USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1131 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 Single : A 1 GLY N :NH3+ -114:sc= 0.161 (180deg=0) USER MOD Single : A 4 MET CE :methyl -132:sc= 0 (180deg=-0.0969) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.00733 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 CYS SG : rot 81:sc= 0.134 USER MOD Single : A 17 TYR OH : rot 30:sc= 0 USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 25 SER OG : rot -101:sc= 1.14 USER MOD Single : A 31 THR OG1 : rot -55:sc= 0.948 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 23:sc= 1.7 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.0143 USER MOD Single : A 44 GLN : amide:sc= 0.948 K(o=0.95,f=-0.022) USER MOD Single : A 48 TYR OH : rot -32:sc= 1.34 USER MOD Single : A 49 GLN : amide:sc= 0.59 K(o=0.59,f=0) USER MOD Single : A 50 HIS : no HD1:sc= 0 K(o=0,f=-2.7!) USER MOD Single : A 53 GLN : amide:sc= 0.52 K(o=0.52,f=-7.3!) USER MOD Single : A 54 GLN : amide:sc= -0.273 X(o=-0.27,f=0) USER MOD Single : A 55 CYS SG : rot 57:sc= 0.634 USER MOD Single : A 56 THR OG1 : rot -140:sc= -1.11 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 36:sc= 1.07 USER MOD Single : A 73 MET CE :methyl -174:sc= 0 (180deg=-0.0523) USER MOD Single : A 74 SER OG : rot 4:sc= 0.486 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot -2:sc= 0.282 USER MOD Single : A 78 LYS NZ :NH3+ 144:sc= 1.05 (180deg=0.315) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc=-0.00948 K(o=-0.0095,f=-0.85) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0.302 K(o=0.3,f=-3.7!) USER MOD Single : A 96 LYS NZ :NH3+ -169:sc=-0.00045 (180deg=-0.0886) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0066 USER MOD Single : A 99 THR OG1 : rot -150:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 144:sc= 0.179 (180deg=-0.459) USER MOD Single : A 109 GLN : amide:sc= 0.0726 X(o=0.073,f=-0.36) USER MOD Single : A 110 ASN : amide:sc= 0.272 X(o=0.27,f=0) USER MOD Single : A 113 LYS NZ :NH3+ -165:sc= -0.262 (180deg=-0.598) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ -159:sc= -0.102 (180deg=-0.57) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ -163:sc= 0.866 (180deg=0.782) USER MOD Single : A 134 LYS NZ :NH3+ -161:sc= -0.041 (180deg=-0.348) USER MOD Single : A 139 ASN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0.874 K(o=0.87,f=0) USER MOD Single : A 144 THR OG1 : rot 180:sc= -0.0062 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.962 -20.502 -10.483 1.00 0.00 N ATOM 2 CA GLY A 1 -1.904 -21.454 -10.849 1.00 0.00 C ATOM 3 C GLY A 1 -1.032 -21.728 -9.639 1.00 0.00 C ATOM 4 O GLY A 1 -1.115 -20.984 -8.662 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.887 -20.973 -10.539 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.804 -20.163 -9.513 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.945 -19.695 -11.139 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -2.345 -22.383 -11.211 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.301 -21.049 -11.662 1.00 0.00 H new ATOM 7 N ILE A 2 -0.193 -22.768 -9.684 1.00 0.00 N ATOM 8 CA ILE A 2 0.327 -23.437 -8.493 1.00 0.00 C ATOM 9 C ILE A 2 0.987 -22.453 -7.516 1.00 0.00 C ATOM 10 O ILE A 2 2.002 -21.814 -7.801 1.00 0.00 O ATOM 11 CB ILE A 2 1.206 -24.656 -8.858 1.00 0.00 C ATOM 12 CG1 ILE A 2 1.715 -25.338 -7.567 1.00 0.00 C ATOM 13 CG2 ILE A 2 2.346 -24.308 -9.828 1.00 0.00 C ATOM 14 CD1 ILE A 2 2.393 -26.694 -7.783 1.00 0.00 C ATOM 0 H ILE A 2 0.146 -23.171 -10.558 1.00 0.00 H new ATOM 0 HA ILE A 2 -0.522 -23.847 -7.945 1.00 0.00 H new ATOM 0 HB ILE A 2 0.584 -25.366 -9.402 1.00 0.00 H new ATOM 0 HG12 ILE A 2 2.420 -24.669 -7.073 1.00 0.00 H new ATOM 0 HG13 ILE A 2 0.873 -25.472 -6.887 1.00 0.00 H new ATOM 0 HG21 ILE A 2 2.926 -25.205 -10.045 1.00 0.00 H new ATOM 0 HG22 ILE A 2 1.928 -23.913 -10.754 1.00 0.00 H new ATOM 0 HG23 ILE A 2 2.994 -23.558 -9.374 1.00 0.00 H new ATOM 0 HD11 ILE A 2 2.717 -27.096 -6.823 1.00 0.00 H new ATOM 0 HD12 ILE A 2 1.687 -27.384 -8.246 1.00 0.00 H new ATOM 0 HD13 ILE A 2 3.258 -26.569 -8.434 1.00 0.00 H new ATOM 26 N ARG A 3 0.336 -22.311 -6.368 1.00 0.00 N ATOM 27 CA ARG A 3 0.703 -21.531 -5.197 1.00 0.00 C ATOM 28 C ARG A 3 0.110 -22.285 -4.014 1.00 0.00 C ATOM 29 O ARG A 3 -0.853 -23.037 -4.189 1.00 0.00 O ATOM 30 CB ARG A 3 0.113 -20.107 -5.281 1.00 0.00 C ATOM 31 CG ARG A 3 1.103 -19.049 -5.802 1.00 0.00 C ATOM 32 CD ARG A 3 0.577 -18.265 -7.013 1.00 0.00 C ATOM 33 NE ARG A 3 0.887 -18.961 -8.271 1.00 0.00 N ATOM 34 CZ ARG A 3 1.978 -18.765 -9.023 1.00 0.00 C ATOM 35 NH1 ARG A 3 2.788 -17.735 -8.800 1.00 0.00 N ATOM 36 NH2 ARG A 3 2.294 -19.590 -10.012 1.00 0.00 N ATOM 0 H ARG A 3 -0.553 -22.789 -6.222 1.00 0.00 H new ATOM 0 HA ARG A 3 1.783 -21.416 -5.109 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -0.761 -20.125 -5.933 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -0.234 -19.809 -4.291 1.00 0.00 H new ATOM 0 HG2 ARG A 3 1.333 -18.350 -4.998 1.00 0.00 H new ATOM 0 HG3 ARG A 3 2.038 -19.540 -6.074 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -0.501 -18.132 -6.924 1.00 0.00 H new ATOM 0 HD3 ARG A 3 1.021 -17.269 -7.026 1.00 0.00 H new ATOM 0 HE ARG A 3 0.213 -19.653 -8.599 1.00 0.00 H new ATOM 0 HH11 ARG A 3 2.583 -17.079 -8.046 1.00 0.00 H new ATOM 0 HH12 ARG A 3 3.615 -17.601 -9.382 1.00 0.00 H new ATOM 0 HH21 ARG A 3 1.701 -20.395 -10.214 1.00 0.00 H new ATOM 0 HH22 ARG A 3 3.130 -19.420 -10.571 1.00 0.00 H new ATOM 50 N MET A 4 0.669 -22.086 -2.832 1.00 0.00 N ATOM 51 CA MET A 4 0.215 -22.636 -1.564 1.00 0.00 C ATOM 52 C MET A 4 0.135 -21.440 -0.611 1.00 0.00 C ATOM 53 O MET A 4 0.533 -20.331 -0.982 1.00 0.00 O ATOM 54 CB MET A 4 1.258 -23.670 -1.089 1.00 0.00 C ATOM 55 CG MET A 4 0.812 -24.591 0.054 1.00 0.00 C ATOM 56 SD MET A 4 2.173 -25.288 1.030 1.00 0.00 S ATOM 57 CE MET A 4 2.696 -23.830 1.972 1.00 0.00 C ATOM 0 H MET A 4 1.499 -21.503 -2.725 1.00 0.00 H new ATOM 0 HA MET A 4 -0.749 -23.140 -1.624 1.00 0.00 H new ATOM 0 HB2 MET A 4 1.541 -24.289 -1.940 1.00 0.00 H new ATOM 0 HB3 MET A 4 2.153 -23.135 -0.771 1.00 0.00 H new ATOM 0 HG2 MET A 4 0.154 -24.032 0.719 1.00 0.00 H new ATOM 0 HG3 MET A 4 0.224 -25.409 -0.363 1.00 0.00 H new ATOM 0 HE1 MET A 4 3.780 -23.729 1.914 1.00 0.00 H new ATOM 0 HE2 MET A 4 2.226 -22.939 1.555 1.00 0.00 H new ATOM 0 HE3 MET A 4 2.397 -23.944 3.014 1.00 0.00 H new ATOM 67 N ALA A 5 -0.378 -21.636 0.603 1.00 0.00 N ATOM 68 CA ALA A 5 -0.414 -20.603 1.624 1.00 0.00 C ATOM 69 C ALA A 5 1.026 -20.395 2.115 1.00 0.00 C ATOM 70 O ALA A 5 1.451 -20.975 3.118 1.00 0.00 O ATOM 71 CB ALA A 5 -1.369 -21.006 2.752 1.00 0.00 C ATOM 0 H ALA A 5 -0.782 -22.524 0.902 1.00 0.00 H new ATOM 0 HA ALA A 5 -0.795 -19.662 1.227 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -1.387 -20.223 3.511 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -2.372 -21.143 2.348 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -1.028 -21.939 3.201 1.00 0.00 H new ATOM 77 N THR A 6 1.795 -19.604 1.372 1.00 0.00 N ATOM 78 CA THR A 6 3.164 -19.214 1.673 1.00 0.00 C ATOM 79 C THR A 6 3.113 -18.393 2.984 1.00 0.00 C ATOM 80 O THR A 6 2.063 -17.840 3.328 1.00 0.00 O ATOM 81 CB THR A 6 3.673 -18.466 0.419 1.00 0.00 C ATOM 82 OG1 THR A 6 3.428 -19.221 -0.759 1.00 0.00 O ATOM 83 CG2 THR A 6 5.171 -18.168 0.391 1.00 0.00 C ATOM 0 H THR A 6 1.460 -19.198 0.498 1.00 0.00 H new ATOM 0 HA THR A 6 3.866 -20.027 1.859 1.00 0.00 H new ATOM 0 HB THR A 6 3.124 -17.525 0.461 1.00 0.00 H new ATOM 0 HG1 THR A 6 3.757 -18.727 -1.539 1.00 0.00 H new ATOM 0 HG21 THR A 6 5.420 -17.642 -0.531 1.00 0.00 H new ATOM 0 HG22 THR A 6 5.434 -17.546 1.246 1.00 0.00 H new ATOM 0 HG23 THR A 6 5.729 -19.103 0.437 1.00 0.00 H new ATOM 91 N LYS A 7 4.214 -18.287 3.730 1.00 0.00 N ATOM 92 CA LYS A 7 4.265 -17.623 5.036 1.00 0.00 C ATOM 93 C LYS A 7 5.308 -16.522 5.074 1.00 0.00 C ATOM 94 O LYS A 7 5.850 -16.129 4.047 1.00 0.00 O ATOM 95 CB LYS A 7 4.447 -18.688 6.140 1.00 0.00 C ATOM 96 CG LYS A 7 5.697 -19.567 5.973 1.00 0.00 C ATOM 97 CD LYS A 7 5.943 -20.443 7.207 1.00 0.00 C ATOM 98 CE LYS A 7 6.673 -19.678 8.323 1.00 0.00 C ATOM 99 NZ LYS A 7 8.081 -20.108 8.429 1.00 0.00 N ATOM 0 H LYS A 7 5.114 -18.668 3.438 1.00 0.00 H new ATOM 0 HA LYS A 7 3.320 -17.112 5.221 1.00 0.00 H new ATOM 0 HB2 LYS A 7 4.496 -18.187 7.107 1.00 0.00 H new ATOM 0 HB3 LYS A 7 3.566 -19.330 6.158 1.00 0.00 H new ATOM 0 HG2 LYS A 7 5.581 -20.201 5.094 1.00 0.00 H new ATOM 0 HG3 LYS A 7 6.566 -18.934 5.797 1.00 0.00 H new ATOM 0 HD2 LYS A 7 4.990 -20.812 7.585 1.00 0.00 H new ATOM 0 HD3 LYS A 7 6.531 -21.315 6.921 1.00 0.00 H new ATOM 0 HE2 LYS A 7 6.631 -18.608 8.122 1.00 0.00 H new ATOM 0 HE3 LYS A 7 6.166 -19.844 9.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 8.550 -19.576 9.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 8.118 -21.125 8.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 8.568 -19.927 7.528 1.00 0.00 H new ATOM 113 N ILE A 8 5.519 -15.967 6.261 1.00 0.00 N ATOM 114 CA ILE A 8 6.505 -14.930 6.509 1.00 0.00 C ATOM 115 C ILE A 8 7.280 -15.261 7.780 1.00 0.00 C ATOM 116 O ILE A 8 6.732 -15.855 8.716 1.00 0.00 O ATOM 117 CB ILE A 8 5.842 -13.534 6.608 1.00 0.00 C ATOM 118 CG1 ILE A 8 5.195 -13.180 7.963 1.00 0.00 C ATOM 119 CG2 ILE A 8 4.824 -13.286 5.489 1.00 0.00 C ATOM 120 CD1 ILE A 8 3.943 -13.958 8.388 1.00 0.00 C ATOM 0 H ILE A 8 4.996 -16.234 7.095 1.00 0.00 H new ATOM 0 HA ILE A 8 7.198 -14.896 5.668 1.00 0.00 H new ATOM 0 HB ILE A 8 6.698 -12.868 6.498 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.950 -13.312 8.738 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.940 -12.121 7.945 1.00 0.00 H new ATOM 0 HG21 ILE A 8 4.389 -12.293 5.606 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.323 -13.352 4.522 1.00 0.00 H new ATOM 0 HG23 ILE A 8 4.035 -14.036 5.542 1.00 0.00 H new ATOM 0 HD11 ILE A 8 3.604 -13.599 9.360 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.154 -13.809 7.650 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.180 -15.020 8.456 1.00 0.00 H new ATOM 132 N ASP A 9 8.544 -14.852 7.844 1.00 0.00 N ATOM 133 CA ASP A 9 9.362 -15.012 9.041 1.00 0.00 C ATOM 134 C ASP A 9 9.202 -13.679 9.764 1.00 0.00 C ATOM 135 O ASP A 9 10.080 -12.816 9.723 1.00 0.00 O ATOM 136 CB ASP A 9 10.821 -15.353 8.714 1.00 0.00 C ATOM 137 CG ASP A 9 11.530 -15.875 9.967 1.00 0.00 C ATOM 138 OD1 ASP A 9 11.282 -15.384 11.093 1.00 0.00 O ATOM 139 OD2 ASP A 9 12.258 -16.886 9.844 1.00 0.00 O ATOM 0 H ASP A 9 9.029 -14.401 7.068 1.00 0.00 H new ATOM 0 HA ASP A 9 9.047 -15.853 9.659 1.00 0.00 H new ATOM 0 HB2 ASP A 9 10.860 -16.104 7.925 1.00 0.00 H new ATOM 0 HB3 ASP A 9 11.334 -14.468 8.338 1.00 0.00 H new ATOM 144 N LYS A 10 8.007 -13.444 10.321 1.00 0.00 N ATOM 145 CA LYS A 10 7.675 -12.174 10.962 1.00 0.00 C ATOM 146 C LYS A 10 8.655 -11.837 12.070 1.00 0.00 C ATOM 147 O LYS A 10 8.947 -10.667 12.236 1.00 0.00 O ATOM 148 CB LYS A 10 6.216 -12.088 11.453 1.00 0.00 C ATOM 149 CG LYS A 10 5.844 -13.247 12.376 1.00 0.00 C ATOM 150 CD LYS A 10 4.498 -13.075 13.081 1.00 0.00 C ATOM 151 CE LYS A 10 4.207 -14.375 13.838 1.00 0.00 C ATOM 152 NZ LYS A 10 3.258 -14.206 14.954 1.00 0.00 N ATOM 0 H LYS A 10 7.250 -14.127 10.338 1.00 0.00 H new ATOM 0 HA LYS A 10 7.768 -11.418 10.182 1.00 0.00 H new ATOM 0 HB2 LYS A 10 6.068 -11.145 11.980 1.00 0.00 H new ATOM 0 HB3 LYS A 10 5.546 -12.082 10.593 1.00 0.00 H new ATOM 0 HG2 LYS A 10 5.822 -14.168 11.794 1.00 0.00 H new ATOM 0 HG3 LYS A 10 6.624 -13.363 13.128 1.00 0.00 H new ATOM 0 HD2 LYS A 10 4.530 -12.230 13.768 1.00 0.00 H new ATOM 0 HD3 LYS A 10 3.710 -12.868 12.357 1.00 0.00 H new ATOM 0 HE2 LYS A 10 3.808 -15.111 13.140 1.00 0.00 H new ATOM 0 HE3 LYS A 10 5.143 -14.778 14.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 3.106 -15.122 15.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 3.646 -13.527 15.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 2.352 -13.850 14.588 1.00 0.00 H new ATOM 166 N GLU A 11 9.184 -12.809 12.801 1.00 0.00 N ATOM 167 CA GLU A 11 10.059 -12.544 13.932 1.00 0.00 C ATOM 168 C GLU A 11 11.411 -11.999 13.453 1.00 0.00 C ATOM 169 O GLU A 11 11.970 -11.085 14.065 1.00 0.00 O ATOM 170 CB GLU A 11 10.208 -13.808 14.791 1.00 0.00 C ATOM 171 CG GLU A 11 8.880 -14.532 15.091 1.00 0.00 C ATOM 172 CD GLU A 11 8.575 -15.649 14.083 1.00 0.00 C ATOM 173 OE1 GLU A 11 8.103 -15.377 12.956 1.00 0.00 O ATOM 174 OE2 GLU A 11 8.790 -16.837 14.421 1.00 0.00 O ATOM 0 H GLU A 11 9.019 -13.800 12.626 1.00 0.00 H new ATOM 0 HA GLU A 11 9.613 -11.773 14.561 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.879 -14.501 14.284 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.682 -13.538 15.735 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.920 -14.955 16.095 1.00 0.00 H new ATOM 0 HG3 GLU A 11 8.066 -13.808 15.082 1.00 0.00 H new ATOM 181 N ALA A 12 11.933 -12.525 12.341 1.00 0.00 N ATOM 182 CA ALA A 12 13.162 -12.028 11.746 1.00 0.00 C ATOM 183 C ALA A 12 12.897 -10.714 11.019 1.00 0.00 C ATOM 184 O ALA A 12 13.601 -9.729 11.231 1.00 0.00 O ATOM 185 CB ALA A 12 13.735 -13.091 10.804 1.00 0.00 C ATOM 0 H ALA A 12 11.512 -13.304 11.835 1.00 0.00 H new ATOM 0 HA ALA A 12 13.898 -11.829 12.525 1.00 0.00 H new ATOM 0 HB1 ALA A 12 14.657 -12.721 10.356 1.00 0.00 H new ATOM 0 HB2 ALA A 12 13.944 -14.001 11.367 1.00 0.00 H new ATOM 0 HB3 ALA A 12 13.012 -13.309 10.018 1.00 0.00 H new ATOM 191 N CYS A 13 11.867 -10.670 10.174 1.00 0.00 N ATOM 192 CA CYS A 13 11.548 -9.478 9.407 1.00 0.00 C ATOM 193 C CYS A 13 11.195 -8.304 10.316 1.00 0.00 C ATOM 194 O CYS A 13 11.581 -7.174 10.014 1.00 0.00 O ATOM 195 CB CYS A 13 10.394 -9.761 8.436 1.00 0.00 C ATOM 196 SG CYS A 13 10.828 -11.047 7.230 1.00 0.00 S ATOM 0 H CYS A 13 11.238 -11.455 10.007 1.00 0.00 H new ATOM 0 HA CYS A 13 12.436 -9.204 8.837 1.00 0.00 H new ATOM 0 HB2 CYS A 13 9.514 -10.072 8.998 1.00 0.00 H new ATOM 0 HB3 CYS A 13 10.128 -8.844 7.910 1.00 0.00 H new ATOM 0 HG CYS A 13 10.692 -12.218 7.777 1.00 0.00 H new ATOM 202 N ARG A 14 10.484 -8.548 11.424 1.00 0.00 N ATOM 203 CA ARG A 14 10.114 -7.496 12.357 1.00 0.00 C ATOM 204 C ARG A 14 11.355 -6.867 12.961 1.00 0.00 C ATOM 205 O ARG A 14 11.288 -5.672 13.215 1.00 0.00 O ATOM 206 CB ARG A 14 9.116 -7.965 13.431 1.00 0.00 C ATOM 207 CG ARG A 14 8.610 -6.799 14.299 1.00 0.00 C ATOM 208 CD ARG A 14 9.379 -6.623 15.613 1.00 0.00 C ATOM 209 NE ARG A 14 8.752 -7.379 16.706 1.00 0.00 N ATOM 210 CZ ARG A 14 8.905 -7.128 18.010 1.00 0.00 C ATOM 211 NH1 ARG A 14 9.777 -6.219 18.433 1.00 0.00 N ATOM 212 NH2 ARG A 14 8.178 -7.791 18.902 1.00 0.00 N ATOM 0 H ARG A 14 10.155 -9.476 11.691 1.00 0.00 H new ATOM 0 HA ARG A 14 9.584 -6.730 11.790 1.00 0.00 H new ATOM 0 HB2 ARG A 14 8.268 -8.453 12.949 1.00 0.00 H new ATOM 0 HB3 ARG A 14 9.593 -8.710 14.068 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.677 -5.875 13.724 1.00 0.00 H new ATOM 0 HG3 ARG A 14 7.556 -6.958 14.525 1.00 0.00 H new ATOM 0 HD2 ARG A 14 10.408 -6.957 15.481 1.00 0.00 H new ATOM 0 HD3 ARG A 14 9.418 -5.566 15.875 1.00 0.00 H new ATOM 0 HE ARG A 14 8.150 -8.161 16.448 1.00 0.00 H new ATOM 0 HH11 ARG A 14 10.341 -5.701 17.759 1.00 0.00 H new ATOM 0 HH12 ARG A 14 9.882 -6.039 19.431 1.00 0.00 H new ATOM 0 HH21 ARG A 14 7.504 -8.491 18.592 1.00 0.00 H new ATOM 0 HH22 ARG A 14 8.294 -7.600 19.897 1.00 0.00 H new ATOM 226 N ALA A 15 12.464 -7.591 13.156 1.00 0.00 N ATOM 227 CA ALA A 15 13.666 -6.981 13.697 1.00 0.00 C ATOM 228 C ALA A 15 14.119 -5.812 12.824 1.00 0.00 C ATOM 229 O ALA A 15 14.273 -4.701 13.323 1.00 0.00 O ATOM 230 CB ALA A 15 14.772 -8.024 13.857 1.00 0.00 C ATOM 0 H ALA A 15 12.546 -8.586 12.948 1.00 0.00 H new ATOM 0 HA ALA A 15 13.439 -6.584 14.686 1.00 0.00 H new ATOM 0 HB1 ALA A 15 15.665 -7.548 14.263 1.00 0.00 H new ATOM 0 HB2 ALA A 15 14.437 -8.808 14.536 1.00 0.00 H new ATOM 0 HB3 ALA A 15 15.004 -8.460 12.885 1.00 0.00 H new ATOM 236 N ALA A 16 14.316 -6.025 11.522 1.00 0.00 N ATOM 237 CA ALA A 16 14.778 -4.956 10.650 1.00 0.00 C ATOM 238 C ALA A 16 13.696 -3.905 10.434 1.00 0.00 C ATOM 239 O ALA A 16 13.987 -2.708 10.412 1.00 0.00 O ATOM 240 CB ALA A 16 15.173 -5.554 9.303 1.00 0.00 C ATOM 0 H ALA A 16 14.163 -6.920 11.056 1.00 0.00 H new ATOM 0 HA ALA A 16 15.632 -4.471 11.122 1.00 0.00 H new ATOM 0 HB1 ALA A 16 15.521 -4.761 8.641 1.00 0.00 H new ATOM 0 HB2 ALA A 16 15.971 -6.282 9.448 1.00 0.00 H new ATOM 0 HB3 ALA A 16 14.309 -6.047 8.856 1.00 0.00 H new ATOM 246 