USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1192 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 116 THR OG1 : rot 61:sc= 0.888 USER MOD Set 1.2: A 117 THR OG1 : rot -39:sc= 0.594 USER MOD Set 2.1: A 99 LYS NZ :NH3+ 166:sc= 0.476 (180deg=0) USER MOD Set 2.2: A 101 THR OG1 : rot 157:sc= 0.445 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0268 USER MOD Single : A 3 SER OG : rot 32:sc= 0.717 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc=-0.00826 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot -160:sc= -2.58! USER MOD Single : A 21 SER OG : rot 136:sc= -0.366! USER MOD Single : A 23 THR OG1 : rot 46:sc= 1.11 USER MOD Single : A 24 CYS SG : rot -170:sc= -2.2 USER MOD Single : A 28 GLN : amide:sc= -0.939 K(o=-0.94,f=-5.5!) USER MOD Single : A 35 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 40 GLN : amide:sc= -1.52 K(o=-1.5,f=-2.2!) USER MOD Single : A 43 ASN : amide:sc= -0.335 X(o=-0.34,f=-0.34) USER MOD Single : A 44 SER OG : rot 180:sc= -0.0342 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0.0212 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 65 GLN : amide:sc= -3.99! C(o=-4!,f=-11!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 GLN : amide:sc= -0.0724 K(o=-0.072,f=-1.7!) USER MOD Single : A 74 GLN :FLIP amide:sc= -0.198 F(o=-0.82,f=-0.2) USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.17 USER MOD Single : A 84 HIS : no HD1:sc= -0.52 X(o=-0.52,f=-0.27) USER MOD Single : A 87 HIS : no HD1:sc= -0.0626 K(o=-0.063,f=-0.64) USER MOD Single : A 93 HIS :FLIP no HE2:sc= 0.104 F(o=-0.92,f=0.1) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 HIS :FLIP no HD1:sc= -0.831 F(o=-2.3!,f=-0.83) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -0.0828 X(o=-0.083,f=-0.0058) USER MOD Single : A 105 TYR OH : rot -0:sc= 0.0516 USER MOD Single : A 112 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0.27 USER MOD Single : A 127 GLN : amide:sc= -0.0854 X(o=-0.085,f=-0.45!) USER MOD Single : A 131 HIS : no HD1:sc= -1.67 K(o=-1.7,f=-2.6) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.17 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 THR OG1 : rot 180:sc=0.000461 USER MOD Single : A 139 MET CE :methyl -139:sc= -0.167 (180deg=-0.388) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00202) USER MOD Single : A 146 TYR OH : rot 158:sc=0.000285 USER MOD Single : A 147 GLN :FLIP amide:sc= -1.17 F(o=-1.8!,f=-1.2) USER MOD Single : A 149 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 16:sc= 0.034 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.675 -14.795 -23.203 1.00 0.00 N ATOM 2 CA GLY A 1 4.823 -15.007 -22.342 1.00 0.00 C ATOM 3 C GLY A 1 5.457 -13.707 -21.888 1.00 0.00 C ATOM 4 O GLY A 1 6.522 -13.326 -22.374 1.00 0.00 O ATOM 0 H1 GLY A 1 3.278 -15.714 -23.485 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.953 -14.249 -22.691 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.969 -14.270 -24.051 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.516 -15.582 -21.468 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.565 -15.604 -22.872 1.00 0.00 H new ATOM 8 N SER A 2 4.800 -13.024 -20.957 1.00 0.00 N ATOM 9 CA SER A 2 5.302 -11.756 -20.442 1.00 0.00 C ATOM 10 C SER A 2 4.809 -11.513 -19.020 1.00 0.00 C ATOM 11 O SER A 2 3.915 -12.207 -18.534 1.00 0.00 O ATOM 12 CB SER A 2 4.866 -10.604 -21.350 1.00 0.00 C ATOM 13 OG SER A 2 5.378 -10.766 -22.661 1.00 0.00 O ATOM 0 H SER A 2 3.918 -13.328 -20.544 1.00 0.00 H new ATOM 0 HA SER A 2 6.391 -11.804 -20.426 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.778 -10.556 -21.385 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.214 -9.658 -20.935 1.00 0.00 H new ATOM 0 HG SER A 2 5.084 -10.018 -23.222 1.00 0.00 H new ATOM 19 N SER A 3 5.397 -10.521 -18.357 1.00 0.00 N ATOM 20 CA SER A 3 5.020 -10.187 -16.988 1.00 0.00 C ATOM 21 C SER A 3 3.505 -10.063 -16.857 1.00 0.00 C ATOM 22 O SER A 3 2.888 -9.185 -17.460 1.00 0.00 O ATOM 23 CB SER A 3 5.690 -8.882 -16.556 1.00 0.00 C ATOM 24 OG SER A 3 5.207 -7.786 -17.313 1.00 0.00 O ATOM 0 H SER A 3 6.136 -9.935 -18.746 1.00 0.00 H new ATOM 0 HA SER A 3 5.359 -10.993 -16.337 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.503 -8.707 -15.497 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.770 -8.966 -16.679 1.00 0.00 H new ATOM 0 HG SER A 3 4.269 -7.941 -17.551 1.00 0.00 H new ATOM 30 N GLY A 4 2.910 -10.948 -16.063 1.00 0.00 N ATOM 31 CA GLY A 4 1.473 -10.921 -15.866 1.00 0.00 C ATOM 32 C GLY A 4 1.071 -10.116 -14.646 1.00 0.00 C ATOM 33 O GLY A 4 1.848 -9.304 -14.144 1.00 0.00 O ATOM 0 H GLY A 4 3.398 -11.684 -15.552 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.996 -10.498 -16.750 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.104 -11.941 -15.762 1.00 0.00 H new ATOM 37 N SER A 5 -0.149 -10.340 -14.168 1.00 0.00 N ATOM 38 CA SER A 5 -0.657 -9.625 -13.002 1.00 0.00 C ATOM 39 C SER A 5 -0.082 -10.210 -11.715 1.00 0.00 C ATOM 40 O SER A 5 -0.015 -11.427 -11.548 1.00 0.00 O ATOM 41 CB SER A 5 -2.185 -9.686 -12.966 1.00 0.00 C ATOM 42 OG SER A 5 -2.755 -8.684 -13.790 1.00 0.00 O ATOM 0 H SER A 5 -0.804 -11.011 -14.570 1.00 0.00 H new ATOM 0 HA SER A 5 -0.345 -8.584 -13.079 1.00 0.00 H new ATOM 0 HB2 SER A 5 -2.521 -10.668 -13.298 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.533 -9.560 -11.941 1.00 0.00 H new ATOM 0 HG SER A 5 -3.732 -8.745 -13.751 1.00 0.00 H new ATOM 48 N SER A 6 0.332 -9.331 -10.808 1.00 0.00 N ATOM 49 CA SER A 6 0.905 -9.758 -9.537 1.00 0.00 C ATOM 50 C SER A 6 -0.139 -10.468 -8.681 1.00 0.00 C ATOM 51 O SER A 6 -1.297 -10.055 -8.625 1.00 0.00 O ATOM 52 CB SER A 6 1.470 -8.555 -8.777 1.00 0.00 C ATOM 53 OG SER A 6 1.967 -8.940 -7.508 1.00 0.00 O ATOM 0 H SER A 6 0.281 -8.320 -10.930 1.00 0.00 H new ATOM 0 HA SER A 6 1.713 -10.458 -9.749 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.269 -8.096 -9.359 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.692 -7.802 -8.653 1.00 0.00 H new ATOM 0 HG SER A 6 2.324 -8.154 -7.044 1.00 0.00 H new ATOM 59 N GLY A 7 0.280 -11.541 -8.016 1.00 0.00 N ATOM 60 CA GLY A 7 -0.631 -12.293 -7.172 1.00 0.00 C ATOM 61 C GLY A 7 -0.305 -13.773 -7.142 1.00 0.00 C ATOM 62 O GLY A 7 0.271 -14.323 -8.081 1.00 0.00 O ATOM 0 H GLY A 7 1.233 -11.903 -8.047 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.594 -11.895 -6.158 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.651 -12.156 -7.531 1.00 0.00 H new ATOM 66 N PRO A 8 -0.676 -14.442 -6.041 1.00 0.00 N ATOM 67 CA PRO A 8 -0.429 -15.877 -5.865 1.00 0.00 C ATOM 68 C PRO A 8 -1.286 -16.731 -6.792 1.00 0.00 C ATOM 69 O PRO A 8 -0.787 -17.644 -7.449 1.00 0.00 O ATOM 70 CB PRO A 8 -0.809 -16.126 -4.403 1.00 0.00 C ATOM 71 CG PRO A 8 -1.787 -15.050 -4.079 1.00 0.00 C ATOM 72 CD PRO A 8 -1.366 -13.851 -4.882 1.00 0.00 C ATOM 0 HA PRO A 8 0.600 -16.146 -6.103 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.249 -17.114 -4.271 1.00 0.00 H new ATOM 0 HB3 PRO A 8 0.064 -16.077 -3.753 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -2.802 -15.355 -4.336 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -1.782 -14.826 -3.012 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -2.223 -13.251 -5.188 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -0.706 -13.197 -4.312 1.00 0.00 H new ATOM 80 N ARG A 9 -2.580 -16.427 -6.841 1.00 0.00 N ATOM 81 CA ARG A 9 -3.507 -17.168 -7.688 1.00 0.00 C ATOM 82 C ARG A 9 -3.505 -16.615 -9.110 1.00 0.00 C ATOM 83 O ARG A 9 -3.243 -17.340 -10.070 1.00 0.00 O ATOM 84 CB ARG A 9 -4.920 -17.107 -7.108 1.00 0.00 C ATOM 85 CG ARG A 9 -5.800 -18.273 -7.524 1.00 0.00 C ATOM 86 CD ARG A 9 -5.436 -19.543 -6.770 1.00 0.00 C ATOM 87 NE ARG A 9 -6.029 -20.730 -7.381 1.00 0.00 N ATOM 88 CZ ARG A 9 -6.212 -21.876 -6.733 1.00 0.00 C ATOM 89 NH1 ARG A 9 -5.850 -21.987 -5.462 1.00 0.00 N ATOM 90 NH2 ARG A 9 -6.758 -22.912 -7.355 1.00 0.00 N ATOM 0 H ARG A 9 -3.009 -15.673 -6.304 1.00 0.00 H new ATOM 0 HA ARG A 9 -3.179 -18.207 -7.720 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -4.856 -17.081 -6.020 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -5.392 -16.176 -7.422 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -6.845 -18.026 -7.339 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -5.698 -18.443 -8.596 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -4.352 -19.651 -6.744 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -5.773 -19.460 -5.737 1.00 0.00 H new ATOM 0 HE ARG A 9 -6.318 -20.676 -8.358 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -5.430 -21.192 -4.980 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -5.991 -22.867 -4.966 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -7.038 -22.830 -8.332 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -6.898 -23.791 -6.856 1.00 0.00 H new ATOM 104 N LYS A 10 -3.800 -15.326 -9.239 1.00 0.00 N ATOM 105 CA LYS A 10 -3.831 -14.674 -10.542 1.00 0.00 C ATOM 106 C LYS A 10 -2.631 -15.086 -11.387 1.00 0.00 C ATOM 107 O LYS A 10 -2.770 -15.407 -12.567 1.00 0.00 O ATOM 108 CB LYS A 10 -3.852 -13.152 -10.375 1.00 0.00 C ATOM 109 CG LYS A 10 -5.119 -12.630 -9.720 1.00 0.00 C ATOM 110 CD LYS A 10 -4.961 -11.186 -9.274 1.00 0.00 C ATOM 111 CE LYS A 10 -4.719 -10.262 -10.457 1.00 0.00 C ATOM 112 NZ LYS A 10 -5.968 -10.007 -11.228 1.00 0.00 N ATOM 0 H LYS A 10 -4.021 -14.712 -8.455 1.00 0.00 H new ATOM 0 HA LYS A 10 -4.739 -14.990 -11.055 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -2.992 -12.848 -9.777 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -3.740 -12.686 -11.354 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -5.950 -12.707 -10.421 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -5.368 -13.252 -8.860 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -5.857 -10.869 -8.740 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -4.129 -11.109 -8.574 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -4.313 -9.315 -10.101 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -3.970 -10.703 -11.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -5.760 -9.373 -12.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -6.343 -10.907 -11.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -6.674 -9.563 -10.607 1.00 0.00 H new ATOM 126 N ALA A 11 -1.451 -15.077 -10.773 1.00 0.00 N ATOM 127 CA ALA A 11 -0.227 -15.454 -11.469 1.00 0.00 C ATOM 128 C ALA A 11 0.004 -16.961 -11.397 1.00 0.00 C ATOM 129 O ALA A 11 -0.831 -17.701 -10.880 1.00 0.00 O ATOM 130 CB ALA A 11 0.963 -14.708 -10.883 1.00 0.00 C ATOM 0 H ALA A 11 -1.318 -14.813 -9.797 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.335 -15.179 -12.518 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.871 -14.999 -11.412 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.808 -13.634 -10.991 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.063 -14.956 -9.826 1.00 0.00 H new ATOM 136 N SER A 12 1.142 -17.406 -11.921 1.00 0.00 N ATOM 137 CA SER A 12 1.480 -18.824 -11.920 1.00 0.00 C ATOM 138 C SER A 12 1.202 -19.448 -10.557 1.00 0.00 C ATOM 139 O SER A 12 0.946 -18.744 -9.580 1.00 0.00 O ATOM 140 CB SER A 12 2.950 -19.020 -12.294 1.00 0.00 C ATOM 141 OG SER A 12 3.201 -18.592 -13.622 1.00 0.00 O ATOM 0 H SER A 12 1.845 -16.805 -12.351 1.00 0.00 H new ATOM 0 HA SER A 12 0.855 -19.322 -12.662 1.00 0.00 H new ATOM 0 HB2 SER A 12 3.582 -18.461 -11.603 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.217 -20.072 -12.191 1.00 0.00 H new ATOM 0 HG SER A 12 4.148 -18.726 -13.836 1.00 0.00 H new ATOM 147 N ARG A 13 1.254 -20.775 -10.498 1.00 0.00 N ATOM 148 CA ARG A 13 1.007 -21.495 -9.255 1.00 0.00 C ATOM 149 C ARG A 13 2.165 -21.309 -8.279 1.00 0.00 C ATOM 150 O ARG A 13 3.016 -22.187 -8.134 1.00 0.00 O ATOM 151 CB ARG A 13 0.798 -22.985 -9.536 1.00 0.00 C ATOM 152 CG ARG A 13 -0.647 -23.353 -9.826 1.00 0.00 C ATOM 153 CD ARG A 13 -1.063 -22.922 -11.224 1.00 0.00 C ATOM 154 NE ARG A 13 -2.366 -23.464 -11.599 1.00 0.00 N ATOM 155 CZ ARG A 13 -2.550 -24.712 -12.016 1.00 0.00 C ATOM 156 NH1 ARG A 13 -1.520 -25.542 -12.112 1.00 0.00 N ATOM 157 NH2 ARG A 13 -3.767 -25.132 -12.340 1.00 0.00 N ATOM 0 H ARG A 13 1.465 -21.373 -11.297 1.00 0.00 H new ATOM 0 HA ARG A 13 0.103 -21.087 -8.802 1.00 0.00 H new ATOM 0 HB2 ARG A 13 1.416 -23.276 -10.386 1.00 0.00 H new ATOM 0 HB3 ARG A 13 1.145 -23.560 -8.678 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -0.777 -24.430 -9.723 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -1.298 -22.881 -9.090 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -1.095 -21.834 -11.273 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -0.313 -23.251 -11.943 1.00 0.00 H new ATOM 0 HE ARG A 13 -3.179 -22.851 -11.537 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -0.583 -25.223 -11.865 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -1.665 -26.499 -12.432 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -4.562 -24.496 -12.269 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -3.907 -26.090 -12.660 1.00 0.00 H new ATOM 171 N LYS A 14 2.192 -20.160 -7.614 1.00 0.00 N ATOM 172 CA LYS A 14 3.245 -19.857 -6.651 1.00 0.00 C ATOM 173 C LYS A 14 2.775 -20.133 -5.226 1.00 0.00 C ATOM 174 O LYS A 14 1.599 -19.986 -4.895 1.00 0.00 O ATOM 175 CB LYS A 14 3.678 -18.396 -6.781 1.00 0.00 C ATOM 176 CG LYS A 14 4.721 -18.164 -7.861 1.00 0.00 C ATOM 177 CD LYS A 14 6.087 -18.674 -7.434 1.00 0.00 C ATOM 178 CE LYS A 14 7.163 -18.297 -8.440 1.00 0.00 C ATOM 179 NZ LYS A 14 7.067 -19.110 -9.685 1.00 0.00 N ATOM 0 H LYS A 14 1.496 -19.422 -7.724 1.00 0.00 H new ATOM 0 HA LYS A 14 4.096 -20.503 -6.866 1.00 0.00 H new ATOM 0 HB2 LYS A 14 2.802 -17.784 -6.996 1.00 0.00 H new ATOM 0 HB3 LYS A 14 4.076 -18.057 -5.824 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.414 -18.666 -8.778 1.00 0.00 H new ATOM 0 HG3 LYS A 14 4.783 -17.099 -8.086 1.00 0.00 H new ATOM 0 HD2 LYS A 14 6.341 -18.263 -6.457 1.00 0.00 H new ATOM 0 HD3 LYS A 14 6.054 -19.758 -7.325 1.00 0.00 H new ATOM 0 HE2 LYS A 14 7.073 -17.240 -8.689 1.00 0.00 H new ATOM 0 HE3 LYS A 14 8.146 -18.436 -7.