -6.602 -46.809 37.146 1.00 0.00 H new ATOM 659 N ARG A 42 -7.281 -38.714 35.570 1.00 0.00 N ATOM 660 CA ARG A 42 -7.199 -37.277 35.544 1.00 0.00 C ATOM 661 C ARG A 42 -7.548 -36.734 36.905 1.00 0.00 C ATOM 662 O ARG A 42 -8.679 -36.894 37.364 1.00 0.00 O ATOM 663 CB ARG A 42 -8.176 -36.716 34.505 1.00 0.00 C ATOM 664 CG ARG A 42 -8.338 -37.599 33.273 1.00 0.00 C ATOM 665 CD ARG A 42 -9.220 -36.956 32.218 1.00 0.00 C ATOM 666 NE ARG A 42 -10.491 -36.457 32.776 1.00 0.00 N ATOM 667 CZ ARG A 42 -11.615 -36.289 32.071 1.00 0.00 C ATOM 668 NH1 ARG A 42 -11.692 -36.735 30.830 1.00 0.00 N ATOM 669 NH2 ARG A 42 -12.673 -35.710 32.626 1.00 0.00 N ATOM 0 H ARG A 42 -8.198 -39.082 35.824 1.00 0.00 H new ATOM 0 HA ARG A 42 -6.185 -36.980 35.277 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -9.151 -36.579 34.973 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.832 -35.730 34.191 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.357 -37.807 32.846 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -8.767 -38.557 33.568 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -8.682 -36.130 31.752 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.431 -37.682 31.433 1.00 0.00 H new ATOM 0 HE ARG A 42 -10.514 -36.224 33.769 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -10.893 -37.209 30.408 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -12.550 -36.606 30.294 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -12.631 -35.391 33.594 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.528 -35.584 32.084 1.00 0.00 H new ATOM 683 N VAL A 43 -6.604 -36.102 37.552 1.00 0.00 N ATOM 684 CA VAL A 43 -6.869 -35.539 38.849 1.00 0.00 C ATOM 685 C VAL A 43 -6.811 -34.035 38.791 1.00 0.00 C ATOM 686 O VAL A 43 -5.819 -33.447 38.345 1.00 0.00 O ATOM 687 CB VAL A 43 -5.902 -36.082 39.949 1.00 0.00 C ATOM 688 CG1 VAL A 43 -4.449 -35.918 39.546 1.00 0.00 C ATOM 689 CG2 VAL A 43 -6.165 -35.393 41.281 1.00 0.00 C ATOM 0 H VAL A 43 -5.654 -35.965 37.206 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.875 -35.849 39.131 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.097 -37.149 40.061 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.806 -36.307 40.336 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.263 -36.468 38.623 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.232 -34.861 39.389 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.482 -35.785 42.034 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.009 -34.320 41.173 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.193 -35.581 41.591 1.00 0.00 H new ATOM 699 N PHE A 44 -7.884 -33.421 39.215 1.00 0.00 N ATOM 700 CA PHE A 44 -7.969 -31.991 39.239 1.00 0.00 C ATOM 701 C PHE A 44 -7.733 -31.521 40.648 1.00 0.00 C ATOM 702 O PHE A 44 -8.416 -31.959 41.578 1.00 0.00 O ATOM 703 CB PHE A 44 -9.341 -31.523 38.740 1.00 0.00 C ATOM 704 CG PHE A 44 -9.474 -30.031 38.632 1.00 0.00 C ATOM 705 CD1 PHE A 44 -8.944 -29.355 37.547 1.00 0.00 C ATOM 706 CD2 PHE A 44 -10.126 -29.303 39.616 1.00 0.00 C ATOM 707 CE1 PHE A 44 -9.064 -27.985 37.435 1.00 0.00 C ATOM 708 CE2 PHE A 44 -10.251 -27.927 39.512 1.00 0.00 C ATOM 709 CZ PHE A 44 -9.718 -27.268 38.419 1.00 0.00 C ATOM 0 H PHE A 44 -8.719 -33.899 39.552 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.214 -31.568 38.577 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -9.532 -31.966 37.763 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.110 -31.898 39.416 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -8.428 -29.908 36.776 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -10.541 -29.814 40.472 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -8.647 -27.474 36.580 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -10.763 -27.370 40.283 1.00 0.00 H new ATOM 0 HZ PHE A 44 -9.813 -26.195 38.335 1.00 0.00 H new ATOM 719 N LEU A 45 -6.761 -30.656 40.815 1.00 0.00 N ATOM 720 CA LEU A 45 -6.443 -30.145 42.121 1.00 0.00 C ATOM 721 C LEU A 45 -7.487 -29.089 42.486 1.00 0.00 C ATOM 722 O LEU A 45 -7.504 -27.990 41.924 1.00 0.00 O ATOM 723 CB LEU A 45 -5.031 -29.559 42.117 1.00 0.00 C ATOM 724 CG LEU A 45 -3.939 -30.466 41.507 1.00 0.00 C ATOM 725 CD1 LEU A 45 -2.580 -29.813 41.596 1.00 0.00 C ATOM 726 CD2 LEU A 45 -3.920 -31.822 42.175 1.00 0.00 C ATOM 0 H LEU A 45 -6.178 -30.293 40.061 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.465 -30.941 42.865 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.048 -28.619 41.566 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -4.751 -29.322 43.144 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.181 -30.610 40.454 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -1.830 -30.473 41.160 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -2.594 -28.869 41.052 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.334 -29.626 42.641 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.142 -32.438 41.725 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.717 -31.701 43.239 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -4.888 -32.306 42.043 1.00 0.00 H new ATOM 738 N LYS A 46 -8.364 -29.451 43.409 1.00 0.00 N ATOM 739 CA LYS A 46 -9.536 -28.647 43.744 1.00 0.00 C ATOM 740 C LYS A 46 -9.199 -27.311 44.418 1.00 0.00 C ATOM 741 O LYS A 46 -9.197 -26.261 43.768 1.00 0.00 O ATOM 742 CB LYS A 46 -10.496 -29.469 44.612 1.00 0.00 C ATOM 743 CG LYS A 46 -11.807 -28.771 44.939 1.00 0.00 C ATOM 744 CD LYS A 46 -12.719 -29.680 45.746 1.00 0.00 C ATOM 745 CE LYS A 46 -14.044 -29.012 46.055 1.00 0.00 C ATOM 746 NZ LYS A 46 -13.868 -27.781 46.871 1.00 0.00 N ATOM 0 H LYS A 46 -8.286 -30.312 43.950 1.00 0.00 H new ATOM 0 HA LYS A 46 -10.017 -28.385 42.802 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.716 -30.406 44.100 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -9.993 -29.725 45.545 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.607 -27.858 45.500 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.306 -28.475 44.016 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -12.896 -30.602 45.192 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -12.225 -29.957 46.677 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -14.550 -28.760 45.123 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -14.688 -29.712 46.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -14.792 -27.468 47.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -13.235 -27.982 47.