N TYR A 17 12.448 -4.353 10.275 1.00 0.00 N ATOM 247 CA TYR A 17 11.306 -3.470 10.137 1.00 0.00 C ATOM 248 C TYR A 17 11.243 -2.522 11.329 1.00 0.00 C ATOM 249 O TYR A 17 11.034 -1.339 11.119 1.00 0.00 O ATOM 250 CB TYR A 17 10.028 -4.299 9.966 1.00 0.00 C ATOM 251 CG TYR A 17 8.712 -3.614 10.282 1.00 0.00 C ATOM 252 CD1 TYR A 17 8.200 -3.668 11.593 1.00 0.00 C ATOM 253 CD2 TYR A 17 7.968 -2.986 9.266 1.00 0.00 C ATOM 254 CE1 TYR A 17 6.940 -3.121 11.891 1.00 0.00 C ATOM 255 CE2 TYR A 17 6.723 -2.406 9.562 1.00 0.00 C ATOM 256 CZ TYR A 17 6.204 -2.472 10.874 1.00 0.00 C ATOM 257 OH TYR A 17 5.012 -1.879 11.147 1.00 0.00 O ATOM 0 H TYR A 17 12.209 -5.344 10.239 1.00 0.00 H new ATOM 0 HA TYR A 17 11.408 -2.854 9.244 1.00 0.00 H new ATOM 0 HB2 TYR A 17 9.988 -4.649 8.935 1.00 0.00 H new ATOM 0 HB3 TYR A 17 10.110 -5.182 10.600 1.00 0.00 H new ATOM 0 HD1 TYR A 17 8.780 -4.134 12.376 1.00 0.00 H new ATOM 0 HD2 TYR A 17 8.354 -2.950 8.258 1.00 0.00 H new ATOM 0 HE1 TYR A 17 6.537 -3.196 12.890 1.00 0.00 H new ATOM 0 HE2 TYR A 17 6.162 -1.909 8.785 1.00 0.00 H new ATOM 0 HH TYR A 17 5.010 -1.561 12.074 1.00 0.00 H new ATOM 267 N ASN A 18 11.464 -3.000 12.556 1.00 0.00 N ATOM 268 CA ASN A 18 11.372 -2.211 13.778 1.00 0.00 C ATOM 269 C ASN A 18 12.310 -1.016 13.728 1.00 0.00 C ATOM 270 O ASN A 18 11.894 0.080 14.101 1.00 0.00 O ATOM 271 CB ASN A 18 11.738 -3.084 14.993 1.00 0.00 C ATOM 272 CG ASN A 18 11.701 -2.319 16.304 1.00 0.00 C ATOM 273 OD1 ASN A 18 10.744 -1.613 16.593 1.00 0.00 O ATOM 274 ND2 ASN A 18 12.699 -2.489 17.147 1.00 0.00 N ATOM 0 H ASN A 18 11.718 -3.973 12.727 1.00 0.00 H new ATOM 0 HA ASN A 18 10.347 -1.852 13.870 1.00 0.00 H new ATOM 0 HB2 ASN A 18 11.048 -3.926 15.050 1.00 0.00 H new ATOM 0 HB3 ASN A 18 12.736 -3.499 14.848 1.00 0.00 H new ATOM 0 HD21 ASN A 18 12.682 -2.029 18.057 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.489 -3.081 16.890 1.00 0.00 H new ATOM 281 N LEU A 19 13.556 -1.227 13.288 1.00 0.00 N ATOM 282 CA LEU A 19 14.523 -0.165 13.096 1.00 0.00 C ATOM 283 C LEU A 19 13.998 0.842 12.094 1.00 0.00 C ATOM 284 O LEU A 19 13.768 1.987 12.451 1.00 0.00 O ATOM 285 CB LEU A 19 15.884 -0.722 12.658 1.00 0.00 C ATOM 286 CG LEU A 19 16.784 -1.258 13.780 1.00 0.00 C ATOM 287 CD1 LEU A 19 16.149 -2.218 14.789 1.00 0.00 C ATOM 288 CD2 LEU A 19 17.976 -1.936 13.104 1.00 0.00 C ATOM 0 H LEU A 19 13.915 -2.153 13.056 1.00 0.00 H new ATOM 0 HA LEU A 19 14.672 0.340 14.050 1.00 0.00 H new ATOM 0 HB2 LEU A 19 15.712 -1.526 11.942 1.00 0.00 H new ATOM 0 HB3 LEU A 19 16.424 0.065 12.131 1.00 0.00 H new ATOM 0 HG LEU A 19 17.048 -0.397 14.393 1.00 0.00 H new ATOM 0 HD11 LEU A 19 16.895 -2.518 15.525 1.00 0.00 H new ATOM 0 HD12 LEU A 19 15.321 -1.720 15.294 1.00 0.00 H new ATOM 0 HD13 LEU A 19 15.778 -3.101 14.268 1.00 0.00 H new ATOM 0 HD21 LEU A 19 18.647 -2.335 13.865 1.00 0.00 H new ATOM 0 HD22 LEU A 19 17.621 -2.749 12.471 1.00 0.00 H new ATOM 0 HD23 LEU A 19 18.511 -1.208 12.494 1.00 0.00 H new ATOM 300 N VAL A 20 13.781 0.420 10.853 1.00 0.00 N ATOM 301 CA VAL A 20 13.353 1.304 9.774 1.00 0.00 C ATOM 302 C VAL A 20 12.025 2.009 10.104 1.00 0.00 C ATOM 303 O VAL A 20 11.804 3.139 9.677 1.00 0.00 O ATOM 304 CB VAL A 20 13.345 0.455 8.489 1.00 0.00 C ATOM 305 CG1 VAL A 20 12.659 1.084 7.283 1.00 0.00 C ATOM 306 CG2 VAL A 20 14.792 0.184 8.069 1.00 0.00 C ATOM 0 H VAL A 20 13.898 -0.552 10.565 1.00 0.00 H new ATOM 0 HA VAL A 20 14.039 2.139 9.631 1.00 0.00 H new ATOM 0 HB VAL A 20 12.778 -0.438 8.752 1.00 0.00 H new ATOM 0 HG11 VAL A 20 12.713 0.400 6.436 1.00 0.00 H new ATOM 0 HG12 VAL A 20 11.614 1.284 7.522 1.00 0.00 H new ATOM 0 HG13 VAL A 20 13.158 2.019 7.027 1.00 0.00 H new ATOM 0 HG21 VAL A 20 14.800 -0.417 7.160 1.00 0.00 H new ATOM 0 HG22 VAL A 20 15.300 1.130 7.884 1.00 0.00 H new ATOM 0 HG23 VAL A 20 15.307 -0.355 8.864 1.00 0.00 H new ATOM 316 N ARG A 21 11.142 1.378 10.883 1.00 0.00 N ATOM 317 CA ARG A 21 9.885 1.948 11.349 1.00 0.00 C ATOM 318 C ARG A 21 10.120 3.014 12.414 1.00 0.00 C ATOM 319 O ARG A 21 9.271 3.895 12.564 1.00 0.00 O ATOM 320 CB ARG A 21 9.018 0.829 11.979 1.00 0.00 C ATOM 321 CG ARG A 21 7.571 1.276 12.271 1.00 0.00 C ATOM 322 CD ARG A 21 7.361 1.594 13.759 1.00 0.00 C ATOM 323 NE ARG A 21 6.209 2.486 13.975 1.00 0.00 N ATOM 324 CZ ARG A 21 5.431 2.538 15.063 1.00 0.00 C ATOM 325 NH1 ARG A 21 5.620 1.708 16.086 1.00 0.00 N ATOM 326 NH2 ARG A 21 4.454 3.434 15.119 1.00 0.00 N ATOM 0 H ARG A 21 11.292 0.425 11.215 1.00 0.00 H new ATOM 0 HA ARG A 21 9.386 2.400 10.492 1.00 0.00 H new ATOM 0 HB2 ARG A 21 8.998 -0.029 11.307 1.00 0.00 H new ATOM 0 HB3 ARG A 21 9.483 0.496 12.907 1.00 0.00 H new ATOM 0 HG2 ARG A 21 7.336 2.157 11.674 1.00 0.00 H new ATOM 0 HG3 ARG A 21 6.879 0.491 11.966 1.00 0.00 H new ATOM 0 HD2 ARG A 21 7.209 0.666 14.310 1.00 0.00 H new ATOM 0 HD3 ARG A 21 8.261 2.060 14.161 1.00 0.00 H new ATOM 0 HE ARG A 21 5.981 3.130 13.218 1.00 0.00 H new ATOM 0 HH11 ARG A 21 6.369 1.016 16.050 1.00 0.00 H new ATOM 0 HH12 ARG A 21 5.016 1.764 16.906 1.00 0.00 H new ATOM 0 HH21 ARG A 21 4.303 4.073 14.339 1.00 0.00 H new ATOM 0 HH22 ARG A 21 3.854 3.484 15.943 1.00 0.00 H new ATOM 340 N ASP A 22 11.205 2.923 13.181 1.00 0.00 N ATOM 341 CA ASP A 22 11.457 3.827 14.289 1.00 0.00 C ATOM 342 C ASP A 22 11.813 5.214 13.752 1.00 0.00 C ATOM 343 O ASP A 22 12.237 5.357 12.604 1.00 0.00 O ATOM 344 CB ASP A 22 12.598 3.294 15.162 1.00 0.00 C ATOM 345 CG ASP A 22 12.465 3.920 16.541 1.00 0.00 C ATOM 346 OD1 ASP A 22 12.974 5.034 16.761 1.00 0.00 O ATOM 347 OD2 ASP A 22 11.731 3.276 17.336 1.00 0.00 O ATOM 0 H ASP A 22 11.931 2.219 13.047 1.00 0.00 H new ATOM 0 HA ASP A 22 10.556 3.898 14.899 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.550 2.207 15.230 1.00 0.00 H new ATOM 0 HB3 ASP A 22 13.563 3.543 14.722 1.00 0.00 H new ATOM 352 N ASP A 23 11.594 6.254 14.553 1.00 0.00 N ATOM 353 CA ASP A 23 11.911 7.638 14.229 1.00 0.00 C ATOM 354 C ASP A 23 13.349 8.026 14.575 1.00 0.00 C ATOM 355 O ASP A 23 13.834 9.032 14.057 1.00 0.00 O ATOM 356 CB ASP A 23 10.868 8.563 14.875 1.00 0.00 C ATOM 357 CG ASP A 23 9.591 8.645 14.032 1.00 0.00 C ATOM 358 OD1 ASP A 23 8.860 7.635 13.871 1.00 0.00 O ATOM 359 OD2 ASP A 23 9.326 9.704 13.418 1.00 0.00 O ATOM 0 H ASP A 23 11.176 6.150 15.478 1.00 0.00 H new ATOM 0 HA ASP A 23 11.856 7.756 13.147 1.00 0.00 H new ATOM 0 HB2 ASP A 23 10.624 8.197 15.872 1.00 0.00 H new ATOM 0 HB3 ASP A 23 11.290 9.561 14.996 1.00 0.00 H new ATOM 364 N GLY A 24 14.031 7.265 15.438 1.00 0.00 N ATOM 365 CA GLY A 24 15.408 7.500 15.859 1.00 0.00 C ATOM 366 C GLY A 24 16.431 6.532 15.260 1.00 0.00 C ATOM 367 O GLY A 24 17.614 6.654 15.576 1.00 0.00 O ATOM 0 H GLY A 24 13.621 6.440 15.876 1.00 0.00 H new ATOM 0 HA2 GLY A 24 15.688 8.518 15.588 1.00 0.00 H new ATOM 0 HA3 GLY A 24 15.458 7.434 16.946 1.00 0.00 H new ATOM 371 N SER A 25 16.015 5.542 14.463 1.00 0.00 N ATOM 372 CA SER A 25 16.951 4.581 13.895 1.00 0.00 C ATOM 373 C SER A 25 17.833 5.253 12.847 1.00 0.00 C ATOM 374 O SER A 25 17.349 5.987 11.987 1.00 0.00 O ATOM 375 CB SER A 25 16.196 3.406 13.261 1.00 0.00 C ATOM 376 OG SER A 25 17.046 2.570 12.499 1.00 0.00 O ATOM 0 H SER A 25 15.041 5.390 14.201 1.00 0.00 H new ATOM 0 HA SER A 25 17.582 4.203 14.700 1.00 0.00 H new ATOM 0 HB2 SER A 25 15.719 2.818 14.045 1.00 0.00 H new ATOM 0 HB3 SER A 25 15.400 3.790 12.623 1.00 0.00 H new ATOM 0 HG SER A 25 16.936 2.772 11.546 1.00 0.00 H new ATOM 382 N ALA A 26 19.136 4.962 12.909 1.00 0.00 N ATOM 383 CA ALA A 26 20.083 5.442 11.915 1.00 0.00 C ATOM 384 C ALA A 26 19.919 4.614 10.631 1.00 0.00 C ATOM 385 O ALA A 26 20.277 5.079 9.556 1.00 0.00 O ATOM 386 CB ALA A 26 21.514 5.329 12.453 1.00 0.00 C ATOM 0 H ALA A 26 19.555 4.392 13.644 1.00 0.00 H new ATOM 0 HA ALA A 26 19.888 6.491 11.694 1.00 0.00 H new ATOM 0 HB1 ALA A 26 22.215 5.691 11.701 1.00 0.00 H new ATOM 0 HB2 ALA A 26 21.611 5.929 13.358 1.00 0.00 H new ATOM 0 HB3 ALA A 26 21.735 4.287 12.683 1.00 0.00 H new ATOM 392 N VAL A 27 19.426 3.373 10.732 1.00 0.00 N ATOM 393 CA VAL A 27 19.136 2.521 9.587 1.00 0.00 C ATOM 394 C VAL A 27 17.807 3.029 9.030 1.00 0.00 C ATOM 395 O VAL A 27 16.817 3.063 9.768 1.00 0.00 O ATOM 396 CB VAL A 27 19.058 1.044 10.034 1.00 0.00 C ATOM 397 CG1 VAL A 27 18.513 0.121 8.938 1.00 0.00 C ATOM 398 CG2 VAL A 27 20.440 0.529 10.466 1.00 0.00 C ATOM 0 H VAL A 27 19.217 2.932 11.628 1.00 0.00 H new ATOM 0 HA VAL A 27 19.912 2.562 8.822 1.00 0.00 H new ATOM 0 HB VAL A 27 18.366 1.022 10.876 1.00 0.00 H new ATOM 0 HG11 VAL A 27 18.481 -0.904 9.308 1.00 0.00 H new ATOM 0 HG12 VAL A 27 17.508 0.439 8.661 1.00 0.00 H new ATOM 0 HG13 VAL A 27 19.163 0.171 8.064 1.00 0.00 H new ATOM 0 HG21 VAL A 27 20.359 -0.513 10.776 1.00 0.00 H new ATOM 0 HG22 VAL A 27 21.135 0.606 9.630 1.00 0.00 H new ATOM 0 HG23 VAL A 27 20.808 1.128 11.299 1.00 0.00 H new ATOM 408 N ILE A 28 17.792 3.392 7.746 1.00 0.00 N ATOM 409 CA ILE A 28 16.641 3.968 7.060 1.00 0.00 C ATOM 410 C ILE A 28 16.094 3.010 5.999 1.00 0.00 C ATOM 411 O ILE A 28 14.923 3.128 5.638 1.00 0.00 O ATOM 412 CB ILE A 28 16.961 5.373 6.492 1.00 0.00 C ATOM 413 CG1 ILE A 28 17.731 5.353 5.146 1.00 0.00 C ATOM 414 CG2 ILE A 28 17.694 6.252 7.522 1.00 0.00 C ATOM 415 CD1 ILE A 28 16.775 5.522 3.956 1.00 0.00 C ATOM 0 H ILE A 28 18.606 3.289 7.140 1.00 0.00 H new ATOM 0 HA ILE A 28 15.847 4.109 7.793 1.00 0.00 H new ATOM 0 HB ILE A 28 15.988 5.816 6.279 1.00 0.00 H new ATOM 0 HG12 ILE A 28 18.472 6.152 5.136 1.00 0.00 H new ATOM 0 HG13 ILE A 28 18.274 4.413 5.049 1.00 0.00 H new ATOM 0 HG21 ILE A 28 17.900 7.229 7.085 1.00 0.00 H new ATOM 0 HG22 ILE A 28 17.069 6.375 8.406 1.00 0.00 H new ATOM 0 HG23 ILE A 28 18.633 5.775 7.805 1.00 0.00 H new ATOM 0 HD11 ILE A 28 17.344 5.504 3.027 1.00 0.00 H new ATOM 0 HD12 ILE A 28 16.050 4.708 3.953 1.00 0.00 H new ATOM 0 HD13 ILE A 28 16.251 6.474 4.042 1.00 0.00 H new ATOM 427 N TRP A 29 16.909 2.081 5.482 1.00 0.00 N ATOM 428 CA TRP A 29 16.450 1.086 4.529 1.00 0.00 C ATOM 429 C TRP A 29 16.873 -0.308 4.952 1.00 0.00 C ATOM 430 O TRP A 29 17.884 -0.507 5.629 1.00 0.00 O ATOM 431 CB TRP A 29 16.914 1.397 3.100 1.00 0.00 C ATOM 432 CG TRP A 29 18.379 1.304 2.807 1.00 0.00 C ATOM 433 CD1 TRP A 29 19.220 2.357 2.701 1.00 0.00 C ATOM 434 CD2 TRP A 29 19.191 0.109 2.567 1.00 0.00 C ATOM 435 NE1 TRP A 29 20.482 1.893 2.402 1.00 0.00 N ATOM 436 CE2 TRP A 29 20.539 0.519 2.372 1.00 0.00 C ATOM 437 CE3 TRP A 29 18.943 -1.281 2.515 1.00 0.00 C ATOM 438 CZ2 TRP A 29 21.595 -0.394 2.224 1.00 0.00 C ATOM 439 CZ3 TRP A 29 19.994 -2.210 2.396 1.00 0.00 C ATOM 440 CH2 TRP A 29 21.322 -1.771 2.263 1.00 0.00 C ATOM 0 H TRP A 29 17.899 2.006 5.717 1.00 0.00 H new ATOM 0 HA TRP A 29 15.361 1.124 4.524 1.00 0.00 H new ATOM 0 HB2 TRP A 29 16.393 0.719 2.424 1.00 0.00 H new ATOM 0 HB3 TRP A 29 16.586 2.407 2.854 1.00 0.00 H new ATOM 0 HD1 TRP A 29 18.947 3.394 2.830 1.00 0.00 H new ATOM 0 HE1 TRP A 29 21.283 2.499 2.223 1.00 0.00 H new ATOM 0 HE3 TRP A 29 17.925 -1.638 2.568 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 22.606 -0.041 2.082 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 19.778 -3.268 2.407 1.00 0.00 H new ATOM 0 HH2 TRP A 29 22.127 -2.487 2.191 1.00 0.00 H new ATOM 451 N VAL A 30 16.077 -1.264 4.495 1.00 0.00 N ATOM 452 CA VAL A 30 16.182 -2.705 4.690 1.00 0.00 C ATOM 453 C VAL A 30 15.832 -3.401 3.378 1.00 0.00 C ATOM 454 O VAL A 30 15.284 -2.793 2.457 1.00 0.00 O ATOM 455 CB VAL A 30 15.249 -3.080 5.866 1.00 0.00 C ATOM 456 CG1 VAL A 30 14.769 -4.536 5.975 1.00 0.00 C ATOM 457 CG2 VAL A 30 15.986 -2.778 7.179 1.00 0.00 C ATOM 0 H VAL A 30 15.265 -1.029 3.925 1.00 0.00 H new ATOM 0 HA VAL A 30 17.190 -3.028 4.950 1.00 0.00 H new ATOM 0 HB VAL A 30 14.353 -2.489 5.673 1.00 0.00 H new ATOM 0 HG11 VAL A 30 14.124 -4.642 6.848 1.00 0.00 H new ATOM 0 HG12 VAL A 30 14.212 -4.804 5.077 1.00 0.00 H new ATOM 0 HG13 VAL A 30 15.630 -5.196 6.078 1.00 0.00 H new ATOM 0 HG21 VAL A 30 15.346 -3.035 8.023 1.00 0.00 H new ATOM 0 HG22 VAL A 30 16.902 -3.367 7.226 1.00 0.00 H new ATOM 0 HG23 VAL A 30 16.234 -1.717 7.222 1.00 0.00 H new ATOM 467 N THR A 31 16.153 -4.685 3.291 1.00 0.00 N ATOM 468 CA THR A 31 15.823 -5.540 2.166 1.00 0.00 C ATOM 469 C THR A 31 15.083 -6.773 2.679 1.00 0.00 C ATOM 470 O THR A 31 15.130 -7.083 3.872 1.00 0.00 O ATOM 471 CB THR A 31 17.051 -5.815 1.282 1.00 0.00 C ATOM 472 OG1 THR A 31 18.149 -6.273 2.035 1.00 0.00 O ATOM 473 CG2 THR A 31 17.496 -4.565 0.517 1.00 0.00 C ATOM 0 H THR A 31 16.666 -5.172 4.026 1.00 0.00 H new ATOM 0 HA THR A 31 15.136 -5.036 1.486 1.00 0.00 H new ATOM 0 HB THR A 31 16.738 -6.587 0.579 1.00 0.00 H new ATOM 0 HG1 THR A 31 18.344 -5.633 2.751 1.00 0.00 H new ATOM 0 HG21 THR A 31 18.366 -4.803 -0.095 1.00 0.00 H new ATOM 0 HG22 THR A 31 16.684 -4.223 -0.124 1.00 0.00 H new ATOM 0 HG23 THR A 31 17.755 -3.778 1.225 1.00 0.00 H new ATOM 481 N PHE A 32 14.371 -7.457 1.788 1.00 0.00 N ATOM 482 CA PHE A 32 13.626 -8.670 2.067 1.00 0.00 C ATOM 483 C PHE A 32 13.977 -9.653 0.962 1.00 0.00 C ATOM 484 O PHE A 32 13.917 -9.318 -0.225 1.00 0.00 O ATOM 485 CB PHE A 32 12.118 -8.378 2.165 1.00 0.00 C ATOM 486 CG PHE A 32 11.722 -7.666 3.448 1.00 0.00 C ATOM 487 CD1 PHE A 32 11.947 -8.301 4.682 1.00 0.00 C ATOM 488 CD2 PHE A 32 11.162 -6.372 3.430 1.00 0.00 C ATOM 489 CE1 PHE A 32 11.697 -7.627 5.888 1.00 0.00 C ATOM 490 CE2 PHE A 32 10.850 -5.726 4.643 1.00 0.00 C ATOM 491 CZ PHE A 32 11.139 -6.340 5.872 1.00 0.00 C ATOM 0 H PHE A 32 14.298 -7.165 0.813 1.00 0.00 H new ATOM 0 HA PHE A 32 13.892 -9.098 3.033 1.00 0.00 H new ATOM 0 HB2 PHE A 32 11.818 -7.769 1.313 1.00 0.00 H new ATOM 0 HB3 PHE A 32 11.569 -9.317 2.095 1.00 0.00 H new ATOM 0 HD1 PHE A 32 12.315 -9.316 4.702 1.00 0.00 H new ATOM 0 HD2 PHE A 32 10.973 -5.877 2.489 1.00 0.00 H new ATOM 0 HE1 PHE A 32 11.935 -8.100 6.829 1.00 0.00 H new ATOM 0 HE2 PHE A 32 10.385 -4.751 4.627 1.00 0.00 H new ATOM 0 HZ PHE A 32 10.933 -5.825 6.799 1.00 0.00 H new ATOM 501 N LYS A 33 14.413 -10.846 1.354 1.00 0.00 N ATOM 502 CA LYS A 33 14.872 -11.905 0.481 1.00 0.00 C ATOM 503 C LYS A 33 13.781 -12.972 0.564 1.00 0.00 C ATOM 504 O LYS A 33 12.889 -12.893 1.415 1.00 0.00 O ATOM 505 CB LYS A 33 16.231 -12.440 0.997 1.00 0.00 C ATOM 506 CG LYS A 33 17.295 -11.392 1.403 1.00 0.00 C ATOM 507 CD LYS A 33 18.198 -10.956 0.246 1.00 0.00 C ATOM 508 CE LYS A 33 19.403 -11.895 0.147 1.00 0.00 C ATOM 509 NZ LYS A 33 20.106 -11.767 -1.145 1.00 0.00 N ATOM 0 H LYS A 33 14.455 -11.107 2.339 1.00 0.00 H new ATOM 0 HA LYS A 33 15.032 -11.581 -0.548 1.00 0.00 H new ATOM 0 HB2 LYS A 33 16.038 -13.077 1.860 1.00 0.00 H new ATOM 0 HB3 LYS A 33 16.660 -13.075 0.222 1.00 0.00 H new ATOM 0 HG2 LYS A 33 16.792 -10.515 1.811 1.00 0.00 H new ATOM 0 HG3 LYS A 33 17.913 -11.804 2.200 1.00 0.00 H new ATOM 0 HD2 LYS A 33 17.638 -10.968 -0.689 1.00 0.00 H new ATOM 0 HD3 LYS A 33 18.536 -9.931 0.402 1.00 0.00 H new ATOM 0 HE2 LYS A 33 20.097 -11.679 0.959 1.00 0.00 H new ATOM 0 HE3 LYS A 33 19.070 -12.925 0.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 20.914 -12.421 -1.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 19.452 -11.998 -1.