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 7.817 -18.823 -10.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 7.178 -20.117 -9.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 6.139 -18.958 -10.128 1.00 0.00 H new ATOM 193 N PRO A 15 3.715 -20.544 -4.362 1.00 0.00 N ATOM 194 CA PRO A 15 3.421 -20.848 -2.958 1.00 0.00 C ATOM 195 C PRO A 15 3.086 -19.598 -2.152 1.00 0.00 C ATOM 196 O PRO A 15 3.656 -18.526 -2.357 1.00 0.00 O ATOM 197 CB PRO A 15 4.720 -21.478 -2.451 1.00 0.00 C ATOM 198 CG PRO A 15 5.780 -20.927 -3.341 1.00 0.00 C ATOM 199 CD PRO A 15 5.137 -20.742 -4.688 1.00 0.00 C ATOM 0 HA PRO A 15 2.549 -21.495 -2.856 1.00 0.00 H new ATOM 0 HB2 PRO A 15 4.905 -21.220 -1.408 1.00 0.00 H new ATOM 0 HB3 PRO A 15 4.681 -22.566 -2.508 1.00 0.00 H new ATOM 0 HG2 PRO A 15 6.159 -19.980 -2.956 1.00 0.00 H new ATOM 0 HG3 PRO A 15 6.629 -21.608 -3.404 1.00 0.00 H new ATOM 0 HD2 PRO A 15 5.551 -19.884 -5.217 1.00 0.00 H new ATOM 0 HD3 PRO A 15 5.285 -21.612 -5.327 1.00 0.00 H new ATOM 207 N PRO A 16 2.139 -19.734 -1.211 1.00 0.00 N ATOM 208 CA PRO A 16 1.708 -18.626 -0.355 1.00 0.00 C ATOM 209 C PRO A 16 2.783 -18.216 0.647 1.00 0.00 C ATOM 210 O PRO A 16 3.038 -17.028 0.846 1.00 0.00 O ATOM 211 CB PRO A 16 0.488 -19.194 0.373 1.00 0.00 C ATOM 212 CG PRO A 16 0.698 -20.670 0.371 1.00 0.00 C ATOM 213 CD PRO A 16 1.418 -20.983 -0.911 1.00 0.00 C ATOM 0 HA PRO A 16 1.497 -17.725 -0.930 1.00 0.00 H new ATOM 0 HB2 PRO A 16 0.417 -18.806 1.389 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -0.437 -18.925 -0.136 1.00 0.00 H new ATOM 0 HG2 PRO A 16 1.285 -20.982 1.235 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -0.253 -21.200 0.424 1.00 0.00 H new ATOM 0 HD2 PRO A 16 2.102 -21.823 -0.793 1.00 0.00 H new ATOM 0 HD3 PRO A 16 0.723 -21.247 -1.708 1.00 0.00 H new ATOM 221 N ARG A 17 3.410 -19.205 1.274 1.00 0.00 N ATOM 222 CA ARG A 17 4.455 -18.947 2.256 1.00 0.00 C ATOM 223 C ARG A 17 5.272 -17.717 1.869 1.00 0.00 C ATOM 224 O ARG A 17 5.194 -16.678 2.522 1.00 0.00 O ATOM 225 CB ARG A 17 5.375 -20.162 2.386 1.00 0.00 C ATOM 226 CG ARG A 17 4.641 -21.491 2.315 1.00 0.00 C ATOM 227 CD ARG A 17 5.406 -22.589 3.038 1.00 0.00 C ATOM 228 NE ARG A 17 5.456 -22.363 4.480 1.00 0.00 N ATOM 229 CZ ARG A 17 6.227 -23.061 5.307 1.00 0.00 C ATOM 230 NH1 ARG A 17 7.009 -24.022 4.836 1.00 0.00 N ATOM 231 NH2 ARG A 17 6.217 -22.796 6.607 1.00 0.00 N ATOM 0 H ARG A 17 3.212 -20.194 1.119 1.00 0.00 H new ATOM 0 HA ARG A 17 3.977 -18.758 3.217 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.123 -20.127 1.594 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.910 -20.102 3.334 1.00 0.00 H new ATOM 0 HG2 ARG A 17 3.650 -21.385 2.757 1.00 0.00 H new ATOM 0 HG3 ARG A 17 4.496 -21.773 1.272 1.00 0.00 H new ATOM 0 HD2 ARG A 17 4.935 -23.551 2.838 1.00 0.00 H new ATOM 0 HD3 ARG A 17 6.421 -22.643 2.644 1.00 0.00 H new ATOM 0 HE ARG A 17 4.867 -21.629 4.874 1.00 0.00 H new ATOM 0 HH11 ARG A 17 7.020 -24.227 3.837 1.00 0.00 H new ATOM 0 HH12 ARG A 17 7.600 -24.557 5.473 1.00 0.00 H new ATOM 0 HH21 ARG A 17 5.617 -22.056 6.972 1.00 0.00 H new ATOM 0 HH22 ARG A 17 6.809 -23.332 7.241 1.00 0.00 H new ATOM 245 N GLU A 18 6.055 -17.845 0.802 1.00 0.00 N ATOM 246 CA GLU A 18 6.887 -16.744 0.330 1.00 0.00 C ATOM 247 C GLU A 18 6.061 -15.745 -0.476 1.00 0.00 C ATOM 248 O GLU A 18 5.773 -15.968 -1.651 1.00 0.00 O ATOM 249 CB GLU A 18 8.039 -17.276 -0.526 1.00 0.00 C ATOM 250 CG GLU A 18 9.023 -18.137 0.249 1.00 0.00 C ATOM 251 CD GLU A 18 10.030 -17.314 1.028 1.00 0.00 C ATOM 252 OE1 GLU A 18 10.713 -16.471 0.410 1.00 0.00 O ATOM 253 OE2 GLU A 18 10.135 -17.512 2.257 1.00 0.00 O ATOM 0 H GLU A 18 6.131 -18.699 0.249 1.00 0.00 H new ATOM 0 HA GLU A 18 7.297 -16.233 1.201 1.00 0.00 H new ATOM 0 HB2 GLU A 18 7.629 -17.859 -1.351 1.00 0.00 H new ATOM 0 HB3 GLU A 18 8.573 -16.434 -0.966 1.00 0.00 H new ATOM 0 HG2 GLU A 18 8.474 -18.780 0.937 1.00 0.00 H new ATOM 0 HG3 GLU A 18 9.552 -18.791 -0.444 1.00 0.00 H new ATOM 260 N GLU A 19 5.682 -14.645 0.166 1.00 0.00 N ATOM 261 CA GLU A 19 4.887 -13.613 -0.489 1.00 0.00 C ATOM 262 C GLU A 19 5.267 -12.226 0.023 1.00 0.00 C ATOM 263 O GLU A 19 5.038 -11.899 1.187 1.00 0.00 O ATOM 264 CB GLU A 19 3.396 -13.862 -0.259 1.00 0.00 C ATOM 265 CG GLU A 19 2.784 -14.844 -1.245 1.00 0.00 C ATOM 266 CD GLU A 19 2.626 -14.255 -2.633 1.00 0.00 C ATOM 267 OE1 GLU A 19 3.654 -14.062 -3.316 1.00 0.00 O ATOM 268 OE2 GLU A 19 1.475 -13.988 -3.037 1.00 0.00 O ATOM 0 H GLU A 19 5.913 -14.445 1.139 1.00 0.00 H new ATOM 0 HA GLU A 19 5.094 -13.656 -1.558 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.251 -14.239 0.754 1.00 0.00 H new ATOM 0 HB3 GLU A 19 2.863 -12.913 -0.326 1.00 0.00 H new ATOM 0 HG2 GLU A 19 3.410 -15.734 -1.301 1.00 0.00 H new ATOM 0 HG3 GLU A 19 1.809 -15.163 -0.877 1.00 0.00 H new ATOM 275 N SER A 20 5.849 -11.415 -0.856 1.00 0.00 N ATOM 276 CA SER A 20 6.264 -10.066 -0.492 1.00 0.00 C ATOM 277 C SER A 20 5.471 -9.024 -1.274 1.00 0.00 C ATOM 278 O SER A 20 5.024 -9.279 -2.393 1.00 0.00 O ATOM 279 CB SER A 20 7.761 -9.884 -0.750 1.00 0.00 C ATOM 280 OG SER A 20 8.094 -10.227 -2.085 1.00 0.00 O ATOM 0 H SER A 20 6.043 -11.669 -1.824 1.00 0.00 H new ATOM 0 HA SER A 20 6.066 -9.925 0.571 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.044 -8.849 -0.556 1.00 0.00 H new ATOM 0 HB3 SER A 20 8.331 -10.505 -0.059 1.00 0.00 H new ATOM 0 HG SER A 20 9.055 -10.411 -2.145 1.00 0.00 H new ATOM 286 N SER A 21 5.300 -7.849 -0.677 1.00 0.00 N ATOM 287 CA SER A 21 4.557 -6.768 -1.316 1.00 0.00 C ATOM 288 C SER A 21 4.968 -5.415 -0.743 1.00 0.00 C ATOM 289 O SER A 21 5.451 -5.327 0.386 1.00 0.00 O ATOM 290 CB SER A 21 3.053 -6.977 -1.132 1.00 0.00 C ATOM 291 OG SER A 21 2.737 -7.250 0.221 1.00 0.00 O ATOM 0 H SER A 21 5.665 -7.621 0.248 1.00 0.00 H new ATOM 0 HA SER A 21 4.790 -6.779 -2.381 1.00 0.00 H new ATOM 0 HB2 SER A 21 2.516 -6.087 -1.461 1.00 0.00 H new ATOM 0 HB3 SER A 21 2.718 -7.802 -1.760 1.00 0.00 H new ATOM 0 HG SER A 21 1.948 -6.731 0.484 1.00 0.00 H new ATOM 297 N ALA A 22 4.771 -4.362 -1.529 1.00 0.00 N ATOM 298 CA ALA A 22 5.119 -3.013 -1.102 1.00 0.00 C ATOM 299 C ALA A 22 3.920 -2.075 -1.213 1.00 0.00 C ATOM 300 O ALA A 22 3.527 -1.682 -2.312 1.00 0.00 O ATOM 301 CB ALA A 22 6.285 -2.482 -1.922 1.00 0.00 C ATOM 0 H ALA A 22 4.372 -4.418 -2.466 1.00 0.00 H new ATOM 0 HA ALA A 22 5.417 -3.057 -0.055 1.00 0.00 H new ATOM 0 HB1 ALA A 22 6.533 -1.473 -1.591 1.00 0.00 H new ATOM 0 HB2 ALA A 22 7.150 -3.131 -1.787 1.00 0.00 H new ATOM 0 HB3 ALA A 22 6.008 -2.460 -2.976 1.00 0.00 H new ATOM 307 N THR A 23 3.342 -1.723 -0.069 1.00 0.00 N ATOM 308 CA THR A 23 2.188 -0.835 -0.039 1.00 0.00 C ATOM 309 C THR A 23 2.588 0.572 0.395 1.00 0.00 C ATOM 310 O THR A 23 3.501 0.745 1.203 1.00 0.00 O ATOM 311 CB THR A 23 1.097 -1.363 0.912 1.00 0.00 C ATOM 312 OG1 THR A 23 -0.044 -0.498 0.876 1.00 0.00 O ATOM 313 CG2 THR A 23 1.622 -1.460 2.336 1.00 0.00 C ATOM 0 H THR A 23 3.655 -2.040 0.849 1.00 0.00 H new ATOM 0 HA THR A 23 1.789 -0.800 -1.053 1.00 0.00 H new ATOM 0 HB THR A 23 0.807 -2.360 0.580 1.00 0.00 H new ATOM 0 HG1 THR A 23 -0.261 -0.282 -0.055 1.00 0.00 H new ATOM 0 HG21 THR A 23 0.834 -1.835 2.989 1.00 0.00 H new ATOM 0 HG22 THR A 23 2.472 -2.141 2.365 1.00 0.00 H new ATOM 0 HG23 THR A 23 1.936 -0.473 2.676 1.00 0.00 H new ATOM 321 N CYS A 24 1.898 1.570 -0.145 1.00 0.00 N ATOM 322 CA CYS A 24 2.182 2.962 0.188 1.00 0.00 C ATOM 323 C CYS A 24 0.898 3.712 0.531 1.00 0.00 C ATOM 324 O CYS A 24 -0.191 3.328 0.104 1.00 0.00 O ATOM 325 CB CYS A 24 2.893 3.652 -0.977 1.00 0.00 C ATOM 326 SG CYS A 24 2.955 5.454 -0.842 1.00 0.00 S ATOM 0 H CYS A 24 1.139 1.442 -0.814 1.00 0.00 H new ATOM 0 HA CYS A 24 2.834 2.975 1.061 1.00 0.00 H new ATOM 0 HB2 CYS A 24 3.911 3.268 -1.046 1.00 0.00 H new ATOM 0 HB3 CYS A 24 2.389 3.385 -1.906 1.00 0.00 H new ATOM 0 HG CYS A 24 3.383 5.959 -1.961 1.00 0.00 H new ATOM 332 N VAL A 25 1.034 4.783 1.306 1.00 0.00 N ATOM 333 CA VAL A 25 -0.115 5.585 1.709 1.00 0.00 C ATOM 334 C VAL A 25 -0.187 6.881 0.907 1.00 0.00 C ATOM 335 O VAL A 25 0.761 7.668 0.892 1.00 0.00 O ATOM 336 CB VAL A 25 -0.064 5.926 3.209 1.00 0.00 C ATOM 337 CG1 VAL A 25 -1.237 6.814 3.596 1.00 0.00 C ATOM 338 CG2 VAL A 25 -0.050 4.654 4.044 1.00 0.00 C ATOM 0 H VAL A 25 1.928 5.115 1.667 1.00 0.00 H new ATOM 0 HA VAL A 25 -1.004 4.987 1.511 1.00 0.00 H new ATOM 0 HB VAL A 25 0.857 6.475 3.408 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -1.184 7.044 4.660 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -1.197 7.740 3.022 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -2.172 6.295 3.384 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.014 4.914 5.102 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -0.952 4.077 3.843 1.00 0.00 H new ATOM 0 HG23 VAL A 25 0.826 4.059 3.786 1.00 0.00 H new ATOM 348 N LEU A 26 -1.316 7.096 0.242 1.00 0.00 N ATOM 349 CA LEU A 26 -1.514 8.297 -0.562 1.00 0.00 C ATOM 350 C LEU A 26 -2.522 9.234 0.096 1.00 0.00 C ATOM 351 O LEU A 26 -3.717 8.945 0.135 1.00 0.00 O ATOM 352 CB LEU A 26 -1.990 7.922 -1.966 1.00 0.00 C ATOM 353 CG LEU A 26 -2.501 9.073 -2.832 1.00 0.00 C ATOM 354 CD1 LEU A 26 -1.393 10.087 -3.079 1.00 0.00 C ATOM 355 CD2 LEU A 26 -3.048 8.548 -4.151 1.00 0.00 C ATOM 0 H LEU A 26 -2.109 6.454 0.243 1.00 0.00 H new ATOM 0 HA LEU A 26 -0.558 8.816 -0.636 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.166 7.438 -2.490 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -2.786 7.183 -1.873 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.311 9.571 -2.299 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.775 10.900 -3.697 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.047 10.488 -2.126 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.562 9.601 -3.591 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.407 9.382 -4.754 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.258 8.024 -4.690 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.871 7.861 -3.956 1.00 0.00 H new ATOM 367 N GLU A 27 -2.030 10.358 0.608 1.00 0.00 N ATOM 368 CA GLU A 27 -2.890 11.337 1.263 1.00 0.00 C ATOM 369 C GLU A 27 -2.835 12.679 0.539 1.00 0.00 C ATOM 370 O GLU A 27 -1.793 13.071 0.014 1.00 0.00 O ATOM 371 CB GLU A 27 -2.474 11.517 2.725 1.00 0.00 C ATOM 372 CG GLU A 27 -3.342 12.503 3.488 1.00 0.00 C ATOM 373 CD GLU A 27 -3.003 12.558 4.965 1.00 0.00 C ATOM 374 OE1 GLU A 27 -1.880 12.989 5.299 1.00 0.00 O ATOM 375 OE2 GLU A 27 -3.860 12.170 5.786 1.00 0.00 O ATOM 0 H GLU A 27 -1.043 10.613 0.582 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.914 10.965 1.227 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -2.511 10.550 3.226 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.438 11.855 2.760 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -3.224 13.496 3.055 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -4.390 12.226 3.370 1.00 0.00 H new ATOM 382 N GLN A 28 -3.966 13.377 0.513 1.00 0.00 N ATOM 383 CA GLN A 28 -4.047 14.675 -0.147 1.00 0.00 C ATOM 384 C GLN A 28 -4.854 15.663 0.689 1.00 0.00 C ATOM 385 O GLN A 28 -5.858 15.314 1.309 1.00 0.00 O ATOM 386 CB GLN A 28 -4.679 14.526 -1.532 1.00 0.00 C ATOM 387 CG GLN A 28 -3.835 13.715 -2.503 1.00 0.00 C ATOM 388 CD GLN A 28 -4.398 13.719 -3.910 1.00 0.00 C ATOM 389 OE1 GLN A 28 -5.329 14.466 -4.217 1.00 0.00 O ATOM 390 NE2 GLN A 28 -3.837 12.882 -4.775 1.00 0.00 N ATOM 0 H GLN A 28 -4.838 13.066 0.941 1.00 0.00 H new ATOM 0 HA GLN A 28 -3.034 15.063 -0.256 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -5.655 