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -13.454 -27.030 46.282 1.00 0.00 H new ATOM 760 N GLY A 47 -8.899 -27.350 45.703 1.00 0.00 N ATOM 761 CA GLY A 47 -8.665 -26.118 46.426 1.00 0.00 C ATOM 762 C GLY A 47 -7.347 -26.109 47.141 1.00 0.00 C ATOM 763 O GLY A 47 -7.101 -26.966 47.990 1.00 0.00 O ATOM 0 H GLY A 47 -8.813 -28.203 46.256 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.702 -25.280 45.730 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.467 -25.967 47.149 1.00 0.00 H new ATOM 767 N ARG A 48 -6.485 -25.140 46.776 1.00 0.00 N ATOM 768 CA ARG A 48 -5.144 -24.965 47.374 1.00 0.00 C ATOM 769 C ARG A 48 -4.180 -26.070 46.916 1.00 0.00 C ATOM 770 O ARG A 48 -2.961 -25.902 46.934 1.00 0.00 O ATOM 771 CB ARG A 48 -5.242 -24.909 48.903 1.00 0.00 C ATOM 772 CG ARG A 48 -3.934 -24.630 49.613 1.00 0.00 C ATOM 773 CD ARG A 48 -4.163 -24.452 51.097 1.00 0.00 C ATOM 774 NE ARG A 48 -4.987 -23.270 51.372 1.00 0.00 N ATOM 775 CZ ARG A 48 -5.521 -22.981 52.564 1.00 0.00 C ATOM 776 NH1 ARG A 48 -5.337 -23.797 53.597 1.00 0.00 N ATOM 777 NH2 ARG A 48 -6.248 -21.880 52.715 1.00 0.00 N ATOM 0 H ARG A 48 -6.699 -24.452 46.054 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.737 -24.016 47.025 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -5.961 -24.138 49.179 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -5.639 -25.858 49.263 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -3.239 -25.452 49.443 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -3.474 -23.732 49.200 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -4.650 -25.339 51.501 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -3.204 -24.356 51.606 1.00 0.00 H new ATOM 0 HE ARG A 48 -5.165 -22.625 50.602 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -4.786 -24.648 53.483 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -5.746 -23.572 54.504 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -6.399 -21.256 51.923 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -6.656 -21.659 53.623 1.00 0.00 H new ATOM 791 N GLU A 49 -4.751 -27.170 46.476 1.00 0.00 N ATOM 792 CA GLU A 49 -4.023 -28.314 45.978 1.00 0.00 C ATOM 793 C GLU A 49 -3.208 -27.937 44.745 1.00 0.00 C ATOM 794 O GLU A 49 -2.119 -28.458 44.531 1.00 0.00 O ATOM 795 CB GLU A 49 -5.034 -29.405 45.628 1.00 0.00 C ATOM 796 CG GLU A 49 -5.866 -29.858 46.817 1.00 0.00 C ATOM 797 CD GLU A 49 -7.237 -30.366 46.414 1.00 0.00 C ATOM 798 OE1 GLU A 49 -7.317 -31.330 45.625 1.00 0.00 O ATOM 799 OE2 GLU A 49 -8.246 -29.783 46.887 1.00 0.00 O ATOM 0 H GLU A 49 -5.763 -27.296 46.455 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.329 -28.671 46.739 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.699 -29.037 44.847 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.504 -30.264 45.216 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.333 -30.646 47.349 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.981 -29.026 47.512 1.00 0.00 H new ATOM 806 N MET A 50 -3.739 -27.001 43.950 1.00 0.00 N ATOM 807 CA MET A 50 -3.103 -26.563 42.722 1.00 0.00 C ATOM 808 C MET A 50 -1.754 -25.891 42.980 1.00 0.00 C ATOM 809 O MET A 50 -0.918 -25.789 42.079 1.00 0.00 O ATOM 810 CB MET A 50 -4.039 -25.629 41.960 1.00 0.00 C ATOM 811 CG MET A 50 -3.618 -25.374 40.534 1.00 0.00 C ATOM 812 SD MET A 50 -4.881 -24.508 39.578 1.00 0.00 S ATOM 813 CE MET A 50 -6.164 -25.764 39.505 1.00 0.00 C ATOM 0 H MET A 50 -4.622 -26.531 44.148 1.00 0.00 H new ATOM 0 HA MET A 50 -2.903 -27.446 42.114 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.042 -26.055 41.962 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.096 -24.677 42.488 1.00 0.00 H new ATOM 0 HG2 MET A 50 -2.699 -24.787 40.530 1.00 0.00 H new ATOM 0 HG3 MET A 50 -3.391 -26.324 40.051 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.821 -25.564 38.658 1.00 0.00 H new ATOM 0 HE2 MET A 50 -5.706 -26.746 39.385 1.00 0.00 H new ATOM 0 HE3 MET A 50 -6.745 -25.745 40.427 1.00 0.00 H new ATOM 823 N ALA A 51 -1.540 -25.452 44.218 1.00 0.00 N ATOM 824 CA ALA A 51 -0.291 -24.813 44.597 1.00 0.00 C ATOM 825 C ALA A 51 0.841 -25.842 44.700 1.00 0.00 C ATOM 826 O ALA A 51 2.021 -25.479 44.766 1.00 0.00 O ATOM 827 CB ALA A 51 -0.456 -24.074 45.918 1.00 0.00 C ATOM 0 H ALA A 51 -2.220 -25.529 44.975 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.027 -24.094 43.822 1.00 0.00 H new ATOM 0 HB1 ALA A 51 0.487 -23.600 46.190 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -1.229 -23.312 45.815 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.745 -24.780 46.696 1.00 0.00 H new ATOM 833 N THR A 52 0.480 -27.118 44.717 1.00 0.00 N ATOM 834 CA THR A 52 1.455 -28.190 44.806 1.00 0.00 C ATOM 835 C THR A 52 1.052 -29.370 43.907 1.00 0.00 C ATOM 836 O THR A 52 0.198 -30.183 44.262 1.00 0.00 O ATOM 837 CB THR A 52 1.622 -28.666 46.265 1.00 0.00 C ATOM 838 OG1 THR A 52 1.914 -27.539 47.111 1.00 0.00 O ATOM 839 CG2 THR A 52 2.745 -29.685 46.379 1.00 0.00 C ATOM 0 H THR A 52 -0.488 -27.435 44.670 1.00 0.00 H new ATOM 0 HA THR A 52 2.412 -27.799 44.460 1.00 0.00 H new ATOM 0 HB THR A 52 0.691 -29.137 46.580 1.00 0.00 H new ATOM 0 HG1 THR A 52 2.018 -27.843 48.037 1.00 0.00 H new ATOM 0 HG21 THR A 52 2.842 -30.005 47.417 1.00 0.00 H new ATOM 0 HG22 THR A 52 2.518 -30.548 45.753 1.00 0.00 H new ATOM 0 HG23 THR A 52 3.681 -29.234 46.049 1.00 0.00 H new ATOM 847 N PRO A 53 1.689 -29.467 42.740 1.00 0.00 N ATOM 848 CA PRO A 53 1.402 -30.514 41.743 1.00 0.00 C ATOM 849 C PRO A 53 1.832 -31.899 42.217 1.00 0.00 C ATOM 850 O PRO A 53 1.393 -32.922 41.682 1.00 0.00 O ATOM 851 CB PRO A 53 2.223 -30.079 40.523 1.00 0.00 C ATOM 852 CG PRO A 53 3.314 -29.224 41.081 1.00 0.00 C ATOM 853 CD PRO A 53 2.759 -28.558 42.296 1.00 0.00 C ATOM 0 HA PRO A 53 0.335 -30.605 41.541 1.00 0.00 H new ATOM 0 HB2 PRO A 53 2.628 -30.940 39.992 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.611 -29.525 39.812 1.00 0.00 H new ATOM 0 HG2 PRO A 53 4.186 -29.826 41.334 1.00 0.00 H new ATOM 0 HG3 PRO A 53 3.639 -28.485 40.349 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.521 -28.431 43.065 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.371 -27.566 42.066 1.00 0.00 H new ATOM 861 N GLU A 54 2.674 -31.912 43.240 1.00 0.00 N ATOM 862 CA GLU A 54 3.205 -33.132 43.833 1.00 0.00 C ATOM 863 C GLU A 54 2.068 -34.027 44.337 1.00 0.00 C ATOM 864 O GLU A 54 2.148 -35.254 44.261 1.00 0.00 O ATOM 865 CB GLU A 54 4.124 -32.758 44.999 1.00 0.00 C ATOM 866 CG GLU A 54 4.855 -33.923 45.643 1.00 0.00 C ATOM 867 CD GLU A 54 5.635 -33.492 46.866 1.00 0.00 C ATOM 868 OE1 GLU A 54 5.044 -33.452 47.970 1.00 0.00 O ATOM 869 OE2 GLU A 54 6.840 -33.188 46.740 1.00 0.00 O ATOM 0 H GLU A 54 3.013 -31.061 43.689 1.00 0.00 H new ATOM 0 HA GLU A 54 3.765 -33.682 43.077 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.862 -32.038 44.644 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.530 -32.255 45.762 1.00 0.00 H new ATOM 0 HG2 GLU A 54 4.136 -34.693 45.923 1.00 0.00 H new ATOM 0 HG3 GLU A 54 5.535 -34.371 44.918 1.00 0.00 H new ATOM 876 N ALA A 55 0.999 -33.395 44.819 1.00 0.00 N ATOM 877 CA ALA A 55 -0.143 -34.119 45.369 1.00 0.00 C ATOM 878 C ALA A 55 -0.829 -34.972 44.305 1.00 0.00 C ATOM 879 O ALA A 55 -1.238 -36.106 44.571 1.00 0.00 O ATOM 880 CB ALA A 55 -1.135 -33.146 45.991 1.00 0.00 C ATOM 0 H ALA A 55 0.901 -32.380 44.839 1.00 0.00 H new ATOM 0 HA ALA A 55 0.228 -34.790 46.144 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -1.982 -33.700 46.397 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -0.647 -32.591 46.792 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.488 -32.450 45.230 1.00 0.00 H new ATOM 886 N GLY A 56 -0.938 -34.428 43.098 1.00 0.00 N ATOM 887 CA GLY A 56 -1.549 -35.158 42.006 1.00 0.00 C ATOM 888 C GLY A 56 -0.755 -36.380 41.636 1.00 0.00 C ATOM 889 O GLY A 56 -1.315 -37.446 41.384 1.00 0.00 O ATOM 0 H GLY A 56 -0.613 -33.492 42.857 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.560 -35.453 42.287 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -1.637 -34.505 41.137 1.00 0.00 H new ATOM 893 N VAL A 57 0.560 -36.228 41.624 1.00 0.00 N ATOM 894 CA VAL A 57 1.453 -37.317 41.292 1.00 0.00 C ATOM 895 C VAL A 57 1.386 -38.413 42.352 1.00 0.00 C ATOM 896 O VAL A 57 1.300 -39.598 42.026 1.00 0.00 O ATOM 897 CB VAL A 57 2.910 -36.823 41.143 1.00 0.00 C ATOM 898 CG1 VAL A 57 3.848 -37.981 40.826 1.00 0.00 