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 20.447 -10.791 -1.259 1.00 0.00 H new ATOM 523 N TYR A 34 13.857 -13.995 -0.278 1.00 0.00 N ATOM 524 CA TYR A 34 12.912 -15.100 -0.213 1.00 0.00 C ATOM 525 C TYR A 34 13.683 -16.379 0.006 1.00 0.00 C ATOM 526 O TYR A 34 14.764 -16.577 -0.571 1.00 0.00 O ATOM 527 CB TYR A 34 12.097 -15.218 -1.505 1.00 0.00 C ATOM 528 CG TYR A 34 11.023 -14.169 -1.643 1.00 0.00 C ATOM 529 CD1 TYR A 34 11.364 -12.866 -2.037 1.00 0.00 C ATOM 530 CD2 TYR A 34 9.683 -14.489 -1.359 1.00 0.00 C ATOM 531 CE1 TYR A 34 10.374 -11.879 -2.114 1.00 0.00 C ATOM 532 CE2 TYR A 34 8.680 -13.517 -1.513 1.00 0.00 C ATOM 533 CZ TYR A 34 9.026 -12.193 -1.856 1.00 0.00 C ATOM 534 OH TYR A 34 8.081 -11.218 -1.904 1.00 0.00 O ATOM 0 H TYR A 34 14.561 -14.082 -1.011 1.00 0.00 H new ATOM 0 HA TYR A 34 12.218 -14.918 0.608 1.00 0.00 H new ATOM 0 HB2 TYR A 34 12.772 -15.148 -2.358 1.00 0.00 H new ATOM 0 HB3 TYR A 34 11.636 -16.205 -1.544 1.00 0.00 H new ATOM 0 HD1 TYR A 34 12.388 -12.625 -2.280 1.00 0.00 H new ATOM 0 HD2 TYR A 34 9.425 -15.482 -1.022 1.00 0.00 H new ATOM 0 HE1 TYR A 34 10.647 -10.867 -2.374 1.00 0.00 H new ATOM 0 HE2 TYR A 34 7.643 -13.784 -1.369 1.00 0.00 H new ATOM 0 HH TYR A 34 8.401 -10.479 -2.462 1.00 0.00 H new ATOM 544 N ASP A 35 13.076 -17.257 0.791 1.00 0.00 N ATOM 545 CA ASP A 35 13.590 -18.578 1.091 1.00 0.00 C ATOM 546 C ASP A 35 12.403 -19.537 1.066 1.00 0.00 C ATOM 547 O ASP A 35 11.426 -19.297 1.763 1.00 0.00 O ATOM 548 CB ASP A 35 14.270 -18.518 2.460 1.00 0.00 C ATOM 549 CG ASP A 35 14.932 -19.849 2.766 1.00 0.00 C ATOM 550 OD1 ASP A 35 14.271 -20.775 3.276 1.00 0.00 O ATOM 551 OD2 ASP A 35 16.127 -19.995 2.422 1.00 0.00 O ATOM 0 H ASP A 35 12.186 -17.060 1.249 1.00 0.00 H new ATOM 0 HA ASP A 35 14.330 -18.925 0.369 1.00 0.00 H new ATOM 0 HB2 ASP A 35 15.013 -17.721 2.472 1.00 0.00 H new ATOM 0 HB3 ASP A 35 13.536 -18.281 3.230 1.00 0.00 H new ATOM 556 N GLY A 36 12.459 -20.587 0.243 1.00 0.00 N ATOM 557 CA GLY A 36 11.407 -21.578 0.009 1.00 0.00 C ATOM 558 C GLY A 36 9.978 -21.028 0.044 1.00 0.00 C ATOM 559 O GLY A 36 9.493 -20.482 -0.956 1.00 0.00 O ATOM 0 H GLY A 36 13.293 -20.779 -0.312 1.00 0.00 H new ATOM 0 HA2 GLY A 36 11.577 -22.043 -0.962 1.00 0.00 H new ATOM 0 HA3 GLY A 36 11.496 -22.364 0.759 1.00 0.00 H new ATOM 563 N SER A 37 9.296 -21.197 1.178 1.00 0.00 N ATOM 564 CA SER A 37 7.913 -20.790 1.397 1.00 0.00 C ATOM 565 C SER A 37 7.764 -19.524 2.255 1.00 0.00 C ATOM 566 O SER A 37 6.676 -19.323 2.798 1.00 0.00 O ATOM 567 CB SER A 37 7.088 -21.915 1.966 1.00 0.00 C ATOM 568 OG SER A 37 7.289 -23.185 1.375 1.00 0.00 O ATOM 0 H SER A 37 9.711 -21.638 1.999 1.00 0.00 H new ATOM 0 HA SER A 37 7.531 -20.536 0.408 1.00 0.00 H new ATOM 0 HB2 SER A 37 7.301 -21.993 3.032 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.034 -21.653 1.870 1.00 0.00 H new ATOM 0 HG SER A 37 6.712 -23.845 1.813 1.00 0.00 H new ATOM 574 N THR A 38 8.795 -18.692 2.430 1.00 0.00 N ATOM 575 CA THR A 38 8.705 -17.534 3.307 1.00 0.00 C ATOM 576 C THR A 38 9.520 -16.326 2.836 1.00 0.00 C ATOM 577 O THR A 38 10.329 -16.394 1.902 1.00 0.00 O ATOM 578 CB THR A 38 9.068 -17.991 4.732 1.00 0.00 C ATOM 579 OG1 THR A 38 8.646 -17.077 5.719 1.00 0.00 O ATOM 580 CG2 THR A 38 10.555 -18.259 4.965 1.00 0.00 C ATOM 0 H THR A 38 9.700 -18.804 1.973 1.00 0.00 H new ATOM 0 HA THR A 38 7.682 -17.159 3.288 1.00 0.00 H new ATOM 0 HB THR A 38 8.531 -18.935 4.821 1.00 0.00 H new ATOM 0 HG1 THR A 38 8.898 -17.413 6.605 1.00 0.00 H new ATOM 0 HG21 THR A 38 10.710 -18.575 5.996 1.00 0.00 H new ATOM 0 HG22 THR A 38 10.893 -19.045 4.290 1.00 0.00 H new ATOM 0 HG23 THR A 38 11.123 -17.348 4.775 1.00 0.00 H new ATOM 588 N ILE A 39 9.257 -15.203 3.505 1.00 0.00 N ATOM 589 CA ILE A 39 9.936 -13.929 3.348 1.00 0.00 C ATOM 590 C ILE A 39 10.932 -13.888 4.495 1.00 0.00 C ATOM 591 O ILE A 39 10.547 -14.162 5.639 1.00 0.00 O ATOM 592 CB ILE A 39 8.979 -12.717 3.528 1.00 0.00 C ATOM 593 CG1 ILE A 39 7.623 -12.835 2.814 1.00 0.00 C ATOM 594 CG2 ILE A 39 9.684 -11.401 3.145 1.00 0.00 C ATOM 595 CD1 ILE A 39 7.731 -13.068 1.316 1.00 0.00 C ATOM 0 H ILE A 39 8.521 -15.162 4.210 1.00 0.00 H new ATOM 0 HA ILE A 39 10.372 -13.857 2.351 1.00 0.00 H new ATOM 0 HB ILE A 39 8.735 -12.714 4.590 1.00 0.00 H new ATOM 0 HG12 ILE A 39 7.060 -13.655 3.259 1.00 0.00 H new ATOM 0 HG13 ILE A 39 7.051 -11.924 2.989 1.00 0.00 H new ATOM 0 HG21 ILE A 39 8.995 -10.567 3.279 1.00 0.00 H new ATOM 0 HG22 ILE A 39 10.557 -11.257 3.782 1.00 0.00 H new ATOM 0 HG23 ILE A 39 10.000 -11.447 2.103 1.00 0.00 H new ATOM 0 HD11 ILE A 39 6.732 -13.140 0.886 1.00 0.00 H new ATOM 0 HD12 ILE A 39 8.265 -12.237 0.856 1.00 0.00 H new ATOM 0 HD13 ILE A 39 8.274 -13.995 1.130 1.00 0.00 H new ATOM 607 N VAL A 40 12.175 -13.526 4.201 1.00 0.00 N ATOM 608 CA VAL A 40 13.208 -13.353 5.223 1.00 0.00 C ATOM 609 C VAL A 40 13.803 -11.952 5.053 1.00 0.00 C ATOM 610 O VAL A 40 13.714 -11.401 3.956 1.00 0.00 O ATOM 611 CB VAL A 40 14.232 -14.503 5.166 1.00 0.00 C ATOM 612 CG1 VAL A 40 13.529 -15.858 5.102 1.00 0.00 C ATOM 613 CG2 VAL A 40 15.157 -14.437 3.956 1.00 0.00 C ATOM 0 H VAL A 40 12.498 -13.344 3.251 1.00 0.00 H new ATOM 0 HA VAL A 40 12.795 -13.413 6.230 1.00 0.00 H new ATOM 0 HB VAL A 40 14.822 -14.392 6.076 1.00 0.00 H new ATOM 0 HG11 VAL A 40 14.274 -16.653 5.063 1.00 0.00 H new ATOM 0 HG12 VAL A 40 12.907 -15.987 5.988 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.904 -15.902 4.210 1.00 0.00 H new ATOM 0 HG21 VAL A 40 15.851 -15.277 3.982 1.00 0.00 H new ATOM 0 HG22 VAL A 40 14.565 -14.483 3.042 1.00 0.00 H new ATOM 0 HG23 VAL A 40 15.718 -13.503 3.977 1.00 0.00 H new ATOM 623 N PRO A 41 14.382 -11.311 6.078 1.00 0.00 N ATOM 624 CA PRO A 41 15.021 -10.020 5.876 1.00 0.00 C ATOM 625 C PRO A 41 16.360 -10.217 5.156 1.00 0.00 C ATOM 626 O PRO A 41 16.918 -11.318 5.111 1.00 0.00 O ATOM 627 CB PRO A 41 15.181 -9.426 7.273 1.00 0.00 C ATOM 628 CG PRO A 41 15.389 -10.676 8.120 1.00 0.00 C ATOM 629 CD PRO A 41 14.491 -11.727 7.466 1.00 0.00 C ATOM 0 HA PRO A 41 14.441 -9.345 5.247 1.00 0.00 H new ATOM 0 HB2 PRO A 41 16.030 -8.745 7.333 1.00 0.00 H new ATOM 0 HB3 PRO A 41 14.299 -8.864 7.582 1.00 0.00 H new ATOM 0 HG2 PRO A 41 16.433 -10.988 8.119 1.00 0.00 H new ATOM 0 HG3 PRO A 41 15.109 -10.504 9.159 1.00 0.00 H new ATOM 0 HD2 PRO A 41 14.925 -12.724 7.547 1.00 0.00 H new ATOM 0 HD3 PRO A 41 13.513 -11.765 7.945 1.00 0.00 H new ATOM 637 N GLY A 42 16.875 -9.131 4.599 1.00 0.00 N ATOM 638 CA GLY A 42 18.160 -9.028 3.937 1.00 0.00 C ATOM 639 C GLY A 42 18.990 -7.965 4.645 1.00 0.00 C ATOM 640 O GLY A 42 18.754 -7.664 5.821 1.00 0.00 O ATOM 0 H GLY A 42 16.372 -8.244 4.599 1.00 0.00 H new ATOM 0 HA2 GLY A 42 18.676 -9.988 3.961 1.00 0.00 H new ATOM 0 HA3 GLY A 42 18.025 -8.765 2.888 1.00 0.00 H new ATOM 644 N GLU A 43 19.984 -7.432 3.938 1.00 0.00 N ATOM 645 CA GLU A 43 20.828 -6.350 4.413 1.00 0.00 C ATOM 646 C GLU A 43 20.037 -5.081 4.731 1.00 0.00 C ATOM 647 O GLU A 43 18.869 -4.922 4.352 1.00 0.00 O ATOM 648 CB GLU A 43 21.982 -6.076 3.430 1.00 0.00 C ATOM 649 CG GLU A 43 23.150 -7.055 3.619 1.00 0.00 C ATOM 650 CD GLU A 43 23.807 -6.959 5.009 1.00 0.00 C ATOM 651 OE1 GLU A 43 23.503 -6.015 5.775 1.00 0.00 O ATOM 652 OE2 GLU A 43 24.582 -7.890 5.335 1.00 0.00 O ATOM 0 H GLU A 43 20.226 -7.750 3.000 1.00 0.00 H new ATOM 0 HA GLU A 43 21.264 -6.678 5.357 1.00 0.00 H new ATOM 0 HB2 GLU A 43 21.611 -6.149 2.408 1.00 0.00 H new ATOM 0 HB3 GLU A 43 22.340 -5.056 3.568 1.00 0.00 H new ATOM 0 HG2 GLU A 43 22.791 -8.072 3.464 1.00 0.00 H new ATOM 0 HG3 GLU A 43 23.903 -6.863 2.855 1.00 0.00 H new ATOM 659 N GLN A 44 20.722 -4.162 5.407 1.00 0.00 N ATOM 660 CA GLN A 44 20.213 -2.905 5.923 1.00 0.00 C ATOM 661 C GLN A 44 21.227 -1.781 5.679 1.00 0.00 C ATOM 662 O GLN A 44 22.412 -2.056 5.491 1.00 0.00 O ATOM 663 CB GLN A 44 19.935 -3.103 7.427 1.00 0.00 C ATOM 664 CG GLN A 44 21.076 -3.756 8.245 1.00 0.00 C ATOM 665 CD GLN A 44 20.892 -5.266 8.455 1.00 0.00 C ATOM 666 OE1 GLN A 44 20.037 -5.692 9.232 1.00 0.00 O ATOM 667 NE2 GLN A 44 21.699 -6.122 7.847 1.00 0.00 N ATOM 0 H GLN A 44 21.711 -4.289 5.620 1.00 0.00 H new ATOM 0 HA GLN A 44 19.294 -2.616 5.414 1.00 0.00 H new ATOM 0 HB2 GLN A 44 19.709 -2.131 7.866 1.00 0.00 H new ATOM 0 HB3 GLN A 44 19.040 -3.716 7.534 1.00 0.00 H new ATOM 0 HG2 GLN A 44 22.024 -3.581 7.736 1.00 0.00 H new ATOM 0 HG3 GLN A 44 21.141 -3.267 9.217 1.00 0.00 H new ATOM 0 HE21 GLN A 44 22.411 -5.781 7.201 1.00 0.00 H new ATOM 0 HE22 GLN A 44 21.608 -7.122 8.024 1.00 0.00 H new ATOM 676 N GLY A 45 20.795 -0.518 5.740 1.00 0.00 N ATOM 677 CA GLY A 45 21.687 0.616 5.559 1.00 0.00 C ATOM 678 C GLY A 45 21.038 1.956 5.896 1.00 0.00 C ATOM 679 O GLY A 45 19.854 2.044 6.227 1.00 0.00 O ATOM 0 H GLY A 45 19.824 -0.261 5.915 1.00 0.00 H new ATOM 0 HA2 GLY A 45 22.568 0.479 6.186 1.00 0.00 H new ATOM 0 HA3 GLY A 45 22.031 0.637 4.525 1.00 0.00 H new ATOM 683 N ALA A 46 21.850 3.011 5.806 1.00 0.00 N ATOM 684 CA ALA A 46 21.519 4.397 6.147 1.00 0.00 C ATOM 685 C ALA A 46 21.802 5.361 4.983 1.00 0.00 C ATOM 686 O ALA A 46 21.534 6.551 5.082 1.00 0.00 O ATOM 687 CB ALA A 46 22.373 4.802 7.353 1.00 0.00 C ATOM 0 H ALA A 46 22.810 2.916 5.475 1.00 0.00 H new ATOM 0 HA ALA A 46 20.454 4.457 6.370 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.147 5.832 7.629 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.152 4.144 8.193 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.429 4.719 7.095 1.00 0.00 H new ATOM 693 N GLU A 47 22.357 4.847 3.886 1.00 0.00 N ATOM 694 CA GLU A 47 22.795 5.567 2.700 1.00 0.00 C ATOM 695 C GLU A 47 22.205 4.815 1.514 1.00 0.00 C ATOM 696 O GLU A 47 22.408 3.602 1.420 1.00 0.00 O ATOM 697 CB GLU A 47 24.338 5.576 2.731 1.00 0.00 C ATOM 698 CG GLU A 47 25.066 5.811 1.402 1.00 0.00 C ATOM 699 CD GLU A 47 24.739 7.121 0.685 1.00 0.00 C ATOM 700 OE1 GLU A 47 23.542 7.324 0.387 1.00 0.00 O ATOM 701 OE2 GLU A 47 25.703 7.804 0.280 1.00 0.00 O ATOM 0 H GLU A 47 22.522 3.844 3.801 1.00 0.00 H new ATOM 0 HA GLU A 47 22.466 6.605 2.640 1.00 0.00 H new ATOM 0 HB2 GLU A 47 24.657 6.348 3.432 1.00 0.00 H new ATOM 0 HB3 GLU A 47 24.673 4.621 3.135 1.00 0.00 H new ATOM 0 HG2 GLU A 47 26.140 5.779 1.587 1.00 0.00 H new ATOM 0 HG3 GLU A 47 24.833 4.984 0.731 1.00 0.00 H new ATOM 708 N TYR A 48 21.503 5.497 0.608 1.00 0.00 N ATOM 709 CA TYR A 48 20.829 4.854 -0.513 1.00 0.00 C ATOM 710 C TYR A 48 21.831 4.631 -1.649 1.00 0.00 C ATOM 711 O TYR A 48 21.591 3.758 -2.473 1.00 0.00 O ATOM 712 CB TYR A 48 19.631 5.695 -0.987 1.00 0.00 C ATOM 713 CG TYR A 48 18.753 5.012 -2.032 1.00 0.00 C ATOM 714 CD1 TYR A 48 19.027 5.170 -3.406 1.00 0.00 C ATOM 715 CD2 TYR A 48 17.649 4.231 -1.637 1.00 0.00 C ATOM 716 CE1 TYR A 48 18.230 4.537 -4.380 1.00 0.00 C ATOM 717 CE2 TYR A 48 16.831 3.617 -2.605 1.00 0.00 C ATOM 718 CZ TYR A 48 17.114 3.765 -3.983 1.00 0.00 C ATOM 719 OH TYR A 48 16.282 3.194 -4.901 1.00 0.00 O ATOM 0 H TYR A 48 21.388 6.510 0.634 1.00 0.00 H new ATOM 0 HA TYR A 48 20.441 3.888 -0.191 1.00 0.00 H new ATOM 0 HB2 TYR A 48 19.016 5.948 -0.123 1.00 0.00 H new ATOM 0 HB3 TYR A 48 20.002 6.633 -1.400 1.00 0.00 H new ATOM 0 HD1 TYR A 48 19.859 5.785 -3.716 1.00 0.00 H new ATOM 0 HD2 TYR A 48 17.429 4.103 -0.587 1.00 0.00 H new ATOM 0 HE1 TYR A 48 18.471 4.641 -5.428 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.981 3.029 -2.293 1.00 0.00 H new ATOM 0 HH TYR A 48 16.236 3.761 -5.699 1.00 0.00 H new ATOM 729 N GLN A 49 23.004 5.282 -1.650 1.00 0.00 N ATOM 730 CA GLN A 49 24.051 5.052 -2.645 1.00 0.00 C ATOM 731 C GLN A 49 24.427 3.556 -2.664 1.00 0.00 C ATOM 732 O GLN A 49 24.677 2.965 -3.716 1.00 0.00 O ATOM 733 CB GLN A 49 25.250 5.928 -2.267 1.00 0.00 C ATOM 734 CG GLN A 49 26.368 5.971 -3.308 1.00 0.00 C ATOM 735 CD GLN A 49 27.661 6.615 -2.792 1.00 0.00 C ATOM 736 OE1 GLN A 49 28.729 6.361 -3.337 1.00 0.00 O ATOM 737 NE2 GLN A 49 27.635 7.432 -1.746 1.00 0.00 N ATOM 0 H GLN A 49 23.250 5.986 -0.954 1.00 0.00 H new ATOM 0 HA GLN A 49 23.711 5.316 -3.647 1.00 0.00 H new ATOM 0 HB2 GLN A 49 24.898 6.944 -2.091 1.00 0.00 H new ATOM 0 HB3 GLN A 49 25.663 5.566 -1.326 1.00 0.00 H new ATOM 0 HG2 GLN A 49 26.585 4.955 -3.639 1.00 0.00 H new ATOM 0 HG3 GLN A 49 26.020 6.523 -4.181 1.00 0.00 H new ATOM 0 HE21 GLN A 49 26.749 7.647 -1.289 1.00 0.00 H new ATOM 0 HE22 GLN A 49 28.501 7.845 -1.400 1.00 0.00 H new ATOM 746 N HIS A 50 24.420 2.917 -1.487 1.00 0.00 N ATOM 747 CA HIS A 50 24.678 1.491 -1.350 1.00 0.00 C ATOM 748 C HIS A 50 23.590 0.645 -2.014 1.00 0.00 C ATOM 749 O HIS A 50 23.902 -0.445 -2.480 1.00 0.00 O ATOM 750 CB HIS A 50 24.815 1.120 0.132 1.00 0.00 C ATOM 751 CG HIS A 50 26.134 1.557 0.718 1.00 0.00 C ATOM 752 ND1 HIS A 50 26.481 2.832 1.110 1.00 0.00 N ATOM 753 CD2 HIS A 50 27.234 0.759 0.887 1.00 0.00 C ATOM 754 CE1 HIS A 50 27.766 2.800 1.502 1.00 0.00 C ATOM 755 NE2 HIS A 50 28.262 1.558 1.390 1.00 0.00 N ATOM 0 H HIS A 50 24.233 3.385 -0.600 1.00 0.00 H new ATOM 0 HA HIS A 50 25.615 1.274 -1.863 1.00 0.00 H new ATOM 0 HB2 HIS A 50 24.002 1.578 0.694 1.00 0.00 H new ATOM 0 HB3 HIS A 50 24.711 0.041 0.244 1.00 0.00 H new ATOM 0 HD2 HIS A 50 27.295 -0.297 0.670 1.00 0.00 H new ATOM 0 HE1 HIS A 50 28.322 3.655 1.858 1.00 0.00 H new ATOM 0 HE2 HIS A 50 29.207 1.256 1.627 1.00 0.00 H new ATOM 763 N PHE A 51 22.345 1.120 -2.093 1.00 0.00 N ATOM 764 CA PHE A 51 21.232 0.416 -2.721 1.00 0.00 C ATOM 765 C PHE A 51 21.555 0.195 -4.197 1.00 0.00 C ATOM 766 O PHE A 51 21.474 -0.931 -4.693 1.00 0.00 O ATOM 767 CB PHE A 51 19.929 1.224 -2.567 1.00 0.00 C ATOM 768 CG PHE A 51 18.630 0.445 -2.713 1.00 0.00 C ATOM 769 CD1 PHE A 51 18.380 -0.345 -3.853 1.00 0.00 C ATOM 770 CD2 PHE A 51 17.615 0.590 -1.749 1.00 0.00 C ATOM 771 CE1 PHE A 51 17.138 -0.966 -4.043 1.00 0.00 C ATOM 772 CE2 PHE A 51 16.359 -0.008 -1.950 1.00 0.00 C ATOM 773 CZ PHE A 51 16.119 -0.780 -3.101 1.00 0.00 C ATOM 0 H PHE A 51 22.080 2.028 -1.711 1.00 0.00 H new ATOM 0 HA PHE A 51 21.088 -0.548 -2.233 1.00 0.00 H new ATOM 0 HB2 PHE A 51 19.935 1.698 -1.586 1.00 0.00 H new ATOM 0 HB3 PHE A 51 19.933 2.024 -3.308 1.00 0.00 H new ATOM 0 HD1 PHE A 51 19.157 -0.474 -4.592 1.00 0.00 H new ATOM 0 HD2 PHE A 51 17.802 1.162 -0.852 1.00 0.00 H new ATOM 0 HE1 PHE A 51 16.968 -1.585 -4.912 1.00 0.00 H new ATOM 0 HE2 PHE A 51 15.576 0.126 -1.218 1.00 0.00 H new ATOM 0 HZ PHE A 51 15.149 -1.229 -3.258 1.00 0.00 H new ATOM 783 N ILE A 52 21.935 1.253 -4.918 1.00 0.00 N ATOM 784 CA ILE A 52 22.174 1.139 -6.351 1.00 0.00 C ATOM 785 C ILE A 52 23.332 0.172 -6.604 1.00 0.00 C ATOM 786 O ILE A 52 23.284 -0.585 -7.572 1.00 0.00 O ATOM 787 CB ILE A 52 22.354 2.511 -7.036 1.00 0.00 C ATOM 788 CG1 ILE A 52 21.328 3.562 -6.549 1.00 0.00 C ATOM 789 CG2 ILE A 52 22.176 2.339 -8.550 1.00 0.00 C ATOM 790 CD1 ILE A 52 21.993 4.567 -5.618 1.00 0.00 C ATOM 0 H ILE A 52 22.081 2.187 -4.534 1.00 0.00 H new ATOM 0 HA ILE A 52 21.284 0.719 -6.820 1.00 0.00 H new ATOM 0 HB ILE A 52 23.352 2.869 -6.781 1.00 0.00 H new ATOM 0 HG12 ILE A 52 20.896 4.081 -7.405 1.00 0.00 H new ATOM 0 HG13 ILE A 52 20.508 3.065 -6.031 1.00 0.00 H new ATOM 0 HG21 ILE A 52 22.301 3.303 -9.043 1.00 0.00 H new ATOM 0 HG22 ILE A 52 22.922 1.639 -8.927 1.00 0.00 H new ATOM 0 HG23 ILE A 52 21.178 1.952 -8.757 1.00 0.00 H new ATOM 0 HD11 ILE A 52 21.256 5.298 -5.286 1.00 0.00 H new ATOM 0 HD12 ILE A 52 22.403 4.046 -4.753 1.00 0.00 H new ATOM 0 HD13 ILE A 52 22.797 5.077 -6.148 1.00 0.00 H new ATOM 802 N GLN A 53 24.346 0.130 -5.735 1.00 0.00 N ATOM 803 CA GLN A 53 25.443 -0.825 -5.866 1.00 0.00 C ATOM 804 C GLN A 53 24.996 -2.244 -5.474 1.00 0.00 C ATOM 805 O GLN A 53 25.439 -3.211 -6.097 1.00 0.00 O ATOM 806 CB GLN A 53 26.665 -0.346 -5.066 1.00 0.00 C ATOM 807 CG GLN A 53 27.158 1.073 -5.429 1.00 0.00 C ATOM 808 CD GLN A 53 27.785 1.222 -6.823 1.00 0.00 C ATOM 809 OE1 GLN A 53 27.362 0.625 -7.813 1.00 0.00 O ATOM 810 NE2 GLN A 53 28.813 2.048 -6.940 1.00 0.00 N ATOM 0 H GLN A 53 24.427 0.751 -4.930 1.00 0.00 H new ATOM 0 HA GLN A 53 25.742 -0.877 -6.913 1.00 0.00 H new ATOM 0 HB2 GLN A 53 26.419 -0.370 -4.004 1.00 0.00 H new ATOM 0 HB3 GLN A 53 27.482 -1.051 -5.220 1.00 0.00 H new ATOM 0 HG2 GLN A 53 26.316 1.761 -5.354 1.00 0.00 H new ATOM 0 HG3 GLN A 53 27.891 1.385 -4.685 1.00 0.00 H new ATOM 0 HE21 GLN A 53 29.165 2.544 -6.121 1.00 0.00 H new ATOM 0 HE22 GLN A 53 29.253 2.189 -7.849 1.00 0.00 H new ATOM 819 N GLN A 54 24.107 -2.386 -4.486 1.00 0.00 N ATOM 820 CA GLN A 54 23.526 -3.656 -4.060 1.00 0.00 C ATOM 821 C GLN A 54 22.718 -4.336 -5.158 1.00 0.00 C ATOM 822 O GLN A 54 22.700 -5.570 -5.172 1.00 0.00 O ATOM 823 CB GLN A 54 22.613 -3.465 -2.835 1.00 0.00 C ATOM 824 CG GLN A 54 23.357 -3.396 -1.497 1.00 0.00 C ATOM 825 CD GLN A 54 23.095 -4.685 -0.730 1.00 0.00 C ATOM 826 OE1 GLN A 54 23.786 -5.682 -0.915 1.00 0.00 O ATOM 827 NE2 GLN A 54 22.027 -4.728 0.047 1.00 0.00 N ATOM 0 H GLN A 54 23.763 -1.592 -3.945 1.00 0.00 H new ATOM 0 HA GLN A 54 24.372 -4.295 -3.807 1.00 0.00 H new ATOM 0 HB2 GLN A 54 22.038 -2.548 -2.965 1.00 0.00 H new ATOM 0 HB3 GLN A 54 21.898 -4.287 -2.798 1.00 0.00 H new ATOM 0 HG2 GLN A 54 24.426 -3.266 -1.665 1.00 0.00 H new ATOM 0 HG3 GLN A 54 23.018 -2.536 -0.919 1.00 0.00 H new ATOM 0 HE21 GLN A 54 21.465 -3.889 0.189 1.00 0.00 H new ATOM 0 HE22 GLN A 54 21.765 -5.601 0.505 1.00 0.00 H new ATOM 836 N CYS A 55 22.050 -3.573 -6.030 1.00 0.00 N ATOM 837 CA CYS A 55 21.178 -4.097 -7.072 1.00 0.00 C ATOM 838 C CYS A 55 21.898 -5.177 -7.872 1.00 0.00 C ATOM 839 O CYS A 55 22.960 -4.950 -8.452 1.00 0.00 O ATOM 840 CB CYS A 55 20.704 -2.967 -7.983 1.00 0.00 C ATOM 841 SG CYS A 55 19.588 -1.856 -7.091 1.00 0.00 S ATOM 0 H CYS A 55 22.105 -2.555 -6.026 1.00 0.00 H new ATOM 0 HA CYS A 55 20.302 -4.548 -6.605 1.00 0.00 H new ATOM 0 HB2 CYS A 55 21.563 -2.408 -8.354 1.00 