14.051 -1.428 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -4.850 15.517 -1.953 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -2.822 14.116 -2.520 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -3.765 12.687 -2.147 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -3.068 12.281 -4.478 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -4.175 12.840 -5.736 1.00 0.00 H new ATOM 399 N PRO A 29 -4.404 16.926 0.709 1.00 0.00 N ATOM 400 CA PRO A 29 -5.070 17.991 1.466 1.00 0.00 C ATOM 401 C PRO A 29 -6.416 18.375 0.864 1.00 0.00 C ATOM 402 O PRO A 29 -6.495 18.797 -0.289 1.00 0.00 O ATOM 403 CB PRO A 29 -4.088 19.161 1.371 1.00 0.00 C ATOM 404 CG PRO A 29 -3.317 18.908 0.121 1.00 0.00 C ATOM 405 CD PRO A 29 -3.213 17.413 -0.006 1.00 0.00 C ATOM 0 HA PRO A 29 -5.293 17.686 2.488 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -4.613 20.115 1.326 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -3.432 19.198 2.240 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -3.823 19.339 -0.743 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.329 19.365 0.173 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -3.214 17.097 -1.049 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -2.294 17.035 0.441 1.00 0.00 H new ATOM 413 N GLY A 30 -7.477 18.228 1.653 1.00 0.00 N ATOM 414 CA GLY A 30 -8.807 18.564 1.180 1.00 0.00 C ATOM 415 C GLY A 30 -9.497 19.582 2.066 1.00 0.00 C ATOM 416 O GLY A 30 -9.062 19.834 3.189 1.00 0.00 O ATOM 0 H GLY A 30 -7.438 17.882 2.612 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -8.740 18.956 0.165 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -9.412 17.659 1.133 1.00 0.00 H new ATOM 420 N ALA A 31 -10.576 20.171 1.559 1.00 0.00 N ATOM 421 CA ALA A 31 -11.328 21.167 2.313 1.00 0.00 C ATOM 422 C ALA A 31 -11.456 20.764 3.778 1.00 0.00 C ATOM 423 O ALA A 31 -11.064 21.511 4.675 1.00 0.00 O ATOM 424 CB ALA A 31 -12.704 21.366 1.696 1.00 0.00 C ATOM 0 H ALA A 31 -10.948 19.976 0.630 1.00 0.00 H new ATOM 0 HA ALA A 31 -10.782 22.110 2.269 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -13.255 22.112 2.269 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -12.595 21.706 0.666 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -13.249 20.422 1.710 1.00 0.00 H new ATOM 430 N LEU A 32 -12.009 19.579 4.015 1.00 0.00 N ATOM 431 CA LEU A 32 -12.191 19.077 5.373 1.00 0.00 C ATOM 432 C LEU A 32 -10.857 19.010 6.111 1.00 0.00 C ATOM 433 O LEU A 32 -10.787 19.263 7.313 1.00 0.00 O ATOM 434 CB LEU A 32 -12.841 17.693 5.343 1.00 0.00 C ATOM 435 CG LEU A 32 -14.092 17.558 4.476 1.00 0.00 C ATOM 436 CD1 LEU A 32 -14.362 16.097 4.150 1.00 0.00 C ATOM 437 CD2 LEU A 32 -15.294 18.182 5.171 1.00 0.00 C ATOM 0 H LEU A 32 -12.339 18.948 3.285 1.00 0.00 H new ATOM 0 HA LEU A 32 -12.846 19.767 5.905 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -12.101 16.974 4.992 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -13.099 17.413 6.364 1.00 0.00 H new ATOM 0 HG LEU A 32 -13.921 18.092 3.541 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.257 16.021 3.532 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -13.511 15.682 3.609 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -14.512 15.540 5.075 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -16.175 18.076 4.539 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -15.467 17.678 6.122 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.102 19.240 5.351 1.00 0.00 H new ATOM 449 N GLY A 33 -9.800 18.667 5.382 1.00 0.00 N ATOM 450 CA GLY A 33 -8.482 18.574 5.983 1.00 0.00 C ATOM 451 C GLY A 33 -7.529 17.726 5.165 1.00 0.00 C ATOM 452 O GLY A 33 -6.606 18.247 4.540 1.00 0.00 O ATOM 0 H GLY A 33 -9.833 18.452 4.386 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -8.066 19.575 6.096 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -8.572 18.151 6.984 1.00 0.00 H new ATOM 456 N ALA A 34 -7.753 16.417 5.168 1.00 0.00 N ATOM 457 CA ALA A 34 -6.906 15.494 4.420 1.00 0.00 C ATOM 458 C ALA A 34 -7.475 14.081 4.450 1.00 0.00 C ATOM 459 O ALA A 34 -7.965 13.620 5.480 1.00 0.00 O ATOM 460 CB ALA A 34 -5.490 15.509 4.976 1.00 0.00 C ATOM 0 H ALA A 34 -8.514 15.970 5.680 1.00 0.00 H new ATOM 0 HA ALA A 34 -6.879 15.824 3.381 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.869 14.816 4.409 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -5.078 16.515 4.895 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -5.507 15.207 6.023 1.00 0.00 H new ATOM 466 N GLN A 35 -7.407 13.396 3.312 1.00 0.00 N ATOM 467 CA GLN A 35 -7.916 12.034 3.209 1.00 0.00 C ATOM 468 C GLN A 35 -6.942 11.145 2.443 1.00 0.00 C ATOM 469 O GLN A 35 -6.158 11.627 1.625 1.00 0.00 O ATOM 470 CB GLN A 35 -9.281 12.028 2.518 1.00 0.00 C ATOM 471 CG GLN A 35 -9.377 13.002 1.355 1.00 0.00 C ATOM 472 CD GLN A 35 -10.797 13.166 0.847 1.00 0.00 C ATOM 473 OE1 GLN A 35 -11.298 12.333 0.091 1.00 0.00 O ATOM 474 NE2 GLN A 35 -11.452 14.243 1.262 1.00 0.00 N ATOM 0 H GLN A 35 -7.005 13.762 2.449 1.00 0.00 H new ATOM 0 HA GLN A 35 -8.025 11.637 4.218 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -9.492 11.021 2.157 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -10.051 12.272 3.250 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -8.992 13.973 1.666 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -8.742 12.654 0.541 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -10.997 14.907 1.889 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -12.411 14.407 0.954 1.00 0.00 H new ATOM 483 N ILE A 36 -6.996 9.845 2.715 1.00 0.00 N ATOM 484 CA ILE A 36 -6.119 8.889 2.050 1.00 0.00 C ATOM 485 C ILE A 36 -6.875 8.094 0.991 1.00 0.00 C ATOM 486 O ILE A 36 -8.097 8.193 0.879 1.00 0.00 O ATOM 487 CB ILE A 36 -5.487 7.909 3.057 1.00 0.00 C ATOM 488 CG1 ILE A 36 -6.521 7.481 4.101 1.00 0.00 C ATOM 489 CG2 ILE A 36 -4.280 8.547 3.729 1.00 0.00 C ATOM 490 CD1 ILE A 36 -6.047 6.355 4.993 1.00 0.00 C ATOM 0 H ILE A 36 -7.637 9.430 3.391 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.328 9.467 1.572 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.152 7.022 2.519 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -6.778 8.341 4.720 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -7.433 7.171 3.591 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.844 7.843 4.438 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.539 8.808 2.974 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.592 9.448 4.258 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -6.830 6.103 5.708 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.817 5.481 4.384 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -5.152 6.669 5.530 1.00 0.00 H new ATOM 502 N LEU A 37 -6.140 7.303 0.216 1.00 0.00 N ATOM 503 CA LEU A 37 -6.740 6.488 -0.834 1.00 0.00 C ATOM 504 C LEU A 37 -6.744 5.014 -0.444 1.00 0.00 C ATOM 505 O LEU A 37 -5.757 4.497 0.084 1.00 0.00 O ATOM 506 CB LEU A 37 -5.983 6.678 -2.149 1.00 0.00 C ATOM 507 CG LEU A 37 -6.233 5.621 -3.226 1.00 0.00 C ATOM 508 CD1 LEU A 37 -7.444 5.992 -4.067 1.00 0.00 C ATOM 509 CD2 LEU A 37 -5.002 5.454 -4.105 1.00 0.00 C ATOM 0 H LEU A 37 -5.127 7.209 0.295 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.772 6.812 -0.966 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.245 7.654 -2.558 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.915 6.700 -1.931 1.00 0.00 H new ATOM 0 HG LEU A 37 -6.436 4.670 -2.734 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.606 5.229 -4.828 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.324 6.060 -3.428 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.271 6.954 -4.549 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.198 4.698 -4.866 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.768 6.403 -4.588 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -4.157 5.141 -3.492 1.00 0.00 H new ATOM 521 N LEU A 38 -7.857 4.340 -0.709 1.00 0.00 N ATOM 522 CA LEU A 38 -7.990 2.923 -0.387 1.00 0.00 C ATOM 523 C LEU A 38 -8.466 2.132 -1.600 1.00 0.00 C ATOM 524 O LEU A 38 -9.531 2.406 -2.155 1.00 0.00 O ATOM 525 CB LEU A 38 -8.965 2.732 0.776 1.00 0.00 C ATOM 526 CG LEU A 38 -8.762 1.475 1.622 1.00 0.00 C ATOM 527 CD1 LEU A 38 -7.391 1.490 2.282 1.00 0.00 C ATOM 528 CD2 LEU A 38 -9.858 1.354 2.671 1.00 0.00 C ATOM 0 H LEU A 38 -8.681 4.752 -1.146 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.009 2.549 -0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -8.894 3.601 1.430 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.979 2.716 0.375 1.00 0.00 H new ATOM 0 HG LEU A 38 -8.817 0.607 0.965 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.265 0.587 2.880 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.618 1.528 1.514 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.306 2.366 2.925 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -9.697 0.453 3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -9.835 2.227 3.324 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -10.828 1.295 2.178 1.00 0.00 H new ATOM 540 N VAL A 39 -7.672 1.146 -2.007 1.00 0.00 N ATOM 541 CA VAL A 39 -8.015 0.312 -3.153 1.00 0.00 C ATOM 542 C VAL A 39 -8.499 -1.063 -2.706 1.00 0.00 C ATOM 543 O VAL A 39 -7.923 -1.672 -1.807 1.00 0.00 O ATOM 544 CB VAL A 39 -6.812 0.137 -4.100 1.00 0.00 C ATOM 545 CG1 VAL A 39 -6.460 1.460 -4.765 1.00 0.00 C ATOM 546 CG2 VAL A 39 -5.617 -0.423 -3.344 1.00 0.00 C ATOM 0 H VAL A 39 -6.787 0.906 -1.560 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.817 0.821 -3.687 1.00 0.00 H new ATOM 0 HB VAL A 39 -7.085 -0.574 -4.880 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.608 1.318 -5.430 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.314 1.817 -5.340 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.205 2.195 -4.001 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.776 -0.540 -4.028 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.340 0.262 -2.543 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.877 -1.392 -2.919 1.00 0.00 H new ATOM 556 N GLN A 40 -9.562 -1.544 -3.343 1.00 0.00 N ATOM 557 CA GLN A 40 -10.125 -2.848 -3.010 1.00 0.00 C ATOM 558 C GLN A 40 -9.574 -3.930 -3.933 1.00 0.00 C ATOM 559 O GLN A 40 -9.255 -3.667 -5.093 1.00 0.00 O ATOM 560 CB GLN A 40 -11.651 -2.807 -3.107 1.00 0.00 C ATOM 561 CG GLN A 40 -12.177 -2.996 -4.520 1.00 0.00 C ATOM 562 CD GLN A 40 -13.607 -2.517 -4.680 1.00 0.00 C ATOM 563 OE1 GLN A 40 -14.005 -2.064 -5.754 1.00 0.00 O ATOM 564 NE2 GLN A 40 -14.386 -2.614 -3.610 1.00 0.00 N ATOM 0 H GLN A 40 -10.050 -1.052 -4.091 1.00 0.00 H new ATOM 0 HA GLN A 40 -9.839 -3.089 -1.986 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -12.068 -3.584 -2.466 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -12.006 -1.851 -2.721 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -11.537 -2.455 -5.217 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -12.119 -4.051 -4.787 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -14.013 -2.996 -2.741 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -15.357 -2.307 -3.657 1.00 0.00 H new ATOM 573 N ARG A 41 -9.464 -5.146 -3.410 1.00 0.00 N ATOM 574 CA ARG A 41 -8.950 -6.268 -4.187 1.00 0.00 C ATOM 575 C ARG A 41 -9.935 -6.668 -5.283 1.00 0.00 C ATOM 576 O ARG A 41 -11.138 -6.430 -5.185 1.00 0.00 O ATOM 577 CB ARG A 41 -8.674 -7.464 -3.274 1.00 0.00 C ATOM 578 CG ARG A 41 -7.407 -7.319 -2.448 1.00 0.00 C ATOM 579 CD ARG A 41 -6.165 -7.625 -3.272 1.00 0.00 C ATOM 580 NE ARG A 41 -5.731 -6.470 -4.055 1.00 0.00 N ATOM 581 CZ ARG A 41 -4.940 -6.559 -5.118 1.00 0.00 C ATOM 582 NH1 ARG A 41 -4.500 -7.742 -5.525 1.00 0.00 N ATOM 583 NH2 ARG A 41 -4.588 -5.463 -5.779 1.00 0.00 N ATOM 0 H ARG A 41 -9.724 -5.380 -2.452 1.00 0.00 H new ATOM 0 HA ARG A 41 -8.018 -5.955 -4.657 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -9.522 -7.601 -2.603 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -8.600 -8.365 -3.882 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -7.343 -6.305 -2.054 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -7.451 -7.991 -1.591 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -5.358 -7.938 -2.609 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -6.370 -8.461 -3.941 1.00 0.00 H new ATOM 0 HE ARG A 41 -6.053 -5.545 -3.770 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -4.769 -8.587 -5.021 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -3.893 -7.807 -6.342 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -4.925 -4.551 -5.471 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -3.980 -5.533 -6.595 1.00 0.00 H new ATOM 597 N PRO A 42 -9.412 -7.289 -6.350 1.00 0.00 N ATOM 598 CA PRO A 42 -10.227 -7.734 -7.484 1.00 0.00 C ATOM 599 C PRO A 42 -11.132 -8.906 -7.123 1.00 0.00 C ATOM 600 O PRO A 42 -10.997 -9.501 -6.054 1.00 0.00 O ATOM 601 CB PRO A 42 -9.187 -8.161 -8.523 1.00 0.00 C ATOM 602 CG PRO A 42 -7.981 -8.520 -7.725 1.00 0.00 C ATOM 603 CD PRO A 42 -7.985 -7.604 -6.533 1.00 0.00 C ATOM 0 HA PRO A 42 -10.901 -6.952 -7.833 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -9.539 -9.008 -9.111 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -8.973 -7.354 -9.224 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -8.015 -9.564 -7.415 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -7.072 -8.392 -8.313 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -7.564 -8.089 -5.652 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -7.395 -6.706 -6.715 1.00 0.00 H new ATOM 611 N ASN A 43 -12.054 -9.236 -8.022 1.00 0.00 N ATOM 612 CA ASN A 43 -12.981 -10.339 -7.797 1.00 0.00 C ATOM 613 C ASN A 43 -12.285 -11.501 -7.094 1.00 0.00 C ATOM 614 O ASN A 43 -12.727 -11.957 -6.039 1.00 0.00 O ATOM 615 CB ASN A 43 -13.575 -10.813 -9.125 1.00 0.00 C ATOM 616 CG ASN A 43 -14.001 -9.660 -10.012 1.00 0.00 C ATOM 617 OD1 ASN A 43 -13.403 -9.415 -11.061 1.00 0.00 O ATOM 618 ND2 ASN A 43 -15.039 -8.944 -9.595 1.00 0.00 N ATOM 0 H ASN A 43 -12.179 -8.755 -8.913 1.00 0.00 H new ATOM 0 HA ASN A 43 -13.785 -9.979 -7.155 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -12.840 -11.421 -9.652 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -14.435 -11.453 -8.927 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -15.371 -8.155 -10.150 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -15.504 -9.183 -8.719 1.00 0.00 H new ATOM 625 N SER A 44 -11.193 -11.973 -7.686 1.00 0.00 N ATOM 626 CA SER A 44 -10.437 -13.084 -7.119 1.00 0.00 C ATOM 627 C SER A 44 -9.227 -12.576 -6.340 1.00 0.00 C ATOM 628 O SER A 44 -8.845 -11.413 -6.455 1.00 0.00 O ATOM 629 CB SER A 44 -9.981 -14.036 -8.226 1.00 0.00 C ATOM 630 OG SER A 44 -9.439 -15.228 -7.684 1.00 0.00 O ATOM 0 H SER A 44 -10.812 -11.604 -8.557 1.00 0.00 H new ATOM 0 HA SER A 44 -11.090 -13.623 -6.432 1.00 0.00 H new ATOM 0 HB2 SER A 44 -10.825 -14.278 -8.872 1.00 0.00 H new ATOM 0 HB3 SER A 44 -9.234 -13.543 -8.848 1.00 0.00 H new ATOM 0 HG SER A 44 -9.157 -15.820 -8.412 1.00 0.00 H new ATOM 636 N GLY A 45 -8.631 -13.458 -5.544 1.00 0.00 N ATOM 637 CA GLY A 45 -7.472 -13.082 -4.756 1.00 0.00 C ATOM 638 C GLY A 45 -7.749 -13.112 -3.266 1.00 0.00 C ATOM 639 O GLY A 45 -8.763 -12.586 -2.805 1.00 0.00 O ATOM 0 H GLY A 45 -8.930 -14.427 -5.431 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.648 -13.758 -4.983 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -7.151 -12.081 -5.043 1.00 0.00 H new ATOM 643 N LEU A 46 -6.847 -13.730 -2.512 1.00 0.00 N ATOM 644 CA LEU A 46 -7.001 -13.828 -1.064 1.00 0.00 C ATOM 645 C LEU A 46 -7.654 -12.571 -0.498 1.00 0.00 C ATOM 646 O LEU A 46 -7.253 -11.451 -0.821 1.00 0.00 O ATOM 647 CB LEU A 46 -5.640 -14.051 -0.401 1.00 0.00 C ATOM 648 CG LEU A 46 -5.180 -15.504 -0.284 1.00 0.00 C ATOM 649 CD1 LEU A 46 -3.717 -15.570 0.125 1.00 0.00 C ATOM 650 CD2 LEU A 46 -6.049 -16.259 0.713 1.00 0.00 C ATOM 0 H LEU A 46 -6.003 -14.170 -2.878 1.00 0.00 H new ATOM 0 HA LEU A 46 -7.648 -14.679 -0.850 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -4.889 -13.497 -0.964 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -5.671 -13.619 0.599 1.00 0.00 H new ATOM 0 HG LEU A 46 -5.284 -15.978 -1.260 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -3.408 -16.612 0.203 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.107 -15.066 -0.624 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.586 -15.079 1.090 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.708 -17.292 0.784 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -5.976 -15.785 1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.086 -16.242 0.378 1.00 0.00 H new ATOM 662 N LEU A 47 -8.659 -12.762 0.348 1.00 0.00 N ATOM 663 CA LEU A 47 -9.367 -11.644 0.961 1.00 0.00 C ATOM 664 C LEU A 47 -9.964 -10.728 -0.103 1.00 0.00 C ATOM 665 O LEU A 47 -9.769 -9.514 -0.072 1.00 0.00 O ATOM 666 CB LEU A 47 -8.421 -10.847 1.863 1.00 0.00 C ATOM 667 CG LEU A 47 -8.099 -11.476 3.218 1.00 0.00 C ATOM 668 CD1 LEU A 47 -6.960 -10.729 3.895 1.00 0.00 C ATOM 669 CD2 LEU A 47 -9.334 -11.488 4.108 1.00 0.00 C ATOM 0 H LEU A 47 -9.003 -13.681 0.626 1.00 0.00 H new ATOM 0 HA LEU A 47 -10.180 -12.049 1.564 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -7.485 -10.690 1.326 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.858 -9.864 2.036 1.00 0.00 H new ATOM 0 HG LEU A 47 -7.784 -12.507 3.053 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -6.744 -11.191 4.859 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.072 -10.772 3.265 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.247 -9.689 4.047 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -9.086 -11.939 5.069 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -9.679 -10.466 4.266 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -10.123 -12.067 3.628 1.00 0.00 H new ATOM 681 N ALA A 48 -10.694 -11.319 -1.043 1.00 0.00 N ATOM 682 CA ALA A 48 -11.324 -10.558 -2.114 1.00 0.00 C ATOM 683 C ALA A 48 -12.490 -9.729 -1.586 1.00 0.00 C ATOM 684 O ALA A 48 -13.104 -10.075 -0.578 1.00 0.00 O ATOM 685 CB ALA A 48 -11.794 -11.491 -3.220 1.00 0.00 C ATOM 0 H ALA A 48 -10.864 -12.324 -1.084 1.00 0.00 H new ATOM 0 HA ALA A 48 -10.582 -9.873 -2.524 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -12.263 -10.908 -4.013 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -10.940 -12.034 -3.625 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -12.516 -12.200 -2.815 1.00 0.00 H new ATOM 691 N GLY A 49 -12.790 -8.632 -2.274 1.00 0.00 N ATOM 692 CA GLY A 49 -13.881 -7.770 -1.859 1.00 0.00 C ATOM 693 C GLY A 49 -13.569 -7.013 -0.584 1.00 0.00 C ATOM 694 O GLY A 49 -14.475 -6.542 0.105 1.00 0.00 O ATOM 0 H GLY A 49 -12.297 -8.325 -3.112 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -14.101 -7.059 -2.655 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -14.778 -8.371 -1.711 1.00 0.00 H new ATOM 698 N LEU A 50 -12.285 -6.899 -0.265 1.00 0.00 N ATOM 699 CA LEU A 50 -11.854 -6.195 0.938 1.00 0.00 C ATOM 700 C LEU A 50 -11.140 -4.895 0.584 1.00 0.00 C ATOM 701 O LEU A 50 -10.455 -4.811 -0.436 1.00 0.00 O ATOM 702 CB LEU A 50 -10.933 -7.087 1.772 1.00 0.00 C ATOM 703 CG LEU A 50 -11.620 -7.987 2.800 1.00 0.00 C ATOM 704 CD1 LEU A 50 -12.348 -7.151 3.841 1.00 0.00 C ATOM 705 CD2 LEU A 50 -12.584 -8.942 2.112 1.00 0.00 C ATOM 0 H LEU A 50 -11.523 -7.285 -0.823 1.00 0.00 H new ATOM 0 HA LEU A 50 -12.741 -5.951 1.523 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -10.359 -7.717 1.093 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -10.220 -6.450 2.295 1.00 0.00 H new ATOM 0 HG LEU A 50 -10.855 -8.576 3.307 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -12.830 -7.809 4.564 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -11.634 -6.508 4.356 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -13.102 -6.535 3.351 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -13.064 -9.575 2.858 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -13.343 -8.371 1.578 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -12.036 -9.566 1.406 1.00 0.00 H new ATOM 717 N TRP A 51 -11.300 -3.887 1.432 1.00 0.00 N ATOM 718 CA TRP A 51 -10.668 -2.592 1.208 1.00 0.00 C ATOM 719 C TRP A 51 -9.303 -2.529 1.884 1.00 0.00 C ATOM 720 O TRP A 51 -9.125 -3.036 2.992 1.00 0.00 O ATOM 721 CB TRP A 51 -11.562 -1.468 1.733 1.00 0.00 C ATOM 722 CG TRP A 51 -12.896 -1.403 1.052 1.00 0.00 C ATOM 723 CD1 TRP A 51 -14.061 -1.977 1.476 1.00 0.00 C ATOM 724 CD2 TRP A 51 -13.201 -0.729 -0.174 1.00 0.00 C ATOM 725 NE1 TRP A 51 -15.072 -1.700 0.587 1.00 0.00 N ATOM 726 CE2 TRP A 51 -14.571 -0.935 -0.433 1.00 0.00 C ATOM 727 CE3 TRP A 51 -12.451 0.030 -1.076 1.00 0.00 C ATOM 728 CZ2 TRP A 51 -15.202 -0.410 -1.558 1.00 0.00 C ATOM 729 CZ3 TRP A 51 -13.080 0.550 -2.191 1.00 0.00 C ATOM 730 CH2 TRP A 51 -14.444 0.329 -2.425 1.00 0.00 C ATOM 0 H TRP A 51 -11.862 -3.941 2.282 1.00 0.00 H new ATOM 0 HA TRP A 51 -10.528 -2.465 0.135 1.00 0.00 H new ATOM 0 HB2 TRP A 51 -11.715 -1.605 2.804 1.00 0.00 H new ATOM 0 HB3 TRP A 51 -11.049 -0.515 1.604 1.00 0.00 H new ATOM 0 HD1 TRP A 51 -14.171 -2.562 2.377 1.00 0.00 H new ATOM 0 HE1 TRP A 51 -16.039 -2.013 0.673 1.00 0.00 H new ATOM 0 HE3 TRP A 51 -11.399 0.207 -0.905 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 -16.253 -0.580 -1.740 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 -12.510 1.138 -2.895 1.00 0.00 H new ATOM 0 HH2 TRP A 51 -14.905 0.750 -3.306 1.00 0.00 H new ATOM 741 N GLU A 52 -8.342 -1.904 1.211 1.00 0.00 N ATOM 742 CA GLU A 52 -6.992 -1.777 1.749 1.00 0.00 C ATOM 743 C GLU A 52 -6.144 -0.855 0.877 1.00 0.00 C ATOM 744 O GLU A 52 -6.595 -0.379 -0.165 1.00 0.00 O ATOM 745 CB GLU A 52 -6.328 -3.152 1.852 1.00 0.00 C ATOM 746 CG GLU A 52 -6.194 -3.864 0.517 1.00 0.00 C ATOM 747 CD GLU A 52 -5.625 -5.263 0.658 1.00 0.00 C ATOM 748 OE1 GLU A 52 -6.087 -6.005 1.550 1.00 0.00 O ATOM 749 OE2 GLU A 52 -4.720 -5.616 -0.126 1.00 0.00 O ATOM 0 H GLU A 52 -8.473 -1.478 0.293 1.00 0.00 H new ATOM 0 HA GLU A 52 -7.065 -1.341 2.746 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -5.338 -3.036 2.293 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -6.909 -3.777 2.531 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.172 -3.920 0.039 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -5.551 -3.279 -0.140 1.00 0.00 H new ATOM 756 N PHE A 53 -4.913 -0.606 1.312 1.00 0.00 N ATOM 757 CA PHE A 53 -4.002 0.260 0.574 1.00 0.00 C ATOM 758 C PHE A 53 -3.382 -0.483 -0.608 1.00 0.00 C ATOM 759 O PHE A 53 -3.229 -1.705 -0.593 1.00 0.00 O ATOM 760 CB PHE A 53 -2.900 0.782 1.497 1.00 0.00 C ATOM 761 CG PHE A 53 -3.421 1.528 2.691 1.00 0.00 C ATOM 762 CD1 PHE A 53 -4.496 2.395 2.568 1.00 0.00 C ATOM 763 CD2 PHE A 53 -2.837 1.365 3.936 1.00 0.00 C ATOM 764 CE1 PHE A 53 -4.979 3.082 3.664 1.00 0.00 C ATOM 765 CE2 PHE A 53 -3.316 2.050 5.037 1.00 0.00 C ATOM 766 CZ PHE A 53 -4.388 2.911 4.901 1.00 0.00 C ATOM 0 H PHE A 53 -4.524 -0.992 2.172 1.00 0.00 H new ATOM 0 HA PHE A 53 -4.575 1.104 0.190 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -2.296 -0.058 1.839 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -2.241 1.438 0.928 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -4.961 2.535 1.603 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -1.997 0.695 4.048 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -5.818 3.753 3.554 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -2.853 1.912 6.003 1.00 0.00 H new ATOM 0 HZ PHE A 53 -4.763 3.449 5.759 1.00 0.00 H new ATOM 776 N PRO A 54 -3.019 0.271 -1.655 1.00 0.00 N ATOM 777 CA PRO A 54 -2.411 -0.294 -2.864 1.00 0.00 C ATOM 778 C PRO A 54 -0.996 -0.806 -2.615 1.00 0.00 C ATOM 779 O PRO A 54 -0.234 -0.208 -1.856 1.00 0.00 O ATOM 780 CB PRO A 54 -2.389 0.888 -3.835 1.00 0.00 C ATOM 781 CG PRO A 54 -2.375 2.096 -2.963 1.00 0.00 C ATOM 782 CD PRO A 54 -3.172 1.732 -1.741 1.00 0.00 C ATOM 0 HA PRO A 54 -2.965 -1.157 -3.234 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.510 0.855 -4.479 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -3.262 0.881 -4.487 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -1.355 2.373 -2.696 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -2.814 2.952 -3.475 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -2.790 2.229 -0.849 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -4.218 2.021 -1.843 1.00 0.00 H new ATOM 790 N SER A 55 -0.650 -1.915 -3.262 1.00 0.00 N ATOM 791 CA SER A 55 0.673 -2.508 -3.108 1.00 0.00 C ATOM 792 C SER A 55 1.167 -3.083 -4.432 1.00 0.00 C ATOM 793 O SER A 55 0.374 -3.508 -5.273 1.00 0.00 O ATOM 794 CB SER A 55 0.641 -3.607 -2.044 1.00 0.00 C ATOM 795 OG SER A 55 0.302 -4.860 -2.612 1.00 0.00 O ATOM 0 H SER A 55 -1.267 -2.420 -3.897 1.00 0.00 H new ATOM 0 HA SER A 55 1.361 -1.724 -2.791 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.615 -3.676 -1.559 1.00 0.00 H new ATOM 0 HB3 SER A 55 -0.082 -3.348 -1.271 1.00 0.00 H new ATOM 0 HG SER A 55 0.290 -5.545 -1.911 1.00 0.00 H new ATOM 801 N VAL A 56 2.484 -3.090 -4.612 1.00 0.00 N ATOM 802 CA VAL A 56 3.086 -3.613 -5.832 1.00 0.00 C ATOM 803 C VAL A 56 3.985 -4.809 -5.535 1.00 0.00 C ATOM 804 O VAL A 56 4.086 -5.253 -4.390 1.00 0.00 O ATOM 805 CB VAL A 56 3.912 -2.533 -6.558 1.00 0.00 C ATOM 806 CG1 VAL A 56 3.059 -1.304 -6.833 1.00 0.00 C ATOM 807 CG2 VAL A 56 5.142 -2.166 -5.741 1.00 0.00 C ATOM 0 H VAL A 56 3.154 -2.739 -3.928 1.00 0.00 H new ATOM 0 HA VAL A 56 2.267 -3.930 -6.477 1.00 0.00 H new ATOM 0 HB VAL A 56 4.245 -2.936 -7.514 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.659 -0.552 -7.346 1.00 0.00 H new ATOM 0 HG12 VAL A 56 2.212 -1.582 -7.460 1.00 0.00 