C ATOM 899 CG2 VAL A 57 2.995 -35.756 40.064 1.00 0.00 C ATOM 0 H VAL A 57 1.032 -35.351 41.843 1.00 0.00 H new ATOM 0 HA VAL A 57 1.128 -37.726 40.336 1.00 0.00 H new ATOM 0 HB VAL A 57 3.223 -36.387 42.092 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.867 -37.607 40.726 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.808 -38.713 41.632 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.541 -38.452 39.892 1.00 0.00 H new ATOM 0 HG21 VAL A 57 4.026 -35.416 39.969 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.661 -36.172 39.114 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.359 -34.913 40.335 1.00 0.00 H new ATOM 909 N ALA A 58 1.393 -38.003 43.622 1.00 0.00 N ATOM 910 CA ALA A 58 1.342 -38.947 44.743 1.00 0.00 C ATOM 911 C ALA A 58 0.067 -39.786 44.693 1.00 0.00 C ATOM 912 O ALA A 58 0.091 -40.994 44.946 1.00 0.00 O ATOM 913 CB ALA A 58 1.433 -38.202 46.070 1.00 0.00 C ATOM 0 H ALA A 58 1.434 -37.023 43.901 1.00 0.00 H new ATOM 0 HA ALA A 58 2.196 -39.619 44.659 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.394 -38.917 46.892 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.372 -37.650 46.114 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.599 -37.506 46.154 1.00 0.00 H new ATOM 919 N LEU A 59 -1.042 -39.141 44.354 1.00 0.00 N ATOM 920 CA LEU A 59 -2.322 -39.829 44.237 1.00 0.00 C ATOM 921 C LEU A 59 -2.262 -40.898 43.145 1.00 0.00 C ATOM 922 O LEU A 59 -2.654 -42.045 43.359 1.00 0.00 O ATOM 923 CB LEU A 59 -3.421 -38.818 43.896 1.00 0.00 C ATOM 924 CG LEU A 59 -4.817 -39.396 43.607 1.00 0.00 C ATOM 925 CD1 LEU A 59 -5.466 -39.949 44.861 1.00 0.00 C ATOM 926 CD2 LEU A 59 -5.701 -38.352 42.970 1.00 0.00 C ATOM 0 H LEU A 59 -1.081 -38.141 44.155 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.544 -40.310 45.189 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.507 -38.115 44.724 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.101 -38.246 43.025 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.692 -40.224 42.909 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.450 -40.348 44.616 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -4.844 -40.744 45.272 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.571 -39.153 45.598 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.684 -38.779 42.773 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.803 -37.501 43.644 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.255 -38.020 42.032 1.00 0.00 H new ATOM 938 N LEU A 60 -1.742 -40.514 41.988 1.00 0.00 N ATOM 939 CA LEU A 60 -1.657 -41.408 40.851 1.00 0.00 C ATOM 940 C LEU A 60 -0.716 -42.575 41.120 1.00 0.00 C ATOM 941 O LEU A 60 -1.022 -43.716 40.773 1.00 0.00 O ATOM 942 CB LEU A 60 -1.234 -40.653 39.604 1.00 0.00 C ATOM 943 CG LEU A 60 -2.216 -39.588 39.112 1.00 0.00 C ATOM 944 CD1 LEU A 60 -1.681 -38.910 37.876 1.00 0.00 C ATOM 945 CD2 LEU A 60 -3.585 -40.187 38.836 1.00 0.00 C ATOM 0 H LEU A 60 -1.371 -39.580 41.815 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.652 -41.821 40.685 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.274 -40.175 39.799 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.074 -41.373 38.801 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.327 -38.844 39.901 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.391 -38.155 37.539 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.728 -38.434 38.106 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.537 -39.650 37.089 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.261 -39.406 38.488 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.497 -40.958 38.071 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.981 -40.628 39.751 1.00 0.00 H new ATOM 957 N GLU A 61 0.424 -42.296 41.752 1.00 0.00 N ATOM 958 CA GLU A 61 1.385 -43.348 42.064 1.00 0.00 C ATOM 959 C GLU A 61 0.799 -44.345 43.046 1.00 0.00 C ATOM 960 O GLU A 61 1.052 -45.550 42.943 1.00 0.00 O ATOM 961 CB GLU A 61 2.691 -42.773 42.608 1.00 0.00 C ATOM 962 CG GLU A 61 3.488 -41.983 41.589 1.00 0.00 C ATOM 963 CD GLU A 61 4.801 -41.477 42.144 1.00 0.00 C ATOM 964 OE1 GLU A 61 4.798 -40.817 43.192 1.00 0.00 O ATOM 965 OE2 GLU A 61 5.852 -41.762 41.528 1.00 0.00 O ATOM 0 H GLU A 61 0.700 -41.362 42.054 1.00 0.00 H new ATOM 0 HA GLU A 61 1.609 -43.868 41.132 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.466 -42.128 43.458 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.308 -43.590 42.982 1.00 0.00 H new ATOM 0 HG2 GLU A 61 3.683 -42.611 40.720 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.893 -41.137 41.244 1.00 0.00 H new ATOM 972 N LYS A 62 0.010 -43.846 43.989 1.00 0.00 N ATOM 973 CA LYS A 62 -0.639 -44.699 44.972 1.00 0.00 C ATOM 974 C LYS A 62 -1.575 -45.673 44.255 1.00 0.00 C ATOM 975 O LYS A 62 -1.617 -46.866 44.559 1.00 0.00 O ATOM 976 CB LYS A 62 -1.445 -43.852 45.962 1.00 0.00 C ATOM 977 CG LYS A 62 -1.775 -44.581 47.246 1.00 0.00 C ATOM 978 CD LYS A 62 -2.513 -43.688 48.226 1.00 0.00 C ATOM 979 CE LYS A 62 -2.737 -44.398 49.550 1.00 0.00 C ATOM 980 NZ LYS A 62 -3.494 -45.668 49.380 1.00 0.00 N ATOM 0 H LYS A 62 -0.195 -42.852 44.093 1.00 0.00 H new ATOM 0 HA LYS A 62 0.123 -45.252 45.521 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -0.882 -42.950 46.200 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.372 -43.533 45.485 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.385 -45.456 47.021 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -0.855 -44.943 47.705 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -1.942 -42.774 48.392 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -3.472 -43.392 47.802 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -1.774 -44.609 50.016 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -3.281 -43.739 50.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.859 -45.980 50.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -4.289 -45.514 48.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -2.864 -46.399 48.992 1.00 0.00 H new ATOM 994 N ILE A 63 -2.311 -45.139 43.292 1.00 0.00 N ATOM 995 CA ILE A 63 -3.243 -45.912 42.484 1.00 0.00 C ATOM 996 C ILE A 63 -2.491 -46.943 41.639 1.00 0.00 C ATOM 997 O ILE A 63 -2.887 -48.110 41.556 1.00 0.00 O ATOM 998 CB ILE A 63 -4.024 -44.965 41.547 1.00 0.00 C ATOM 999 CG1 ILE A 63 -4.910 -44.034 42.367 1.00 0.00 C ATOM 1000 CG2 ILE A 63 -4.860 -45.748 40.545 1.00 0.00 C ATOM 1001 CD1 ILE A 63 -5.490 -42.897 41.567 1.00 0.00 C ATOM 0 H ILE A 63 -2.278 -44.149 43.047 1.00 0.00 H new ATOM 0 HA ILE A 63 -3.933 -46.431 43.150 1.00 0.00 H new ATOM 0 HB ILE A 63 -3.304 -44.369 40.987 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.724 -44.612 42.805 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.328 -43.626 43.194 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -5.398 -45.054 39.899 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -4.207 -46.376 39.939 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.574 -46.375 41.078 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -6.109 -42.276 42.214 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.682 -42.295 41.151 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.099 -43.296 40.756 1.00 0.00 H new ATOM 1013 N TRP A 64 -1.391 -46.503 41.037 1.00 0.00 N ATOM 1014 CA TRP A 64 -0.569 -47.358 40.194 1.00 0.00 C ATOM 1015 C TRP A 64 -0.039 -48.555 40.968 1.00 0.00 C ATOM 1016 O TRP A 64 0.059 -49.656 