0.00 H new ATOM 0 HB3 CYS A 55 20.194 -3.383 -8.852 1.00 0.00 H new ATOM 0 HG CYS A 55 20.192 -1.387 -6.040 1.00 0.00 H new ATOM 847 N THR A 56 21.305 -6.356 -7.872 1.00 0.00 N ATOM 848 CA THR A 56 21.761 -7.589 -8.458 1.00 0.00 C ATOM 849 C THR A 56 21.402 -7.679 -9.950 1.00 0.00 C ATOM 850 O THR A 56 20.676 -6.840 -10.493 1.00 0.00 O ATOM 851 CB THR A 56 21.169 -8.680 -7.545 1.00 0.00 C ATOM 852 OG1 THR A 56 19.857 -8.304 -7.130 1.00 0.00 O ATOM 853 CG2 THR A 56 21.986 -8.913 -6.272 1.00 0.00 C ATOM 0 H THR A 56 20.402 -6.479 -7.414 1.00 0.00 H new ATOM 0 HA THR A 56 22.845 -7.694 -8.492 1.00 0.00 H new ATOM 0 HB THR A 56 21.171 -9.595 -8.137 1.00 0.00 H new ATOM 0 HG1 THR A 56 19.730 -8.546 -6.189 1.00 0.00 H new ATOM 0 HG21 THR A 56 21.514 -9.693 -5.675 1.00 0.00 H new ATOM 0 HG22 THR A 56 22.996 -9.222 -6.540 1.00 0.00 H new ATOM 0 HG23 THR A 56 22.030 -7.990 -5.694 1.00 0.00 H new ATOM 861 N ASP A 57 21.952 -8.695 -10.615 1.00 0.00 N ATOM 862 CA ASP A 57 21.864 -8.955 -12.046 1.00 0.00 C ATOM 863 C ASP A 57 20.485 -9.393 -12.567 1.00 0.00 C ATOM 864 O ASP A 57 19.811 -8.590 -13.211 1.00 0.00 O ATOM 865 CB ASP A 57 22.934 -10.020 -12.391 1.00 0.00 C ATOM 866 CG ASP A 57 22.806 -11.322 -11.581 1.00 0.00 C ATOM 867 OD1 ASP A 57 22.955 -11.269 -10.342 1.00 0.00 O ATOM 868 OD2 ASP A 57 22.505 -12.386 -12.170 1.00 0.00 O ATOM 0 H ASP A 57 22.507 -9.403 -10.134 1.00 0.00 H new ATOM 0 HA ASP A 57 22.038 -8.004 -12.550 1.00 0.00 H new ATOM 0 HB2 ASP A 57 22.867 -10.257 -13.453 1.00 0.00 H new ATOM 0 HB3 ASP A 57 23.923 -9.595 -12.221 1.00 0.00 H new ATOM 873 N ASP A 58 20.084 -10.645 -12.361 1.00 0.00 N ATOM 874 CA ASP A 58 18.852 -11.264 -12.837 1.00 0.00 C ATOM 875 C ASP A 58 17.836 -11.466 -11.722 1.00 0.00 C ATOM 876 O ASP A 58 16.634 -11.443 -11.972 1.00 0.00 O ATOM 877 CB ASP A 58 19.201 -12.613 -13.480 1.00 0.00 C ATOM 878 CG ASP A 58 18.001 -13.543 -13.701 1.00 0.00 C ATOM 879 OD1 ASP A 58 17.690 -14.348 -12.786 1.00 0.00 O ATOM 880 OD2 ASP A 58 17.491 -13.643 -14.839 1.00 0.00 O ATOM 0 H ASP A 58 20.651 -11.298 -11.820 1.00 0.00 H new ATOM 0 HA ASP A 58 18.392 -10.596 -13.565 1.00 0.00 H new ATOM 0 HB2 ASP A 58 19.684 -12.429 -14.440 1.00 0.00 H new ATOM 0 HB3 ASP A 58 19.929 -13.124 -12.850 1.00 0.00 H new ATOM 885 N VAL A 59 18.325 -11.680 -10.494 1.00 0.00 N ATOM 886 CA VAL A 59 17.499 -11.986 -9.348 1.00 0.00 C ATOM 887 C VAL A 59 16.424 -10.925 -9.136 1.00 0.00 C ATOM 888 O VAL A 59 16.574 -9.744 -9.458 1.00 0.00 O ATOM 889 CB VAL A 59 18.358 -12.184 -8.078 1.00 0.00 C ATOM 890 CG1 VAL A 59 19.681 -12.914 -8.329 1.00 0.00 C ATOM 891 CG2 VAL A 59 18.666 -10.876 -7.369 1.00 0.00 C ATOM 0 H VAL A 59 19.321 -11.642 -10.279 1.00 0.00 H new ATOM 0 HA VAL A 59 16.989 -12.928 -9.551 1.00 0.00 H new ATOM 0 HB VAL A 59 17.733 -12.811 -7.443 1.00 0.00 H new ATOM 0 HG11 VAL A 59 20.225 -13.014 -7.390 1.00 0.00 H new ATOM 0 HG12 VAL A 59 19.478 -13.904 -8.738 1.00 0.00 H new ATOM 0 HG13 VAL A 59 20.282 -12.345 -9.038 1.00 0.00 H new ATOM 0 HG21 VAL A 59 19.271 -11.075 -6.485 1.00 0.00 H new ATOM 0 HG22 VAL A 59 19.214 -10.217 -8.043 1.00 0.00 H new ATOM 0 HG23 VAL A 59 17.734 -10.396 -7.070 1.00 0.00 H new ATOM 901 N ARG A 60 15.365 -11.352 -8.465 1.00 0.00 N ATOM 902 CA ARG A 60 14.256 -10.517 -8.076 1.00 0.00 C ATOM 903 C ARG A 60 14.403 -10.324 -6.566 1.00 0.00 C ATOM 904 O ARG A 60 14.493 -11.315 -5.831 1.00 0.00 O ATOM 905 CB ARG A 60 12.969 -11.181 -8.616 1.00 0.00 C ATOM 906 CG ARG A 60 12.691 -12.639 -8.192 1.00 0.00 C ATOM 907 CD ARG A 60 13.479 -13.749 -8.919 1.00 0.00 C ATOM 908 NE ARG A 60 14.200 -14.668 -8.015 1.00 0.00 N ATOM 909 CZ ARG A 60 13.657 -15.541 -7.148 1.00 0.00 C ATOM 910 NH1 ARG A 60 12.358 -15.527 -6.858 1.00 0.00 N ATOM 911 NH2 ARG A 60 14.438 -16.441 -6.564 1.00 0.00 N ATOM 0 H ARG A 60 15.258 -12.323 -8.170 1.00 0.00 H new ATOM 0 HA ARG A 60 14.219 -9.512 -8.495 1.00 0.00 H new ATOM 0 HB2 ARG A 60 12.120 -10.572 -8.306 1.00 0.00 H new ATOM 0 HB3 ARG A 60 13.004 -11.148 -9.705 1.00 0.00 H new ATOM 0 HG2 ARG A 60 12.894 -12.725 -7.125 1.00 0.00 H new ATOM 0 HG3 ARG A 60 11.628 -12.834 -8.331 1.00 0.00 H new ATOM 0 HD2 ARG A 60 12.788 -14.328 -9.533 1.00 0.00 H new ATOM 0 HD3 ARG A 60 14.196 -13.286 -9.597 1.00 0.00 H new ATOM 0 HE ARG A 60 15.219 -14.637 -8.052 1.00 0.00 H new ATOM 0 HH11 ARG A 60 11.745 -14.841 -7.298 1.00 0.00 H new ATOM 0 HH12 ARG A 60 11.976 -16.202 -6.196 1.00 0.00 H new ATOM 0 HH21 ARG A 60 15.436 -16.464 -6.775 1.00 0.00 H new ATOM 0 HH22 ARG A 60 14.041 -17.110 -5.904 1.00 0.00 H new ATOM 925 N LEU A 61 14.469 -9.077 -6.096 1.00 0.00 N ATOM 926 CA LEU A 61 14.693 -8.702 -4.694 1.00 0.00 C ATOM 927 C LEU A 61 13.624 -7.699 -4.262 1.00 0.00 C ATOM 928 O LEU A 61 12.874 -7.185 -5.096 1.00 0.00 O ATOM 929 CB LEU A 61 16.129 -8.150 -4.557 1.00 0.00 C ATOM 930 CG LEU A 61 16.627 -7.716 -3.161 1.00 0.00 C ATOM 931 CD1 LEU A 61 16.649 -8.900 -2.195 1.00 0.00 C ATOM 932 CD2 LEU A 61 18.049 -7.148 -3.271 1.00 0.00 C ATOM 0 H LEU A 61 14.364 -8.266 -6.705 1.00 0.00 H new ATOM 0 HA LEU A 61 14.605 -9.563 -4.032 1.00 0.00 H new ATOM 0 HB2 LEU A 61 16.813 -8.912 -4.930 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.217 -7.290 -5.221 1.00 0.00 H new ATOM 0 HG LEU A 61 15.943 -6.957 -2.781 1.00 0.00 H new ATOM 0 HD11 LEU A 61 17.003 -8.567 -1.219 1.00 0.00 H new ATOM 0 HD12 LEU A 61 15.643 -9.307 -2.096 1.00 0.00 H new ATOM 0 HD13 LEU A 61 17.316 -9.671 -2.580 1.00 0.00 H new ATOM 0 HD21 LEU A 61 18.396 -6.843 -2.284 1.00 0.00 H new ATOM 0 HD22 LEU A 61 18.716 -7.912 -3.670 1.00 0.00 H new ATOM 0 HD23 LEU A 61 18.046 -6.285 -3.937 1.00 0.00 H new ATOM 944 N PHE A 62 13.491 -7.464 -2.963 1.00 0.00 N ATOM 945 CA PHE A 62 12.567 -6.473 -2.416 1.00 0.00 C ATOM 946 C PHE A 62 13.323 -5.622 -1.392 1.00 0.00 C ATOM 947 O PHE A 62 14.240 -6.114 -0.729 1.00 0.00 O ATOM 948 CB PHE A 62 11.356 -7.151 -1.748 1.00 0.00 C ATOM 949 CG PHE A 62 10.228 -7.714 -2.603 1.00 0.00 C ATOM 950 CD1 PHE A 62 10.445 -8.731 -3.550 1.00 0.00 C ATOM 951 CD2 PHE A 62 8.905 -7.324 -2.324 1.00 0.00 C ATOM 952 CE1 PHE A 62 9.356 -9.352 -4.192 1.00 0.00 C ATOM 953 CE2 PHE A 62 7.818 -7.947 -2.957 1.00 0.00 C ATOM 954 CZ PHE A 62 8.043 -8.973 -3.885 1.00 0.00 C ATOM 0 H PHE A 62 14.026 -7.960 -2.250 1.00 0.00 H new ATOM 0 HA PHE A 62 12.189 -5.848 -3.225 1.00 0.00 H new ATOM 0 HB2 PHE A 62 11.739 -7.969 -1.138 1.00 0.00 H new ATOM 0 HB3 PHE A 62 10.914 -6.425 -1.066 1.00 0.00 H new ATOM 0 HD1 PHE A 62 11.453 -9.038 -3.786 1.00 0.00 H new ATOM 0 HD2 PHE A 62 8.723 -6.533 -1.612 1.00 0.00 H new ATOM 0 HE1 PHE A 62 9.534 -10.125 -4.925 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.809 -7.636 -2.729 1.00 0.00 H new ATOM 0 HZ PHE A 62 7.209 -9.468 -4.360 1.00 0.00 H new ATOM 964 N ALA A 63 12.892 -4.372 -1.205 1.00 0.00 N ATOM 965 CA ALA A 63 13.440 -3.437 -0.236 1.00 0.00 C ATOM 966 C ALA A 63 12.338 -2.664 0.468 1.00 0.00 C ATOM 967 O ALA A 63 11.267 -2.471 -0.096 1.00 0.00 O ATOM 968 CB ALA A 63 14.405 -2.477 -0.917 1.00 0.00 C ATOM 0 H ALA A 63 12.124 -3.975 -1.747 1.00 0.00 H new ATOM 0 HA ALA A 63 13.981 -4.011 0.516 1.00 0.00 H new ATOM 0 HB1 ALA A 63 14.808 -1.782 -0.180 1.00 0.00 H new ATOM 0 HB2 ALA A 63 15.221 -3.041 -1.368 1.00 0.00 H new ATOM 0 HB3 ALA A 63 13.878 -1.919 -1.691 1.00 0.00 H new ATOM 974 N PHE A 64 12.620 -2.185 1.671 1.00 0.00 N ATOM 975 CA PHE A 64 11.741 -1.386 2.505 1.00 0.00 C ATOM 976 C PHE A 64 12.561 -0.166 2.882 1.00 0.00 C ATOM 977 O PHE A 64 13.646 -0.323 3.438 1.00 0.00 O ATOM 978 CB PHE A 64 11.348 -2.246 3.718 1.00 0.00 C ATOM 979 CG PHE A 64 10.591 -1.573 4.853 1.00 0.00 C ATOM 980 CD1 PHE A 64 9.419 -0.850 4.583 1.00 0.00 C ATOM 981 CD2 PHE A 64 11.006 -1.734 6.192 1.00 0.00 C ATOM 982 CE1 PHE A 64 8.657 -0.307 5.633 1.00 0.00 C ATOM 983 CE2 PHE A 64 10.258 -1.160 7.239 1.00 0.00 C ATOM 984 CZ PHE A 64 9.081 -0.449 6.961 1.00 0.00 C ATOM 0 H PHE A 64 13.522 -2.355 2.115 1.00 0.00 H new ATOM 0 HA PHE A 64 10.816 -1.068 2.024 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.740 -3.076 3.357 1.00 0.00 H new ATOM 0 HB3 PHE A 64 12.260 -2.676 4.133 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.100 -0.709 3.561 1.00 0.00 H new ATOM 0 HD2 PHE A 64 11.899 -2.299 6.415 1.00 0.00 H new ATOM 0 HE1 PHE A 64 7.741 0.222 5.415 1.00 0.00 H new ATOM 0 HE2 PHE A 64 10.592 -1.268 8.260 1.00 0.00 H new ATOM 0 HZ PHE A 64 8.506 -0.014 7.765 1.00 0.00 H new ATOM 994 N VAL A 65 12.068 1.032 2.584 1.00 0.00 N ATOM 995 CA VAL A 65 12.806 2.265 2.818 1.00 0.00 C ATOM 996 C VAL A 65 11.864 3.247 3.512 1.00 0.00 C ATOM 997 O VAL A 65 10.692 3.369 3.135 1.00 0.00 O ATOM 998 CB VAL A 65 13.270 2.852 1.463 1.00 0.00 C ATOM 999 CG1 VAL A 65 14.105 4.134 1.589 1.00 0.00 C ATOM 1000 CG2 VAL A 65 14.089 1.864 0.614 1.00 0.00 C ATOM 0 H VAL A 65 11.145 1.174 2.173 1.00 0.00 H new ATOM 0 HA VAL A 65 13.683 2.078 3.438 1.00 0.00 H new ATOM 0 HB VAL A 65 12.325 3.079 0.969 1.00 0.00 H new ATOM 0 HG11 VAL A 65 14.391 4.481 0.596 1.00 0.00 H new ATOM 0 HG12 VAL A 65 13.516 4.904 2.087 1.00 0.00 H new ATOM 0 HG13 VAL A 65 15.002 3.928 2.173 1.00 0.00 H new ATOM 0 HG21 VAL A 65 14.381 2.342 -0.321 1.00 0.00 H new ATOM 0 HG22 VAL A 65 14.982 1.566 1.163 1.00 0.00 H new ATOM 0 HG23 VAL A 65 13.485 0.983 0.398 1.00 0.00 H new ATOM 1010 N ARG A 66 12.364 3.926 4.542 1.00 0.00 N ATOM 1011 CA ARG A 66 11.632 4.966 5.245 1.00 0.00 C ATOM 1012 C ARG A 66 11.762 6.221 4.392 1.00 0.00 C ATOM 1013 O ARG A 66 12.873 6.654 4.099 1.00 0.00 O ATOM 1014 CB ARG A 66 12.168 5.142 6.677 1.00 0.00 C ATOM 1015 CG ARG A 66 11.400 6.261 7.403 1.00 0.00 C ATOM 1016 CD ARG A 66 11.645 6.359 8.917 1.00 0.00 C ATOM 1017 NE ARG A 66 10.994 7.578 9.431 1.00 0.00 N ATOM 1018 CZ ARG A 66 10.305 7.747 10.567 1.00 0.00 C ATOM 1019 NH1 ARG A 66 10.171 6.784 11.467 1.00 0.00 N ATOM 1020 NH2 ARG A 66 9.736 8.925 10.791 1.00 0.00 N ATOM 0 H ARG A 66 13.300 3.764 4.913 1.00 0.00 H new ATOM 0 HA ARG A 66 10.579 4.716 5.372 1.00 0.00 H new ATOM 0 HB2 ARG A 66 12.067 4.207 7.227 1.00 0.00 H new ATOM 0 HB3 ARG A 66 13.231 5.382 6.648 1.00 0.00 H new ATOM 0 HG2 ARG A 66 11.666 7.215 6.947 1.00 0.00 H new ATOM 0 HG3 ARG A 66 10.333 6.114 7.234 1.00 0.00 H new ATOM 0 HD2 ARG A 66 11.246 5.478 9.421 1.00 0.00 H new ATOM 0 HD3 ARG A 66 12.715 6.388 9.124 1.00 0.00 H new ATOM 0 HE ARG A 66 11.080 8.406 8.841 1.00 0.00 H new ATOM 0 HH11 ARG A 66 10.601 5.873 11.307 1.00 0.00 H new ATOM 0 HH12 ARG A 66 9.638 6.954 12.320 1.00 0.00 H new ATOM 0 HH21 ARG A 66 9.829 9.675 10.106 1.00 0.00 H new ATOM 0 HH22 ARG A 66 9.206 9.080 11.648 1.00 0.00 H new ATOM 1034 N PHE A 67 10.636 6.808 4.000 1.00 0.00 N ATOM 1035 CA PHE A 67 10.562 7.961 3.120 1.00 0.00 C ATOM 1036 C PHE A 67 9.731 9.032 3.815 1.00 0.00 C ATOM 1037 O PHE A 67 9.134 8.808 4.870 1.00 0.00 O ATOM 1038 CB PHE A 67 10.008 7.508 1.755 1.00 0.00 C ATOM 1039 CG PHE A 67 10.183 8.533 0.661 1.00 0.00 C ATOM 1040 CD1 PHE A 67 11.452 8.734 0.089 1.00 0.00 C ATOM 1041 CD2 PHE A 67 9.075 9.260 0.190 1.00 0.00 C ATOM 1042 CE1 PHE A 67 11.614 9.672 -0.941 1.00 0.00 C ATOM 1043 CE2 PHE A 67 9.241 10.187 -0.850 1.00 0.00 C ATOM 1044 CZ PHE A 67 10.513 10.410 -1.402 1.00 0.00 C ATOM 0 H PHE A 67 9.718 6.479 4.299 1.00 0.00 H new ATOM 0 HA PHE A 67 11.539 8.401 2.918 1.00 0.00 H new ATOM 0 HB2 PHE A 67 10.505 6.584 1.459 1.00 0.00 H new ATOM 0 HB3 PHE A 67 8.948 7.279 1.861 1.00 0.00 H new ATOM 0 HD1 PHE A 67 12.300 8.167 0.442 1.00 0.00 H new ATOM 0 HD2 PHE A 67 8.100 9.105 0.627 1.00 0.00 H new ATOM 0 HE1 PHE A 67 12.588 9.827 -1.380 1.00 0.00 H new ATOM 0 HE2 PHE A 67 8.388 10.731 -1.227 1.00 0.00 H new ATOM 0 HZ PHE A 67 10.644 11.148 -2.180 1.00 0.00 H new ATOM 1054 N THR A 68 9.705 10.243 3.280 1.00 0.00 N ATOM 1055 CA THR A 68 8.956 11.335 3.862 1.00 0.00 C ATOM 1056 C THR A 68 8.222 12.073 2.747 1.00 0.00 C ATOM 1057 O THR A 68 8.837 12.648 1.852 1.00 0.00 O ATOM 1058 CB THR A 68 9.968 12.181 4.645 1.00 0.00 C ATOM 1059 OG1 THR A 68 10.383 11.456 5.789 1.00 0.00 O ATOM 1060 CG2 THR A 68 9.398 13.511 5.110 1.00 0.00 C ATOM 0 H THR A 68 10.206 10.492 2.427 1.00 0.00 H new ATOM 0 HA THR A 68 8.178 11.022 4.558 1.00 0.00 H new ATOM 0 HB THR A 68 10.798 12.392 3.970 1.00 0.00 H new ATOM 0 HG1 THR A 68 11.032 11.988 6.296 1.00 0.00 H new ATOM 0 HG21 THR A 68 10.162 14.063 5.658 1.00 0.00 H new ATOM 0 HG22 THR A 68 9.080 14.093 4.245 1.00 0.00 H new ATOM 0 HG23 THR A 68 8.543 13.332 5.761 1.00 0.00 H new ATOM 1068 N THR A 69 6.893 11.998 2.762 1.00 0.00 N ATOM 1069 CA THR A 69 5.994 12.698 1.863 1.00 0.00 C ATOM 1070 C THR A 69 4.650 12.802 2.582 1.00 0.00 C ATOM 1071 O THR A 69 4.282 11.949 3.396 1.00 0.00 O ATOM 1072 CB THR A 69 5.967 12.038 0.470 1.00 0.00 C ATOM 1073 OG1 THR A 69 7.100 12.500 -0.227 1.00 0.00 O ATOM 1074 CG2 THR A 69 4.765 12.395 -0.412 1.00 0.00 C ATOM 0 H THR A 69 6.395 11.417 3.437 1.00 0.00 H new ATOM 0 HA THR A 69 6.328 13.711 1.639 1.00 0.00 H new ATOM 0 HB THR A 69 5.926 10.964 0.651 1.00 0.00 H new ATOM 0 HG1 THR A 69 7.850 12.598 0.396 1.00 0.00 H new ATOM 0 HG21 THR A 69 4.848 11.876 -1.367 1.00 0.00 H new ATOM 0 HG22 THR A 69 3.845 12.092 0.087 1.00 0.00 H new ATOM 0 HG23 THR A 69 4.747 13.471 -0.584 1.00 0.00 H new ATOM 1082 N GLY A 70 3.911 13.846 2.245 1.00 0.00 N ATOM 1083 CA GLY A 70 2.652 14.240 2.825 1.00 0.00 C ATOM 1084 C GLY A 70 2.978 15.534 3.511 1.00 0.00 C ATOM 1085 O GLY A 70 3.745 15.600 4.470 1.00 0.00 O ATOM 0 H GLY A 70 4.203 14.483 1.504 1.00 0.00 H new ATOM 0 HA2 GLY A 70 1.882 14.371 2.065 1.00 0.00 H new ATOM 0 HA3 GLY A 70 2.282 13.494 3.528 1.00 0.00 H new ATOM 1089 N ASP A 71 2.375 16.550 2.950 1.00 0.00 N ATOM 1090 CA ASP A 71 2.540 17.945 3.298 1.00 0.00 C ATOM 1091 C ASP A 71 1.501 18.248 4.369 1.00 0.00 C ATOM 1092 O ASP A 71 0.305 18.071 4.124 1.00 0.00 O ATOM 1093 CB ASP A 71 2.378 18.785 2.015 1.00 0.00 C ATOM 1094 CG ASP A 71 3.260 18.259 0.872 1.00 0.00 C ATOM 1095 OD1 ASP A 71 4.481 18.530 0.836 1.00 0.00 O ATOM 1096 OD2 ASP A 71 2.754 17.490 0.018 1.00 0.00 O ATOM 0 H ASP A 71 1.711 16.420 2.187 1.00 0.00 H new ATOM 0 HA ASP A 71 3.524 18.185 3.701 1.00 0.00 H new ATOM 0 HB2 ASP A 71 1.334 18.774 1.703 1.00 0.00 H new ATOM 0 HB3 ASP A 71 2.636 19.823 2.225 1.00 0.00 H new ATOM 1101 N ALA A 72 1.931 18.550 5.596 1.00 0.00 N ATOM 1102 CA ALA A 72 1.058 18.941 6.700 1.00 0.00 C ATOM 1103 C ALA A 72 1.766 19.952 7.607 1.00 0.00 C ATOM 1104 O ALA A 72 2.952 20.226 7.441 1.00 0.00 O ATOM 1105 CB ALA A 72 0.623 17.699 7.489 1.00 0.00 C ATOM 0 H ALA A 72 2.918 18.528 5.853 1.00 0.00 H new ATOM 0 HA ALA A 72 0.166 19.420 6.297 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.028 17.999 8.310 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.084 17.019 6.829 1.00 0.00 H new ATOM 0 HB3 ALA A 72 1.503 17.195 7.889 1.00 0.00 H new ATOM 1111 N MET A 73 1.048 20.443 8.621 1.00 0.00 N ATOM 1112 CA MET A 73 1.543 21.355 9.650 1.00 0.00 C ATOM 1113 C MET A 73 2.604 20.722 10.569 1.00 0.00 C ATOM 1114 O MET A 73 3.117 21.388 11.466 1.00 0.00 O ATOM 1115 CB MET A 73 0.369 21.835 10.522 1.00 0.00 C ATOM 1116 CG MET A 73 -0.733 22.556 9.737 1.00 0.00 C ATOM 1117 SD MET A 73 -2.012 23.325 10.772 1.00 0.00 S ATOM 1118 CE MET A 73 -2.739 21.885 11.605 1.00 0.00 C ATOM 0 H MET A 73 0.065 20.204 8.751 1.00 0.00 H new ATOM 0 HA MET A 73 2.016 22.184 9.124 1.00 0.00 H new ATOM 0 HB2 MET A 73 -0.065 20.976 11.034 1.00 0.00 H new ATOM 0 HB3 MET A 73 0.751 22.505 11.292 1.00 0.00 H new ATOM 0 HG2 MET A 73 -0.275 23.325 9.115 1.00 0.00 H new ATOM 0 HG3 MET A 73 -1.208 21.843 9.063 1.00 0.00 H new ATOM 0 HE1 MET A 73 -3.605 22.200 12.188 1.00 0.00 H new ATOM 0 HE2 MET A 73 -3.050 21.153 10.860 1.00 0.00 H new ATOM 0 HE3 MET A 73 -1.999 21.436 12.268 1.00 0.00 H new ATOM 1128 N SER A 74 2.895 19.427 10.451 1.00 0.00 N ATOM 1129 CA SER A 74 3.924 18.743 11.211 1.00 0.00 C ATOM 1130 C SER A 74 4.541 17.654 10.335 1.00 0.00 C ATOM 1131 O SER A 74 4.026 17.365 9.251 1.00 0.00 O ATOM 1132 CB SER A 74 3.294 18.184 12.487 1.00 0.00 C ATOM 1133 OG SER A 74 2.899 19.250 13.330 1.00 0.00 O ATOM 0 H SER A 74 2.403 18.812 9.803 1.00 0.00 H new ATOM 0 HA SER A 74 4.725 19.421 11.504 1.00 0.00 H new ATOM 0 HB2 SER A 74 2.432 17.566 12.238 1.00 0.00 H new ATOM 0 HB3 SER A 74 4.007 17.543 13.005 1.00 0.00 H new ATOM 0 HG SER A 74 3.057 20.103 12.875 1.00 0.00 H new ATOM 1139 N LYS A 75 5.639 17.043 10.798 1.00 0.00 N ATOM 1140 CA LYS A 75 6.260 15.953 10.051 1.00 0.00 C ATOM 1141 C LYS A 75 5.278 14.797 9.919 1.00 0.00 C ATOM 1142 O LYS A 75 4.456 14.557 10.803 1.00 0.00 O ATOM 1143 CB LYS A 75 7.515 15.397 10.745 1.00 0.00 C ATOM 1144 CG LYS A 75 8.704 16.363 10.837 1.00 0.00 C ATOM 1145 CD LYS A 75 9.925 15.613 11.396 1.00 0.00 C ATOM 1146 CE LYS A 75 11.163 16.517 11.456 1.00 0.00 C ATOM 1147 NZ LYS A 75 12.359 15.788 11.947 1.00 0.00 N ATOM 0 H LYS A 75 6.106 17.283 11.672 1.00 0.00 H new ATOM 0 HA LYS A 75 6.541 16.367 9.083 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.243 15.087 11.754 1.00 0.00 H new ATOM 0 HB3 LYS A 75 7.837 14.502 10.212 1.00 0.00 H new ATOM 0 HG2 LYS A 75 8.933 16.771 9.853 1.00 0.00 H new ATOM 0 HG3 LYS A 75 8.454 17.206 11.481 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.698 15.239 12.394 1.00 0.00 H new ATOM 0 HD3 LYS A 75 10.137 14.745 10.772 1.00 0.00 H new ATOM 0 HE2 LYS A 75 11.366 16.920 10.464 1.00 0.00 H new ATOM 0 HE3 LYS A 75 10.961 17.365 12.