H new ATOM 0 HG13 VAL A 56 2.694 -0.896 -5.890 1.00 0.00 H new ATOM 0 HG21 VAL A 56 5.714 -1.402 -6.268 1.00 0.00 H new ATOM 0 HG22 VAL A 56 4.832 -1.781 -4.769 1.00 0.00 H new ATOM 0 HG23 VAL A 56 5.762 -3.051 -5.600 1.00 0.00 H new ATOM 817 N THR A 57 4.635 -5.325 -6.571 1.00 0.00 N ATOM 818 CA THR A 57 5.525 -6.470 -6.422 1.00 0.00 C ATOM 819 C THR A 57 6.805 -6.080 -5.691 1.00 0.00 C ATOM 820 O THR A 57 7.429 -5.068 -6.010 1.00 0.00 O ATOM 821 CB THR A 57 5.892 -7.079 -7.788 1.00 0.00 C ATOM 822 OG1 THR A 57 6.201 -6.037 -8.722 1.00 0.00 O ATOM 823 CG2 THR A 57 4.751 -7.928 -8.328 1.00 0.00 C ATOM 0 H THR A 57 4.563 -4.969 -7.524 1.00 0.00 H new ATOM 0 HA THR A 57 4.987 -7.214 -5.835 1.00 0.00 H new ATOM 0 HB THR A 57 6.765 -7.717 -7.653 1.00 0.00 H new ATOM 0 HG1 THR A 57 6.435 -6.432 -9.588 1.00 0.00 H new ATOM 0 HG21 THR A 57 5.035 -8.347 -9.293 1.00 0.00 H new ATOM 0 HG22 THR A 57 4.538 -8.737 -7.630 1.00 0.00 H new ATOM 0 HG23 THR A 57 3.862 -7.309 -8.448 1.00 0.00 H new ATOM 831 N TRP A 58 7.191 -6.889 -4.711 1.00 0.00 N ATOM 832 CA TRP A 58 8.398 -6.628 -3.935 1.00 0.00 C ATOM 833 C TRP A 58 9.598 -6.414 -4.852 1.00 0.00 C ATOM 834 O TRP A 58 9.616 -6.889 -5.987 1.00 0.00 O ATOM 835 CB TRP A 58 8.674 -7.787 -2.976 1.00 0.00 C ATOM 836 CG TRP A 58 9.881 -7.572 -2.116 1.00 0.00 C ATOM 837 CD1 TRP A 58 9.953 -6.824 -0.975 1.00 0.00 C ATOM 838 CD2 TRP A 58 11.192 -8.108 -2.329 1.00 0.00 C ATOM 839 NE1 TRP A 58 11.228 -6.864 -0.466 1.00 0.00 N ATOM 840 CE2 TRP A 58 12.007 -7.645 -1.278 1.00 0.00 C ATOM 841 CE3 TRP A 58 11.755 -8.935 -3.304 1.00 0.00 C ATOM 842 CZ2 TRP A 58 13.354 -7.983 -1.177 1.00 0.00 C ATOM 843 CZ3 TRP A 58 13.092 -9.269 -3.203 1.00 0.00 C ATOM 844 CH2 TRP A 58 13.880 -8.794 -2.146 1.00 0.00 C ATOM 0 H TRP A 58 6.686 -7.731 -4.435 1.00 0.00 H new ATOM 0 HA TRP A 58 8.239 -5.718 -3.357 1.00 0.00 H new ATOM 0 HB2 TRP A 58 7.803 -7.936 -2.337 1.00 0.00 H new ATOM 0 HB3 TRP A 58 8.806 -8.703 -3.553 1.00 0.00 H new ATOM 0 HD1 TRP A 58 9.128 -6.281 -0.537 1.00 0.00 H new ATOM 0 HE1 TRP A 58 11.544 -6.389 0.380 1.00 0.00 H new ATOM 0 HE3 TRP A 58 11.156 -9.307 -4.122 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 13.962 -7.618 -0.363 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 13.537 -9.907 -3.952 1.00 0.00 H new ATOM 0 HH2 TRP A 58 14.922 -9.073 -2.095 1.00 0.00 H new ATOM 855 N GLU A 59 10.599 -5.696 -4.351 1.00 0.00 N ATOM 856 CA GLU A 59 11.802 -5.420 -5.127 1.00 0.00 C ATOM 857 C GLU A 59 13.046 -5.487 -4.245 1.00 0.00 C ATOM 858 O GLU A 59 13.088 -4.934 -3.146 1.00 0.00 O ATOM 859 CB GLU A 59 11.705 -4.044 -5.788 1.00 0.00 C ATOM 860 CG GLU A 59 10.869 -4.035 -7.056 1.00 0.00 C ATOM 861 CD GLU A 59 11.188 -5.200 -7.973 1.00 0.00 C ATOM 862 OE1 GLU A 59 12.355 -5.315 -8.401 1.00 0.00 O ATOM 863 OE2 GLU A 59 10.270 -5.995 -8.264 1.00 0.00 O ATOM 0 H GLU A 59 10.600 -5.296 -3.413 1.00 0.00 H new ATOM 0 HA GLU A 59 11.886 -6.182 -5.902 1.00 0.00 H new ATOM 0 HB2 GLU A 59 11.278 -3.338 -5.076 1.00 0.00 H new ATOM 0 HB3 GLU A 59 12.709 -3.692 -6.023 1.00 0.00 H new ATOM 0 HG2 GLU A 59 9.812 -4.065 -6.790 1.00 0.00 H new ATOM 0 HG3 GLU A 59 11.037 -3.100 -7.591 1.00 0.00 H new ATOM 870 N PRO A 60 14.083 -6.180 -4.737 1.00 0.00 N ATOM 871 CA PRO A 60 15.347 -6.336 -4.010 1.00 0.00 C ATOM 872 C PRO A 60 16.132 -5.031 -3.926 1.00 0.00 C ATOM 873 O PRO A 60 17.114 -4.933 -3.190 1.00 0.00 O ATOM 874 CB PRO A 60 16.111 -7.367 -4.844 1.00 0.00 C ATOM 875 CG PRO A 60 15.550 -7.234 -6.218 1.00 0.00 C ATOM 876 CD PRO A 60 14.103 -6.865 -6.040 1.00 0.00 C ATOM 0 HA PRO A 60 15.187 -6.639 -2.975 1.00 0.00 H new ATOM 0 HB2 PRO A 60 17.183 -7.169 -4.833 1.00 0.00 H new ATOM 0 HB3 PRO A 60 15.969 -8.375 -4.454 1.00 0.00 H new ATOM 0 HG2 PRO A 60 16.081 -6.469 -6.784 1.00 0.00 H new ATOM 0 HG3 PRO A 60 15.650 -8.167 -6.772 1.00 0.00 H new ATOM 0 HD2 PRO A 60 13.753 -6.214 -6.841 1.00 0.00 H new ATOM 0 HD3 PRO A 60 13.461 -7.746 -6.041 1.00 0.00 H new ATOM 884 N SER A 61 15.692 -4.031 -4.683 1.00 0.00 N ATOM 885 CA SER A 61 16.357 -2.733 -4.696 1.00 0.00 C ATOM 886 C SER A 61 15.407 -1.633 -4.236 1.00 0.00 C ATOM 887 O SER A 61 14.296 -1.501 -4.751 1.00 0.00 O ATOM 888 CB SER A 61 16.879 -2.419 -6.100 1.00 0.00 C ATOM 889 OG SER A 61 17.959 -1.503 -6.048 1.00 0.00 O ATOM 0 H SER A 61 14.878 -4.095 -5.295 1.00 0.00 H new ATOM 0 HA SER A 61 17.198 -2.775 -4.004 1.00 0.00 H new ATOM 0 HB2 SER A 61 17.202 -3.340 -6.586 1.00 0.00 H new ATOM 0 HB3 SER A 61 16.074 -2.004 -6.706 1.00 0.00 H new ATOM 0 HG SER A 61 18.276 -1.319 -6.957 1.00 0.00 H new ATOM 895 N GLU A 62 15.852 -0.843 -3.263 1.00 0.00 N ATOM 896 CA GLU A 62 15.042 0.247 -2.733 1.00 0.00 C ATOM 897 C GLU A 62 14.513 1.130 -3.859 1.00 0.00 C ATOM 898 O GLU A 62 13.410 1.668 -3.773 1.00 0.00 O ATOM 899 CB GLU A 62 15.859 1.088 -1.751 1.00 0.00 C ATOM 900 CG GLU A 62 15.171 2.378 -1.336 1.00 0.00 C ATOM 901 CD GLU A 62 14.130 2.164 -0.256 1.00 0.00 C ATOM 902 OE1 GLU A 62 14.339 1.282 0.602 1.00 0.00 O ATOM 903 OE2 GLU A 62 13.105 2.878 -0.268 1.00 0.00 O ATOM 0 H GLU A 62 16.769 -0.938 -2.826 1.00 0.00 H new ATOM 0 HA GLU A 62 14.192 -0.189 -2.207 1.00 0.00 H new ATOM 0 HB2 GLU A 62 16.066 0.494 -0.861 1.00 0.00 H new ATOM 0 HB3 GLU A 62 16.821 1.328 -2.204 1.00 0.00 H new ATOM 0 HG2 GLU A 62 15.919 3.085 -0.979 1.00 0.00 H new ATOM 0 HG3 GLU A 62 14.697 2.829 -2.208 1.00 0.00 H new ATOM 910 N GLN A 63 15.310 1.275 -4.913 1.00 0.00 N ATOM 911 CA GLN A 63 14.923 2.094 -6.056 1.00 0.00 C ATOM 912 C GLN A 63 13.846 1.401 -6.883 1.00 0.00 C ATOM 913 O GLN A 63 12.790 1.975 -7.153 1.00 0.00 O ATOM 914 CB GLN A 63 16.141 2.393 -6.931 1.00 0.00 C ATOM 915 CG GLN A 63 15.855 3.373 -8.058 1.00 0.00 C ATOM 916 CD GLN A 63 17.117 3.967 -8.649 1.00 0.00 C ATOM 917 OE1 GLN A 63 18.222 3.487 -8.395 1.00 0.00 O ATOM 918 NE2 GLN A 63 16.962 5.019 -9.444 1.00 0.00 N ATOM 0 H GLN A 63 16.227 0.836 -4.999 1.00 0.00 H new ATOM 0 HA GLN A 63 14.517 3.032 -5.678 1.00 0.00 H new ATOM 0 HB2 GLN A 63 16.938 2.795 -6.305 1.00 0.00 H new ATOM 0 HB3 GLN A 63 16.510 1.460 -7.357 1.00 0.00 H new ATOM 0 HG2 GLN A 63 15.295 2.865 -8.843 1.00 0.00 H new ATOM 0 HG3 GLN A 63 15.221 4.176 -7.683 1.00 0.00 H new ATOM 0 HE21 GLN A 63 16.028 5.386 -9.629 1.00 0.00 H new ATOM 0 HE22 GLN A 63 17.777 5.461 -9.870 1.00 0.00 H new ATOM 927 N LEU A 64 14.118 0.164 -7.282 1.00 0.00 N ATOM 928 CA LEU A 64 13.171 -0.609 -8.079 1.00 0.00 C ATOM 929 C LEU A 64 11.786 -0.600 -7.440 1.00 0.00 C ATOM 930 O LEU A 64 10.772 -0.637 -8.134 1.00 0.00 O ATOM 931 CB LEU A 64 13.663 -2.048 -8.239 1.00 0.00 C ATOM 932 CG LEU A 64 14.708 -2.284 -9.331 1.00 0.00 C ATOM 933 CD1 LEU A 64 15.598 -1.060 -9.490 1.00 0.00 C ATOM 934 CD2 LEU A 64 15.543 -3.515 -9.013 1.00 0.00 C ATOM 0 H LEU A 64 14.986 -0.326 -7.067 1.00 0.00 H new ATOM 0 HA LEU A 64 13.099 -0.145 -9.063 1.00 0.00 H new ATOM 0 HB2 LEU A 64 14.081 -2.375 -7.287 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.802 -2.684 -8.445 1.00 0.00 H new ATOM 0 HG LEU A 64 14.189 -2.456 -10.274 1.00 0.00 H new ATOM 0 HD11 LEU A 64 16.336 -1.245 -10.271 1.00 0.00 H new ATOM 0 HD12 LEU A 64 14.988 -0.200 -9.764 1.00 0.00 H new ATOM 0 HD13 LEU A 64 16.109 -0.857 -8.549 1.00 0.00 H new ATOM 0 HD21 LEU A 64 16.281 -3.667 -9.801 1.00 0.00 H new ATOM 0 HD22 LEU A 64 16.053 -3.372 -8.060 1.00 0.00 H new ATOM 0 HD23 LEU A 64 14.894 -4.388 -8.950 1.00 0.00 H new ATOM 946 N GLN A 65 11.754 -0.550 -6.111 1.00 0.00 N ATOM 947 CA GLN A 65 10.493 -0.535 -5.379 1.00 0.00 C ATOM 948 C GLN A 65 9.776 0.798 -5.556 1.00 0.00 C ATOM 949 O GLN A 65 8.655 0.848 -6.060 1.00 0.00 O ATOM 950 CB GLN A 65 10.741 -0.802 -3.893 1.00 0.00 C ATOM 951 CG GLN A 65 9.465 -0.901 -3.073 1.00 0.00 C ATOM 952 CD GLN A 65 8.300 -1.456 -3.870 1.00 0.00 C ATOM 953 OE1 GLN A 65 7.304 -0.769 -4.095 1.00 0.00 O ATOM 954 NE2 GLN A 65 8.421 -2.707 -4.300 1.00 0.00 N ATOM 0 H GLN A 65 12.585 -0.519 -5.521 1.00 0.00 H new ATOM 0 HA GLN A 65 9.857 -1.323 -5.782 1.00 0.00 H new ATOM 0 HB2 GLN A 65 11.304 -1.729 -3.788 1.00 0.00 H new ATOM 0 HB3 GLN A 65 11.363 -0.004 -3.488 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.643 -1.537 -2.206 1.00 0.00 H new ATOM 0 HG3 GLN A 65 9.203 0.087 -2.695 1.00 0.00 H new ATOM 0 HE21 GLN A 65 9.265 -3.239 -4.090 1.00 0.00 H new ATOM 0 HE22 GLN A 65 7.670 -3.135 -4.841 1.00 0.00 H new ATOM 963 N ARG A 66 10.431 1.877 -5.139 1.00 0.00 N ATOM 964 CA ARG A 66 9.855 3.212 -5.251 1.00 0.00 C ATOM 965 C ARG A 66 9.552 3.553 -6.706 1.00 0.00 C ATOM 966 O ARG A 66 8.759 4.451 -6.993 1.00 0.00 O ATOM 967 CB ARG A 66 10.807 4.252 -4.659 1.00 0.00 C ATOM 968 CG ARG A 66 11.193 3.976 -3.216 1.00 0.00 C ATOM 969 CD ARG A 66 11.677 5.236 -2.516 1.00 0.00 C ATOM 970 NE ARG A 66 13.080 5.518 -2.806 1.00 0.00 N ATOM 971 CZ ARG A 66 13.756 6.523 -2.260 1.00 0.00 C ATOM 972 NH1 ARG A 66 13.160 7.337 -1.400 1.00 0.00 N ATOM 973 NH2 ARG A 66 15.031 6.715 -2.574 1.00 0.00 N ATOM 0 H ARG A 66 11.361 1.853 -4.721 1.00 0.00 H new ATOM 0 HA ARG A 66 8.920 3.225 -4.691 1.00 0.00 H new ATOM 0 HB2 ARG A 66 11.711 4.291 -5.266 1.00 0.00 H new ATOM 0 HB3 ARG A 66 10.340 5.235 -4.719 1.00 0.00 H new ATOM 0 HG2 ARG A 66 10.335 3.568 -2.681 1.00 0.00 H new ATOM 0 HG3 ARG A 66 11.977 3.219 -3.187 1.00 0.00 H new ATOM 0 HD2 ARG A 66 11.065 6.082 -2.828 1.00 0.00 H new ATOM 0 HD3 ARG A 66 11.544 5.127 -1.440 1.00 0.00 H new ATOM 0 HE ARG A 66 13.568 4.910 -3.464 1.00 0.00 H new ATOM 0 HH11 ARG A 66 12.180 7.192 -1.156 1.00 0.00 H new ATOM 0 HH12 ARG A 66 13.681 8.108 -0.982 1.00 0.00 H new ATOM 0 HH21 ARG A 66 15.493 6.091 -3.235 1.00 0.00 H new ATOM 0 HH22 ARG A 66 15.549 7.487 -2.154 1.00 0.00 H new ATOM 987 N LYS A 67 10.187 2.832 -7.623 1.00 0.00 N ATOM 988 CA LYS A 67 9.986 3.056 -9.050 1.00 0.00 C ATOM 989 C LYS A 67 8.646 2.487 -9.505 1.00 0.00 C ATOM 990 O LYS A 67 7.782 3.219 -9.989 1.00 0.00 O ATOM 991 CB LYS A 67 11.123 2.419 -9.852 1.00 0.00 C ATOM 992 CG LYS A 67 12.296 3.353 -10.090 1.00 0.00 C ATOM 993 CD LYS A 67 13.065 2.972 -11.344 1.00 0.00 C ATOM 994 CE LYS A 67 14.163 1.963 -11.041 1.00 0.00 C ATOM 995 NZ LYS A 67 14.427 1.067 -12.200 1.00 0.00 N ATOM 0 H LYS A 67 10.847 2.086 -7.403 1.00 0.00 H new ATOM 0 HA LYS A 67 9.983 4.131 -9.228 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.476 1.533 -9.325 1.00 0.00 H new ATOM 0 HB3 LYS A 67 10.735 2.084 -10.814 1.00 0.00 H new ATOM 0 HG2 LYS A 67 11.934 4.377 -10.181 1.00 0.00 H new ATOM 0 HG3 LYS A 67 12.965 3.326 -9.230 1.00 0.00 H new ATOM 0 HD2 LYS A 67 12.378 2.554 -12.080 1.00 0.00 H new ATOM 0 HD3 LYS A 67 13.503 3.865 -11.789 1.00 0.00 H new ATOM 0 HE2 LYS A 67 15.078 2.491 -10.774 1.00 0.00 H new ATOM 0 HE3 LYS A 67 13.877 1.364 -10.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 15.181 0.394 -11.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 13.560 0.544 -12.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 14.724 1.636 -13.018 1.00 0.00 H new ATOM 1009 N ALA A 68 8.478 1.178 -9.346 1.00 0.00 N ATOM 1010 CA ALA A 68 7.243 0.513 -9.739 1.00 0.00 C ATOM 1011 C ALA A 68 6.103 0.870 -8.792 1.00 0.00 C ATOM 1012 O ALA A 68 4.933 0.856 -9.179 1.00 0.00 O ATOM 1013 CB ALA A 68 7.445 -0.995 -9.781 1.00 0.00 C ATOM 0 H ALA A 68 9.183 0.557 -8.947 1.00 0.00 H new ATOM 0 HA ALA A 68 6.974 0.860 -10.737 1.00 0.00 H new ATOM 0 HB1 ALA A 68 6.514 -1.479 -10.076 1.00 0.00 H new ATOM 0 HB2 ALA A 68 8.225 -1.238 -10.503 1.00 0.00 H new ATOM 0 HB3 ALA A 68 7.741 -1.350 -8.794 1.00 0.00 H new ATOM 1019 N LEU A 69 6.450 1.189 -7.550 1.00 0.00 N ATOM 1020 CA LEU A 69 5.454 1.550 -6.547 1.00 0.00 C ATOM 1021 C LEU A 69 4.503 2.616 -7.081 1.00 0.00 C ATOM 1022 O LEU A 69 3.287 2.424 -7.101 1.00 0.00 O ATOM 1023 CB LEU A 69 6.141 2.054 -5.276 1.00 0.00 C ATOM 1024 CG LEU A 69 5.215 2.515 -4.150 1.00 0.00 C ATOM 1025 CD1 LEU A 69 4.102 1.503 -3.926 1.00 0.00 C ATOM 1026 CD2 LEU A 69 6.004 2.736 -2.868 1.00 0.00 C ATOM 0 H LEU A 69 7.413 1.205 -7.213 1.00 0.00 H new ATOM 0 HA LEU A 69 4.874 0.658 -6.311 1.00 0.00 H new ATOM 0 HB2 LEU A 69 6.779 1.258 -4.892 1.00 0.00 H new ATOM 0 HB3 LEU A 69 6.794 2.884 -5.545 1.00 0.00 H new ATOM 0 HG LEU A 69 4.762 3.463 -4.442 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.453 1.848 -3.121 1.00 0.00 H new ATOM 0 HD12 LEU A 69 3.519 1.395 -4.841 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.535 0.540 -3.655 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.329 3.064 -2.077 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.485 1.804 -2.571 1.00 0.00 H new ATOM 0 HD23 LEU A 69 6.764 3.499 -3.036 1.00 0.00 H new ATOM 1038 N LEU A 70 5.065 3.738 -7.516 1.00 0.00 N ATOM 1039 CA LEU A 70 4.268 4.834 -8.054 1.00 0.00 C ATOM 1040 C LEU A 70 3.489 4.388 -9.287 1.00 0.00 C ATOM 1041 O LEU A 70 2.293 4.656 -9.408 1.00 0.00 O ATOM 1042 CB LEU A 70 5.168 6.020 -8.408 1.00 0.00 C ATOM 1043 CG LEU A 70 5.962 6.628 -7.251 1.00 0.00 C ATOM 1044 CD1 LEU A 70 6.978 7.632 -7.771 1.00 0.00 C ATOM 1045 CD2 LEU A 70 5.025 7.284 -6.247 1.00 0.00 C ATOM 0 H LEU A 70 6.070 3.913 -7.507 1.00 0.00 H new ATOM 0 HA LEU A 70 3.556 5.141 -7.288 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.871 5.700 -9.177 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.549 6.802 -8.848 1.00 0.00 H new ATOM 0 HG LEU A 70 6.500 5.827 -6.744 1.00 0.00 H new ATOM 0 HD11 LEU A 70 7.534 8.054 -6.934 1.00 0.00 H new ATOM 0 HD12 LEU A 70 7.669 7.132 -8.450 1.00 0.00 H new ATOM 0 HD13 LEU A 70 6.461 8.431 -8.303 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.608 7.711 -5.431 1.00 0.00 H new ATOM 0 HD22 LEU A 70 4.458 8.074 -6.740 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.337 6.538 -5.850 1.00 0.00 H new ATOM 1057 N GLN A 71 4.174 3.703 -10.197 1.00 0.00 N ATOM 1058 CA GLN A 71 3.544 3.218 -11.420 1.00 0.00 C ATOM 1059 C GLN A 71 2.131 2.716 -11.142 1.00 0.00 C ATOM 1060 O GLN A 71 1.200 3.010 -11.892 1.00 0.00 O ATOM 1061 CB GLN A 71 4.383 2.099 -12.040 1.00 0.00 C ATOM 1062 CG GLN A 71 5.737 2.565 -12.550 1.00 0.00 C ATOM 1063 CD GLN A 71 6.344 1.606 -13.555 1.00 0.00 C ATOM 1064 OE1 GLN A 71 5.634 0.838 -14.205 1.00 0.00 O ATOM 1065 NE2 GLN A 71 7.664 1.646 -13.689 1.00 0.00 N ATOM 0 H GLN A 71 5.164 3.471 -10.111 1.00 0.00 H new ATOM 0 HA GLN A 71 3.483 4.049 -12.123 1.00 0.00 H new ATOM 0 HB2 GLN A 71 4.534 1.315 -11.298 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.827 1.654 -12.865 1.00 0.00 H new ATOM 0 HG2 GLN A 71 5.629 3.547 -13.010 1.00 0.00 H new ATOM 0 HG3 GLN A 71 6.418 2.681 -11.707 1.00 0.00 H new ATOM 0 HE21 GLN A 71 8.214 2.298 -13.130 1.00 0.00 H new ATOM 0 HE22 GLN A 71 8.128 1.024 -14.351 1.00 0.00 H new ATOM 1074 N GLU A 72 1.979 1.957 -10.062 1.00 0.00 N ATOM 1075 CA GLU A 72 0.678 1.413 -9.688 1.00 0.00 C ATOM 1076 C GLU A 72 -0.227 2.506 -9.128 1.00 0.00 C ATOM 1077 O GLU A 72 -1.373 2.657 -9.555 1.00 0.00 O ATOM 1078 CB GLU A 72 0.846 0.296 -8.656 1.00 0.00 C ATOM 1079 CG GLU A 72 -0.470 -0.213 -8.092 1.00 0.00 C ATOM 1080 CD GLU A 72 -1.076 -1.320 -8.933 1.00 0.00 C ATOM 1081 OE1 GLU A 72 -0.504 -2.431 -8.951 1.00 0.00 O ATOM 1082 OE2 GLU A 72 -2.120 -1.076 -9.572 1.00 0.00 O ATOM 0 H GLU A 72 2.739 1.705 -9.431 1.00 0.00 H new ATOM 0 HA GLU A 72 0.212 1.003 -10.584 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.380 -0.535 -9.116 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.467 0.660 -7.837 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -0.309 -0.579 -7.078 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -1.176 0.615 -8.024 1.00 0.00 H new ATOM 1089 N LEU A 73 0.294 3.266 -8.172 1.00 0.00 N ATOM 1090 CA LEU A 73 -0.467 4.346 -7.553 1.00 0.00 C ATOM 1091 C LEU A 73 -1.112 5.234 -8.611 1.00 0.00 C ATOM 1092 O LEU A 73 -2.314 5.495 -8.567 1.00 0.00 O ATOM 1093 CB LEU A 73 0.441 5.185 -6.652 1.00 0.00 C ATOM 1094 CG LEU A 73 0.798 4.568 -5.298 1.00 0.00 C ATOM 1095 CD1 LEU A 73 1.921 5.352 -4.635 1.00 0.00 C ATOM 1096 CD2 LEU A 73 -0.426 4.519 -4.396 1.00 0.00 C ATOM 0 H LEU A 73 1.240 3.155 -7.808 1.00 0.00 H new ATOM 0 HA LEU A 73 -1.257 3.900 -6.949 1.00 0.00 H new ATOM 0 HB2 LEU A 73 1.366 5.389 -7.191 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -0.043 6.145 -6.475 1.00 0.00 H new ATOM 0 HG LEU A 73 1.143 3.547 -5.464 1.00 0.00 H new ATOM 0 HD11 LEU A 73 2.162 4.899 -3.673 1.00 0.00 H new ATOM 0 HD12 LEU A 73 2.803 5.336 -5.275 1.00 0.00 H new ATOM 0 HD13 LEU A 73 1.603 6.383 -4.481 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -0.154 4.077 -3.437 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -0.801 5.530 -4.236 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -1.201 3.915 -4.867 1.00 0.00 H new ATOM 1108 N GLN A 74 -0.306 5.693 -9.563 1.00 0.00 N ATOM 1109 CA GLN A 74 -0.800 6.550 -10.634 1.00 0.00 C ATOM 1110 C GLN A 74 -2.061 5.965 -11.263 1.00 0.00 C ATOM 1111 O GLN A 74 -2.987 6.696 -11.613 1.00 0.00 O ATOM 1112 CB GLN A 74 0.277 6.738 -11.704 1.00 0.00 C ATOM 1113 CG GLN A 74 1.582 7.300 -11.162 1.00 0.00 C ATOM 1114 CD GLN A 74 2.726 7.175 -12.148 1.00 0.00 C ATOM 1115 OE1 GLN A 74 3.935 6.987 -11.631 1.00 0.00 O flip ATOM 1116 NE2 GLN A 74 2.526 7.246 -13.361 1.00 0.00 N flip ATOM 0 H GLN A 74 0.691 5.486 -9.614 1.00 0.00 H new ATOM 0 HA GLN A 74 -1.047 7.520 -10.203 1.00 0.00 H new ATOM 0 HB2 GLN A 74 0.475 5.778 -12.181 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -0.103 7.406 -12.477 1.00 0.00 H new ATOM 0 HG2 GLN A 74 1.442 8.350 -10.905 1.00 0.00 H new ATOM 0 HG3 GLN A 74 1.843 6.779 -10.241 1.00 0.00 H new ATOM 0 HE21 GLN A 74 1.580 7.391 -13.714 1.00 0.00 H new ATOM 0 HE22 GLN A 74 3.306 7.160 -14.012 1.00 0.00 H new ATOM 1125 N ARG A 75 -2.088 4.644 -11.402 1.00 0.00 N ATOM 1126 CA ARG A 75 -3.234 3.961 -11.990 1.00 0.00 C ATOM 1127 C ARG A 75 -4.510 4.280 -11.218 1.00 0.00 C ATOM 1128 O ARG A 75 -5.597 4.343 -11.794 1.00 0.00 O ATOM 1129 CB ARG A 75 -3.000 2.449 -12.008 1.00 0.00 C ATOM 1130 CG ARG A 75 -1.678 2.045 -12.640 1.00 0.00 C ATOM 1131 CD ARG A 75 -1.819 1.835 -14.140 1.00 0.00 C ATOM 1132 NE ARG A 75 -1.849 3.099 -14.870 1.00 0.00 N ATOM 1133 CZ ARG A 75 -2.277 3.216 -16.122 1.00 0.00 C ATOM 1134 NH1 ARG A 75 -2.709 2.149 -16.780 1.00 0.00 N ATOM 1135 NH2 ARG A 75 -2.274 4.401 -16.718 1.00 0.00 N ATOM 0 H ARG A 75 -1.329 4.025 -11.116 1.00 0.00 H new ATOM 0 HA ARG A 75 -3.351 4.315 -13.014 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -3.034 2.072 -10.986 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -3.814 1.970 -12.552 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -0.931 2.815 -12.448 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -1.317 1.128 -12.175 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -0.988 1.228 -14.500 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -2.733 1.277 -14.343 1.00 0.00 H new ATOM 0 HE ARG A 75 -1.523 3.939 -14.392 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -2.713 1.236 -16.325 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -3.037 2.241 -17.741 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -1.943 5.224 -16.215 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -2.603 4.489 -17.679 1.00 0.00 H new ATOM 1149 N TRP A 76 -4.373 4.478 -9.912 1.00 0.00 N ATOM 1150 CA TRP A 76 -5.515 4.789 -9.062 1.00 0.00 C ATOM 1151 C TRP A 76 -5.777 6.291 -9.030 1.00 0.00 C ATOM 1152 O TRP A 76 -6.777 6.767 -9.567 1.00 0.00 O ATOM 1153 CB TRP A 76 -5.277 4.271 -7.642 1.00 0.00 C ATOM 1154 CG TRP A 76 -4.959 2.807 -7.591 1.00 0.00 C ATOM 1155 CD1 TRP A 76 -3.778 2.238 -7.208 1.00 0.00 C ATOM 1156 CD2 TRP A 76 -5.834 1.728 -7.934 1.00 0.00 C ATOM 1157 NE1 TRP A 76 -3.867 0.870 -7.293 1.00 0.00 N ATOM 1158 CE2 TRP A 76 -5.118 0.531 -7.736 1.00 0.00 C ATOM 1159 CE3 TRP A 76 -7.153 1.655 -8.390 1.00 0.00 C ATOM 1160 CZ2 TRP A 76 -5.677 -0.720 -7.978 1.00 0.00 C ATOM 1161 CZ3 TRP A 76 -7.708 0.412 -8.630 1.00 0.00 C ATOM 1162 CH2 TRP A 76 -6.971 -0.762 -8.423 1.00 0.00 C ATOM 0 H TRP A 76 -3.482 4.429 -9.419 1.00 0.00 H new ATOM 0 HA TRP A 76 -6.392 4.294 -9.480 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -4.457 4.830 -7.191 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -6.164 4.464 -7.039 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -2.903 2.783 -6.886 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -3.122 0.213 -7.063 1.00 0.00 H new ATOM 0 HE3 TRP A 76 -7.729 2.554 -8.552 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -5.110 -1.626 -7.820 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 -8.726 0.344 -8.983 1.00 0.00 H new ATOM 0 HH2 TRP A 76 -7.433 -1.718 -8.618 1.00 0.00 H new ATOM 1173 N ALA A 77 -4.873 7.033 -8.398 1.00 0.00 N ATOM 1174 CA ALA A 77 -5.006 8.481 -8.299 1.00 0.00 C ATOM 1175 C ALA A 77 -4.560 9.163 -9.588 1.00 0.00 C ATOM 1176 O ALA A 77 -5.379 9.687 -10.341 1.00 0.00 O ATOM 1177 CB ALA A 77 -4.204 9.005 -7.117 1.00 0.00 C ATOM 0 H ALA A 77 -4.040 6.654 -7.947 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.059 8.714 -8.141 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -4.312 10.088 -7.055 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -4.572 8.550 -6.197 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -3.152 8.753 -7.251 1.00 0.00 H new ATOM 1183 N GLY A 78 -3.253 9.151 -9.836 1.00 0.00 N ATOM 1184 CA GLY A 78 -2.721 9.772 -11.035 1.00 0.00 C ATOM 1185 C GLY A 78 -1.336 10.351 -10.822 1.00 0.00 C ATOM 1186 O GLY A 78 -0.330 9.643 -10.867 1.00 0.00 O ATOM 0 H GLY A 78 -2.554 8.723 -9.229 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -2.684 9.034 -11.837 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -3.396 10.563 -11.361 1.00 0.00 H new ATOM 1190 N PRO A 79 -1.271 11.669 -10.585 1.00 0.00 N ATOM 1191 CA PRO A 79 -0.005 12.373 -10.361 1.00 0.00 C ATOM 1192 C PRO A 79 0.635 12.002 -9.027 1.00 0.00 C ATOM 1193 O PRO A 79 0.168 12.417 -7.966 1.00 0.00 O ATOM 1194 CB PRO A 79 -0.412 13.848 -10.367 1.00 0.00 C ATOM 1195 CG PRO A 79 -1.846 13.846 -9.965 1.00 0.00 C ATOM 1196 CD PRO A 79 -2.430 12.576 -10.517 1.00 0.00 C ATOM 0 HA PRO A 79 0.741 12.120 -11.115 1.00 0.00 H new ATOM 0 HB2 PRO A 79 0.194 14.429 -9.671 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -0.278 14.292 -11.353 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -1.947 13.883 -8.880 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -2.364 14.719 -10.363 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -3.213 12.180 -9.871 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -2.876 12.732 -11.499 1.00 0.00 H new ATOM 1204 N LEU A 80 1.708 11.221 -9.088 1.00 0.00 N ATOM 1205 CA LEU A 80 2.413 10.794 -7.884 1.00 0.00 C ATOM 1206 C LEU A 80 3.883 11.200 -7.942 1.00 0.00 C ATOM 1207 O LEU A 80 4.627 10.801 -8.837 1.00 0.00 O ATOM 1208 CB LEU A 80 2.297 9.279 -7.710 1.00 0.00 C ATOM 1209 CG LEU A 80 1.091 8.786 -6.912 1.00 0.00 C ATOM 1210 CD1 LEU A 80 1.173 9.264 -5.471 1.00 0.00 C ATOM 1211 CD2 LEU A 80 -0.205 9.255 -7.559 1.00 0.00 C ATOM 0 H LEU A 80 2.109 10.871 -9.958 1.00 0.00 H new ATOM 0 HA LEU A 80 1.952 11.287 -7.028 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.265 8.821 -8.699 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.202 8.919 -7.221 1.00 0.00 H new ATOM 0 HG LEU A 80 1.100 7.696 -6.913 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.306 8.903 -4.918 1.00 0.00 H new ATOM 0 HD12 LEU A 80 2.083 8.878 -5.011 1.00 0.00 H new ATOM 0 HD13 LEU A 80 1.189 10.354 -5.449 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -1.053 8.895 -6.977 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.223 10.344 -7.590 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.268 8.862 -8.574 1.00 0.00 H new ATOM 1223 N PRO A 81 4.312 12.010 -6.964 1.00 0.00 N ATOM 1224 CA PRO A 81 5.696 12.486 -6.879 1.00 0.00 C ATOM 1225 C PRO A 81 6.670 11.370 -6.517 1.00 0.00 C ATOM 1226 O PRO A 81 6.261 10.284 -6.108 1.00 0.00 O ATOM 1227 CB PRO A 81 5.644 13.534 -5.765 1.00 0.00 C ATOM 1228 CG PRO A 81 4.482 13.134 -4.923 1.00 0.00 C ATOM 1229 CD PRO A 81 3.479 12.525 -5.864 1.00 0.00 C ATOM 0 HA PRO A 81 6.052 12.877 -7.832 1.00 0.00 H new ATOM 0 HB2 PRO A 81 6.568 13.543 -5.186 1.00 0.00 H new ATOM 0 HB3 PRO A 81 5.512 14.537 -6.171 1.00 0.00 H new ATOM 0 HG2 PRO A 81 4.783 12.419 -4.157 1.00 0.00 H new ATOM 0 HG3 PRO A 81 4.059 13.996 -4.406 1.00 0.00 H new ATOM 0 HD2 PRO A 81 2.910 11.729 -5.384 1.00 0.00 H new ATOM 0 HD3 PRO A 81 2.759 13.263 -6.217 1.00 0.00 H new ATOM 1237 N ALA A 82 7.962 11.647 -6.669 1.00 0.00 N ATOM 1238 CA ALA A 82 8.994 10.667 -6.355 1.00 0.00 C ATOM 1239 C ALA A 82 9.633 10.957 -5.000 1.00 0.00 C ATOM 1240 O ALA A 82 9.432 10.217 -4.037 1.00 0.00 O ATOM 1241 CB ALA A 82 10.054 10.649 -7.447 1.00 0.00 C ATOM 0 H ALA A 82 8.318 12.541 -7.007 1.00 0.00 H new ATOM 0 HA ALA A 82 8.524 9.685 -6.303 1.00 0.00 H new ATOM 0 HB1 ALA A 82 10.819 9.913 -7.200 1.00 0.00 H new ATOM 0 HB2 ALA A 82 9.592 10.386 -8.399 1.00 0.00 H new ATOM 0 HB3 ALA A 82 10.512 11.635 -7.526 1.00 0.00 H new ATOM 1247 N THR A 83 10.402 12.038 -4.934 1.00 0.00 N ATOM 1248 CA THR A 83 11.072 12.424 -3.697 1.00 0.00 C ATOM 1249 C THR A 83 10.133 12.299 -2.502 1.00 0.00 C ATOM 1250 O THR A 83 10.482 11.697 -1.487 1.00 0.00 O ATOM 1251 CB THR A 83 11.600 13.869 -3.772 1.00 0.00 C ATOM 1252 OG1 THR A 83 10.510 14.780 -3.960 1.00 0.00 O ATOM 1253 CG2 THR A 83 12.597 14.022 -4.910 1.00 0.00 C ATOM 0 H THR A 83 10.577 12.662 -5.721 1.00 0.00 H new ATOM 0 HA THR A 83 11.914 11.744 -3.567 1.00 0.00 H new ATOM 0 HB THR A 83 12.106 14.097 -2.834 1.00 0.00 H new ATOM 0 HG1 THR A 83 10.854 15.697 -4.005 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.956 15.051 -4.943 1.00 0.00 H new ATOM 0 HG22 THR