40.433 1.00 0.00 O ATOM 1017 CB TRP A 64 0.576 -46.564 39.547 1.00 0.00 C ATOM 1018 CG TRP A 64 1.479 -47.415 38.703 1.00 0.00 C ATOM 1019 CD1 TRP A 64 2.825 -47.568 38.841 1.00 0.00 C ATOM 1020 CD2 TRP A 64 1.092 -48.256 37.607 1.00 0.00 C ATOM 1021 NE1 TRP A 64 3.296 -48.440 37.887 1.00 0.00 N ATOM 1022 CE2 TRP A 64 2.253 -48.880 37.130 1.00 0.00 C ATOM 1023 CE3 TRP A 64 -0.128 -48.544 36.997 1.00 0.00 C ATOM 1024 CZ2 TRP A 64 2.233 -49.773 36.070 1.00 0.00 C ATOM 1025 CZ3 TRP A 64 -0.146 -49.423 35.938 1.00 0.00 C ATOM 1026 CH2 TRP A 64 1.026 -50.036 35.488 1.00 0.00 C ATOM 0 H TRP A 64 -1.047 -45.547 41.120 1.00 0.00 H new ATOM 0 HA TRP A 64 -1.204 -47.739 39.394 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.156 -45.769 38.931 1.00 0.00 H new ATOM 0 HB3 TRP A 64 1.165 -46.084 40.329 1.00 0.00 H new ATOM 0 HD1 TRP A 64 3.432 -47.078 39.588 1.00 0.00 H new ATOM 0 HE1 TRP A 64 4.271 -48.713 37.766 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -1.041 -48.086 37.348 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 3.139 -50.244 35.717 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -1.082 -49.643 35.446 1.00 0.00 H new ATOM 0 HH2 TRP A 64 0.976 -50.732 34.663 1.00 0.00 H new ATOM 1037 N THR A 65 0.275 -48.344 42.228 1.00 0.00 N ATOM 1038 CA THR A 65 0.795 -49.407 43.074 1.00 0.00 C ATOM 1039 C THR A 65 -0.220 -50.566 43.187 1.00 0.00 C ATOM 1040 O THR A 65 0.152 -51.718 43.436 1.00 0.00 O ATOM 1041 CB THR A 65 1.127 -48.876 44.492 1.00 0.00 C ATOM 1042 OG1 THR A 65 1.944 -47.698 44.403 1.00 0.00 O ATOM 1043 CG2 THR A 65 1.856 -49.925 45.312 1.00 0.00 C ATOM 0 H THR A 65 0.180 -47.442 42.695 1.00 0.00 H new ATOM 0 HA THR A 65 1.709 -49.776 42.610 1.00 0.00 H new ATOM 0 HB THR A 65 0.185 -48.635 44.985 1.00 0.00 H new ATOM 0 HG1 THR A 65 1.430 -46.974 43.989 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.076 -49.525 46.302 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.229 -50.811 45.410 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.788 -50.194 44.814 1.00 0.00 H new ATOM 1051 N MET A 66 -1.492 -50.253 42.983 1.00 0.00 N ATOM 1052 CA MET A 66 -2.546 -51.240 43.095 1.00 0.00 C ATOM 1053 C MET A 66 -2.850 -51.922 41.745 1.00 0.00 C ATOM 1054 O MET A 66 -3.296 -53.062 41.714 1.00 0.00 O ATOM 1055 CB MET A 66 -3.813 -50.598 43.653 1.00 0.00 C ATOM 1056 CG MET A 66 -3.654 -50.053 45.066 1.00 0.00 C ATOM 1057 SD MET A 66 -5.184 -49.366 45.731 1.00 0.00 S ATOM 1058 CE MET A 66 -6.140 -50.864 45.988 1.00 0.00 C ATOM 0 H MET A 66 -1.816 -49.317 42.738 1.00 0.00 H new ATOM 0 HA MET A 66 -2.196 -52.012 43.781 1.00 0.00 H new ATOM 0 HB2 MET A 66 -4.119 -49.787 42.993 1.00 0.00 H new ATOM 0 HB3 MET A 66 -4.616 -51.335 43.646 1.00 0.00 H new ATOM 0 HG2 MET A 66 -3.306 -50.852 45.721 1.00 0.00 H new ATOM 0 HG3 MET A 66 -2.884 -49.281 45.068 1.00 0.00 H new ATOM 0 HE1 MET A 66 -7.139 -50.734 45.572 1.00 0.00 H new ATOM 0 HE2 MET A 66 -5.646 -51.700 45.493 1.00 0.00 H new ATOM 0 HE3 MET A 66 -6.216 -51.069 47.056 1.00 0.00 H new ATOM 1068 N ILE A 67 -2.613 -51.210 40.641 1.00 0.00 N ATOM 1069 CA ILE A 67 -2.931 -51.739 39.300 1.00 0.00 C ATOM 1070 C ILE A 67 -1.703 -52.046 38.462 1.00 0.00 C ATOM 1071 O ILE A 67 -1.810 -52.202 37.265 1.00 0.00 O ATOM 1072 CB ILE A 67 -3.840 -50.784 38.506 1.00 0.00 C ATOM 1073 CG1 ILE A 67 -3.213 -49.389 38.419 1.00 0.00 C ATOM 1074 CG2 ILE A 67 -5.222 -50.734 39.115 1.00 0.00 C ATOM 1075 CD1 ILE A 67 -3.987 -48.419 37.559 1.00 0.00 C ATOM 0 H ILE A 67 -2.206 -50.275 40.641 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.454 -52.676 39.492 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.941 -51.165 37.490 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -3.127 -48.978 39.425 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -2.201 -49.481 38.024 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.849 -50.053 38.539 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.662 -51.731 39.102 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -5.154 -50.381 40.144 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -3.478 -47.455 37.549 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -4.051 -48.806 36.542 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.991 -48.295 37.964 1.00 0.00 H new ATOM 1087 N GLU A 68 -0.547 -52.131 39.081 1.00 0.00 N ATOM 1088 CA GLU A 68 0.671 -52.465 38.339 1.00 0.00 C ATOM 1089 C GLU A 68 0.590 -53.885 37.753 1.00 0.00 C ATOM 1090 O GLU A 68 1.285 -54.225 36.789 1.00 0.00 O ATOM 1091 CB GLU A 68 1.928 -52.278 39.212 1.00 0.00 C ATOM 1092 CG GLU A 68 1.792 -52.742 40.658 1.00 0.00 C ATOM 1093 CD GLU A 68 1.588 -54.236 40.798 1.00 0.00 C ATOM 1094 OE1 GLU A 68 2.546 -54.999 40.527 1.00 0.00 O ATOM 1095 OE2 GLU A 68 0.481 -54.655 41.193 1.00 0.00 O ATOM 0 H GLU A 68 -0.414 -51.978 40.081 1.00 0.00 H new ATOM 0 HA GLU A 68 0.754 -51.771 37.502 1.00 0.00 H new ATOM 0 HB2 GLU A 68 2.754 -52.819 38.751 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.197 -51.222 39.210 1.00 0.00 H new ATOM 0 HG2 GLU A 68 2.687 -52.453 41.209 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.951 -52.224 41.120 1.00 0.00 H new ATOM 1102 N ASN A 69 -0.272 -54.691 38.332 1.00 0.00 N ATOM 1103 CA ASN A 69 -0.496 -56.045 37.882 1.00 0.00 C ATOM 1104 C ASN A 69 -1.290 -56.040 36.591 1.00 0.00 C ATOM 1105 O ASN A 69 -2.247 -55.294 36.454 1.00 0.00 O ATOM 1106 CB ASN A 69 -1.208 -56.864 38.967 1.00 0.00 C ATOM 1107 CG ASN A 69 -2.416 -56.152 39.550 1.00 0.00 C ATOM 1108 OD1 ASN A 69 -3.540 -56.310 39.076 1.00 0.00 O ATOM 1109 ND2 ASN A 69 -2.185 -55.359 40.588 1.00 0.00 N ATOM 0 H ASN A 69 -0.841 -54.422 39.135 1.00 0.00 H new ATOM 0 HA ASN A 69 0.468 -56.516 37.689 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -1.524 -57.818 38.546 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -0.503 -57.087 39.768 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -2.955 -54.852 41.024 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -1.237 -55.256 40.950 1.00 0.00 H new ATOM 1116 N GLU A 70 -0.839 -56.865 35.636 1.00 0.00 N ATOM 1117 CA GLU A 70 -1.416 -56.977 34.266 1.00 0.00 C ATOM 1118 C GLU A 70 -1.490 -55.622 33.520 1.00 0.00 C ATOM 1119 O GLU A 70 -1.996 -55.548 32.397 1.00 0.00 O ATOM 1120 CB GLU A 70 -2.787 -57.700 34.248 1.00 0.00 C ATOM 1121 CG GLU A 70 -3.971 -56.880 34.748 1.00 0.00 C ATOM 1122 CD GLU A 70 -5.279 -57.627 34.623 1.00 0.00 C ATOM 1123 OE1 GLU A 70 -5.895 -57.580 33.535 1.00 0.00 O ATOM 1124 OE2 GLU A 70 -5.700 -58.277 35.607 1.00 0.00 O ATOM 0 H GLU A 70 -0.047 -57.491 35.785 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.712 -57.602 33.716 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -2.995 -58.020 33.227 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -2.710 -58.602 34.856 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.808 -56.609 35.791 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.031 -55.950 34.183 1.00 0.00 H new ATOM 1131 N ALA A 71 -0.936 -54.573 34.117 1.00 0.00 N ATOM 1132 CA ALA A 71 -0.944 -53.255 33.502 1.00 0.00 C ATOM 1133 C ALA A 71 0.474 -52.713 33.372 1.00 0.00 C ATOM 1134 O ALA A 71 1.402 -53.222 33.996 1.00 0.00 O ATOM 1135 CB ALA A 71 -1.822 -52.288 34.313 1.00 0.00 C ATOM 0 H ALA A 71 -0.476 -54.612 35.027 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.366 -53.346 32.501 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -1.817 -51.307 33.839 