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 13.173 16.434 11.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 12.175 15.425 12.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 12.567 14.994 11.309 1.00 0.00 H new ATOM 1161 N ARG A 76 5.441 14.049 8.840 1.00 0.00 N ATOM 1162 CA ARG A 76 4.730 12.831 8.486 1.00 0.00 C ATOM 1163 C ARG A 76 5.824 11.912 7.959 1.00 0.00 C ATOM 1164 O ARG A 76 6.890 12.404 7.576 1.00 0.00 O ATOM 1165 CB ARG A 76 3.655 13.053 7.401 1.00 0.00 C ATOM 1166 CG ARG A 76 2.845 14.355 7.520 1.00 0.00 C ATOM 1167 CD ARG A 76 1.551 14.272 6.698 1.00 0.00 C ATOM 1168 NE ARG A 76 0.486 13.657 7.501 1.00 0.00 N ATOM 1169 CZ ARG A 76 -0.829 13.645 7.259 1.00 0.00 C ATOM 1170 NH1 ARG A 76 -1.358 14.178 6.161 1.00 0.00 N ATOM 1171 NH2 ARG A 76 -1.626 13.091 8.160 1.00 0.00 N ATOM 0 H ARG A 76 6.131 14.299 8.131 1.00 0.00 H new ATOM 0 HA ARG A 76 4.187 12.429 9.342 1.00 0.00 H new ATOM 0 HB2 ARG A 76 4.141 13.037 6.426 1.00 0.00 H new ATOM 0 HB3 ARG A 76 2.962 12.212 7.425 1.00 0.00 H new ATOM 0 HG2 ARG A 76 2.605 14.544 8.566 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.447 15.195 7.174 1.00 0.00 H new ATOM 0 HD2 ARG A 76 1.248 15.269 6.379 1.00 0.00 H new ATOM 0 HD3 ARG A 76 1.721 13.687 5.794 1.00 0.00 H new ATOM 0 HE ARG A 76 0.787 13.179 8.350 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -0.755 14.617 5.466 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -2.367 14.148 6.015 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -1.232 12.689 9.011 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -2.634 13.067 8.003 1.00 0.00 H new ATOM 1185 N SER A 77 5.580 10.613 7.889 1.00 0.00 N ATOM 1186 CA SER A 77 6.549 9.696 7.317 1.00 0.00 C ATOM 1187 C SER A 77 5.768 8.651 6.538 1.00 0.00 C ATOM 1188 O SER A 77 4.623 8.324 6.867 1.00 0.00 O ATOM 1189 CB SER A 77 7.443 9.119 8.421 1.00 0.00 C ATOM 1190 OG SER A 77 8.662 8.628 7.894 1.00 0.00 O ATOM 0 H SER A 77 4.722 10.172 8.220 1.00 0.00 H new ATOM 0 HA SER A 77 7.234 10.191 6.629 1.00 0.00 H new ATOM 0 HB2 SER A 77 7.650 9.890 9.164 1.00 0.00 H new ATOM 0 HB3 SER A 77 6.916 8.315 8.935 1.00 0.00 H new ATOM 0 HG SER A 77 8.664 8.735 6.920 1.00 0.00 H new ATOM 1196 N LYS A 78 6.392 8.149 5.481 1.00 0.00 N ATOM 1197 CA LYS A 78 5.837 7.149 4.594 1.00 0.00 C ATOM 1198 C LYS A 78 6.892 6.076 4.431 1.00 0.00 C ATOM 1199 O LYS A 78 8.020 6.227 4.901 1.00 0.00 O ATOM 1200 CB LYS A 78 5.398 7.805 3.270 1.00 0.00 C ATOM 1201 CG LYS A 78 4.023 8.461 3.472 1.00 0.00 C ATOM 1202 CD LYS A 78 3.418 9.011 2.174 1.00 0.00 C ATOM 1203 CE LYS A 78 1.957 9.442 2.370 1.00 0.00 C ATOM 1204 NZ LYS A 78 1.780 10.542 3.344 1.00 0.00 N ATOM 0 H LYS A 78 7.332 8.441 5.213 1.00 0.00 H new ATOM 0 HA LYS A 78 4.935 6.687 4.995 1.00 0.00 H new ATOM 0 HB2 LYS A 78 6.129 8.551 2.958 1.00 0.00 H new ATOM 0 HB3 LYS A 78 5.347 7.058 2.478 1.00 0.00 H new ATOM 0 HG2 LYS A 78 3.339 7.730 3.903 1.00 0.00 H new ATOM 0 HG3 LYS A 78 4.118 9.273 4.193 1.00 0.00 H new ATOM 0 HD2 LYS A 78 4.006 9.862 1.830 1.00 0.00 H new ATOM 0 HD3 LYS A 78 3.472 8.250 1.395 1.00 0.00 H new ATOM 0 HE2 LYS A 78 1.548 9.753 1.408 1.00 0.00 H new ATOM 0 HE3 LYS A 78 1.376 8.581 2.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 1.012 11.167 3.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 1.541 10.146 4.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 2.662 11.088 3.416 1.00 0.00 H new ATOM 1218 N PHE A 79 6.523 4.988 3.778 1.00 0.00 N ATOM 1219 CA PHE A 79 7.445 3.903 3.508 1.00 0.00 C ATOM 1220 C PHE A 79 7.128 3.391 2.122 1.00 0.00 C ATOM 1221 O PHE A 79 5.951 3.324 1.742 1.00 0.00 O ATOM 1222 CB PHE A 79 7.352 2.796 4.561 1.00 0.00 C ATOM 1223 CG PHE A 79 7.488 3.275 5.993 1.00 0.00 C ATOM 1224 CD1 PHE A 79 6.394 3.877 6.646 1.00 0.00 C ATOM 1225 CD2 PHE A 79 8.727 3.197 6.648 1.00 0.00 C ATOM 1226 CE1 PHE A 79 6.550 4.453 7.914 1.00 0.00 C ATOM 1227 CE2 PHE A 79 8.874 3.750 7.930 1.00 0.00 C ATOM 1228 CZ PHE A 79 7.794 4.386 8.567 1.00 0.00 C ATOM 0 H PHE A 79 5.580 4.834 3.422 1.00 0.00 H new ATOM 0 HA PHE A 79 8.474 4.259 3.557 1.00 0.00 H new ATOM 0 HB2 PHE A 79 6.394 2.287 4.451 1.00 0.00 H new ATOM 0 HB3 PHE A 79 8.129 2.058 4.363 1.00 0.00 H new ATOM 0 HD1 PHE A 79 5.427 3.895 6.165 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.564 2.713 6.167 1.00 0.00 H new ATOM 0 HE1 PHE A 79 5.716 4.948 8.389 1.00 0.00 H new ATOM 0 HE2 PHE A 79 9.828 3.686 8.433 1.00 0.00 H new ATOM 0 HZ PHE A 79 7.918 4.819 9.549 1.00 0.00 H new ATOM 1238 N ALA A 80 8.187 3.086 1.386 1.00 0.00 N ATOM 1239 CA ALA A 80 8.159 2.652 0.011 1.00 0.00 C ATOM 1240 C ALA A 80 8.715 1.236 -0.009 1.00 0.00 C ATOM 1241 O ALA A 80 9.820 0.982 0.478 1.00 0.00 O ATOM 1242 CB ALA A 80 8.966 3.648 -0.838 1.00 0.00 C ATOM 0 H ALA A 80 9.135 3.140 1.759 1.00 0.00 H new ATOM 0 HA ALA A 80 7.157 2.632 -0.417 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.953 3.331 -1.881 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.523 4.640 -0.754 1.00 0.00 H new ATOM 0 HB3 ALA A 80 9.996 3.680 -0.481 1.00 0.00 H new ATOM 1248 N LEU A 81 7.877 0.284 -0.425 1.00 0.00 N ATOM 1249 CA LEU A 81 8.279 -1.106 -0.601 1.00 0.00 C ATOM 1250 C LEU A 81 8.705 -1.133 -2.057 1.00 0.00 C ATOM 1251 O LEU A 81 7.880 -0.947 -2.943 1.00 0.00 O ATOM 1252 CB LEU A 81 7.124 -2.066 -0.264 1.00 0.00 C ATOM 1253 CG LEU A 81 7.346 -3.567 -0.544 1.00 0.00 C ATOM 1254 CD1 LEU A 81 7.067 -4.004 -1.988 1.00 0.00 C ATOM 1255 CD2 LEU A 81 8.704 -4.097 -0.087 1.00 0.00 C ATOM 0 H LEU A 81 6.898 0.460 -0.649 1.00 0.00 H new ATOM 0 HA LEU A 81 9.077 -1.440 0.062 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.888 -1.952 0.794 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.245 -1.745 -0.823 1.00 0.00 H new ATOM 0 HG LEU A 81 6.582 -4.030 0.081 1.00 0.00 H new ATOM 0 HD11 LEU A 81 7.251 -5.074 -2.086 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.028 -3.790 -2.239 1.00 0.00 H new ATOM 0 HD13 LEU A 81 7.724 -3.459 -2.666 1.00 0.00 H new ATOM 0 HD21 LEU A 81 8.778 -5.159 -0.321 1.00 0.00 H new ATOM 0 HD22 LEU A 81 9.498 -3.556 -0.602 1.00 0.00 H new ATOM 0 HD23 LEU A 81 8.807 -3.955 0.989 1.00 0.00 H new ATOM 1267 N ILE A 82 9.975 -1.345 -2.334 1.00 0.00 N ATOM 1268 CA ILE A 82 10.486 -1.290 -3.696 1.00 0.00 C ATOM 1269 C ILE A 82 10.740 -2.711 -4.128 1.00 0.00 C ATOM 1270 O ILE A 82 11.470 -3.434 -3.449 1.00 0.00 O ATOM 1271 CB ILE A 82 11.732 -0.392 -3.794 1.00 0.00 C ATOM 1272 CG1 ILE A 82 11.430 1.024 -3.258 1.00 0.00 C ATOM 1273 CG2 ILE A 82 12.171 -0.257 -5.256 1.00 0.00 C ATOM 1274 CD1 ILE A 82 12.063 1.239 -1.888 1.00 0.00 C ATOM 0 H ILE A 82 10.681 -1.559 -1.630 1.00 0.00 H new ATOM 0 HA ILE A 82 9.763 -0.832 -4.371 1.00 0.00 H new ATOM 0 HB ILE A 82 12.520 -0.854 -3.199 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.808 1.769 -3.958 1.00 0.00 H new ATOM 0 HG13 ILE A 82 10.352 1.168 -3.190 1.00 0.00 H new ATOM 0 HG21 ILE A 82 13.053 0.380 -5.314 1.00 0.00 H new ATOM 0 HG22 ILE A 82 12.408 -1.242 -5.657 1.00 0.00 H new ATOM 0 HG23 ILE A 82 11.364 0.187 -5.839 1.00 0.00 H new ATOM 0 HD11 ILE A 82 11.834 2.245 -1.535 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.665 0.508 -1.184 1.00 0.00 H new ATOM 0 HD13 ILE A 82 13.144 1.118 -1.964 1.00 0.00 H new ATOM 1286 N THR A 83 10.165 -3.113 -5.253 1.00 0.00 N ATOM 1287 CA THR A 83 10.400 -4.438 -5.779 1.00 0.00 C ATOM 1288 C THR A 83 11.409 -4.282 -6.920 1.00 0.00 C ATOM 1289 O THR A 83 11.161 -3.517 -7.856 1.00 0.00 O ATOM 1290 CB THR A 83 9.067 -5.025 -6.273 1.00 0.00 C ATOM 1291 OG1 THR A 83 7.969 -4.693 -5.435 1.00 0.00 O ATOM 1292 CG2 THR A 83 9.178 -6.544 -6.213 1.00 0.00 C ATOM 0 H THR A 83 9.535 -2.538 -5.813 1.00 0.00 H new ATOM 0 HA THR A 83 10.796 -5.120 -5.027 1.00 0.00 H new ATOM 0 HB THR A 83 8.892 -4.625 -7.272 1.00 0.00 H new ATOM 0 HG1 THR A 83 7.149 -5.090 -5.797 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.246 -6.991 -6.558 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.997 -6.874 -6.852 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.371 -6.854 -5.186 1.00 0.00 H new ATOM 1300 N TRP A 84 12.538 -4.983 -6.847 1.00 0.00 N ATOM 1301 CA TRP A 84 13.537 -5.004 -7.900 1.00 0.00 C ATOM 1302 C TRP A 84 13.208 -6.240 -8.720 1.00 0.00 C ATOM 1303 O TRP A 84 13.142 -7.349 -8.170 1.00 0.00 O ATOM 1304 CB TRP A 84 14.942 -5.094 -7.289 1.00 0.00 C ATOM 1305 CG TRP A 84 16.046 -5.369 -8.266 1.00 0.00 C ATOM 1306 CD1 TRP A 84 16.807 -6.488 -8.318 1.00 0.00 C ATOM 1307 CD2 TRP A 84 16.496 -4.535 -9.373 1.00 0.00 C ATOM 1308 NE1 TRP A 84 17.644 -6.428 -9.413 1.00 0.00 N ATOM 1309 CE2 TRP A 84 17.458 -5.267 -10.129 1.00 0.00 C ATOM 1310 CE3 TRP A 84 16.177 -3.238 -9.823 1.00 0.00 C ATOM 1311 CZ2 TRP A 84 17.996 -4.783 -11.328 1.00 0.00 C ATOM 1312 CZ3 TRP A 84 16.754 -2.721 -10.995 1.00 0.00 C ATOM 1313 CH2 TRP A 84 17.621 -3.506 -11.773 1.00 0.00 C ATOM 0 H TRP A 84 12.783 -5.559 -6.042 1.00 0.00 H new ATOM 0 HA TRP A 84 13.526 -4.103 -8.513 1.00 0.00 H new ATOM 0 HB2 TRP A 84 15.158 -4.157 -6.775 1.00 0.00 H new ATOM 0 HB3 TRP A 84 14.943 -5.880 -6.534 1.00 0.00 H new ATOM 0 HD1 TRP A 84 16.765 -7.303 -7.610 1.00 0.00 H new ATOM 0 HE1 TRP A 84 18.317 -7.153 -9.661 1.00 0.00 H new ATOM 0 HE3 TRP A 84 15.481 -2.634 -9.260 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 18.688 -5.383 -11.901 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 16.529 -1.710 -11.301 1.00 0.00 H new ATOM 0 HH2 TRP A 84 17.998 -3.128 -12.712 1.00 0.00 H new ATOM 1324 N ILE A 85 12.982 -6.068 -10.019 1.00 0.00 N ATOM 1325 CA ILE A 85 12.647 -7.154 -10.924 1.00 0.00 C ATOM 1326 C ILE A 85 13.328 -6.823 -12.247 1.00 0.00 C ATOM 1327 O ILE A 85 12.808 -6.002 -13.005 1.00 0.00 O ATOM 1328 CB ILE A 85 11.121 -7.358 -11.081 1.00 0.00 C ATOM 1329 CG1 ILE A 85 10.395 -7.420 -9.720 1.00 0.00 C ATOM 1330 CG2 ILE A 85 10.896 -8.671 -11.853 1.00 0.00 C ATOM 1331 CD1 ILE A 85 8.924 -7.811 -9.811 1.00 0.00 C ATOM 0 H ILE A 85 13.028 -5.157 -10.475 1.00 0.00 H new ATOM 0 HA ILE A 85 13.000 -8.106 -10.528 1.00 0.00 H new ATOM 0 HB ILE A 85 10.707 -6.506 -11.620 1.00 0.00 H new ATOM 0 HG12 ILE A 85 10.910 -8.135 -9.079 1.00 0.00 H new ATOM 0 HG13 ILE A 85 10.471 -6.446 -9.236 1.00 0.00 H new ATOM 0 HG21 ILE A 85 9.827 -8.841 -11.979 1.00 0.00 H new ATOM 0 HG22 ILE A 85 11.370 -8.603 -12.832 1.00 0.00 H new ATOM 0 HG23 ILE A 85 11.332 -9.500 -11.296 1.00 0.00 H new ATOM 0 HD11 ILE A 85 8.490 -7.831 -8.811 1.00 0.00 H new ATOM 0 HD12 ILE A 85 8.391 -7.083 -10.423 1.00 0.00 H new ATOM 0 HD13 ILE A 85 8.837 -8.799 -10.264 1.00 0.00 H new ATOM 1343 N GLY A 86 14.496 -7.410 -12.517 1.00 0.00 N ATOM 1344 CA GLY A 86 15.149 -7.208 -13.804 1.00 0.00 C ATOM 1345 C GLY A 86 14.263 -7.777 -14.919 1.00 0.00 C ATOM 1346 O GLY A 86 13.321 -8.535 -14.663 1.00 0.00 O ATOM 0 H GLY A 86 14.999 -8.018 -11.871 1.00 0.00 H new ATOM 0 HA2 GLY A 86 15.326 -6.146 -13.972 1.00 0.00 H new ATOM 0 HA3 GLY A 86 16.122 -7.699 -13.812 1.00 0.00 H new ATOM 1350 N GLU A 87 14.547 -7.460 -16.179 1.00 0.00 N ATOM 1351 CA GLU A 87 13.740 -7.995 -17.268 1.00 0.00 C ATOM 1352 C GLU A 87 14.126 -9.456 -17.562 1.00 0.00 C ATOM 1353 O GLU A 87 13.355 -10.177 -18.189 1.00 0.00 O ATOM 1354 CB GLU A 87 13.832 -7.119 -18.531 1.00 0.00 C ATOM 1355 CG GLU A 87 12.597 -7.411 -19.405 1.00 0.00 C ATOM 1356 CD GLU A 87 12.515 -6.681 -20.737 1.00 0.00 C ATOM 1357 OE1 GLU A 87 13.544 -6.169 -21.232 1.00 0.00 O ATOM 1358 OE2 GLU A 87 11.406 -6.741 -21.321 1.00 0.00 O ATOM 0 H GLU A 87 15.312 -6.850 -16.466 1.00 0.00 H new ATOM 0 HA GLU A 87 12.698 -7.979 -16.950 1.00 0.00 H new ATOM 0 HB2 GLU A 87 13.867 -6.064 -18.261 1.00 0.00 H new ATOM 0 HB3 GLU A 87 14.748 -7.338 -19.080 1.00 0.00 H new ATOM 0 HG2 GLU A 87 12.565 -8.483 -19.602 1.00 0.00 H new ATOM 0 HG3 GLU A 87 11.706 -7.166 -18.827 1.00 0.00 H new ATOM 1365 N ASN A 88 15.238 -9.970 -17.022 1.00 0.00 N ATOM 1366 CA ASN A 88 15.687 -11.323 -17.364 1.00 0.00 C ATOM 1367 C ASN A 88 14.975 -12.390 -16.542 1.00 0.00 C ATOM 1368 O ASN A 88 14.813 -13.513 -17.035 1.00 0.00 O ATOM 1369 CB ASN A 88 17.214 -11.427 -17.268 1.00 0.00 C ATOM 1370 CG ASN A 88 17.869 -10.528 -18.312 1.00 0.00 C ATOM 1371 OD1 ASN A 88 17.385 -10.401 -19.438 1.00 0.00 O ATOM 1372 ND2 ASN A 88 18.949 -9.861 -17.967 1.00 0.00 N ATOM 0 H ASN A 88 15.834 -9.478 -16.357 1.00 0.00 H new ATOM 0 HA ASN A 88 15.411 -11.515 -18.401 1.00 0.00 H new ATOM 0 HB2 ASN A 88 17.544 -11.138 -16.270 1.00 0.00 H new ATOM 0 HB3 ASN A 88 17.526 -12.460 -17.420 1.00 0.00 H new ATOM 0 HD21 ASN A 88 19.394 -9.231 -18.634 1.00 0.00 H new ATOM 0 HD22 ASN A 88 19.341 -9.974 -17.032 1.00 0.00 H new ATOM 1379 N VAL A 89 14.515 -12.080 -15.330 1.00 0.00 N ATOM 1380 CA VAL A 89 13.736 -13.006 -14.534 1.00 0.00 C ATOM 1381 C VAL A 89 12.413 -13.158 -15.295 1.00 0.00 C ATOM 1382 O VAL A 89 11.749 -12.165 -15.609 1.00 0.00 O ATOM 1383 CB VAL A 89 13.646 -12.491 -13.086 1.00 0.00 C ATOM 1384 CG1 VAL A 89 13.413 -10.986 -12.923 1.00 0.00 C ATOM 1385 CG2 VAL A 89 12.592 -13.243 -12.274 1.00 0.00 C ATOM 0 H VAL A 89 14.676 -11.179 -14.880 1.00 0.00 H new ATOM 0 HA VAL A 89 14.171 -13.998 -14.415 1.00 0.00 H new ATOM 0 HB VAL A 89 14.646 -12.690 -12.700 1.00 0.00 H new ATOM 0 HG11 VAL A 89 13.367 -10.738 -11.863 1.00 0.00 H new ATOM 0 HG12 VAL A 89 14.232 -10.438 -13.389 1.00 0.00 H new ATOM 0 HG13 VAL A 89 12.474 -10.709 -13.402 1.00 0.00 H new ATOM 0 HG21 VAL A 89 12.563 -12.846 -11.259 1.00 0.00 H new ATOM 0 HG22 VAL A 89 11.615 -13.117 -12.741 1.00 0.00 H new ATOM 0 HG23 VAL A 89 12.845 -14.303 -12.242 1.00 0.00 H new ATOM 1395 N SER A 90 12.056 -14.395 -15.639 1.00 0.00 N ATOM 1396 CA SER A 90 10.886 -14.696 -16.441 1.00 0.00 C ATOM 1397 C SER A 90 9.596 -14.346 -15.699 1.00 0.00 C ATOM 1398 O SER A 90 9.527 -14.339 -14.463 1.00 0.00 O ATOM 1399 CB SER A 90 10.919 -16.183 -16.817 1.00 0.00 C ATOM 1400 OG SER A 90 10.052 -16.474 -17.899 1.00 0.00 O ATOM 0 H SER A 90 12.583 -15.223 -15.361 1.00 0.00 H new ATOM 0 HA SER A 90 10.904 -14.088 -17.346 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.937 -16.468 -17.081 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.634 -16.782 -15.952 1.00 0.00 H new ATOM 0 HG SER A 90 10.102 -17.430 -18.110 1.00 0.00 H new ATOM 1406 N GLY A 91 8.530 -14.165 -16.476 1.00 0.00 N ATOM 1407 CA GLY A 91 7.189 -13.873 -16.008 1.00 0.00 C ATOM 1408 C GLY A 91 6.648 -14.923 -15.037 1.00 0.00 C ATOM 1409 O GLY A 91 5.771 -14.603 -14.234 1.00 0.00 O ATOM 0 H GLY A 91 8.587 -14.222 -17.493 1.00 0.00 H new ATOM 0 HA2 GLY A 91 7.186 -12.899 -15.519 1.00 0.00 H new ATOM 0 HA3 GLY A 91 6.520 -13.801 -16.865 1.00 0.00 H new ATOM 1413 N LEU A 92 7.140 -16.167 -15.075 1.00 0.00 N ATOM 1414 CA LEU A 92 6.736 -17.209 -14.134 1.00 0.00 C ATOM 1415 C LEU A 92 7.244 -16.864 -12.738 1.00 0.00 C ATOM 1416 O LEU A 92 6.472 -16.881 -11.783 1.00 0.00 O ATOM 1417 CB LEU A 92 7.238 -18.580 -14.611 1.00 0.00 C ATOM 1418 CG LEU A 92 6.698 -19.761 -13.774 1.00 0.00 C ATOM 1419 CD1 LEU A 92 6.718 -21.032 -14.628 1.00 0.00 C ATOM 1420 CD2 LEU A 92 7.509 -20.049 -12.502 1.00 0.00 C ATOM 0 H LEU A 92 7.829 -16.476 -15.760 1.00 0.00 H new ATOM 0 HA LEU A 92 5.648 -17.263 -14.088 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.949 -18.721 -15.652 1.00 0.00 H new ATOM 0 HB3 LEU A 92 8.327 -18.590 -14.578 1.00 0.00 H new ATOM 0 HG LEU A 92 5.692 -19.475 -13.468 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.338 -21.869 -14.043 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.090 -20.889 -15.508 1.00 0.00 H new ATOM 0 HD13 LEU A 92 7.740 -21.243 -14.942 