A 83 13.439 13.349 -4.749 1.00 0.00 H new ATOM 0 HG23 THR A 83 12.112 13.776 -5.855 1.00 0.00 H new ATOM 1261 N HIS A 84 8.940 12.872 -2.630 1.00 0.00 N ATOM 1262 CA HIS A 84 7.950 12.822 -1.560 1.00 0.00 C ATOM 1263 C HIS A 84 7.874 11.425 -0.954 1.00 0.00 C ATOM 1264 O HIS A 84 7.779 11.269 0.264 1.00 0.00 O ATOM 1265 CB HIS A 84 6.577 13.238 -2.087 1.00 0.00 C ATOM 1266 CG HIS A 84 6.333 14.715 -2.023 1.00 0.00 C ATOM 1267 ND1 HIS A 84 6.550 15.465 -0.886 1.00 0.00 N ATOM 1268 CD2 HIS A 84 5.888 15.581 -2.962 1.00 0.00 C ATOM 1269 CE1 HIS A 84 6.248 16.728 -1.129 1.00 0.00 C ATOM 1270 NE2 HIS A 84 5.844 16.825 -2.383 1.00 0.00 N ATOM 0 H HIS A 84 8.636 13.376 -3.463 1.00 0.00 H new ATOM 0 HA HIS A 84 8.258 13.519 -0.781 1.00 0.00 H new ATOM 0 HB2 HIS A 84 6.478 12.906 -3.121 1.00 0.00 H new ATOM 0 HB3 HIS A 84 5.806 12.725 -1.512 1.00 0.00 H new ATOM 0 HD2 HIS A 84 5.617 15.339 -3.979 1.00 0.00 H new ATOM 0 HE1 HIS A 84 6.319 17.542 -0.423 1.00 0.00 H new ATOM 0 HE2 HIS A 84 5.548 17.684 -2.846 1.00 0.00 H new ATOM 1279 N LEU A 85 7.916 10.411 -1.811 1.00 0.00 N ATOM 1280 CA LEU A 85 7.850 9.025 -1.361 1.00 0.00 C ATOM 1281 C LEU A 85 8.998 8.707 -0.409 1.00 0.00 C ATOM 1282 O LEU A 85 10.157 9.005 -0.697 1.00 0.00 O ATOM 1283 CB LEU A 85 7.889 8.075 -2.560 1.00 0.00 C ATOM 1284 CG LEU A 85 7.606 6.604 -2.261 1.00 0.00 C ATOM 1285 CD1 LEU A 85 6.137 6.400 -1.924 1.00 0.00 C ATOM 1286 CD2 LEU A 85 8.011 5.732 -3.440 1.00 0.00 C ATOM 0 H LEU A 85 7.995 10.523 -2.822 1.00 0.00 H new ATOM 0 HA LEU A 85 6.910 8.887 -0.827 1.00 0.00 H new ATOM 0 HB2 LEU A 85 7.163 8.421 -3.296 1.00 0.00 H new ATOM 0 HB3 LEU A 85 8.873 8.148 -3.024 1.00 0.00 H new ATOM 0 HG LEU A 85 8.200 6.309 -1.396 1.00 0.00 H new ATOM 0 HD11 LEU A 85 5.955 5.346 -1.714 1.00 0.00 H new ATOM 0 HD12 LEU A 85 5.879 6.994 -1.048 1.00 0.00 H new ATOM 0 HD13 LEU A 85 5.523 6.713 -2.769 1.00 0.00 H new ATOM 0 HD21 LEU A 85 7.802 4.688 -3.209 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.445 6.028 -4.323 1.00 0.00 H new ATOM 0 HD23 LEU A 85 9.077 5.854 -3.634 1.00 0.00 H new ATOM 1298 N ARG A 86 8.668 8.098 0.726 1.00 0.00 N ATOM 1299 CA ARG A 86 9.671 7.739 1.721 1.00 0.00 C ATOM 1300 C ARG A 86 9.275 6.462 2.456 1.00 0.00 C ATOM 1301 O ARG A 86 8.090 6.191 2.657 1.00 0.00 O ATOM 1302 CB ARG A 86 9.859 8.880 2.722 1.00 0.00 C ATOM 1303 CG ARG A 86 10.225 10.205 2.074 1.00 0.00 C ATOM 1304 CD ARG A 86 11.003 11.097 3.030 1.00 0.00 C ATOM 1305 NE ARG A 86 10.127 11.763 3.990 1.00 0.00 N ATOM 1306 CZ ARG A 86 10.572 12.528 4.981 1.00 0.00 C ATOM 1307 NH1 ARG A 86 11.873 12.722 5.140 1.00 0.00 N ATOM 1308 NH2 ARG A 86 9.713 13.101 5.815 1.00 0.00 N ATOM 0 H ARG A 86 7.713 7.843 0.979 1.00 0.00 H new ATOM 0 HA ARG A 86 10.613 7.562 1.203 1.00 0.00 H new ATOM 0 HB2 ARG A 86 8.939 9.006 3.293 1.00 0.00 H new ATOM 0 HB3 ARG A 86 10.639 8.605 3.432 1.00 0.00 H new ATOM 0 HG2 ARG A 86 10.821 10.022 1.180 1.00 0.00 H new ATOM 0 HG3 ARG A 86 9.318 10.717 1.753 1.00 0.00 H new ATOM 0 HD2 ARG A 86 11.740 10.499 3.566 1.00 0.00 H new ATOM 0 HD3 ARG A 86 11.553 11.846 2.461 1.00 0.00 H new ATOM 0 HE ARG A 86 9.120 11.634 3.895 1.00 0.00 H new ATOM 0 HH11 ARG A 86 12.536 12.284 4.501 1.00 0.00 H new ATOM 0 HH12 ARG A 86 12.212 13.310 5.902 1.00 0.00 H new ATOM 0 HH21 ARG A 86 8.711 12.954 5.695 1.00 0.00 H new ATOM 0 HH22 ARG A 86 10.055 13.688 6.576 1.00 0.00 H new ATOM 1322 N HIS A 87 10.273 5.681 2.855 1.00 0.00 N ATOM 1323 CA HIS A 87 10.029 4.432 3.569 1.00 0.00 C ATOM 1324 C HIS A 87 9.925 4.677 5.071 1.00 0.00 C ATOM 1325 O HIS A 87 10.890 5.097 5.711 1.00 0.00 O ATOM 1326 CB HIS A 87 11.145 3.429 3.279 1.00 0.00 C ATOM 1327 CG HIS A 87 11.206 2.301 4.264 1.00 0.00 C ATOM 1328 ND1 HIS A 87 12.095 2.268 5.317 1.00 0.00 N ATOM 1329 CD2 HIS A 87 10.480 1.162 4.350 1.00 0.00 C ATOM 1330 CE1 HIS A 87 11.915 1.157 6.009 1.00 0.00 C ATOM 1331 NE2 HIS A 87 10.940 0.468 5.443 1.00 0.00 N ATOM 0 H HIS A 87 11.259 5.890 2.696 1.00 0.00 H new ATOM 0 HA HIS A 87 9.082 4.021 3.220 1.00 0.00 H new ATOM 0 HB2 HIS A 87 11.004 3.020 2.279 1.00 0.00 H new ATOM 0 HB3 HIS A 87 12.101 3.952 3.278 1.00 0.00 H new ATOM 0 HD2 HIS A 87 9.687 0.856 3.684 1.00 0.00 H new ATOM 0 HE1 HIS A 87 12.470 0.862 6.887 1.00 0.00 H new ATOM 0 HE2 HIS A 87 10.586 -0.433 5.765 1.00 0.00 H new ATOM 1340 N LEU A 88 8.749 4.412 5.629 1.00 0.00 N ATOM 1341 CA LEU A 88 8.519 4.603 7.057 1.00 0.00 C ATOM 1342 C LEU A 88 8.189 3.279 7.738 1.00 0.00 C ATOM 1343 O LEU A 88 7.040 2.840 7.743 1.00 0.00 O ATOM 1344 CB LEU A 88 7.382 5.602 7.281 1.00 0.00 C ATOM 1345 CG LEU A 88 7.307 6.767 6.293 1.00 0.00 C ATOM 1346 CD1 LEU A 88 6.134 7.674 6.627 1.00 0.00 C ATOM 1347 CD2 LEU A 88 8.610 7.552 6.295 1.00 0.00 C ATOM 0 H LEU A 88 7.940 4.064 5.115 1.00 0.00 H new ATOM 0 HA LEU A 88 9.434 4.998 7.497 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.437 5.060 7.245 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.477 6.011 8.287 1.00 0.00 H new ATOM 0 HG LEU A 88 7.153 6.362 5.293 1.00 0.00 H new ATOM 0 HD11 LEU A 88 6.096 8.497 5.914 1.00 0.00 H new ATOM 0 HD12 LEU A 88 5.206 7.104 6.573 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.257 8.072 7.634 1.00 0.00 H new ATOM 0 HD21 LEU A 88 8.539 8.377 5.586 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.795 7.947 7.294 1.00 0.00 H new ATOM 0 HD23 LEU A 88 9.431 6.895 6.006 1.00 0.00 H new ATOM 1359 N GLY A 89 9.208 2.646 8.315 1.00 0.00 N ATOM 1360 CA GLY A 89 9.005 1.379 8.993 1.00 0.00 C ATOM 1361 C GLY A 89 8.493 0.298 8.061 1.00 0.00 C ATOM 1362 O GLY A 89 8.434 0.493 6.848 1.00 0.00 O ATOM 0 H GLY A 89 10.169 2.988 8.324 1.00 0.00 H new ATOM 0 HA2 GLY A 89 9.945 1.054 9.439 1.00 0.00 H new ATOM 0 HA3 GLY A 89 8.296 1.517 9.809 1.00 0.00 H new ATOM 1366 N GLU A 90 8.124 -0.845 8.630 1.00 0.00 N ATOM 1367 CA GLU A 90 7.617 -1.962 7.841 1.00 0.00 C ATOM 1368 C GLU A 90 6.543 -2.727 8.609 1.00 0.00 C ATOM 1369 O GLU A 90 6.323 -2.489 9.796 1.00 0.00 O ATOM 1370 CB GLU A 90 8.758 -2.905 7.460 1.00 0.00 C ATOM 1371 CG GLU A 90 9.120 -3.897 8.553 1.00 0.00 C ATOM 1372 CD GLU A 90 10.553 -4.382 8.450 1.00 0.00 C ATOM 1373 OE1 GLU A 90 11.438 -3.558 8.138 1.00 0.00 O ATOM 1374 OE2 GLU A 90 10.789 -5.585 8.684 1.00 0.00 O ATOM 0 H GLU A 90 8.166 -1.022 9.634 1.00 0.00 H new ATOM 0 HA GLU A 90 7.171 -1.559 6.932 1.00 0.00 H new ATOM 0 HB2 GLU A 90 8.479 -3.454 6.561 1.00 0.00 H new ATOM 0 HB3 GLU A 90 9.639 -2.313 7.212 1.00 0.00 H new ATOM 0 HG2 GLU A 90 8.967 -3.431 9.526 1.00 0.00 H new ATOM 0 HG3 GLU A 90 8.446 -4.752 8.500 1.00 0.00 H new ATOM 1381 N VAL A 91 5.877 -3.651 7.922 1.00 0.00 N ATOM 1382 CA VAL A 91 4.828 -4.453 8.538 1.00 0.00 C ATOM 1383 C VAL A 91 4.876 -5.894 8.044 1.00 0.00 C ATOM 1384 O VAL A 91 4.482 -6.188 6.916 1.00 0.00 O ATOM 1385 CB VAL A 91 3.432 -3.869 8.249 1.00 0.00 C ATOM 1386 CG1 VAL A 91 2.347 -4.858 8.644 1.00 0.00 C ATOM 1387 CG2 VAL A 91 3.248 -2.545 8.974 1.00 0.00 C ATOM 0 H VAL A 91 6.046 -3.862 6.938 1.00 0.00 H new ATOM 0 HA VAL A 91 5.006 -4.435 9.613 1.00 0.00 H new ATOM 0 HB VAL A 91 3.349 -3.685 7.178 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.368 -4.428 8.433 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.469 -5.779 8.074 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.425 -5.077 9.709 1.00 0.00 H new ATOM 0 HG21 VAL A 91 2.256 -2.147 8.758 1.00 0.00 H new ATOM 0 HG22 VAL A 91 3.351 -2.701 10.048 1.00 0.00 H new ATOM 0 HG23 VAL A 91 4.005 -1.837 8.636 1.00 0.00 H new ATOM 1397 N VAL A 92 5.362 -6.791 8.897 1.00 0.00 N ATOM 1398 CA VAL A 92 5.461 -8.202 8.548 1.00 0.00 C ATOM 1399 C VAL A 92 4.644 -9.063 9.505 1.00 0.00 C ATOM 1400 O VAL A 92 5.002 -9.225 10.672 1.00 0.00 O ATOM 1401 CB VAL A 92 6.924 -8.684 8.564 1.00 0.00 C ATOM 1402 CG1 VAL A 92 6.998 -10.178 8.288 1.00 0.00 C ATOM 1403 CG2 VAL A 92 7.751 -7.905 7.552 1.00 0.00 C ATOM 0 H VAL A 92 5.693 -6.564 9.835 1.00 0.00 H new ATOM 0 HA VAL A 92 5.063 -8.307 7.539 1.00 0.00 H new ATOM 0 HB VAL A 92 7.338 -8.502 9.556 1.00 0.00 H new ATOM 0 HG11 VAL A 92 8.039 -10.500 8.303 1.00 0.00 H new ATOM 0 HG12 VAL A 92 6.440 -10.717 9.053 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.568 -10.389 7.309 1.00 0.00 H new ATOM 0 HG21 VAL A 92 8.782 -8.258 7.576 1.00 0.00 H new ATOM 0 HG22 VAL A 92 7.340 -8.054 6.554 1.00 0.00 H new ATOM 0 HG23 VAL A 92 7.725 -6.844 7.800 1.00 0.00 H new ATOM 1413 N HIS A 93 3.543 -9.615 9.004 1.00 0.00 N ATOM 1414 CA HIS A 93 2.676 -10.462 9.815 1.00 0.00 C ATOM 1415 C HIS A 93 2.962 -11.938 9.558 1.00 0.00 C ATOM 1416 O HIS A 93 2.866 -12.413 8.426 1.00 0.00 O ATOM 1417 CB HIS A 93 1.208 -10.156 9.516 1.00 0.00 C ATOM 1418 CG HIS A 93 0.250 -10.876 10.417 1.00 0.00 C ATOM 1419 ND1 HIS A 93 -0.397 -12.054 10.260 1.00 0.00 N flip ATOM 1420 CD2 HIS A 93 -0.138 -10.388 11.647 1.00 0.00 C flip ATOM 1421 CE1 HIS A 93 -1.157 -12.255 11.386 1.00 0.00 C flip ATOM 1422 NE2 HIS A 93 -0.982 -11.235 12.207 1.00 0.00 N flip ATOM 0 H HIS A 93 3.231 -9.491 8.041 1.00 0.00 H new ATOM 0 HA HIS A 93 2.879 -10.249 10.865 1.00 0.00 H new ATOM 0 HB2 HIS A 93 1.043 -9.082 9.608 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.993 -10.424 8.482 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -0.332 -12.677 9.455 1.00 0.00 H new ATOM 0 HD2 HIS A 93 0.196 -9.459 12.084 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -1.794 -13.108 11.570 1.00 0.00 H new ATOM 1431 N THR A 94 3.316 -12.661 10.616 1.00 0.00 N ATOM 1432 CA THR A 94 3.619 -14.082 10.506 1.00 0.00 C ATOM 1433 C THR A 94 2.370 -14.929 10.724 1.00 0.00 C ATOM 1434 O THR A 94 1.839 -14.996 11.833 1.00 0.00 O ATOM 1435 CB THR A 94 4.697 -14.508 11.520 1.00 0.00 C ATOM 1436 OG1 THR A 94 5.846 -13.662 11.397 1.00 0.00 O ATOM 1437 CG2 THR A 94 5.102 -15.958 11.302 1.00 0.00 C ATOM 0 H THR A 94 3.400 -12.285 11.560 1.00 0.00 H new ATOM 0 HA THR A 94 3.996 -14.247 9.496 1.00 0.00 H new ATOM 0 HB THR A 94 4.281 -14.411 12.523 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.526 -13.938 12.046 1.00 0.00 H new ATOM 0 HG21 THR A 94 5.864 -16.236 12.030 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.231 -16.602 11.425 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.501 -16.077 10.295 1.00 0.00 H new ATOM 1445 N PHE A 95 1.905 -15.575 9.659 1.00 0.00 N ATOM 1446 CA PHE A 95 0.718 -16.418 9.735 1.00 0.00 C ATOM 1447 C PHE A 95 1.079 -17.824 10.204 1.00 0.00 C ATOM 1448 O PHE A 95 2.235 -18.110 10.512 1.00 0.00 O ATOM 1449 CB PHE A 95 0.027 -16.485 8.371 1.00 0.00 C ATOM 1450 CG PHE A 95 -0.616 -15.190 7.961 1.00 0.00 C ATOM 1451 CD1 PHE A 95 -1.784 -14.759 8.566 1.00 0.00 C ATOM 1452 CD2 PHE A 95 -0.050 -14.405 6.970 1.00 0.00 C ATOM 1453 CE1 PHE A 95 -2.378 -13.568 8.190 1.00 0.00 C ATOM 1454 CE2 PHE A 95 -0.638 -13.213 6.588 1.00 0.00 C ATOM 1455 CZ PHE A 95 -1.802 -12.794 7.200 1.00 0.00 C ATOM 0 H PHE A 95 2.332 -15.530 8.734 1.00 0.00 H new ATOM 0 HA PHE A 95 0.034 -15.976 10.460 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.758 -16.774 7.616 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -0.732 -17.267 8.395 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -2.237 -15.360 9.341 1.00 0.00 H new ATOM 0 HD2 PHE A 95 0.862 -14.728 6.490 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -3.290 -13.243 8.669 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -0.187 -12.611 5.813 1.00 0.00 H new ATOM 0 HZ PHE A 95 -2.262 -11.862 6.906 1.00 0.00 H new ATOM 1465 N SER A 96 0.078 -18.698 10.256 1.00 0.00 N ATOM 1466 CA SER A 96 0.288 -20.075 10.692 1.00 0.00 C ATOM 1467 C SER A 96 1.475 -20.699 9.965 1.00 0.00 C ATOM 1468 O SER A 96 2.538 -20.906 10.551 1.00 0.00 O ATOM 1469 CB SER A 96 -0.971 -20.907 10.446 1.00 0.00 C ATOM 1470 OG SER A 96 -2.077 -20.382 11.158 1.00 0.00 O ATOM 0 H SER A 96 -0.885 -18.478 10.002 1.00 0.00 H new ATOM 0 HA SER A 96 0.504 -20.064 11.760 1.00 0.00 H new ATOM 0 HB2 SER A 96 -1.196 -20.925 9.380 1.00 0.00 H new ATOM 0 HB3 SER A 96 -0.794 -21.938 10.751 1.00 0.00 H new ATOM 0 HG SER A 96 -2.870 -20.931 10.982 1.00 0.00 H new ATOM 1476 N HIS A 97 1.285 -20.999 8.684 1.00 0.00 N ATOM 1477 CA HIS A 97 2.340 -21.601 7.875 1.00 0.00 C ATOM 1478 C HIS A 97 2.731 -20.681 6.722 1.00 0.00 C ATOM 1479 O HIS A 97 3.347 -21.118 5.749 1.00 0.00 O ATOM 1480 CB HIS A 97 1.884 -22.955 7.331 1.00 0.00 C ATOM 1481 CG HIS A 97 0.774 -22.857 6.331 1.00 0.00 C ATOM 1482 ND1 HIS A 97 0.792 -22.521 5.019 1.00 0.00 N flip ATOM 1483 CD2 HIS A 97 -0.543 -23.118 6.640 1.00 0.00 C flip ATOM 1484 CE1 HIS A 97 -0.502 -22.586 4.565 1.00 0.00 C flip ATOM 1485 NE2 HIS A 97 -1.289 -22.949 5.563 1.00 0.00 N flip ATOM 0 H HIS A 97 0.411 -20.835 8.184 1.00 0.00 H new ATOM 0 HA HIS A 97 3.213 -21.749 8.511 1.00 0.00 H new ATOM 0 HB2 HIS A 97 2.734 -23.457 6.869 1.00 0.00 H new ATOM 0 HB3 HIS A 97 1.558 -23.580 