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.843 -52.668 34.350 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.430 -52.203 35.326 1.00 0.00 H new ATOM 1141 N ASN A 72 0.633 -51.737 32.519 1.00 0.00 N ATOM 1142 CA ASN A 72 1.893 -51.043 32.330 1.00 0.00 C ATOM 1143 C ASN A 72 1.583 -49.577 32.154 1.00 0.00 C ATOM 1144 O ASN A 72 0.494 -49.228 31.675 1.00 0.00 O ATOM 1145 CB ASN A 72 2.662 -51.590 31.100 1.00 0.00 C ATOM 1146 CG ASN A 72 1.962 -51.329 29.772 1.00 0.00 C ATOM 1147 OD1 ASN A 72 2.176 -50.301 29.131 1.00 0.00 O ATOM 1148 ND2 ASN A 72 1.135 -52.260 29.348 1.00 0.00 N ATOM 0 H ASN A 72 -0.118 -51.391 31.922 1.00 0.00 H new ATOM 0 HA ASN A 72 2.535 -51.199 33.197 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.654 -51.138 31.073 1.00 0.00 H new ATOM 0 HB3 ASN A 72 2.804 -52.664 31.220 1.00 0.00 H new ATOM 0 HD21 ASN A 72 0.646 -52.142 28.460 1.00 0.00 H new ATOM 0 HD22 ASN A 72 0.982 -53.100 29.907 1.00 0.00 H new ATOM 1155 N ARG A 73 2.487 -48.700 32.548 1.00 0.00 N ATOM 1156 CA ARG A 73 2.188 -47.299 32.425 1.00 0.00 C ATOM 1157 C ARG A 73 2.498 -46.829 31.006 1.00 0.00 C ATOM 1158 O ARG A 73 3.620 -46.986 30.512 1.00 0.00 O ATOM 1159 CB ARG A 73 2.909 -46.452 33.498 1.00 0.00 C ATOM 1160 CG ARG A 73 4.285 -45.948 33.126 1.00 0.00 C ATOM 1161 CD ARG A 73 4.946 -45.241 34.300 1.00 0.00 C ATOM 1162 NE ARG A 73 6.241 -44.665 33.939 1.00 0.00 N ATOM 1163 CZ ARG A 73 7.120 -44.176 34.817 1.00 0.00 C ATOM 1164 NH1 ARG A 73 6.863 -44.210 36.125 1.00 0.00 N ATOM 1165 NH2 ARG A 73 8.261 -43.646 34.383 1.00 0.00 N ATOM 0 H ARG A 73 3.400 -48.927 32.941 1.00 0.00 H new ATOM 0 HA ARG A 73 1.123 -47.155 32.607 1.00 0.00 H new ATOM 0 HB2 ARG A 73 2.281 -45.594 33.738 1.00 0.00 H new ATOM 0 HB3 ARG A 73 2.995 -47.048 34.407 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.907 -46.783 32.804 1.00 0.00 H new ATOM 0 HG3 ARG A 73 4.209 -45.263 32.281 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.288 -44.452 34.664 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.080 -45.948 35.119 1.00 0.00 H new ATOM 0 HE ARG A 73 6.489 -44.635 32.950 1.00 0.00 H new ATOM 0 HH11 ARG A 73 5.989 -44.612 36.463 1.00 0.00 H new ATOM 0 HH12 ARG A 73 7.541 -43.834 36.788 1.00 0.00 H new ATOM 0 HH21 ARG A 73 8.461 -43.615 33.383 1.00 0.00 H new ATOM 0 HH22 ARG A 73 8.935 -43.271 35.050 1.00 0.00 H new ATOM 1179 N ASP A 74 1.499 -46.291 30.346 1.00 0.00 N ATOM 1180 CA ASP A 74 1.649 -45.821 28.975 1.00 0.00 C ATOM 1181 C ASP A 74 2.274 -44.447 28.981 1.00 0.00 C ATOM 1182 O ASP A 74 2.796 -43.976 27.972 1.00 0.00 O ATOM 1183 CB ASP A 74 0.282 -45.764 28.300 1.00 0.00 C ATOM 1184 CG ASP A 74 0.358 -45.570 26.797 1.00 0.00 C ATOM 1185 OD1 ASP A 74 0.517 -46.574 26.077 1.00 0.00 O ATOM 1186 OD2 ASP A 74 0.244 -44.415 26.329 1.00 0.00 O ATOM 0 H ASP A 74 0.564 -46.164 30.734 1.00 0.00 H new ATOM 0 HA ASP A 74 2.291 -46.507 28.423 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -0.258 -46.686 28.513 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -0.296 -44.949 28.735 1.00 0.00 H new ATOM 1191 N LYS A 75 2.252 -43.830 30.137 1.00 0.00 N ATOM 1192 CA LYS A 75 2.726 -42.478 30.291 1.00 0.00 C ATOM 1193 C LYS A 75 3.035 -42.225 31.753 1.00 0.00 C ATOM 1194 O LYS A 75 2.490 -42.903 32.627 1.00 0.00 O ATOM 1195 CB LYS A 75 1.642 -41.509 29.810 1.00 0.00 C ATOM 1196 CG LYS A 75 2.074 -40.057 29.745 1.00 0.00 C ATOM 1197 CD LYS A 75 0.941 -39.180 29.256 1.00 0.00 C ATOM 1198 CE LYS A 75 1.360 -37.721 29.137 1.00 0.00 C ATOM 1199 NZ LYS A 75 1.689 -37.126 30.456 1.00 0.00 N ATOM 0 H LYS A 75 1.904 -44.252 30.998 1.00 0.00 H new ATOM 0 HA LYS A 75 3.630 -42.328 29.701 1.00 0.00 H new ATOM 0 HB2 LYS A 75 1.310 -41.820 28.820 1.00 0.00 H new ATOM 0 HB3 LYS A 75 0.782 -41.589 30.475 1.00 0.00 H new ATOM 0 HG2 LYS A 75 2.397 -39.725 30.731 1.00 0.00 H new ATOM 0 HG3 LYS A 75 2.931 -39.957 29.078 1.00 0.00 H new ATOM 0 HD2 LYS A 75 0.597 -39.539 28.286 1.00 0.00 H new ATOM 0 HD3 LYS A 75 0.098 -39.260 29.942 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.226 -37.645 28.479 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.556 -37.150 28.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.034 -36.154 30.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.837 -37.112 31.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 2.427 -37.694 30.919 1.00 0.00 H new ATOM 1213 N GLU A 76 3.897 -41.266 32.022 1.00 0.00 N ATOM 1214 CA GLU A 76 4.235 -40.924 33.383 1.00 0.00 C ATOM 1215 C GLU A 76 3.338 -39.782 33.854 1.00 0.00 C ATOM 1216 O GLU A 76 2.864 -38.986 33.025 1.00 0.00 O ATOM 1217 CB GLU A 76 5.712 -40.530 33.488 1.00 0.00 C ATOM 1218 CG GLU A 76 6.110 -39.343 32.626 1.00 0.00 C ATOM 1219 CD GLU A 76 7.556 -38.933 32.823 1.00 0.00 C ATOM 1220 OE1 GLU A 76 8.458 -39.682 32.375 1.00 0.00 O ATOM 1221 OE2 GLU A 76 7.800 -37.865 33.433 1.00 0.00 O ATOM 0 H GLU A 76 4.376 -40.710 31.313 1.00 0.00 H new ATOM 0 HA GLU A 76 4.074 -41.792 34.022 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.941 -40.300 34.529 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.325 -41.387 33.209 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.947 -39.591 31.577 1.00 0.00 H new ATOM 0 HG3 GLU A 76 5.462 -38.498 32.858 1.00 0.00 H new ATOM 1228 N PRO A 77 3.057 -39.690 35.172 1.00 0.00 N ATOM 1229 CA PRO A 77 2.219 -38.627 35.697 1.00 0.00 C ATOM 1230 C PRO A 77 2.870 -37.277 35.482 1.00 0.00 C ATOM 1231 O PRO A 77 4.061 -37.093 35.763 1.00 0.00 O ATOM 1232 CB PRO A 77 2.105 -38.914 37.196 1.00 0.00 C ATOM 1233 CG PRO A 77 2.632 -40.306 37.386 1.00 0.00 C ATOM 1234 CD PRO A 77 3.542 -40.593 36.224 1.00 0.00 C ATOM 0 HA PRO A 77 1.248 -38.598 35.202 1.00 0.00 H new ATOM 0 HB2 PRO A 77 2.682 -38.195 37.777 1.00 0.00 H new ATOM 0 HB3 PRO A 77 1.071 -38.838 37.531 1.00 0.00 H new ATOM 0 HG2 PRO A 77 3.173 -40.388 38.329 1.00 0.00 H new ATOM 0 HG3 PRO A 77 1.815 -41.026 37.423 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.584 -40.395 36.473 1.00 0.00 H new ATOM 0 HD3 PRO A 77 3.481 -41.637 35.916 1.00 0.00 H new ATOM 1242 N ASN A 78 2.107 -36.349 34.988 1.00 0.00 N ATOM 1243 CA ASN A 78 2.601 -35.018 34.726 1.00 0.00 C ATOM 1244 C ASN A 78 1.492 -34.004 34.914 1.00 0.00 C ATOM 1245 O ASN A 78 0.319 -34.315 34.698 1.00 0.00 O ATOM 1246 CB ASN A 78 3.180 -34.922 33.309 1.00 0.00 C ATOM 1247 CG ASN A 78 3.840 -33.577 33.035 1.00 0.00 C ATOM 1248 OD1 ASN A 78 4.357 -32.927 33.946 1.00 0.00 O ATOM 1249 ND2 ASN A 78 3.833 -33.161 31.788 1.00 0.00 N ATOM 0 H ASN A 78 1.124 -36.486 34.753 1.00 0.00 H new ATOM 0 HA ASN A 78 3.400 -34.800 35.435 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.911 -35.717 33.165 1.00 0.00 H new ATOM 0 HB3 ASN A 78 2.383 -35.086 32.583 1.00 0.00 H new ATOM 0 HD21 ASN A 78 4.266 -32.270 31.545 1.00 0.00 H new ATOM 0 HD22 ASN A 78 3.394 -33.729 31.063 1.00 0.00 H new ATOM 1256 N PHE A 79 1.857 -32.811 35.321 1.00 0.00 N ATOM 1257 CA PHE A 79 0.901 -31.752 35.517 1.00 0.00 C ATOM 1258 C PHE A 79 0.778 -30.943 34.233 1.00 0.00 C ATOM 1259 O PHE A 79 1.717 -30.262 33.824 1.00 0.00 O ATOM 1260 CB PHE A 79 1.354 -30.871 36.687 1.00 0.00 C ATOM 1261 CG PHE A 79 0.439 -29.718 37.015 1.00 0.00 C ATOM 1262 CD1 PHE A 79 -0.719 -29.928 37.732 1.00 0.00 C ATOM 1263 CD2 PHE A 79 0.756 -28.428 36.626 1.00 0.00 C ATOM 1264 CE1 PHE A 79 -1.552 -28.877 38.060 1.00 0.00 C ATOM 1265 CE2 PHE A 79 -0.073 -27.369 36.949 1.00 0.00 C ATOM 1266 CZ PHE A 79 -1.230 -27.599 37.666 1.00 0.00 C ATOM 0 H PHE A 79 2.822 -32.550 35.524 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.078 -32.165 35.758 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.456 -31.497 37.574 1.00 0.00 H new ATOM 0 HB3 PHE A 79 2.344 -30.475 36.461 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.979 -30.929 38.042 1.00 0.00 H new ATOM 0 HD2 PHE A 79 1.660 -28.246 36.064 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.455 -29.058 38.625 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.184 -26.366 36.641 1.00 0.00 H new ATOM 0 HZ PHE A 79 -1.882 -26.776 37.918 1.00 0.00 H new ATOM 1276 N GLU A 80 -0.371 -31.042 33.598 1.00 0.00 N ATOM 1277 CA GLU A 80 -0.616 -30.360 32.337 1.00 0.00 C ATOM 1278 C GLU A 80 -2.101 -30.072 32.191 1.00 0.00 C ATOM 1279 O GLU A 80 -2.932 -30.963 32.369 1.00 0.00 O ATOM 1280 CB GLU A 80 -0.129 -31.228 31.166 1.00 0.00 C ATOM 1281 CG GLU A 80 -0.245 -30.558 29.797 1.00 0.00 C ATOM 1282 CD GLU A 80 0.230 -31.454 28.672 1.00 0.00 C ATOM 1283 OE1 GLU A 80 1.403 -31.881 28.698 1.00 0.00 O ATOM 1284 OE2 GLU A 80 -0.569 -31.749 27.758 1.00 0.00 O ATOM 0 H GLU A 80 -1.160 -31.593 33.936 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.067 -29.418 32.327 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.913 -31.499 31.338 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.702 -32.155 31.154 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -1.283 -30.277 29.620 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.339 -29.638 29.796 1.00 0.00 H new ATOM 1291 N GLY A 81 -2.435 -28.828 31.880 1.00 0.00 N ATOM 1292 CA GLY A 81 -3.829 -28.458 31.752 1.00 0.00 C ATOM 1293 C GLY A 81 -4.510 -28.403 33.095 1.00 0.00 C ATOM 1294 O GLY A 81 -5.722 -28.584 33.196 1.00 0.00 O ATOM 0 H GLY A 81 -1.770 -28.072 31.715 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -3.906 -27.486 31.264 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -4.340 -29.177 31.112 1.00 0.00 H new ATOM 1298 N ARG A 82 -3.699 -28.161 34.140 1.00 0.00 N ATOM 1299 CA ARG A 82 -4.155 -28.096 35.528 1.00 0.00 C ATOM 1300 C ARG A 82 -4.566 -29.469 36.062 1.00 0.00 C ATOM 1301 O ARG A 82 -5.108 -29.584 37.158 1.00 0.00 O ATOM 1302 CB ARG A 82 -5.270 -27.063 35.710 1.00 0.00 C ATOM 1303 CG ARG A 82 -4.834 -25.633 35.409 1.00 0.00 C ATOM 1304 CD ARG A 82 -3.721 -25.196 36.349 1.00 0.00 C ATOM 1305 NE ARG A 82 -3.346 -23.795 36.160 1.00 0.00 N ATOM 1306 CZ ARG A 82 -2.117 -23.373 35.834 1.00 0.00 C ATOM 1307 NH1 ARG A 82 -1.163 -24.247 35.522 1.00 0.00 N ATOM 1308 NH2 ARG A 82 -1.852 -22.075 35.783 1.00 0.00 N ATOM 0 H ARG A 82 -2.697 -28.004 34.036 1.00 0.00 H new ATOM 0 HA ARG A 82 -3.305 -27.764 36.125 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -6.105 -27.324 35.059 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -5.637 -27.114 36.735 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -4.492 -25.562 34.376 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -5.686 -24.960 35.509 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -4.040 -25.347 37.380 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -2.847 -25.827 36.190 1.00 0.00 H new ATOM 0 HE ARG A 82 -4.072 -23.089 36.285 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -1.365 -25.247 35.530 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -0.230 -23.917 35.275 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -2.584 -21.396 35.992 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -0.916 -21.755 35.535 1.00 0.00 H new ATOM 1322 N TYR A 83 -4.293 -30.497 35.283 1.00 0.00 N ATOM 1323 CA TYR A 83 -4.545 -31.871 35.683 1.00 0.00 C ATOM 1324 C TYR A 83 -3.253 -32.643 35.741 1.00 0.00 C ATOM 1325 O TYR A 83 -2.342 -32.406 34.946 1.00 0.00 O ATOM 1326 CB TYR A 83 -5.469 -32.592 34.692 1.00 0.00 C ATOM 1327 CG TYR A 83 -6.939 -32.248 34.772 1.00 0.00 C ATOM 1328 CD1 TYR A 83 -7.462 -31.115 34.163 1.00 0.00 C ATOM 1329 CD2 TYR A 83 -7.812 -33.096 35.436 1.00 0.00 C ATOM 1330 CE1 TYR A 83 -8.818 -30.841 34.218 1.00 0.00 C ATOM 1331 CE2 TYR A 83 -9.160 -32.828 35.500 1.00 0.00 C ATOM 1332 CZ TYR A 83 -9.659 -31.702 34.891 1.00 0.00 C ATOM 1333 OH TYR A 83 -11.013 -31.439 34.950 1.00 0.00 O ATOM 0 H TYR A 83 -3.889 -30.405 34.351 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.021 -31.830 36.663 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.122 -32.376 33.682 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -5.361 -33.666 34.843 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -6.802 -30.439 33.640 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.426 -33.985 35.913 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.214 -29.959 33.737 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -9.822 -33.499 36.026 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.287 -30.952 34.145 1.00 0.00 H new ATOM 1343 N VAL A 84 -3.161 -33.541 36.678 1.00 0.00 N ATOM 1344 CA VAL A 84 -2.055 -34.463 36.725 1.00 0.00 C ATOM 1345 C VAL A 84 -2.546 -35.761 36.102 1.00 0.00 C ATOM 1346 O VAL A 84 -3.421 -36.429 36.648 1.00 0.00 O ATOM 1347 CB VAL A 84 -1.549 -34.700 38.172 1.00 0.00 C ATOM 1348 CG1 VAL A 84 -0.424 -35.706 38.203 1.00 0.00 C ATOM 1349 CG2 VAL A 84 -1.073 -33.401 38.777 1.00 0.00 C ATOM 0 H VAL A 84 -3.843 -33.658 37.428 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.204 -34.055 36.179 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.383 -35.094 38.753 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.092 -35.849 39.231 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.774 -36.656 37.799 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.408 -35.340 37.601 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.720 -33.580 39.793 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.258 -32.997 38.176 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -1.896 -32.687 38.800 1.00 0.00 H new ATOM 1359 N ASN A 85 -2.031 -36.081 34.938 1.00 0.00 N ATOM 1360 CA ASN A 85 -2.544 -37.204 34.165 1.00 0.00 C ATOM 1361 C ASN A 85 -1.565 -38.356 34.078 1.00 0.00 C ATOM 1362 O ASN A 85 -0.348 -38.159 34.047 1.00 0.00 O ATOM 1363 CB ASN A 85 -2.926 -36.745 32.747 1.00 0.00 C ATOM 1364 CG ASN A 85 -1.733 -36.216 31.956 1.00 0.00 C ATOM 1365 OD1 ASN A 85 -1.022 -36.975 31.293 1.00 0.00 O ATOM 1366 ND2 ASN A 85 -1.515 -34.913 32.014 1.00 0.00 N ATOM 0 H ASN A 85 -1.256 -35.583 34.499 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.426 -37.567 34.692 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -3.372 -37.580 32.207 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -3.686 -35.966 32.814 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -0.736 -34.503 31.499 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -2.126 -34.318 32.574 1.00 0.00 H new ATOM 1373 N MET A 86 -2.116 -39.558 34.055 1.00 0.00 N ATOM 1374 CA MET A 86 -1.347 -40.775 33.874 1.00 0.00 C ATOM 1375 C MET A 86 -2.170 -41.775 33.065 1.00 0.00 C ATOM 1376 O MET A 86 -3.377 -41.913 33.282 1.00 0.00 O ATOM 1377 CB MET A 86 -0.954 -41.389 35.222 1.00 0.00 C ATOM 1378 CG MET A 86 -0.057 -42.618 35.101 1.00 0.00 C ATOM 1379 SD MET A 86 0.374 -43.332 36.697 1.00 0.00 S ATOM 1380 CE MET A 86 -1.231 -43.927 37.237 1.00 0.00 C ATOM 0 H MET A 86 -3.118 -39.717 34.162 1.00 0.00 H new ATOM 0 HA MET A 86 -0.430 -40.530 33.338 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.442 -40.634 35.819 1.00 0.00 H new ATOM 