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.066 -20.891 -11.971 1.00 0.00 H new ATOM 0 HD22 LEU A 92 8.537 -20.291 -12.773 1.00 0.00 H new ATOM 0 HD23 LEU A 92 7.501 -19.169 -11.858 1.00 0.00 H new ATOM 1432 N GLN A 93 8.531 -16.552 -12.600 1.00 0.00 N ATOM 1433 CA GLN A 93 9.112 -16.127 -11.330 1.00 0.00 C ATOM 1434 C GLN A 93 8.465 -14.803 -10.923 1.00 0.00 C ATOM 1435 O GLN A 93 8.040 -14.664 -9.779 1.00 0.00 O ATOM 1436 CB GLN A 93 10.630 -15.986 -11.500 1.00 0.00 C ATOM 1437 CG GLN A 93 11.377 -17.288 -11.855 1.00 0.00 C ATOM 1438 CD GLN A 93 12.524 -16.999 -12.823 1.00 0.00 C ATOM 1439 OE1 GLN A 93 12.298 -16.712 -13.994 1.00 0.00 O ATOM 1440 NE2 GLN A 93 13.772 -17.035 -12.403 1.00 0.00 N ATOM 0 H GLN A 93 9.201 -16.587 -13.368 1.00 0.00 H new ATOM 0 HA GLN A 93 8.927 -16.860 -10.545 1.00 0.00 H new ATOM 0 HB2 GLN A 93 10.825 -15.250 -12.280 1.00 0.00 H new ATOM 0 HB3 GLN A 93 11.047 -15.588 -10.575 1.00 0.00 H new ATOM 0 HG2 GLN A 93 11.766 -17.750 -10.948 1.00 0.00 H new ATOM 0 HG3 GLN A 93 10.685 -18.001 -12.304 1.00 0.00 H new ATOM 0 HE21 GLN A 93 13.977 -17.272 -11.432 1.00 0.00 H new ATOM 0 HE22 GLN A 93 14.534 -16.826 -13.049 1.00 0.00 H new ATOM 1449 N ARG A 94 8.297 -13.860 -11.862 1.00 0.00 N ATOM 1450 CA ARG A 94 7.616 -12.593 -11.591 1.00 0.00 C ATOM 1451 C ARG A 94 6.217 -12.827 -11.018 1.00 0.00 C ATOM 1452 O ARG A 94 5.793 -12.074 -10.145 1.00 0.00 O ATOM 1453 CB ARG A 94 7.549 -11.739 -12.866 1.00 0.00 C ATOM 1454 CG ARG A 94 7.214 -10.286 -12.518 1.00 0.00 C ATOM 1455 CD ARG A 94 7.091 -9.392 -13.758 1.00 0.00 C ATOM 1456 NE ARG A 94 5.759 -9.459 -14.388 1.00 0.00 N ATOM 1457 CZ ARG A 94 4.623 -8.944 -13.891 1.00 0.00 C ATOM 1458 NH1 ARG A 94 4.637 -8.296 -12.731 1.00 0.00 N ATOM 1459 NH2 ARG A 94 3.473 -9.067 -14.540 1.00 0.00 N ATOM 0 H ARG A 94 8.628 -13.956 -12.822 1.00 0.00 H new ATOM 0 HA ARG A 94 8.193 -12.052 -10.841 1.00 0.00 H new ATOM 0 HB2 ARG A 94 8.503 -11.783 -13.391 1.00 0.00 H new ATOM 0 HB3 ARG A 94 6.794 -12.141 -13.542 1.00 0.00 H new ATOM 0 HG2 ARG A 94 6.278 -10.257 -11.960 1.00 0.00 H new ATOM 0 HG3 ARG A 94 7.988 -9.886 -11.863 1.00 0.00 H new ATOM 0 HD2 ARG A 94 7.302 -8.360 -13.477 1.00 0.00 H new ATOM 0 HD3 ARG A 94 7.847 -9.685 -14.487 1.00 0.00 H new ATOM 0 HE ARG A 94 5.695 -9.941 -15.284 1.00 0.00 H new ATOM 0 HH11 ARG A 94 5.512 -8.189 -12.217 1.00 0.00 H new ATOM 0 HH12 ARG A 94 3.773 -7.905 -12.355 1.00 0.00 H new ATOM 0 HH21 ARG A 94 3.441 -9.560 -15.433 1.00 0.00 H new ATOM 0 HH22 ARG A 94 2.620 -8.669 -14.147 1.00 0.00 H new ATOM 1473 N ALA A 95 5.509 -13.871 -11.466 1.00 0.00 N ATOM 1474 CA ALA A 95 4.173 -14.170 -10.979 1.00 0.00 C ATOM 1475 C ALA A 95 4.159 -14.421 -9.471 1.00 0.00 C ATOM 1476 O ALA A 95 3.119 -14.195 -8.858 1.00 0.00 O ATOM 1477 CB ALA A 95 3.552 -15.350 -11.729 1.00 0.00 C ATOM 0 H ALA A 95 5.851 -14.523 -12.172 1.00 0.00 H new ATOM 0 HA ALA A 95 3.563 -13.288 -11.174 1.00 0.00 H new ATOM 0 HB1 ALA A 95 2.553 -15.545 -11.338 1.00 0.00 H new ATOM 0 HB2 ALA A 95 3.486 -15.112 -12.791 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.174 -16.235 -11.593 1.00 0.00 H new ATOM 1483 N LYS A 96 5.248 -14.876 -8.834 1.00 0.00 N ATOM 1484 CA LYS A 96 5.254 -15.022 -7.374 1.00 0.00 C ATOM 1485 C LYS A 96 4.934 -13.703 -6.683 1.00 0.00 C ATOM 1486 O LYS A 96 4.104 -13.712 -5.780 1.00 0.00 O ATOM 1487 CB LYS A 96 6.541 -15.685 -6.855 1.00 0.00 C ATOM 1488 CG LYS A 96 6.486 -17.212 -6.977 1.00 0.00 C ATOM 1489 CD LYS A 96 7.667 -17.853 -6.236 1.00 0.00 C ATOM 1490 CE LYS A 96 7.512 -19.365 -6.028 1.00 0.00 C ATOM 1491 NZ LYS A 96 6.394 -19.713 -5.118 1.00 0.00 N ATOM 0 H LYS A 96 6.117 -15.144 -9.296 1.00 0.00 H new ATOM 0 HA LYS A 96 4.451 -15.711 -7.111 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.396 -15.307 -7.415 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.696 -15.409 -5.812 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.547 -17.582 -6.566 1.00 0.00 H new ATOM 0 HG3 LYS A 96 6.509 -17.500 -8.028 1.00 0.00 H new ATOM 0 HD2 LYS A 96 8.583 -17.663 -6.796 1.00 0.00 H new ATOM 0 HD3 LYS A 96 7.781 -17.371 -5.265 1.00 0.00 H new ATOM 0 HE2 LYS A 96 7.350 -19.844 -6.993 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.441 -19.768 -5.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 6.451 -20.721 -4.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 6.458 -19.137 -4.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 5.488 -19.525 -5.593 1.00 0.00 H new ATOM 1505 N THR A 97 5.431 -12.565 -7.161 1.00 0.00 N ATOM 1506 CA THR A 97 5.108 -11.245 -6.621 1.00 0.00 C ATOM 1507 C THR A 97 3.579 -11.008 -6.614 1.00 0.00 C ATOM 1508 O THR A 97 3.060 -10.319 -5.729 1.00 0.00 O ATOM 1509 CB THR A 97 5.875 -10.223 -7.484 1.00 0.00 C ATOM 1510 OG1 THR A 97 7.245 -10.575 -7.499 1.00 0.00 O ATOM 1511 CG2 THR A 97 5.770 -8.780 -7.010 1.00 0.00 C ATOM 0 H THR A 97 6.080 -12.533 -7.947 1.00 0.00 H new ATOM 0 HA THR A 97 5.412 -11.147 -5.579 1.00 0.00 H new ATOM 0 HB THR A 97 5.414 -10.264 -8.471 1.00 0.00 H new ATOM 0 HG1 THR A 97 7.742 -9.932 -8.047 1.00 0.00 H new ATOM 0 HG21 THR A 97 6.341 -8.135 -7.678 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.725 -8.471 -7.013 1.00 0.00 H new ATOM 0 HG23 THR A 97 6.169 -8.699 -5.999 1.00 0.00 H new ATOM 1519 N GLY A 98 2.834 -11.637 -7.533 1.00 0.00 N ATOM 1520 CA GLY A 98 1.379 -11.584 -7.622 1.00 0.00 C ATOM 1521 C GLY A 98 0.649 -12.224 -6.438 1.00 0.00 C ATOM 1522 O GLY A 98 -0.507 -11.881 -6.181 1.00 0.00 O ATOM 0 H GLY A 98 3.250 -12.218 -8.261 1.00 0.00 H new ATOM 0 HA2 GLY A 98 1.070 -10.542 -7.703 1.00 0.00 H new ATOM 0 HA3 GLY A 98 1.065 -12.082 -8.539 1.00 0.00 H new ATOM 1526 N THR A 99 1.312 -13.102 -5.688 1.00 0.00 N ATOM 1527 CA THR A 99 0.786 -13.736 -4.478 1.00 0.00 C ATOM 1528 C THR A 99 1.677 -13.420 -3.260 1.00 0.00 C ATOM 1529 O THR A 99 1.269 -13.659 -2.122 1.00 0.00 O ATOM 1530 CB THR A 99 0.597 -15.243 -4.755 1.00 0.00 C ATOM 1531 OG1 THR A 99 -0.309 -15.414 -5.834 1.00 0.00 O ATOM 1532 CG2 THR A 99 0.025 -16.033 -3.574 1.00 0.00 C ATOM 0 H THR A 99 2.261 -13.402 -5.912 1.00 0.00 H new ATOM 0 HA THR A 99 -0.192 -13.330 -4.219 1.00 0.00 H new ATOM 0 HB THR A 99 1.595 -15.625 -4.969 1.00 0.00 H new ATOM 0 HG1 THR A 99 -0.793 -16.259 -5.724 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.076 -17.082 -3.853 1.00 0.00 H new ATOM 0 HG22 THR A 99 0.697 -15.948 -2.720 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.953 -15.633 -3.308 1.00 0.00 H new ATOM 1540 N ASP A 100 2.829 -12.773 -3.468 1.00 0.00 N ATOM 1541 CA ASP A 100 3.805 -12.496 -2.421 1.00 0.00 C ATOM 1542 C ASP A 100 3.792 -11.047 -1.959 1.00 0.00 C ATOM 1543 O ASP A 100 4.165 -10.798 -0.815 1.00 0.00 O ATOM 1544 CB ASP A 100 5.220 -12.827 -2.896 1.00 0.00 C ATOM 1545 CG ASP A 100 5.523 -14.320 -3.066 1.00 0.00 C ATOM 1546 OD1 ASP A 100 4.688 -15.197 -2.749 1.00 0.00 O ATOM 1547 OD2 ASP A 100 6.654 -14.629 -3.494 1.00 0.00 O ATOM 0 H ASP A 100 3.109 -12.424 -4.385 1.00 0.00 H new ATOM 0 HA ASP A 100 3.518 -13.129 -1.581 1.00 0.00 H new ATOM 0 HB2 ASP A 100 5.391 -12.328 -3.850 1.00 0.00 H new ATOM 0 HB3 ASP A 100 5.931 -12.408 -2.185 1.00 0.00 H new ATOM 1552 N LYS A 101 3.355 -10.065 -2.761 1.00 0.00 N ATOM 1553 CA LYS A 101 3.276 -8.695 -2.228 1.00 0.00 C ATOM 1554 C LYS A 101 2.362 -8.623 -1.009 1.00 0.00 C ATOM 1555 O LYS A 101 2.512 -7.689 -0.229 1.00 0.00 O ATOM 1556 CB LYS A 101 2.864 -7.625 -3.248 1.00 0.00 C ATOM 1557 CG LYS A 101 3.999 -7.127 -4.147 1.00 0.00 C ATOM 1558 CD LYS A 101 3.608 -5.806 -4.831 1.00 0.00 C ATOM 1559 CE LYS A 101 2.532 -6.000 -5.909 1.00 0.00 C ATOM 1560 NZ LYS A 101 1.904 -4.726 -6.317 1.00 0.00 N ATOM 0 H LYS A 101 3.064 -10.180 -3.732 1.00 0.00 H new ATOM 0 HA LYS A 101 4.301 -8.461 -1.941 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.071 -8.029 -3.877 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.444 -6.774 -2.712 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.903 -6.983 -3.555 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.229 -7.879 -4.901 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.243 -5.105 -4.080 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.493 -5.358 -5.282 1.00 0.00 H new ATOM 0 HE2 LYS A 101 2.978 -6.477 -6.781 1.00 0.00 H new ATOM 0 HE3 LYS A 101 1.764 -6.676 -5.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 1.185 -4.911 -7.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 1.454 -4.281 -5.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 2.630 -4.088 -6.701 1.00 0.00 H new ATOM 1574 N THR A 102 1.406 -9.537 -0.832 1.00 0.00 N ATOM 1575 CA THR A 102 0.583 -9.544 0.359 1.00 0.00 C ATOM 1576 C THR A 102 1.457 -9.965 1.559 1.00 0.00 C ATOM 1577 O THR A 102 1.401 -9.323 2.594 1.00 0.00 O ATOM 1578 CB THR A 102 -0.655 -10.428 0.117 1.00 0.00 C ATOM 1579 OG1 THR A 102 -1.687 -10.090 1.010 1.00 0.00 O ATOM 1580 CG2 THR A 102 -0.349 -11.916 0.272 1.00 0.00 C ATOM 0 H THR A 102 1.190 -10.276 -1.501 1.00 0.00 H new ATOM 0 HA THR A 102 0.194 -8.554 0.597 1.00 0.00 H new ATOM 0 HB THR A 102 -0.966 -10.244 -0.911 1.00 0.00 H new ATOM 0 HG1 THR A 102 -2.466 -10.660 0.841 1.00 0.00 H new ATOM 0 HG21 THR A 102 -1.255 -12.495 0.091 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.417 -12.207 -0.447 1.00 0.00 H new ATOM 0 HG23 THR A 102 0.010 -12.110 1.283 1.00 0.00 H new ATOM 1588 N LEU A 103 2.345 -10.959 1.410 1.00 0.00 N ATOM 1589 CA LEU A 103 3.185 -11.532 2.462 1.00 0.00 C ATOM 1590 C LEU A 103 4.048 -10.475 3.117 1.00 0.00 C ATOM 1591 O LEU A 103 3.931 -10.201 4.305 1.00 0.00 O ATOM 1592 CB LEU A 103 4.086 -12.617 1.873 1.00 0.00 C ATOM 1593 CG LEU A 103 3.369 -13.912 1.500 1.00 0.00 C ATOM 1594 CD1 LEU A 103 4.460 -14.894 1.112 1.00 0.00 C ATOM 1595 CD2 LEU A 103 2.540 -14.529 2.629 1.00 0.00 C ATOM 0 H LEU A 103 2.501 -11.404 0.506 1.00 0.00 H new ATOM 0 HA LEU A 103 2.526 -11.960 3.218 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.575 -12.220 0.984 1.00 0.00 H new ATOM 0 HB3 LEU A 103 4.871 -12.847 2.593 1.00 0.00 H new ATOM 0 HG LEU A 103 2.659 -13.691 0.703 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.010 -15.847 0.833 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.023 -14.497 0.267 1.00 0.00 H new ATOM 0 HD13 LEU A 103 5.132 -15.044 1.957 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.067 -15.445 2.274 1.00 0.00 H new ATOM 0 HD22 LEU A 103 3.190 -14.760 3.473 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.772 -13.823 2.945 1.00 0.00 H new ATOM 1607 N VAL A 104 4.936 -9.872 2.341 1.00 0.00 N ATOM 1608 CA VAL A 104 5.761 -8.783 2.843 1.00 0.00 C ATOM 1609 C VAL A 104 4.873 -7.629 3.324 1.00 0.00 C ATOM 1610 O VAL A 104 5.238 -6.986 4.306 1.00 0.00 O ATOM 1611 CB VAL A 104 6.862 -8.448 1.808 1.00 0.00 C ATOM 1612 CG1 VAL A 104 6.389 -8.509 0.342 1.00 0.00 C ATOM 1613 CG2 VAL A 104 7.549 -7.104 2.089 1.00 0.00 C ATOM 0 H VAL A 104 5.104 -10.117 1.365 1.00 0.00 H new ATOM 0 HA VAL A 104 6.316 -9.065 3.737 1.00 0.00 H new ATOM 0 HB VAL A 104 7.596 -9.244 1.936 1.00 0.00 H new ATOM 0 HG11 VAL A 104 7.220 -8.261 -0.319 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.033 -9.514 0.116 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.580 -7.795 0.191 1.00 0.00 H new ATOM 0 HG21 VAL A 104 8.312 -6.920 1.332 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.809 -6.304 2.060 1.00 0.00 H new ATOM 0 HG23 VAL A 104 8.014 -7.132 3.074 1.00 0.00 H new ATOM 1623 N LYS A 105 3.677 -7.416 2.757 1.00 0.00 N ATOM 1624 CA LYS A 105 2.786 -6.374 3.255 1.00 0.00 C ATOM 1625 C LYS A 105 2.173 -6.751 4.602 1.00 0.00 C ATOM 1626 O LYS A 105 1.858 -5.836 5.338 1.00 0.00 O ATOM 1627 CB LYS A 105 1.737 -6.030 2.199 1.00 0.00 C ATOM 1628 CG LYS A 105 0.901 -4.784 2.503 1.00 0.00 C ATOM 1629 CD LYS A 105 -0.167 -4.524 1.428 1.00 0.00 C ATOM 1630 CE LYS A 105 0.368 -4.345 0.001 1.00 0.00 C ATOM 1631 NZ LYS A 105 0.529 -5.619 -0.728 1.00 0.00 N ATOM 0 H LYS A 105 3.314 -7.946 1.965 1.00 0.00 H new ATOM 0 HA LYS A 105 3.370 -5.473 3.439 1.00 0.00 H new ATOM 0 HB2 LYS A 105 2.239 -5.888 1.242 1.00 0.00 H new ATOM 0 HB3 LYS A 105 1.066 -6.881 2.084 1.00 0.00 H new ATOM 0 HG2 LYS A 105 0.417 -4.901 3.473 1.00 0.00 H new ATOM 0 HG3 LYS A 105 1.558 -3.917 2.577 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -0.873 -5.355 1.432 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -0.726 -3.630 1.704 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -0.311 -3.700 -0.556 1.00 0.00 H new ATOM 0 HE3 LYS A 105 1.330 -3.835 0.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 0.291 -5.478 -1.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 1.514 -5.942 -0.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -0.105 -6.335 -0.319 1.00 0.00 H new ATOM 1645 N GLU A 106 2.030 -8.023 4.985 1.00 0.00 N ATOM 1646 CA GLU A 106 1.529 -8.410 6.307 1.00 0.00 C ATOM 1647 C GLU A 106 2.471 -7.885 7.389 1.00 0.00 C ATOM 1648 O GLU A 106 2.035 -7.430 8.450 1.00 0.00 O ATOM 1649 CB GLU A 106 1.418 -9.937 6.403 1.00 0.00 C ATOM 1650 CG GLU A 106 0.287 -10.474 5.528 1.00 0.00 C ATOM 1651 CD GLU A 106 -1.041 -10.355 6.254 1.00 0.00 C ATOM 1652 OE1 GLU A 106 -1.690 -9.288 6.174 1.00 0.00 O ATOM 1653 OE2 GLU A 106 -1.446 -11.335 6.922 1.00 0.00 O ATOM 0 H GLU A 106 2.259 -8.816 4.385 1.00 0.00 H new ATOM 0 HA GLU A 106 0.539 -7.977 6.453 1.00 0.00 H new ATOM 0 HB2 GLU A 106 2.361 -10.391 6.099 1.00 0.00 H new ATOM 0 HB3 GLU A 106 1.245 -10.225 7.440 1.00 0.00 H new ATOM 0 HG2 GLU A 106 0.248 -9.919 4.591 1.00 0.00 H new ATOM 0 HG3 GLU A 106 0.478 -11.516 5.273 1.00 0.00 H new ATOM 1660 N VAL A 107 3.772 -7.940 7.104 1.00 0.00 N ATOM 1661 CA VAL A 107 4.814 -7.412 7.959 1.00 0.00 C ATOM 1662 C VAL A 107 4.756 -5.882 7.859 1.00 0.00 C ATOM 1663 O VAL A 107 4.504 -5.189 8.844 1.00 0.00 O ATOM 1664 CB VAL A 107 6.176 -8.008 7.517 1.00 0.00 C ATOM 1665 CG1 VAL A 107 7.337 -7.416 8.332 1.00 0.00 C ATOM 1666 CG2 VAL A 107 6.196 -9.537 7.681 1.00 0.00 C ATOM 0 H VAL A 107 4.131 -8.365 6.249 1.00 0.00 H new ATOM 0 HA VAL A 107 4.680 -7.688 9.005 1.00 0.00 H new ATOM 0 HB VAL A 107 6.301 -7.751 6.465 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.277 -7.855 7.998 1.00 0.00 H new ATOM 0 HG12 VAL A 107 7.369 -6.336 8.188 1.00 0.00 H new ATOM 0 HG13 VAL A 107 7.189 -7.637 9.389 1.00 0.00 H new ATOM 0 HG21 VAL A 107 7.164 -9.924 7.363 1.00 0.00 H new ATOM 0 HG22 VAL A 107 6.029 -9.793 8.727 1.00 0.00 H new ATOM 0 HG23 VAL A 107 5.409 -9.979 7.069 1.00 0.00 H new ATOM 1676 N VAL A 108 4.948 -5.368 6.648 1.00 0.00 N ATOM 1677 CA VAL A 108 5.042 -3.974 6.247 1.00 0.00 C ATOM 1678 C VAL A 108 3.662 -3.276 6.163 1.00 0.00 C ATOM 1679 O VAL A 108 3.520 -2.319 5.408 1.00 0.00 O ATOM 1680 CB VAL A 108 5.941 -3.931 4.973 1.00 0.00 C ATOM 1681 CG1 VAL A 108 6.274 -2.528 4.450 1.00 0.00 C ATOM 1682 CG2 VAL A 108 7.310 -4.603 5.237 1.00 0.00 C ATOM 0 H VAL A 108 5.052 -5.985 5.842 1.00 0.00 H new ATOM 0 HA VAL A 108 5.526 -3.360 7.007 1.00 0.00 H new ATOM 0 HB VAL A 108 5.337 -4.452 4.230 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.903 -2.610 3.563 1.00 0.00 H new ATOM 0 HG12 VAL A 108 5.352 -2.007 4.194 1.00 0.00 H new ATOM 0 HG13 VAL A 108 6.805 -1.969 5.221 1.00 0.00 H new ATOM 0 HG21 VAL A 108 7.917 -4.559 4.333 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.823 -4.080 6.044 1.00 0.00 H new ATOM 0 HG23 VAL A 108 7.156 -5.644 5.520 1.00 0.00 H new ATOM 1692 N GLN A 109 2.621 -3.702 6.904 1.00 0.00 N ATOM 1693 CA GLN A 109 1.285 -3.081 6.792 1.00 0.00 C ATOM 1694 C GLN A 109 1.360 -1.571 7.078 1.00 0.00 C ATOM 1695 O GLN A 109 0.549 -0.804 6.555 1.00 0.00 O ATOM 1696 CB GLN A 109 0.246 -3.725 7.739 1.00 0.00 C ATOM 1697 CG GLN A 109 -0.331 -5.100 7.342 1.00 0.00 C ATOM 1698 CD GLN A 109 -1.184 -5.130 6.069 1.00 0.00 C ATOM 1699 OE1 GLN A 109 -1.557 -4.094 5.507 1.00 0.00 O ATOM 1700 NE2 GLN A 109 -1.599 -6.305 5.614 1.00 0.00 N ATOM 0 H GLN A 109 2.676 -4.464 7.579 1.00 0.00 H new ATOM 0 HA GLN A 109 0.955 -3.251 5.767 1.00 0.00 H new ATOM 0 HB2 GLN A 109 0.705 -3.825 8.722 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -0.587 -3.030 7.846 1.00 0.00 H new ATOM 0 HG2 GLN A 109 0.498 -5.797 7.216 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -0.936 -5.470 8.170 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -1.296 -7.165 6.072 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -2.221 -6.349 4.807 1.00 0.00 H new ATOM 1709 N ASN A 110 2.351 -1.138 7.865 1.00 0.00 N ATOM 1710 CA ASN A 110 2.627 0.258 8.164 1.00 0.00 C ATOM 1711 C ASN A 110 3.485 0.820 7.029 1.00 0.00 C ATOM 1712 O ASN A 110 4.687 1.032 7.204 1.00 0.00 O ATOM 1713 CB ASN A 110 3.327 0.370 9.528 1.00 0.00 C ATOM 1714 CG ASN A 110 3.416 1.808 10.012 1.00 0.00 C ATOM 1715 OD1 ASN A 110 2.603 2.238 10.831 1.00 0.00 O ATOM 1716 ND2 ASN A 110 4.382 2.577 9.550 1.00 0.00 N ATOM 0 H ASN A 110 3.001 -1.777 8.323 1.00 0.00 H new ATOM 0 HA ASN A 110 1.706 0.837 8.231 1.00 0.00 H new ATOM 0 HB2 ASN A 110 2.785 -0.226 10.262 1.00 0.00 H new ATOM 0 HB3 ASN A 110 4.330 -0.050 9.455 1.00 0.00 H new ATOM 0 HD21 ASN A 110 4.463 3.542 9.871 1.00 0.00 H new ATOM 0 HD22 ASN A 110 5.048 2.207 8.872 1.00 0.00 H new ATOM 1723 N PHE A 111 2.888 1.032 5.856 1.00 0.00 N ATOM 1724 CA PHE A 111 3.574 1.626 4.717 1.00 0.00 C ATOM 1725 C PHE A 111 2.630 2.500 3.913 1.00 0.00 C ATOM 1726 O PHE A 111 1.432 2.552 4.203 1.00 0.00 O ATOM 1727 CB PHE A 111 4.206 0.564 3.810 1.00 0.00 C ATOM 1728 CG PHE A 111 3.299 -0.135 2.803 1.00 0.00 C ATOM 1729 CD1 PHE A 111 2.052 -0.671 3.176 1.00 0.00 C ATOM 1730 CD2 PHE A 111 3.698 -0.203 1.452 1.00 0.00 C ATOM 1731 CE1 PHE A 111 1.195 -1.217 2.207 1.00 0.00 C ATOM 1732 CE2 PHE A 111 2.855 -0.782 0.489 1.00 0.00 C ATOM 1733 CZ PHE A 111 1.589 -1.259 0.859 1.00 0.00 C ATOM 0 H PHE A 111 1.913 0.795 5.672 1.00 0.00 H new ATOM 0 HA PHE A 111 4.377 2.245 5.117 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.020 1.034 3.259 1.00 0.00 H new ATOM 0 HB3 PHE A 111 4.652 -0.200 4.447 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.753 -0.662 4.214 1.00 0.00 H new ATOM 0 HD2 PHE A 111 4.658 0.193 1.156 1.00 0.00 H new ATOM 0 HE1 PHE A 111 0.230 -1.606 2.499 1.00 0.00 H new ATOM 0 HE2 PHE A 111 3.182 -0.860 -0.537 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.920 -1.657 0.111 1.00 0.00 H new ATOM 1743 N ALA A 112 3.171 3.187 2.907 1.00 0.00 N ATOM 1744 CA ALA A 112 2.399 4.063 2.053 1.00 0.00 C ATOM 1745 C ALA A 112 1.973 3.315 0.792 1.00 0.00 C ATOM 1746 O ALA A 112 0.784 3.061 0.636 1.00 0.00 O ATOM 1747 CB ALA A 112 3.221 5.318 1.778 1.00 0.00 C ATOM 0 H ALA A 112 4.162 3.145 2.668 1.00 0.00 H new ATOM 0 HA ALA A 112 1.475 4.380 2.537 1.00 0.00 H new ATOM 0 HB1 ALA A 112 2.654 5.991 1.135 1.00 0.00 H new ATOM 0 HB2 ALA A 112 3.445 5.819 2.719 1.00 0.00 H new ATOM 0 HB3 ALA A 112 4.152 5.042 1.283 1.00 0.00 H new ATOM 1753 N LYS A 113 2.911 2.925 -0.076 1.00 0.00 N ATOM 1754 CA LYS A 113 2.699 2.166 -1.315 1.00 0.00 C ATOM 1755 C LYS A 113 4.018 1.528 -1.729 1.00 0.00 C ATOM 1756 O LYS A 113 5.039 1.702 -1.061 1.00 0.00 O ATOM 1757 CB LYS A 113 2.178 3.057 -2.459 1.00 0.00 C ATOM 1758 CG LYS A 113 0.667 3.329 -2.422 1.00 0.00 C ATOM 1759 CD LYS A 113 0.282 4.772 -2.084 1.00 0.00 C ATOM 1760 CE LYS A 113 0.319 5.644 -3.341 1.00 0.00 C ATOM 1761 NZ LYS A 113 1.683 5.878 -3.856 1.00 0.00 N ATOM 0 H LYS A 113 3.896 3.142 0.075 1.00 0.00 H new ATOM 0 HA LYS A 113 1.942 1.405 -1.123 1.00 0.00 H new ATOM 0 HB2 LYS A 113 2.706 4.010 -2.428 1.00 0.00 H new ATOM 0 HB3 LYS A 113 2.426 2.586 -3.410 1.00 0.00 H new ATOM 0 HG2 LYS A 113 0.242 3.072 -3.392 1.00 0.00 H new ATOM 0 HG3 LYS A 113 0.210 2.665 -1.688 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -0.716 4.796 -1.647 1.00 0.00 H new ATOM 0 HD3 LYS A 113 0.967 5.172 -1.336 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -0.278 5.170 -4.120 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -0.147 6.604 -3.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 1.667 6.664 -4.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 2.316 6.117 -3.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 2.028 5.018 -4.328 1.00 0.00 H new ATOM 1775 N GLU A 114 3.980 0.742 -2.797 1.00 0.00 N ATOM 1776 CA GLU A 114 5.156 0.123 -3.380 1.00 0.00 C ATOM 1777 C GLU A 114 5.567 0.787 -4.693 1.00 0.00 C ATOM 1778 O GLU A 114 4.865 1.670 -5.196 1.00 0.00 O ATOM 1779 CB GLU A 114 4.952 -1.390 -3.495 1.00 0.00 C ATOM 1780 CG GLU A 114 3.735 -1.842 -4.307 1.00 0.00 C ATOM 1781 CD GLU A 114 2.499 -1.983 -3.430 1.00 0.00 C ATOM 1782 OE1 GLU A 114 2.427 -2.973 -2.664 1.00 0.00 O ATOM 1783 OE2 GLU A 114 1.574 -1.155 -3.561 1.00 0.00 O ATOM 0 H GLU A 114 3.115 0.515 -3.288 1.00 0.00 H new ATOM 0 HA GLU A 114 6.002 0.282 -2.712 1.00 0.00 H new ATOM 0 HB2 GLU A 114 5.845 -1.824 -3.944 1.00 0.00 H new ATOM 0 HB3 GLU A 114 4.867 -1.803 -2.490 1.00 0.00 H new ATOM 0 HG2 GLU A 114 3.538 -1.122 -5.101 1.00 0.00 H new ATOM 0 HG3 GLU A 114 3.951 -2.796 -4.788 1.00 0.00 H new ATOM 1790 N PHE A 115 6.717 0.369 -5.230 1.00 0.00 N ATOM 1791 CA PHE A 115 7.276 0.882 -6.474 1.00 0.00 C ATOM 1792 C PHE A 115 7.909 -0.371 -7.117 1.00 0.00 C ATOM 1793 O PHE A 115 8.277 -1.317 -6.404 1.00 0.00 O ATOM 1794 CB PHE A 115 8.357 1.929 -6.110 1.00 0.00 C ATOM 1795 CG PHE A 115 8.727 2.981 -7.145 1.00 0.00 C ATOM 1796 CD1 PHE A 115 9.092 2.712 -8.479 1.00 0.00 C ATOM 1797 CD2 PHE A 115 8.592 4.324 -6.735 1.00 0.00 C ATOM 1798 CE1 PHE A 115 9.316 3.770 -9.378 1.00 0.00 C ATOM 1799 CE2 PHE A 115 8.813 5.379 -7.628 1.00 0.00 C ATOM 1800 CZ PHE A 115 9.186 5.102 -8.947 1.00 0.00 C ATOM 0 H PHE A 115 7.295 -0.352 -4.798 1.00 0.00 H new ATOM 0 HA PHE A 115 6.559 1.364 -7.139 1.00 0.00 H new ATOM 0 HB2 PHE A 115 8.025 2.450 -5.212 1.00 0.00 H new ATOM 0 HB3 PHE A 115 9.266 1.389 -5.847 1.00 0.00 H new ATOM 0 HD1 PHE A 115 9.200 1.690 -8.812 1.00 0.00 H new ATOM 0 HD2 PHE A 115 8.313 4.542 -5.715 1.00 0.00 H new ATOM 0 HE1 PHE A 115 9.588 3.559 -10.402 1.00 0.00 H new ATOM 0 HE2 PHE A 115 8.696 6.401 -7.300 1.00 0.00 H new ATOM 0 HZ PHE A 115 9.374 5.912 -9.636 1.00 0.00 H new ATOM 1810 N VAL A 116 8.068 -0.416 -8.439 1.00 0.00 N ATOM 1811 CA VAL A 116 8.734 -1.520 -9.138 1.00 0.00 C ATOM 1812 C VAL A 116 9.742 -0.912 -10.111 1.00 0.00 C ATOM 1813 O VAL A 116 9.367 -0.006 -10.855 1.00 0.00 O ATOM 1814 CB VAL A 116 7.705 -2.431 -9.841 1.00 0.00 C ATOM 1815 CG1 VAL A 116 8.362 -3.724 -10.349 1.00 0.00 C ATOM 1816 CG2 VAL A 116 6.560 -2.820 -8.896 1.00 0.00 C ATOM 0 H VAL A 116 7.736 0.319 -9.063 1.00 0.00 H new ATOM 0 HA VAL A 116 9.262 -2.162 -8.433 1.00 0.00 H new ATOM 0 HB VAL A 116 7.310 -1.859 -10.681 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.612 -4.345 -10.839 1.00 0.00 H new ATOM 0 HG12 VAL A 116 9.150 -3.477 -11.060 1.00 0.00 H new ATOM 0 HG13 VAL A 116 8.791 -4.269 -9.508 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.854 -3.461 -9.424 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.964 -3.355 -8.036 1.00 0.00 H new ATOM 0 HG23 VAL A 116 6.048 -1.920 -8.555 1.00 0.00 H new ATOM 1826 N ILE A 117 10.994 -1.374 -10.087 1.00 0.00 N ATOM 1827 CA ILE A 117 12.097 -0.884 -10.915 1.00 0.00 C ATOM 1828 C ILE A 117 12.830 -2.104 -11.492 1.00 0.00 C ATOM 1829 O ILE A 117 12.929 -3.148 -10.836 1.00 0.00 O ATOM 1830 CB ILE A 117 13.005 0.043 -10.087 1.00 0.00 C ATOM 1831 CG1 ILE A 117 12.252 1.329 -9.665 1.00 0.00 C ATOM 1832 CG2 ILE A 117 14.231 0.469 -10.909 1.00 0.00 C ATOM 1833 CD1 ILE A 117 11.979 1.404 -8.158 1.00 0.00 C ATOM 0 H ILE A 117 11.278 -2.131 -9.465 1.00 0.00 H new ATOM 0 HA ILE A 117 11.738 -0.281 -11.749 1.00 0.00 H new ATOM 0 HB ILE A 117 13.312 -0.515 -9.203 1.00 0.00 H new ATOM 0 HG12 ILE A 117 12.836 2.199 -9.965 1.00 0.00 H new ATOM 0 HG13 ILE A 117 11.305 1.380 -10.202 1.00 0.00 H new ATOM 0 HG21 ILE A 117 14.862 1.124 -10.308 1.00 0.00 H new ATOM 0 HG22 ILE A 117 14.799 -0.415 -11.200 1.00 0.00 H new ATOM 0 HG23 ILE A 117 13.903 1.000 -11.802 1.00 0.00 H new ATOM 0 HD11 ILE A 117 11.449 2.329 -7.930 1.00 0.00 H new ATOM 0 HD12 ILE A 117 11.369 0.552 -7.856 1.00 0.00 H new ATOM 0 HD13 ILE A 117 12.924 1.384 -7.616 1.00 0.00 H new ATOM 1845 N SER A 118 13.375 -1.940 -12.698 1.00 0.00 N ATOM 1846 CA SER A 118 14.052 -2.961 -13.489 1.00 0.00 C ATOM 1847 C SER A 118 15.408 -2.524 -14.035 1.00 0.00 C ATOM 1848 O SER A 118 16.132 -3.347 -14.599 1.00 0.00 O ATOM 1849 CB SER A 118 13.149 -3.281 -14.675 1.00 0.00 C ATOM 1850 OG SER A 118 12.653 -2.083 -15.257 1.00 0.00 O ATOM 0 H SER A 118 13.353 -1.038 -13.174 1.00 0.00 H new ATOM 0 HA SER A 118 14.236 -3.815 -12.837 1.00 0.00 H new ATOM 0 HB2 SER A 118 13.704 -3.852 -15.419 1.00 0.00 H new ATOM 0 HB3 SER A 118 12.318 -3.906 -14.349 1.00 0.00 H new ATOM 0 HG SER A 118 12.076 -2.303 -16.018 1.00 0.00 H new ATOM 1856 N ASP A 119 15.762 -1.245 -13.899 1.00 0.00 N ATOM 1857 CA ASP A 119 17.000 -0.699 -14.453 1.00 0.00 C ATOM 1858 C ASP A 119 17.789 -0.055 -13.327 1.00 0.00 C ATOM 1859 O ASP A 119 17.266 0.802 -12.614 1.00 0.00 O ATOM 1860 CB ASP A 119 16.689 0.290 -15.584 1.00 0.00 C ATOM 1861 CG ASP A 119 17.924 0.978 -16.183 1.00 0.00 C ATOM 1862 OD1 ASP A 119 19.083 0.600 -15.885 1.00 0.00 O ATOM 1863 OD2 ASP A 119 17.744 1.830 -17.079 1.00 0.00 O ATOM 0 H ASP A 119 15.196 -0.558 -13.400 1.00 0.00 H new ATOM 0 HA ASP A 119 17.605 -1.493 -14.891 1.00 0.00 H new ATOM 0 HB2 ASP A 119 16.162 -0.239 -16.378 1.00 0.00 H new ATOM 0 HB3 ASP A 119 16.010 1.054 -15.205 1.00 0.00 H new ATOM 1868 N ARG A 120 19.039 -0.482 -13.138 1.00 0.00 N ATOM 1869 CA ARG A 120 19.886 0.026 -12.067 1.00 0.00 C ATOM 1870 C ARG A 120 20.102 1.538 -12.197 1.00 0.00 C ATOM 1871 O ARG A 120 20.246 2.191 -11.175 1.00 0.00 O ATOM 1872 CB ARG A 120 21.191 -0.788 -12.036 1.00 0.00 C ATOM 1873 CG ARG A 120 21.963 -0.631 -10.721 1.00 0.00 C ATOM 1874 CD ARG A 120 23.016 -1.741 -10.568 1.00 0.00 C ATOM 1875 NE ARG A 120 24.283 -1.439 -11.246 1.00 0.00 N ATOM 1876 CZ ARG A 120 25.346 -0.828 -10.710 1.00 0.00 C ATOM 1877 NH1 ARG A 120 25.286 -0.258 -9.511 1.00 0.00 N ATOM 1878 NH2 ARG A 120 26.483 -0.806 -11.396 1.00 0.00 N ATOM 0 H ARG A 120 19.488 -1.187 -13.723 1.00 0.00 H new ATOM 0 HA ARG A 120 19.394 -0.105 -11.103 1.00 0.00 H new ATOM 0 HB2 ARG A 120 20.959 -1.842 -12.191 1.00 0.00 H new ATOM 0 HB3 ARG A 120 21.827 -0.476 -12.864 1.00 0.00 H new ATOM 0 HG2 ARG A 120 22.450 0.344 -10.694 1.00 0.00 H new ATOM 0 HG3 ARG A 120 21.269 -0.664 -9.881 1.00 0.00 H new ATOM 0 HD2 ARG A 120 23.210 -1.905 -9.508 1.00 0.00 H new ATOM 0 HD3 ARG A 120 22.612 -2.672 -10.966 1.00 0.00 H new ATOM 0 HE ARG A 120 24.361 -1.723 -12.223 1.00 0.00 H new ATOM 0 HH11 ARG A 120 24.416 -0.280 -8.979 1.00 0.00 H new ATOM 0 HH12 ARG A 120 26.110 0.202 -9.123 1.00 0.00 H new ATOM 0 HH21 ARG A 120 26.534 -1.249 -12.313 1.00 0.00 H new ATOM 0 HH22 ARG A 120 27.305 -0.346 -11.006 1.00 0.00 H new ATOM 1892 N LYS A 121 20.105 2.109 -13.409 1.00 0.00 N ATOM 1893 CA LYS A 121 20.214 3.548 -13.596 1.00 0.00 C ATOM 1894 C LYS A 121 18.914 4.267 -13.250 1.00 0.00 C ATOM 1895 O LYS A 121 18.933 5.462 -12.985 1.00 0.00 O ATOM 1896 CB LYS A 121 20.544 3.908 -15.048 1.00 0.00 C ATOM 1897 CG LYS A 121 21.856 3.332 -15.599 1.00 0.00 C ATOM 1898 CD LYS A 121 22.117 4.017 -16.946 1.00 0.00 C ATOM 1899 CE LYS A 121 23.199 3.315 -17.770 1.00 0.00 C ATOM 1900 NZ LYS A 121 23.256 3.858 -19.145 1.00 0.00 N ATOM 0 H LYS A 121 20.032 1.582 -14.279 1.00 0.00 H new ATOM 0 HA LYS A 121 21.015 3.866 -12.929 1.00 0.00 H new ATOM 0 HB2 LYS A 121 19.725 3.567 -15.682 1.00 0.00 H new ATOM 0 HB3 LYS A 121 20.582 4.994 -15.133 1.00 0.00 H new ATOM 0 HG2 LYS A 121 22.678 3.516 -14.907 1.00 0.00 H new ATOM 0 HG3 LYS A 121 21.780 2.252 -15.724 1.00 0.00 H new ATOM 0 HD2 LYS A 121 21.191 4.044 -17.520 1.00 0.00 H new ATOM 0 HD3 LYS A 121 22.414 5.051 -16.771 1.00 0.00 H new ATOM 0 HE2 LYS A 121 24.168 3.440 -17.286 1.00 0.00 H new ATOM 0 HE3 LYS A 121 22.996 2.245 -17.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 23.997 3.365 -19.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 22.338 3.717 -19.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 23.473 4.874 -19.108 1.00 0.00 H new ATOM 1914 N GLU A 122 17.777 3.582 -13.358 1.00 0.00 N ATOM 1915 CA GLU A 122 16.475 4.181 -13.113 1.00 0.00 C ATOM 1916 C GLU A 122 16.261 4.300 -11.606 1.00 0.00 C ATOM 1917 O GLU A 122 15.779 5.322 -11.152 1.00 0.00 O ATOM 1918 CB GLU A 122 15.402 3.323 -13.793 1.00 0.00 C ATOM 1919 CG GLU A 122 13.974 3.876 -13.715 1.00 0.00 C ATOM 1920 CD GLU A 122 13.443 4.283 -15.089 1.00 0.00 C ATOM 1921 OE1 GLU A 122 13.822 5.380 -15.562 1.00 0.00 O ATOM 1922 OE2 GLU A 122 12.590 3.564 -15.662 1.00 0.00 O ATOM 0 H GLU A 122 17.737 2.597 -13.618 1.00 0.00 H new ATOM 0 HA GLU A 122 16.413 5.184 -13.534 1.00 0.00 H new ATOM 0 HB2 GLU A 122 15.670 3.200 -14.842 1.00 0.00 H new ATOM 0 HB3 GLU A 122 15.415 2.330 -13.343 1.00 0.00 H new ATOM 0 HG2 GLU A 122 13.317 3.123 -13.281 1.00 0.00 H new ATOM 0 HG3 GLU A 122 13.955 4.738 -13.049 1.00 0.00 H new ATOM 1929 N LEU A 123 16.669 3.271 -10.859 1.00 0.00 N ATOM 1930 CA LEU A 123 16.539 3.038 -9.417 1.00 0.00 C ATOM 1931 C LEU A 123 16.872 4.223 -8.506 1.00 0.00 C ATOM 1932 O LEU A 123 16.448 4.224 -7.353 1.00 0.00 O ATOM 1933 CB LEU A 123 17.382 1.780 -9.124 1.00 0.00 C ATOM 1934 CG LEU A 123 17.308 1.090 -7.758 1.00 0.00 C ATOM 1935 CD1 LEU A 123 18.311 1.686 -6.778 1.00 0.00 C ATOM 1936 CD2 LEU A 123 15.880 0.939 -7.214 1.00 0.00 C ATOM 0 H LEU A 123 17.155 2.491 -11.301 1.00 0.00 H new ATOM 0 HA LEU A 123 15.487 2.893 -9.172 1.00 0.00 H new ATOM 0 HB2 LEU A 123 17.118 1.035 -9.874 1.00 0.00 H new ATOM 0 HB3 LEU A 123 18.425 2.047 -9.293 1.00 0.00 H new ATOM 0 HG LEU A 123 17.619 0.056 -7.905 1.00 0.00 H new ATOM 0 HD11 LEU A 123 18.232 1.173 -5.819 1.00 0.00 H new ATOM 0 HD12 LEU A 123 19.320 1.565 -7.172 1.00 0.00 H new ATOM 0 HD13 LEU A 123 18.100 2.747 -6.641 1.00 0.00 H new ATOM 0 HD21 LEU A 123 15.911 0.442 -6.244 1.00 0.00 H new ATOM 0 HD22 LEU A 123 15.427 1.924 -7.103 1.00 0.00 H new ATOM 0 HD23 LEU A 123 15.287 0.344 -7.908 1.00 0.00 H new ATOM 1948 N GLU A 124 17.670 5.170 -8.976 1.00 0.00 N ATOM 1949 CA GLU A 124 18.066 6.372 -8.260 1.00 0.00 C ATOM 1950 C GLU A 124 16.859 7.082 -7.626 1.00 0.00 C ATOM 1951 O GLU A 124 15.864 7.374 -8.298 1.00 0.00 O ATOM 1952 CB GLU A 124 18.804 7.294 -9.250 1.00 0.00 C ATOM 1953 CG GLU A 124 20.168 6.709 -9.688 1.00 0.00 C ATOM 1954 CD GLU A 124 21.209 6.622 -8.558 1.00 0.00 C ATOM 1955 OE1 GLU A 124 20.921 7.100 -7.435 1.00 0.00 O ATOM 1956 OE2 GLU A 124 22.285 6.040 -8.821 1.00 0.00 O ATOM 0 H GLU A 124 18.077 5.118 -9.910 1.00 0.00 H new ATOM 0 HA GLU A 124 18.727 6.105 -7.435 1.00 0.00 H new ATOM 0 HB2 GLU A 124 18.180 7.454 -10.129 1.00 0.00 H new ATOM 0 HB3 GLU A 124 18.960 8.269 -8.788 1.00 0.00 H new ATOM 0 HG2 GLU A 124 20.008 5.711 -10.097 1.00 0.00 H new ATOM 0 HG3 GLU A 124 20.572 7.323 -10.493 1.00 0.00 H new ATOM 1963 N GLU A 125 16.969 7.421 -6.333 1.00 0.00 N ATOM 1964 CA GLU A 125 15.952 8.174 -5.592 1.00 0.00 C ATOM 1965 C GLU A 125 15.600 9.515 -6.228 1.00 0.00 C ATOM 1966 O GLU A 125 14.575 10.108 -5.876 1.00 0.00 O ATOM 1967 CB GLU A 125 16.377 8.427 -4.132 1.00 0.00 C ATOM 1968 CG GLU A 125 16.123 7.240 -3.200 1.00 0.00 C ATOM 1969 CD GLU A 125 14.638 7.064 -2.843 1.00 0.00 C ATOM 1970 OE1 GLU A 125 13.971 8.055 -2.475 1.00 0.00 O ATOM 1971 OE2 GLU A 125 14.129 5.921 -2.904 1.00 0.00 O ATOM 0 H GLU A 125 17.780 7.175 -5.766 1.00 0.00 H new ATOM 0 HA GLU A 125 15.067 7.539 -5.622 1.00 0.00 H new ATOM 0 HB2 GLU A 125 17.439 8.674 -4.110 1.00 0.00 H new ATOM 0 HB3 GLU A 125 15.840 9.296 -3.753 1.00 0.00 H new ATOM 0 HG2 GLU A 125 16.488 6.329 -3.674 1.00 0.00 H new ATOM 0 HG3 GLU A 125 16.698 7.375 -2.284 1.00 0.00 H new ATOM 1978 N ASP A 126 16.428 10.030 -7.143 1.00 0.00 N ATOM 1979 CA ASP A 126 16.167 11.340 -7.692 1.00 0.00 C ATOM 1980 C ASP A 126 14.808 11.443 -8.359 1.00 0.00 C ATOM 1981 O ASP A 126 14.004 12.270 -7.900 1.00 0.00 O ATOM 1982 CB ASP A 126 17.274 11.938 -8.557 1.00 0.00 C ATOM 1983 CG ASP A 126 16.919 13.419 -8.750 1.00 0.00 C ATOM 1984 OD1 ASP A 126 16.867 14.134 -7.715 1.00 0.00 O ATOM 1985 OD2 ASP A 126 16.577 13.803 -9.884 1.00 0.00 O ATOM 0 H ASP A 126 17.261 9.565 -7.504 1.00 0.00 H new ATOM 0 HA ASP A 126 16.153 11.974 -6.805 1.00 0.00 H new ATOM 0 HB2 ASP A 126 18.245 11.831 -8.074 1.00 0.00 H new ATOM 0 HB3 ASP A 126 17.337 11.425 -9.517 1.00 0.00 H new ATOM 1990 N PHE A 127 14.505 10.586 -9.349 1.00 0.00 N ATOM 1991 CA PHE A 127 13.223 10.793 -10.020 1.00 0.00 C ATOM 1992 C PHE A 127 12.124 10.251 -9.098 1.00 0.00 C ATOM 1993 O PHE A 127 10.996 10.727 -9.178 1.00 0.00 O ATOM 1994 CB PHE A 127 13.038 10.088 -11.374 1.00 0.00 C ATOM 1995 CG PHE A 127 12.623 8.627 -11.332 1.00 0.00 C ATOM 1996 CD1 PHE A 127 13.469 7.585 -10.915 1.00 0.00 C ATOM 1997 CD2 PHE A 127 11.274 8.343 -11.639 1.00 0.00 C ATOM 1998 CE1 PHE A 127 12.956 6.275 -10.835 1.00 0.00 C ATOM 1999 CE2 PHE A 127 10.780 7.033 -11.582 