0 HB3 MET A 86 -1.859 -41.663 35.763 1.00 0.00 H new ATOM 0 HG2 MET A 86 -0.561 -43.371 34.496 1.00 0.00 H new ATOM 0 HG3 MET A 86 0.856 -42.344 34.573 1.00 0.00 H new ATOM 0 HE1 MET A 86 -1.448 -43.537 38.231 1.00 0.00 H new ATOM 0 HE2 MET A 86 -1.998 -43.590 36.540 1.00 0.00 H new ATOM 0 HE3 MET A 86 -1.223 -45.017 37.268 1.00 0.00 H new ATOM 1390 N LEU A 87 -1.528 -42.447 32.133 1.00 0.00 N ATOM 1391 CA LEU A 87 -2.192 -43.422 31.287 1.00 0.00 C ATOM 1392 C LEU A 87 -1.740 -44.831 31.605 1.00 0.00 C ATOM 1393 O LEU A 87 -0.546 -45.088 31.772 1.00 0.00 O ATOM 1394 CB LEU A 87 -1.927 -43.115 29.817 1.00 0.00 C ATOM 1395 CG LEU A 87 -2.804 -42.047 29.180 1.00 0.00 C ATOM 1396 CD1 LEU A 87 -2.149 -41.513 27.919 1.00 0.00 C ATOM 1397 CD2 LEU A 87 -4.166 -42.638 28.845 1.00 0.00 C ATOM 0 H LEU A 87 -0.533 -42.335 31.939 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.262 -43.355 31.484 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.886 -42.808 29.714 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.045 -44.038 29.249 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.930 -41.225 29.884 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.787 -40.750 27.473 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -1.181 -41.077 28.168 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.008 -42.328 27.209 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.793 -41.872 28.389 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.042 -43.467 28.148 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.640 -42.999 29.758 1.00 0.00 H new ATOM 1409 N VAL A 88 -2.691 -45.736 31.689 1.00 0.00 N ATOM 1410 CA VAL A 88 -2.394 -47.129 31.933 1.00 0.00 C ATOM 1411 C VAL A 88 -2.896 -47.998 30.797 1.00 0.00 C ATOM 1412 O VAL A 88 -4.034 -47.845 30.320 1.00 0.00 O ATOM 1413 CB VAL A 88 -2.970 -47.643 33.270 1.00 0.00 C ATOM 1414 CG1 VAL A 88 -2.208 -47.046 34.438 1.00 0.00 C ATOM 1415 CG2 VAL A 88 -4.451 -47.323 33.381 1.00 0.00 C ATOM 0 H VAL A 88 -3.685 -45.528 31.591 1.00 0.00 H new ATOM 0 HA VAL A 88 -1.308 -47.198 31.995 1.00 0.00 H new ATOM 0 HB VAL A 88 -2.855 -48.727 33.297 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -2.626 -47.418 35.373 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -1.158 -47.331 34.371 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -2.292 -45.960 34.410 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.833 -47.695 34.331 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -4.595 -46.244 33.330 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.989 -47.800 32.562 1.00 0.00 H new ATOM 1425 N THR A 89 -2.045 -48.876 30.355 1.00 0.00 N ATOM 1426 CA THR A 89 -2.356 -49.791 29.297 1.00 0.00 C ATOM 1427 C THR A 89 -2.186 -51.206 29.824 1.00 0.00 C ATOM 1428 O THR A 89 -1.309 -51.455 30.644 1.00 0.00 O ATOM 1429 CB THR A 89 -1.399 -49.563 28.099 1.00 0.00 C ATOM 1430 OG1 THR A 89 -1.414 -48.183 27.738 1.00 0.00 O ATOM 1431 CG2 THR A 89 -1.796 -50.387 26.887 1.00 0.00 C ATOM 0 H THR A 89 -1.100 -48.978 30.725 1.00 0.00 H new ATOM 0 HA THR A 89 -3.380 -49.633 28.959 1.00 0.00 H new ATOM 0 HB THR A 89 -0.402 -49.874 28.411 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.694 -48.005 27.097 1.00 0.00 H new ATOM 0 HG21 THR A 89 -1.098 -50.195 26.072 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.772 -51.446 27.144 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.803 -50.112 26.574 1.00 0.00 H new ATOM 1439 N PRO A 90 -3.033 -52.135 29.410 1.00 0.00 N ATOM 1440 CA PRO A 90 -2.916 -53.523 29.827 1.00 0.00 C ATOM 1441 C PRO A 90 -1.708 -54.172 29.147 1.00 0.00 C ATOM 1442 O PRO A 90 -1.264 -53.704 28.090 1.00 0.00 O ATOM 1443 CB PRO A 90 -4.230 -54.122 29.333 1.00 0.00 C ATOM 1444 CG PRO A 90 -4.537 -53.321 28.125 1.00 0.00 C ATOM 1445 CD PRO A 90 -4.166 -51.929 28.495 1.00 0.00 C ATOM 0 HA PRO A 90 -2.762 -53.663 30.897 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.126 -55.181 29.098 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.017 -54.038 30.082 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -3.966 -53.668 27.264 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.592 -53.393 27.859 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.882 -51.339 27.623 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.989 -51.405 28.980 1.00 0.00 H new ATOM 1453 N LYS A 91 -1.152 -55.207 29.751 1.00 0.00 N ATOM 1454 CA LYS A 91 -0.005 -55.867 29.163 1.00 0.00 C ATOM 1455 C LYS A 91 -0.377 -56.499 27.834 1.00 0.00 C ATOM 1456 O LYS A 91 -1.423 -57.138 27.710 1.00 0.00 O ATOM 1457 CB LYS A 91 0.598 -56.900 30.121 1.00 0.00 C ATOM 1458 CG LYS A 91 1.284 -56.285 31.343 1.00 0.00 C ATOM 1459 CD LYS A 91 1.873 -57.359 32.240 1.00 0.00 C ATOM 1460 CE LYS A 91 2.654 -56.765 33.411 1.00 0.00 C ATOM 1461 NZ LYS A 91 1.808 -55.966 34.329 1.00 0.00 N ATOM 0 H LYS A 91 -1.472 -55.603 30.635 1.00 0.00 H new ATOM 0 HA LYS A 91 0.760 -55.113 28.978 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -0.191 -57.572 30.459 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.322 -57.507 29.577 1.00 0.00 H new ATOM 0 HG2 LYS A 91 2.073 -55.606 31.018 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.565 -55.691 31.907 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.071 -57.991 32.623 1.00 0.00 H new ATOM 0 HD3 LYS A 91 2.531 -58.000 31.653 1.00 0.00 H new ATOM 0 HE2 LYS A 91 3.126 -57.572 33.972 1.00 0.00 H new ATOM 0 HE3 LYS A 91 3.455 -56.135 33.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 2.136 -56.099 35.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 1.874 -54.960 34.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 0.819 -56.278 34.250 1.00 0.00 H new ATOM 1475 N LYS A 92 0.479 -56.302 26.846 1.00 0.00 N ATOM 1476 CA LYS A 92 0.223 -56.769 25.496 1.00 0.00 C ATOM 1477 C LYS A 92 0.292 -58.283 25.384 1.00 0.00 C ATOM 1478 O LYS A 92 1.371 -58.861 25.313 1.00 0.00 O ATOM 1479 CB LYS A 92 1.209 -56.127 24.523 1.00 0.00 C ATOM 1480 CG LYS A 92 0.988 -54.639 24.315 1.00 0.00 C ATOM 1481 CD LYS A 92 2.057 -54.043 23.406 1.00 0.00 C ATOM 1482 CE LYS A 92 1.762 -52.587 23.087 1.00 0.00 C ATOM 1483 NZ LYS A 92 0.625 -52.453 22.140 1.00 0.00 N ATOM 0 H LYS A 92 1.368 -55.815 26.957 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.794 -56.471 25.239 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.223 -56.286 24.891 1.00 0.00 H new ATOM 0 HB3 LYS A 92 1.136 -56.633 23.560 1.00 0.00 H new ATOM 0 HG2 LYS A 92 0.003 -54.473 23.879 1.00 0.00 H new ATOM 0 HG3 LYS A 92 1.001 -54.129 25.278 1.00 0.00 H new ATOM 0 HD2 LYS A 92 3.032 -54.122 23.887 1.00 0.00 H new ATOM 0 HD3 LYS A 92 2.111 -54.616 22.481 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.534 -52.051 24.008 1.00 0.00 H new ATOM 0 HE3 LYS A 92 2.649 -52.121 22.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 0.549 -51.464 21.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.786 -53.066 21.