1.00 0.00 C ATOM 2000 CZ PHE A 127 11.631 5.990 -11.192 1.00 0.00 C ATOM 0 H PHE A 127 15.078 9.809 -9.678 1.00 0.00 H new ATOM 0 HA PHE A 127 13.178 11.863 -10.222 1.00 0.00 H new ATOM 0 HB2 PHE A 127 12.289 10.638 -11.944 1.00 0.00 H new ATOM 0 HB3 PHE A 127 13.975 10.160 -11.926 1.00 0.00 H new ATOM 0 HD1 PHE A 127 14.499 7.786 -10.659 1.00 0.00 H new ATOM 0 HD2 PHE A 127 10.613 9.148 -11.922 1.00 0.00 H new ATOM 0 HE1 PHE A 127 13.596 5.475 -10.492 1.00 0.00 H new ATOM 0 HE2 PHE A 127 9.751 6.828 -11.837 1.00 0.00 H new ATOM 0 HZ PHE A 127 11.268 4.973 -11.167 1.00 0.00 H new ATOM 2010 N ILE A 128 12.440 9.278 -8.228 1.00 0.00 N ATOM 2011 CA ILE A 128 11.495 8.633 -7.316 1.00 0.00 C ATOM 2012 C ILE A 128 10.828 9.713 -6.475 1.00 0.00 C ATOM 2013 O ILE A 128 9.617 9.661 -6.291 1.00 0.00 O ATOM 2014 CB ILE A 128 12.183 7.532 -6.478 1.00 0.00 C ATOM 2015 CG1 ILE A 128 12.455 6.316 -7.389 1.00 0.00 C ATOM 2016 CG2 ILE A 128 11.375 7.111 -5.239 1.00 0.00 C ATOM 2017 CD1 ILE A 128 13.220 5.174 -6.720 1.00 0.00 C ATOM 0 H ILE A 128 13.388 8.912 -8.141 1.00 0.00 H new ATOM 0 HA ILE A 128 10.718 8.113 -7.876 1.00 0.00 H new ATOM 0 HB ILE A 128 13.117 7.942 -6.094 1.00 0.00 H new ATOM 0 HG12 ILE A 128 11.502 5.932 -7.753 1.00 0.00 H new ATOM 0 HG13 ILE A 128 13.018 6.651 -8.260 1.00 0.00 H new ATOM 0 HG21 ILE A 128 11.917 6.335 -4.698 1.00 0.00 H new ATOM 0 HG22 ILE A 128 11.230 7.974 -4.589 1.00 0.00 H new ATOM 0 HG23 ILE A 128 10.405 6.725 -5.551 1.00 0.00 H new ATOM 0 HD11 ILE A 128 13.365 4.365 -7.436 1.00 0.00 H new ATOM 0 HD12 ILE A 128 14.191 5.536 -6.381 1.00 0.00 H new ATOM 0 HD13 ILE A 128 12.651 4.806 -5.866 1.00 0.00 H new ATOM 2029 N LYS A 129 11.572 10.724 -6.012 1.00 0.00 N ATOM 2030 CA LYS A 129 10.980 11.840 -5.279 1.00 0.00 C ATOM 2031 C LYS A 129 9.852 12.474 -6.092 1.00 0.00 C ATOM 2032 O LYS A 129 8.758 12.684 -5.566 1.00 0.00 O ATOM 2033 CB LYS A 129 12.037 12.920 -5.007 1.00 0.00 C ATOM 2034 CG LYS A 129 13.040 12.604 -3.892 1.00 0.00 C ATOM 2035 CD LYS A 129 13.902 13.830 -3.538 1.00 0.00 C ATOM 2036 CE LYS A 129 14.461 14.633 -4.730 1.00 0.00 C ATOM 2037 NZ LYS A 129 15.169 13.789 -5.712 1.00 0.00 N ATOM 0 H LYS A 129 12.583 10.789 -6.133 1.00 0.00 H new ATOM 0 HA LYS A 129 10.590 11.451 -4.338 1.00 0.00 H new ATOM 0 HB2 LYS A 129 12.591 13.100 -5.928 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.524 13.849 -4.757 1.00 0.00 H new ATOM 0 HG2 LYS A 129 12.504 12.268 -3.005 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.685 11.783 -4.205 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.306 14.502 -2.921 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.740 13.495 -2.927 1.00 0.00 H new ATOM 0 HE2 LYS A 129 13.642 15.151 -5.228 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.143 15.398 -4.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 15.811 14.380 -6.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.719 13.062 -5.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 14.477 13.330 -6.338 1.00 0.00 H new ATOM 2051 N SER A 130 10.136 12.830 -7.344 1.00 0.00 N ATOM 2052 CA SER A 130 9.168 13.444 -8.231 1.00 0.00 C ATOM 2053 C SER A 130 8.034 12.466 -8.499 1.00 0.00 C ATOM 2054 O SER A 130 6.892 12.879 -8.414 1.00 0.00 O ATOM 2055 CB SER A 130 9.853 13.911 -9.515 1.00 0.00 C ATOM 2056 OG SER A 130 8.959 14.507 -10.436 1.00 0.00 O ATOM 0 H SER A 130 11.054 12.696 -7.768 1.00 0.00 H new ATOM 0 HA SER A 130 8.737 14.328 -7.761 1.00 0.00 H new ATOM 0 HB2 SER A 130 10.636 14.626 -9.263 1.00 0.00 H new ATOM 0 HB3 SER A 130 10.340 13.060 -9.990 1.00 0.00 H new ATOM 0 HG SER A 130 9.452 14.787 -11.236 1.00 0.00 H new ATOM 2062 N GLU A 131 8.288 11.187 -8.769 1.00 0.00 N ATOM 2063 CA GLU A 131 7.247 10.209 -9.067 1.00 0.00 C ATOM 2064 C GLU A 131 6.326 10.011 -7.855 1.00 0.00 C ATOM 2065 O GLU A 131 5.102 9.980 -8.005 1.00 0.00 O ATOM 2066 CB GLU A 131 7.911 8.923 -9.589 1.00 0.00 C ATOM 2067 CG GLU A 131 6.955 7.785 -9.979 1.00 0.00 C ATOM 2068 CD GLU A 131 5.878 8.115 -11.022 1.00 0.00 C ATOM 2069 OE1 GLU A 131 5.855 9.208 -11.634 1.00 0.00 O ATOM 2070 OE2 GLU A 131 5.035 7.223 -11.282 1.00 0.00 O ATOM 0 H GLU A 131 9.231 10.798 -8.787 1.00 0.00 H new ATOM 0 HA GLU A 131 6.588 10.565 -9.859 1.00 0.00 H new ATOM 0 HB2 GLU A 131 8.516 9.177 -10.459 1.00 0.00 H new ATOM 0 HB3 GLU A 131 8.593 8.553 -8.823 1.00 0.00 H new ATOM 0 HG2 GLU A 131 7.551 6.954 -10.357 1.00 0.00 H new ATOM 0 HG3 GLU A 131 6.457 7.434 -9.075 1.00 0.00 H new ATOM 2077 N LEU A 132 6.882 9.966 -6.640 1.00 0.00 N ATOM 2078 CA LEU A 132 6.116 9.874 -5.400 1.00 0.00 C ATOM 2079 C LEU A 132 5.292 11.155 -5.215 1.00 0.00 C ATOM 2080 O LEU A 132 4.213 11.091 -4.625 1.00 0.00 O ATOM 2081 CB LEU A 132 7.039 9.556 -4.205 1.00 0.00 C ATOM 2082 CG LEU A 132 7.581 8.105 -4.210 1.00 0.00 C ATOM 2083 CD1 LEU A 132 8.552 7.901 -3.041 1.00 0.00 C ATOM 2084 CD2 LEU A 132 6.473 7.045 -4.102 1.00 0.00 C ATOM 0 H LEU A 132 7.891 9.993 -6.492 1.00 0.00 H new ATOM 0 HA LEU A 132 5.413 9.043 -5.455 1.00 0.00 H new ATOM 0 HB2 LEU A 132 7.880 10.249 -4.212 1.00 0.00 H new ATOM 0 HB3 LEU A 132 6.492 9.728 -3.278 1.00 0.00 H new ATOM 0 HG LEU A 132 8.083 7.974 -5.169 1.00 0.00 H new ATOM 0 HD11 LEU A 132 8.927 6.878 -3.054 1.00 0.00 H new ATOM 0 HD12 LEU A 132 9.387 8.595 -3.136 1.00 0.00 H new ATOM 0 HD13 LEU A 132 8.033 8.085 -2.100 1.00 0.00 H new ATOM 0 HD21 LEU A 132 6.919 6.050 -4.111 1.00 0.00 H new ATOM 0 HD22 LEU A 132 5.923 7.188 -3.172 1.00 0.00 H new ATOM 0 HD23 LEU A 132 5.791 7.144 -4.946 1.00 0.00 H new ATOM 2096 N LYS A 133 5.786 12.314 -5.666 1.00 0.00 N ATOM 2097 CA LYS A 133 5.081 13.599 -5.656 1.00 0.00 C ATOM 2098 C LYS A 133 4.030 13.686 -6.761 1.00 0.00 C ATOM 2099 O LYS A 133 2.937 14.175 -6.495 1.00 0.00 O ATOM 2100 CB LYS A 133 6.071 14.783 -5.654 1.00 0.00 C ATOM 2101 CG LYS A 133 6.597 15.114 -4.239 1.00 0.00 C ATOM 2102 CD LYS A 133 5.558 16.020 -3.541 1.00 0.00 C ATOM 2103 CE LYS A 133 5.947 16.500 -2.137 1.00 0.00 C ATOM 2104 NZ LYS A 133 4.946 17.457 -1.601 1.00 0.00 N ATOM 0 H LYS A 133 6.723 12.384 -6.063 1.00 0.00 H new ATOM 0 HA LYS A 133 4.524 13.666 -4.721 1.00 0.00 H new ATOM 0 HB2 LYS A 133 6.913 14.549 -6.305 1.00 0.00 H new ATOM 0 HB3 LYS A 133 5.581 15.663 -6.071 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.750 14.199 -3.666 1.00 0.00 H new ATOM 0 HG3 LYS A 133 7.562 15.618 -4.300 1.00 0.00 H new ATOM 0 HD2 LYS A 133 5.380 16.893 -4.169 1.00 0.00 H new ATOM 0 HD3 LYS A 133 4.615 15.478 -3.474 1.00 0.00 H new ATOM 0 HE2 LYS A 133 6.031 15.644 -1.467 1.00 0.00 H new ATOM 0 HE3 LYS A 133 6.927 16.976 -2.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 5.358 17.979 -0.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 4.672 18.127 -2.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 4.106 16.936 -1.278 1.00 0.00 H new ATOM 2118 N LYS A 134 4.288 13.162 -7.958 1.00 0.00 N ATOM 2119 CA LYS A 134 3.360 13.089 -9.079 1.00 0.00 C ATOM 2120 C LYS A 134 2.170 12.276 -8.610 1.00 0.00 C ATOM 2121 O LYS A 134 1.056 12.794 -8.581 1.00 0.00 O ATOM 2122 CB LYS A 134 4.038 12.439 -10.299 1.00 0.00 C ATOM 2123 CG LYS A 134 4.967 13.404 -11.051 1.00 0.00 C ATOM 2124 CD LYS A 134 5.901 12.639 -12.004 1.00 0.00 C ATOM 2125 CE LYS A 134 6.454 13.496 -13.149 1.00 0.00 C ATOM 2126 NZ LYS A 134 5.376 13.973 -14.043 1.00 0.00 N ATOM 0 H LYS A 134 5.197 12.757 -8.181 1.00 0.00 H new ATOM 0 HA LYS A 134 3.040 14.083 -9.392 1.00 0.00 H new ATOM 0 HB2 LYS A 134 4.612 11.572 -9.971 1.00 0.00 H new ATOM 0 HB3 LYS A 134 3.272 12.074 -10.983 1.00 0.00 H new ATOM 0 HG2 LYS A 134 4.372 14.121 -11.617 1.00 0.00 H new ATOM 0 HG3 LYS A 134 5.559 13.975 -10.336 1.00 0.00 H new ATOM 0 HD2 LYS A 134 6.735 12.232 -11.432 1.00 0.00 H new ATOM 0 HD3 LYS A 134 5.360 11.792 -12.425 1.00 0.00 H new ATOM 0 HE2 LYS A 134 6.991 14.351 -12.738 1.00 0.00 H new ATOM 0 HE3 LYS A 134 7.174 12.914 -13.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 5.784 14.262 -14.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 4.689 13.208 -14.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 4.896 14.785 -13.605 1.00 0.00 H new ATOM 2140 N ALA A 135 2.407 11.044 -8.160 1.00 0.00 N ATOM 2141 CA ALA A 135 1.377 10.183 -7.598 1.00 0.00 C ATOM 2142 C ALA A 135 0.910 10.650 -6.209 1.00 0.00 C ATOM 2143 O ALA A 135 0.027 10.029 -5.616 1.00 0.00 O ATOM 2144 CB ALA A 135 1.916 8.759 -7.518 1.00 0.00 C ATOM 0 H ALA A 135 3.332 10.615 -8.178 1.00 0.00 H new ATOM 0 HA ALA A 135 0.506 10.227 -8.252 1.00 0.00 H new ATOM 0 HB1 ALA A 135 1.153 8.104 -7.098 1.00 0.00 H new ATOM 0 HB2 ALA A 135 2.181 8.414 -8.517 1.00 0.00 H new ATOM 0 HB3 ALA A 135 2.801 8.740 -6.881 1.00 0.00 H new ATOM 2150 N GLY A 136 1.509 11.700 -5.648 1.00 0.00 N ATOM 2151 CA GLY A 136 1.231 12.205 -4.316 1.00 0.00 C ATOM 2152 C GLY A 136 0.184 13.304 -4.355 1.00 0.00 C ATOM 2153 O GLY A 136 -0.838 13.186 -3.681 1.00 0.00 O ATOM 0 H GLY A 136 2.227 12.238 -6.132 1.00 0.00 H new ATOM 0 HA2 GLY A 136 0.884 11.391 -3.680 1.00 0.00 H new ATOM 0 HA3 GLY A 136 2.149 12.589 -3.870 1.00 0.00 H new ATOM 2157 N GLY A 137 0.428 14.339 -5.155 1.00 0.00 N ATOM 2158 CA GLY A 137 -0.421 15.513 -5.245 1.00 0.00 C ATOM 2159 C GLY A 137 -0.417 16.300 -3.935 1.00 0.00 C ATOM 2160 O GLY A 137 0.255 15.948 -2.957 1.00 0.00 O ATOM 0 H GLY A 137 1.241 14.381 -5.770 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -0.076 16.153 -6.058 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.440 15.211 -5.487 1.00 0.00 H new ATOM 2164 N ALA A 138 -1.137 17.414 -3.938 1.00 0.00 N ATOM 2165 CA ALA A 138 -1.343 18.274 -2.789 1.00 0.00 C ATOM 2166 C ALA A 138 -2.678 18.969 -3.023 1.00 0.00 C ATOM 2167 O ALA A 138 -2.718 20.035 -3.636 1.00 0.00 O ATOM 2168 CB ALA A 138 -0.183 19.270 -2.641 1.00 0.00 C ATOM 0 H ALA A 138 -1.610 17.753 -4.775 1.00 0.00 H new ATOM 0 HA ALA A 138 -1.366 17.712 -1.855 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -0.358 19.906 -1.773 1.00 0.00 H new ATOM 0 HB2 ALA A 138 0.751 18.724 -2.509 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -0.118 19.888 -3.536 1.00 0.00 H new ATOM 2174 N ASN A 139 -3.770 18.319 -2.630 1.00 0.00 N ATOM 2175 CA ASN A 139 -5.109 18.878 -2.706 1.00 0.00 C ATOM 2176 C ASN A 139 -5.886 18.387 -1.501 1.00 0.00 C ATOM 2177 O ASN A 139 -6.020 17.177 -1.296 1.00 0.00 O ATOM 2178 CB ASN A 139 -5.822 18.461 -3.995 1.00 0.00 C ATOM 2179 CG ASN A 139 -7.263 18.955 -3.975 1.00 0.00 C ATOM 2180 OD1 ASN A 139 -7.519 20.130 -4.209 1.00 0.00 O ATOM 2181 ND2 ASN A 139 -8.219 18.102 -3.667 1.00 0.00 N ATOM 0 H ASN A 139 -3.745 17.375 -2.244 1.00 0.00 H new ATOM 0 HA ASN A 139 -5.046 19.966 -2.712 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -5.300 18.872 -4.859 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -5.802 17.376 -4.097 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -9.188 18.417 -3.621 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -7.990 17.127 -3.475 1.00 0.00 H new ATOM 2188 N TYR A 140 -6.375 19.324 -0.702 1.00 0.00 N ATOM 2189 CA TYR A 140 -7.211 19.093 0.456 1.00 0.00 C ATOM 2190 C TYR A 140 -8.305 20.150 0.354 1.00 0.00 C ATOM 2191 O TYR A 140 -8.178 21.264 0.858 1.00 0.00 O ATOM 2192 CB TYR A 140 -6.390 19.149 1.748 1.00 0.00 C ATOM 2193 CG TYR A 140 -5.118 18.307 1.717 1.00 0.00 C ATOM 2194 CD1 TYR A 140 -3.915 18.872 1.243 1.00 0.00 C ATOM 2195 CD2 TYR A 140 -5.149 16.948 2.082 1.00 0.00 C ATOM 2196 CE1 TYR A 140 -2.757 18.083 1.107 1.00 0.00 C ATOM 2197 CE2 TYR A 140 -3.995 16.153 1.957 1.00 0.00 C ATOM 2198 CZ TYR A 140 -2.799 16.715 1.455 1.00 0.00 C ATOM 2199 OH TYR A 140 -1.701 15.918 1.306 1.00 0.00 O ATOM 0 H TYR A 140 -6.187 20.315 -0.856 1.00 0.00 H new ATOM 0 HA TYR A 140 -7.654 18.098 0.483 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -6.121 20.186 1.950 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -7.014 18.814 2.577 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -3.882 19.920 0.982 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -6.063 16.514 2.460 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -1.841 18.522 0.739 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -4.023 15.112 2.245 1.00 0.00 H new ATOM 0 HH TYR A 140 -1.916 15.007 1.597 1.00 0.00 H new ATOM 2209 N ASP A 141 -9.324 19.803 -0.420 1.00 0.00 N ATOM 2210 CA ASP A 141 -10.478 20.618 -0.793 1.00 0.00 C ATOM 2211 C ASP A 141 -11.616 19.660 -1.154 1.00 0.00 C ATOM 2212 O ASP A 141 -11.353 18.649 -1.814 1.00 0.00 O ATOM 2213 CB ASP A 141 -10.097 21.471 -2.013 1.00 0.00 C ATOM 2214 CG ASP A 141 -11.308 22.104 -2.697 1.00 0.00 C ATOM 2215 OD1 ASP A 141 -12.231 22.551 -1.986 1.00 0.00 O ATOM 2216 OD2 ASP A 141 -11.314 22.142 -3.949 1.00 0.00 O ATOM 0 H ASP A 141 -9.371 18.873 -0.837 1.00 0.00 H new ATOM 0 HA ASP A 141 -10.786 21.277 0.019 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -9.410 22.258 -1.700 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -9.563 20.850 -2.732 1.00 0.00 H new ATOM 2221 N ALA A 142 -12.843 19.921 -0.700 1.00 0.00 N ATOM 2222 CA ALA A 142 -14.037 19.141 -1.017 1.00 0.00 C ATOM 2223 C ALA A 142 -15.267 20.037 -0.839 1.00 0.00 C ATOM 2224 O ALA A 142 -15.782 20.169 0.272 1.00 0.00 O ATOM 2225 CB ALA A 142 -14.122 17.899 -0.114 1.00 0.00 C ATOM 0 H ALA A 142 -13.038 20.708 -0.081 1.00 0.00 H new ATOM 0 HA ALA A 142 -13.991 18.792 -2.049 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -15.017 17.329 -0.363 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -13.241 17.276 -0.268 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -14.169 18.210 0.930 1.00 0.00 H new ATOM 2231 N GLN A 143 -15.734 20.689 -1.904 1.00 0.00 N ATOM 2232 CA GLN A 143 -16.854 21.631 -1.831 1.00 0.00 C ATOM 2233 C GLN A 143 -18.162 20.900 -2.147 1.00 0.00 C ATOM 2234 O GLN A 143 -18.878 21.262 -3.080 1.00 0.00 O ATOM 2235 CB GLN A 143 -16.554 22.837 -2.737 1.00 0.00 C ATOM 2236 CG GLN A 143 -15.490 23.726 -2.074 1.00 0.00 C ATOM 2237 CD GLN A 143 -14.883 24.722 -3.054 1.00 0.00 C ATOM 2238 OE1 GLN A 143 -15.532 25.669 -3.485 1.00 0.00 O ATOM 2239 NE2 GLN A 143 -13.623 24.541 -3.410 1.00 0.00 N ATOM 0 H GLN A 143 -15.348 20.580 -2.842 1.00 0.00 H new ATOM 0 HA GLN A 143 -16.979 22.031 -0.825 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -16.202 22.495 -3.710 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -17.465 23.410 -2.911 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -15.938 24.266 -1.240 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -14.701 23.098 -1.660 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -13.098 23.748 -3.042 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -13.176 25.195 -4.053 1.00 0.00 H new ATOM 2248 N THR A 144 -18.497 19.922 -1.300 1.00 0.00 N ATOM 2249 CA THR A 144 -19.637 19.002 -1.402 1.00 0.00 C ATOM 2250 C THR A 144 -19.176 17.856 -2.313 1.00 0.00 C ATOM 2251 O THR A 144 -19.754 17.593 -3.367 1.00 0.00 O ATOM 2252 CB THR A 144 -20.958 19.679 -1.843 1.00 0.00 C ATOM 2253 OG1 THR A 144 -21.101 20.949 -1.234 1.00 0.00 O ATOM 2254 CG2 THR A 144 -22.183 18.846 -1.451 1.00 0.00 C ATOM 0 H THR A 144 -17.940 19.738 -0.465 1.00 0.00 H new ATOM 0 HA THR A 144 -19.909 18.617 -0.419 1.00 0.00 H new ATOM 0 HB THR A 144 -20.905 19.773 -2.928 1.00 0.00 H new ATOM 0 HG1 THR A 144 -21.941 21.360 -1.527 1.00 0.00 H new ATOM 0 HG21 THR A 144 -23.089 19.356 -1.778 1.00 0.00 H new ATOM 0 HG22 THR A 144 -22.125 17.867 -1.927 1.00 0.00 H new ATOM 0 HG23 THR A 144 -22.207 18.722 -0.368 1.00 0.00 H new ATOM 2262 N GLU A 145 -18.071 17.219 -1.922 1.00 0.00 N ATOM 2263 CA GLU A 145 -17.386 16.166 -2.648 1.00 0.00 C ATOM 2264 C GLU A 145 -16.930 15.118 -1.636 1.00 0.00 C ATOM 2265 O GLU A 145 -16.991 15.427 -0.424 1.00 0.00 O ATOM 2266 CB GLU A 145 -16.148 16.743 -3.349 1.00 0.00 C ATOM 2267 CG GLU A 145 -16.339 17.924 -4.311 1.00 0.00 C ATOM 2268 CD GLU A 145 -14.976 18.479 -4.749 1.00 0.00 C ATOM 2269 OE1 GLU A 145 -14.045 17.683 -5.019 1.00 0.00 O ATOM 2270 OE2 GLU A 145 -14.825 19.719 -4.863 1.00 0.00 O ATOM 2271 OXT GLU A 145 -16.460 14.054 -2.097 1.00 0.00 O ATOM 0 H GLU A 145 -17.610 17.442 -1.040 1.00 0.00 H new ATOM 0 HA GLU A 145 -18.052 15.729 -3.392 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -15.444 17.054 -2.577 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -15.674 15.934 -3.906 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -16.906 17.603 -5.184 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -16.920 18.708 -3.825 1.00 0.00 H new TER 2278 GLU A 145