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -0.257 -52.735 22.614 1.00 0.00 H new ATOM 1497 N ALA A 93 -0.869 -58.922 25.406 1.00 0.00 N ATOM 1498 CA ALA A 93 -0.949 -60.358 25.210 1.00 0.00 C ATOM 1499 C ALA A 93 -0.522 -60.702 23.792 1.00 0.00 C ATOM 1500 O ALA A 93 0.153 -61.703 23.551 1.00 0.00 O ATOM 1501 CB ALA A 93 -2.363 -60.856 25.478 1.00 0.00 C ATOM 0 H ALA A 93 -1.768 -58.466 25.558 1.00 0.00 H new ATOM 0 HA ALA A 93 -0.278 -60.851 25.914 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.404 -61.935 25.326 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -2.642 -60.623 26.506 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -3.057 -60.367 24.794 1.00 0.00 H new ATOM 1507 N GLU A 94 -0.910 -59.842 22.863 1.00 0.00 N ATOM 1508 CA GLU A 94 -0.564 -59.989 21.469 1.00 0.00 C ATOM 1509 C GLU A 94 0.311 -58.820 21.033 1.00 0.00 C ATOM 1510 O GLU A 94 -0.001 -57.661 21.328 1.00 0.00 O ATOM 1511 CB GLU A 94 -1.831 -60.066 20.606 1.00 0.00 C ATOM 1512 CG GLU A 94 -1.558 -60.192 19.114 1.00 0.00 C ATOM 1513 CD GLU A 94 -2.818 -60.396 18.310 1.00 0.00 C ATOM 1514 OE1 GLU A 94 -3.522 -59.406 18.028 1.00 0.00 O ATOM 1515 OE2 GLU A 94 -3.114 -61.555 17.958 1.00 0.00 O ATOM 0 H GLU A 94 -1.478 -59.019 23.063 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.008 -60.917 21.336 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -2.427 -60.920 20.929 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -2.432 -59.174 20.781 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.049 -59.294 18.764 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -0.881 -61.029 18.941 1.00 0.00 H new ATOM 1522 N GLY A 95 1.396 -59.124 20.347 1.00 0.00 N ATOM 1523 CA GLY A 95 2.314 -58.088 19.916 1.00 0.00 C ATOM 1524 C GLY A 95 3.316 -57.754 20.996 1.00 0.00 C ATOM 1525 O GLY A 95 3.150 -56.780 21.727 1.00 0.00 O ATOM 0 H GLY A 95 1.662 -60.071 20.078 1.00 0.00 H new ATOM 0 HA2 GLY A 95 2.840 -58.416 19.019 1.00 0.00 H new ATOM 0 HA3 GLY A 95 1.754 -57.192 19.648 1.00 0.00 H new ATOM 1529 N HIS A 96 4.349 -58.565 21.096 1.00 0.00 N ATOM 1530 CA HIS A 96 5.363 -58.398 22.131 1.00 0.00 C ATOM 1531 C HIS A 96 6.625 -57.768 21.561 1.00 0.00 C ATOM 1532 O HIS A 96 6.799 -57.677 20.341 1.00 0.00 O ATOM 1533 CB HIS A 96 5.728 -59.751 22.756 1.00 0.00 C ATOM 1534 CG HIS A 96 4.607 -60.420 23.491 1.00 0.00 C ATOM 1535 ND1 HIS A 96 4.498 -60.420 24.863 1.00 0.00 N ATOM 1536 CD2 HIS A 96 3.544 -61.117 23.031 1.00 0.00 C ATOM 1537 CE1 HIS A 96 3.419 -61.097 25.215 1.00 0.00 C ATOM 1538 NE2 HIS A 96 2.821 -61.531 24.120 1.00 0.00 N ATOM 0 H HIS A 96 4.514 -59.354 20.471 1.00 0.00 H new ATOM 0 HA HIS A 96 4.944 -57.742 22.894 1.00 0.00 H new ATOM 0 HB2 HIS A 96 6.078 -60.418 21.968 1.00 0.00 H new ATOM 0 HB3 HIS A 96 6.561 -59.606 23.444 1.00 0.00 H new ATOM 0 HD2 HIS A 96 3.308 -61.312 21.995 1.00 0.00 H new ATOM 0 HE1 HIS A 96 3.083 -61.267 26.227 1.00 0.00 H new ATOM 0 HE2 HIS A 96 1.964 -62.083 24.090 1.00 0.00 H new ATOM 1546 N HIS A 97 7.500 -57.328 22.452 1.00 0.00 N ATOM 1547 CA HIS A 97 8.797 -56.784 22.063 1.00 0.00 C ATOM 1548 C HIS A 97 9.689 -57.904 21.524 1.00 0.00 C ATOM 1549 O HIS A 97 9.408 -59.081 21.749 1.00 0.00 O ATOM 1550 CB HIS A 97 9.481 -56.099 23.265 1.00 0.00 C ATOM 1551 CG HIS A 97 9.862 -57.044 24.376 1.00 0.00 C ATOM 1552 ND1 HIS A 97 11.130 -57.576 24.515 1.00 0.00 N ATOM 1553 CD2 HIS A 97 9.130 -57.558 25.398 1.00 0.00 C ATOM 1554 CE1 HIS A 97 11.152 -58.376 25.566 1.00 0.00 C ATOM 1555 NE2 HIS A 97 9.956 -58.381 26.116 1.00 0.00 N ATOM 0 H HIS A 97 7.335 -57.336 23.459 1.00 0.00 H new ATOM 0 HA HIS A 97 8.642 -56.039 21.282 1.00 0.00 H new ATOM 0 HB2 HIS A 97 10.377 -55.586 22.916 1.00 0.00 H new ATOM 0 HB3 HIS A 97 8.812 -55.337 23.664 1.00 0.00 H new ATOM 0 HD2 HIS A 97 8.090 -57.355 25.606 1.00 0.00 H new ATOM 0 HE1 HIS A 97 12.009 -58.933 25.916 1.00 0.00 H new ATOM 0 HE2 HIS A 97 9.688 -58.913 26.944 1.00 0.00 H new ATOM 1563 N HIS A 98 10.755 -57.535 20.818 1.00 0.00 N ATOM 1564 CA HIS A 98 11.678 -58.522 20.242 1.00 0.00 C ATOM 1565 C HIS A 98 12.321 -59.383 21.335 1.00 0.00 C ATOM 1566 O HIS A 98 11.933 -60.531 21.536 1.00 0.00 O ATOM 1567 CB HIS A 98 12.766 -57.830 19.410 1.00 0.00 C ATOM 1568 CG HIS A 98 12.244 -57.069 18.234 1.00 0.00 C ATOM 1569 ND1 HIS A 98 12.051 -55.703 18.248 1.00 0.00 N ATOM 1570 CD2 HIS A 98 11.870 -57.484 17.004 1.00 0.00 C ATOM 1571 CE1 HIS A 98 11.577 -55.315 17.077 1.00 0.00 C ATOM 1572 NE2 HIS A 98 11.457 -56.376 16.305 1.00 0.00 N ATOM 0 H HIS A 98 11.005 -56.564 20.629 1.00 0.00 H new ATOM 0 HA HIS A 98 11.097 -59.173 19.589 1.00 0.00 H new ATOM 0 HB2 HIS A 98 13.321 -57.147 20.053 1.00 0.00 H new ATOM 0 HB3 HIS A 98 13.472 -58.582 19.058 1.00 0.00 H new ATOM 0 HD2 HIS A 98 11.892 -58.500 16.638 1.00 0.00 H new ATOM 0 HE1 HIS A 98 11.330 -54.301 16.800 1.00 0.00 H new ATOM 0 HE2 HIS A 98 11.113 -56.375 15.345 1.00 0.00 H new ATOM 1580 N HIS A 99 13.305 -58.818 22.026 1.00 0.00 N ATOM 1581 CA HIS A 99 13.983 -59.510 23.121 1.00 0.00 C ATOM 1582 C HIS A 99 14.854 -58.520 23.902 1.00 0.00 C ATOM 1583 O HIS A 99 15.623 -58.900 24.776 1.00 0.00 O ATOM 1584 CB HIS A 99 14.848 -60.667 22.571 1.00 0.00 C ATOM 1585 CG HIS A 99 15.331 -61.626 23.627 1.00 0.00 C ATOM 1586 ND1 HIS A 99 16.591 -61.560 24.199 1.00 0.00 N ATOM 1587 CD2 HIS A 99 14.713 -62.678 24.215 1.00 0.00 C ATOM 1588 CE1 HIS A 99 16.719 -62.529 25.088 1.00 0.00 C ATOM 1589 NE2 HIS A 99 15.599 -63.216 25.116 1.00 0.00 N ATOM 0 H HIS A 99 13.654 -57.876 21.847 1.00 0.00 H new ATOM 0 HA HIS A 99 13.233 -59.928 23.793 1.00 0.00 H new ATOM 0 HB2 HIS A 99 14.269 -61.219 21.830 1.00 0.00 H new ATOM 0 HB3 HIS A 99 15.711 -60.248 22.053 1.00 0.00 H new ATOM 0 HD2 HIS A 99 13.711 -63.028 24.013 1.00 0.00 H new ATOM 0 HE1 HIS A 99 17.595 -62.723 25.689 1.00 0.00 H new ATOM 0 HE2 HIS A 99 15.416 -64.022 25.713 1.00 0.00 H new ATOM 1597 N HIS A 100 14.703 -57.242 23.592 1.00 0.00 N ATOM 1598 CA HIS A 100 15.520 -56.199 24.210 1.00 0.00 C ATOM 1599 C HIS A 100 14.864 -55.655 25.475 1.00 0.00 C ATOM 1600 O HIS A 100 15.452 -54.832 26.172 1.00 0.00 O ATOM 1601 CB HIS A 100 15.753 -55.050 23.213 1.00 0.00 C ATOM 1602 CG HIS A 100 14.507 -54.264 22.895 1.00 0.00 C ATOM 1603 ND1 HIS A 100 13.502 -54.741 22.077 1.00 0.00 N ATOM 1604 CD2 HIS A 100 14.106 -53.032 23.297 1.00 0.00 C ATOM 1605 CE1 HIS A 100 12.534 -53.836 22.001 1.00 0.00 C ATOM 1606 NE2 HIS A 100 12.879 -52.797 22.732 1.00 0.00 N ATOM 0 H HIS A 100 14.022 -56.897 22.915 1.00 0.00 H new ATOM 0 HA HIS A 100 16.476 -56.644 24.485 1.00 0.00 H new ATOM 0 HB2 HIS A 100 16.505 -54.374 23.620 1.00 0.00 H new ATOM 0 HB3 HIS A 100 16.160 -55.459 22.288 1.00 0.00 H new ATOM 0 HD2 HIS A 100 14.652 -52.360 23.943 1.00 0.00 H new ATOM 0 HE1 HIS A 100 11.619 -53.935 21.436 1.00 0.00 H new ATOM 0 HE2 HIS A 100 12.322 -51.952 22.858 1.00 0.00 H new ATOM 1614 N HIS A 101 13.642 -56.126 25.750 1.00 0.00 N ATOM 1615 CA HIS A 101 12.837 -55.660 26.887 1.00 0.00 C ATOM 1616 C HIS A 101 12.333 -54.250 26.623 1.00 0.00 C ATOM 1617 O HIS A 101 13.103 -53.293 26.816 1.00 0.00 O ATOM 1618 CB HIS A 101 13.613 -55.737 28.216 1.00 0.00 C ATOM 1619 CG HIS A 101 12.845 -55.228 29.404 1.00 0.00 C ATOM 1620 ND1 HIS A 101 13.010 -53.960 29.917 1.00 0.00 N ATOM 1621 CD2 HIS A 101 11.910 -55.825 30.184 1.00 0.00 C ATOM 1622 CE1 HIS A 101 12.212 -53.799 30.957 1.00 0.00 C ATOM 1623 NE2 HIS A 101 11.536 -54.912 31.141 1.00 0.00 N ATOM 1624 OXT HIS A 101 11.177 -54.105 26.196 1.00 0.00 O ATOM 0 H HIS A 101 13.182 -56.843 25.189 1.00 0.00 H new ATOM 0 HA HIS A 101 11.980 -56.326 26.988 1.00 0.00 H new ATOM 0 HB2 HIS A 101 13.899 -56.773 28.398 1.00 0.00 H new ATOM 0 HB3 HIS A 101 14.535 -55.164 28.120 1.00 0.00 H new ATOM 0 HD2 HIS A 101 11.530 -56.830 30.074 1.00 0.00 H new ATOM 0 HE1 HIS A 101 12.129 -52.904 31.556 1.00 0.00 H new ATOM 0 HE2 HIS A 101 10.846 -55.072 31.875 1.00 0.00 H new TER 1632 HIS A 101