8.162 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -0.909 -23.415 7.612 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -0.825 -22.375 3.556 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -2.300 -23.077 5.511 1.00 0.00 H new ATOM 1494 N ILE A 98 2.368 -19.409 6.837 1.00 0.00 N ATOM 1495 CA ILE A 98 2.682 -18.429 5.804 1.00 0.00 C ATOM 1496 C ILE A 98 3.340 -17.191 6.403 1.00 0.00 C ATOM 1497 O ILE A 98 3.118 -16.857 7.567 1.00 0.00 O ATOM 1498 CB ILE A 98 1.420 -18.003 5.030 1.00 0.00 C ATOM 1499 CG1 ILE A 98 0.788 -19.212 4.338 1.00 0.00 C ATOM 1500 CG2 ILE A 98 1.761 -16.922 4.015 1.00 0.00 C ATOM 1501 CD1 ILE A 98 -0.704 -19.078 4.131 1.00 0.00 C ATOM 0 H ILE A 98 1.856 -19.032 7.635 1.00 0.00 H new ATOM 0 HA ILE A 98 3.376 -18.909 5.114 1.00 0.00 H new ATOM 0 HB ILE A 98 0.698 -17.595 5.737 1.00 0.00 H new ATOM 0 HG12 ILE A 98 1.269 -19.359 3.371 1.00 0.00 H new ATOM 0 HG13 ILE A 98 0.986 -20.105 4.932 1.00 0.00 H new ATOM 0 HG21 ILE A 98 0.859 -16.631 3.476 1.00 0.00 H new ATOM 0 HG22 ILE A 98 2.171 -16.054 4.532 1.00 0.00 H new ATOM 0 HG23 ILE A 98 2.498 -17.305 3.309 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -1.084 -19.971 3.635 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -1.196 -18.961 5.096 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -0.908 -18.205 3.512 1.00 0.00 H new ATOM 1513 N LYS A 99 4.150 -16.510 5.598 1.00 0.00 N ATOM 1514 CA LYS A 99 4.839 -15.305 6.046 1.00 0.00 C ATOM 1515 C LYS A 99 4.706 -14.188 5.016 1.00 0.00 C ATOM 1516 O LYS A 99 5.166 -14.320 3.880 1.00 0.00 O ATOM 1517 CB LYS A 99 6.317 -15.605 6.302 1.00 0.00 C ATOM 1518 CG LYS A 99 6.980 -14.623 7.254 1.00 0.00 C ATOM 1519 CD LYS A 99 7.580 -13.443 6.509 1.00 0.00 C ATOM 1520 CE LYS A 99 8.792 -12.883 7.235 1.00 0.00 C ATOM 1521 NZ LYS A 99 9.733 -12.203 6.302 1.00 0.00 N ATOM 0 H LYS A 99 4.345 -16.772 4.632 1.00 0.00 H new ATOM 0 HA LYS A 99 4.375 -14.974 6.975 1.00 0.00 H new ATOM 0 HB2 LYS A 99 6.410 -16.612 6.709 1.00 0.00 H new ATOM 0 HB3 LYS A 99 6.851 -15.595 5.352 1.00 0.00 H new ATOM 0 HG2 LYS A 99 6.247 -14.264 7.976 1.00 0.00 H new ATOM 0 HG3 LYS A 99 7.761 -15.133 7.819 1.00 0.00 H new ATOM 0 HD2 LYS A 99 7.868 -13.754 5.505 1.00 0.00 H new ATOM 0 HD3 LYS A 99 6.828 -12.662 6.398 1.00 0.00 H new ATOM 0 HE2 LYS A 99 8.464 -12.177 7.998 1.00 0.00 H new ATOM 0 HE3 LYS A 99 9.312 -13.691 7.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 10.414 -11.636 6.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 10.245 -12.916 5.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 9.199 -11.581 5.662 1.00 0.00 H new ATOM 1535 N LEU A 100 4.078 -13.089 5.418 1.00 0.00 N ATOM 1536 CA LEU A 100 3.887 -11.948 4.529 1.00 0.00 C ATOM 1537 C LEU A 100 4.824 -10.804 4.904 1.00 0.00 C ATOM 1538 O LEU A 100 5.113 -10.583 6.081 1.00 0.00 O ATOM 1539 CB LEU A 100 2.435 -11.472 4.584 1.00 0.00 C ATOM 1540 CG LEU A 100 1.478 -12.119 3.582 1.00 0.00 C ATOM 1541 CD1 LEU A 100 1.808 -11.674 2.165 1.00 0.00 C ATOM 1542 CD2 LEU A 100 1.535 -13.635 3.692 1.00 0.00 C ATOM 0 H LEU A 100 3.692 -12.963 6.354 1.00 0.00 H new ATOM 0 HA LEU A 100 4.120 -12.266 3.513 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.053 -11.651 5.589 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.421 -10.394 4.425 1.00 0.00 H new ATOM 0 HG LEU A 100 0.464 -11.795 3.817 1.00 0.00 H new ATOM 0 HD11 LEU A 100 1.117 -12.144 1.466 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.715 -10.590 2.093 1.00 0.00 H new ATOM 0 HD13 LEU A 100 2.829 -11.968 1.920 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.848 -14.078 2.972 1.00 0.00 H new ATOM 0 HD22 LEU A 100 2.549 -13.977 3.484 1.00 0.00 H new ATOM 0 HD23 LEU A 100 1.250 -13.938 4.699 1.00 0.00 H new ATOM 1554 N THR A 101 5.295 -10.077 3.896 1.00 0.00 N ATOM 1555 CA THR A 101 6.198 -8.954 4.119 1.00 0.00 C ATOM 1556 C THR A 101 5.731 -7.715 3.364 1.00 0.00 C ATOM 1557 O THR A 101 5.887 -7.621 2.148 1.00 0.00 O ATOM 1558 CB THR A 101 7.635 -9.296 3.683 1.00 0.00 C ATOM 1559 OG1 THR A 101 8.109 -10.436 4.407 1.00 0.00 O ATOM 1560 CG2 THR A 101 8.566 -8.115 3.919 1.00 0.00 C ATOM 0 H THR A 101 5.066 -10.246 2.916 1.00 0.00 H new ATOM 0 HA THR A 101 6.190 -8.748 5.189 1.00 0.00 H new ATOM 0 HB THR A 101 7.624 -9.523 2.617 1.00 0.00 H new ATOM 0 HG1 THR A 101 8.828 -10.869 3.901 1.00 0.00 H new ATOM 0 HG21 THR A 101 9.576 -8.379 3.604 1.00 0.00 H new ATOM 0 HG22 THR A 101 8.219 -7.257 3.343 1.00 0.00 H new ATOM 0 HG23 THR A 101 8.571 -7.862 4.979 1.00 0.00 H new ATOM 1568 N TYR A 102 5.156 -6.766 4.095 1.00 0.00 N ATOM 1569 CA TYR A 102 4.665 -5.531 3.494 1.00 0.00 C ATOM 1570 C TYR A 102 5.576 -4.358 3.837 1.00 0.00 C ATOM 1571 O TYR A 102 5.916 -4.142 5.001 1.00 0.00 O ATOM 1572 CB TYR A 102 3.240 -5.241 3.969 1.00 0.00 C ATOM 1573 CG TYR A 102 2.193 -6.117 3.317 1.00 0.00 C ATOM 1574 CD1 TYR A 102 1.572 -5.727 2.136 1.00 0.00 C ATOM 1575 CD2 TYR A 102 1.827 -7.333 3.880 1.00 0.00 C ATOM 1576 CE1 TYR A 102 0.615 -6.524 1.537 1.00 0.00 C ATOM 1577 CE2 TYR A 102 0.873 -8.136 3.287 1.00 0.00 C ATOM 1578 CZ TYR A 102 0.270 -7.727 2.115 1.00 0.00 C ATOM 1579 OH TYR A 102 -0.682 -8.524 1.522 1.00 0.00 O ATOM 0 H TYR A 102 5.019 -6.828 5.104 1.00 0.00 H new ATOM 0 HA TYR A 102 4.662 -5.659 2.412 1.00 0.00 H new ATOM 0 HB2 TYR A 102 3.192 -5.375 5.050 1.00 0.00 H new ATOM 0 HB3 TYR A 102 3.004 -4.196 3.767 1.00 0.00 H new ATOM 0 HD1 TYR A 102 1.842 -4.786 1.679 1.00 0.00 H new ATOM 0 HD2 TYR A 102 2.297 -7.656 4.797 1.00 0.00 H new ATOM 0 HE1 TYR A 102 0.140 -6.206 0.621 1.00 0.00 H new ATOM 0 HE2 TYR A 102 0.600 -9.079 3.738 1.00 0.00 H new ATOM 0 HH TYR A 102 -0.807 -9.336 2.056 1.00 0.00 H new ATOM 1589 N GLN A 103 5.967 -3.602 2.817 1.00 0.00 N ATOM 1590 CA GLN A 103 6.839 -2.450 3.010 1.00 0.00 C ATOM 1591 C GLN A 103 6.024 -1.170 3.164 1.00 0.00 C ATOM 1592 O GLN A 103 5.398 -0.701 2.213 1.00 0.00 O ATOM 1593 CB GLN A 103 7.807 -2.313 1.833 1.00 0.00 C ATOM 1594 CG GLN A 103 8.705 -3.524 1.640 1.00 0.00 C ATOM 1595 CD GLN A 103 9.745 -3.660 2.734 1.00 0.00 C ATOM 1596 OE1 GLN A 103 10.862 -3.156 2.612 1.00 0.00 O ATOM 1597 NE2 GLN A 103 9.382 -4.343 3.814 1.00 0.00 N ATOM 0 H GLN A 103 5.694 -3.766 1.848 1.00 0.00 H new ATOM 0 HA GLN A 103 7.410 -2.608 3.925 1.00 0.00 H new ATOM 0 HB2 GLN A 103 7.235 -2.146 0.920 1.00 0.00 H new ATOM 0 HB3 GLN A 103 8.429 -1.431 1.985 1.00 0.00 H new ATOM 0 HG2 GLN A 103 8.092 -4.425 1.613 1.00 0.00 H new ATOM 0 HG3 GLN A 103 9.206 -3.450 0.675 1.00 0.00 H new ATOM 0 HE21 GLN A 103 8.446 -4.744 3.873 1.00 0.00 H new ATOM 0 HE22 GLN A 103 10.039 -4.467 4.584 1.00 0.00 H new ATOM 1606 N VAL A 104 6.035 -0.608 4.369 1.00 0.00 N ATOM 1607 CA VAL A 104 5.297 0.618 4.649 1.00 0.00 C ATOM 1608 C VAL A 104 5.938 1.814 3.954 1.00 0.00 C ATOM 1609 O VAL A 104 7.116 2.108 4.159 1.00 0.00 O ATOM 1610 CB VAL A 104 5.224 0.896 6.162 1.00 0.00 C ATOM 1611 CG1 VAL A 104 4.552 2.234 6.427 1.00 0.00 C ATOM 1612 CG2 VAL A 104 4.489 -0.230 6.875 1.00 0.00 C ATOM 0 H VAL A 104 6.547 -0.983 5.167 1.00 0.00 H new ATOM 0 HA VAL A 104 4.287 0.475 4.265 1.00 0.00 H new ATOM 0 HB VAL A 104 6.240 0.943 6.555 1.00 0.00 H new ATOM 0 HG11 VAL A 104 4.509 2.413 7.501 1.00 0.00 H new ATOM 0 HG12 VAL A 104 5.124 3.029 5.949 1.00 0.00 H new ATOM 0 HG13 VAL A 104 3.540 2.220 6.021 1.00 0.00 H new ATOM 0 HG21 VAL A 104 4.446 -0.018 7.943 1.00 0.00 H new ATOM 0 HG22 VAL A 104 3.476 -0.310 6.480 1.00 0.00 H new ATOM 0 HG23 VAL A 104 5.017 -1.169 6.713 1.00 0.00 H new ATOM 1622 N TYR A 105 5.154 2.502 3.131 1.00 0.00 N ATOM 1623 CA TYR A 105 5.643 3.666 2.403 1.00 0.00 C ATOM 1624 C TYR A 105 4.692 4.848 2.563 1.00 0.00 C ATOM 1625 O TYR A 105 3.473 4.690 2.513 1.00 0.00 O ATOM 1626 CB TYR A 105 5.816 3.332 0.921 1.00 0.00 C ATOM 1627 CG TYR A 105 7.116 2.627 0.606 1.00 0.00 C ATOM 1628 CD1 TYR A 105 8.311 3.332 0.529 1.00 0.00 C ATOM 1629 CD2 TYR A 105 7.149 1.256 0.387 1.00 0.00 C ATOM 1630 CE1 TYR A 105 9.500 2.692 0.241 1.00 0.00 C ATOM 1631 CE2 TYR A 105 8.334 0.607 0.099 1.00 0.00 C ATOM 1632 CZ TYR A 105 9.507 1.329 0.027 1.00 0.00 C ATOM 1633 OH TYR A 105 10.691 0.688 -0.259 1.00 0.00 O ATOM 0 H TYR A 105 4.176 2.273 2.952 1.00 0.00 H new ATOM 0 HA TYR A 105 6.611 3.943 2.821 1.00 0.00 H new ATOM 0 HB2 TYR A 105 4.985 2.704 0.599 1.00 0.00 H new ATOM 0 HB3 TYR A 105 5.762 4.253 0.341 1.00 0.00 H new ATOM 0 HD1 TYR A 105 8.310 4.399 0.697 1.00 0.00 H new ATOM 0 HD2 TYR A 105 6.232 0.687 0.443 1.00 0.00 H new ATOM 0 HE1 TYR A 105 10.420 3.255 0.184 1.00 0.00 H new ATOM 0 HE2 TYR A 105 8.342 -0.460 -0.069 1.00 0.00 H new ATOM 0 HH TYR A 105 11.420 1.342 -0.280 1.00 0.00 H new ATOM 1643 N GLY A 106 5.260 6.036 2.754 1.00 0.00 N ATOM 1644 CA GLY A 106 4.450 7.228 2.918 1.00 0.00 C ATOM 1645 C GLY A 106 4.540 8.158 1.725 1.00 0.00 C ATOM 1646 O GLY A 106 5.633 8.450 1.236 1.00 0.00 O ATOM 0 H GLY A 106 6.267 6.193 2.798 1.00 0.00 H new ATOM 0 HA2 GLY A 106 3.410 6.939 3.072 1.00 0.00 H new ATOM 0 HA3 GLY A 106 4.769 7.760 3.814 1.00 0.00 H new ATOM 1650 N LEU A 107 3.390 8.624 1.252 1.00 0.00 N ATOM 1651 CA LEU A 107 3.342 9.527 0.106 1.00 0.00 C ATOM 1652 C LEU A 107 2.204 10.532 0.251 1.00 0.00 C ATOM 1653 O LEU A 107 1.034 10.186 0.093 1.00 0.00 O ATOM 1654 CB LEU A 107 3.173 8.730 -1.189 1.00 0.00 C ATOM 1655 CG LEU A 107 3.369 9.511 -2.488 1.00 0.00 C ATOM 1656 CD1 LEU A 107 2.288 10.570 -2.642 1.00 0.00 C ATOM 1657 CD2 LEU A 107 4.751 10.147 -2.525 1.00 0.00 C ATOM 0 H LEU A 107 2.477 8.392 1.644 1.00 0.00 H new ATOM 0 HA LEU A 107 4.283 10.076 0.068 1.00 0.00 H new ATOM 0 HB2 LEU A 107 3.881 7.901 -1.177 1.00 0.00 H new ATOM 0 HB3 LEU A 107 2.173 8.296 -1.197 1.00 0.00 H new ATOM 0 HG LEU A 107 3.289 8.815 -3.323 1.00 0.00 H new ATOM 0 HD11 LEU A 107 2.444 11.116 -3.572 1.00 0.00 H new ATOM 0 HD12 LEU A 107 1.309 10.091 -2.662 1.00 0.00 H new ATOM 0 HD13 LEU A 107 2.335 11.263 -1.802 1.00 0.00 H new ATOM 0 HD21 LEU A 107 4.873 10.699 -3.457 1.00 0.00 H new ATOM 0 HD22 LEU A 107 4.860 10.830 -1.682 1.00 0.00 H new ATOM 0 HD23 LEU A 107 5.512 9.369 -2.462 1.00 0.00 H new ATOM 1669 N ALA A 108 2.556 11.778 0.551 1.00 0.00 N ATOM 1670 CA ALA A 108 1.565 12.834 0.712 1.00 0.00 C ATOM 1671 C ALA A 108 1.940 14.067 -0.102 1.00 0.00 C ATOM 1672 O ALA A 108 3.118 14.402 -0.236 1.00 0.00 O ATOM 1673 CB ALA A 108 1.414 13.196 2.182 1.00 0.00 C ATOM 0 H ALA A 108 3.521 12.080 0.687 1.00 0.00 H new ATOM 0 HA ALA A 108 0.610 12.462 0.341 1.00 0.00 H new ATOM 0 HB1 ALA A 108 0.671 13.986 2.288 1.00 0.00 H new ATOM 0 HB2 ALA A 108 1.092 12.318 2.742 1.00 0.00 H new ATOM 0 HB3 ALA A 108 2.371 13.544 2.571 1.00 0.00 H new ATOM 1679 N LEU A 109 0.932 14.741 -0.647 1.00 0.00 N ATOM 1680 CA LEU A 109 1.156 15.938 -1.449 1.00 0.00 C ATOM 1681 C LEU A 109 1.256 17.176 -0.564 1.00 0.00 C ATOM 1682 O LEU A 109 0.251 17.667 -0.052 1.00 0.00 O ATOM 1683 CB LEU A 109 0.026 16.114 -2.464 1.00 0.00 C ATOM 1684 CG LEU A 109 -0.157 14.974 -3.469 1.00 0.00 C ATOM 1685 CD1 LEU A 109 -1.469 15.134 -4.223 1.00 0.00 C ATOM 1686 CD2 LEU A 109 1.015 14.924 -4.438 1.00 0.00 C ATOM 0 H LEU A 109 -0.048 14.478 -0.548 1.00 0.00 H new ATOM 0 HA LEU A 109 2.100 15.817 -1.981 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -0.909 16.244 -1.918 1.00 0.00 H new ATOM 0 HB3 LEU A 109 0.203 17.036 -3.018 1.00 0.00 H new ATOM 0 HG LEU A 109 -0.189 14.032 -2.921 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -1.583 14.315 -4.933 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -2.299 15.119 -3.516 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -1.467 16.082 -4.760 1.00 0.00 H new ATOM 0 HD21 LEU A 109 0.868 14.108 -5.145 1.00 0.00 H new ATOM 0 HD22 LEU A 109 1.079 15.867 -4.981 1.00 0.00 H new ATOM 0 HD23 LEU A 109 1.939 14.761 -3.883 1.00 0.00 H new ATOM 1698 N GLU A 110 2.475 17.677 -0.390 1.00 0.00 N ATOM 1699 CA GLU A 110 2.706 18.858 0.432 1.00 0.00 C ATOM 1700 C GLU A 110 1.834 20.022 -0.032 1.00 0.00 C ATOM 1701 O GLU A 110 0.931 20.458 0.681 1.00 0.00 O ATOM 1702 CB GLU A 110 4.181 19.261 0.384 1.00 0.00 C ATOM 1703 CG GLU A 110 4.526 20.421 1.303 1.00 0.00 C ATOM 1704 CD GLU A 110 6.021 20.608 1.471 1.00 0.00 C ATOM 1705 OE1 GLU A 110 6.721 20.740 0.445 1.00 0.00 O ATOM 1706 OE2 GLU A 110 6.491 20.622 2.627 1.00 0.00 O ATOM 0 H GLU A 110 3.318 17.283 -0.808 1.00 0.00 H new ATOM 0 HA GLU A 110 2.438 18.612 1.459 1.00 0.00 H new ATOM 0 HB2 GLU A 110 4.793 18.400 0.654 1.00 0.00 H new ATOM 0 HB3 GLU A 110 4.442 19.529 -0.640 1.00 0.00 H new ATOM 0 HG2 GLU A 110 4.092 21.338 0.904 1.00 0.00 H new ATOM 0 HG3 GLU A 110 4.073 20.253 2.280 1.00 0.00 H new ATOM 1713 N GLY A 111 2.114 20.521 -1.232 1.00 0.00 N ATOM 1714 CA GLY A 111 1.348 21.630 -1.771 1.00 0.00 C ATOM 1715 C GLY A 111 1.184 21.544 -3.275 1.00 0.00 C ATOM 1716 O GLY A 111 1.792 22.315 -4.017 1.00 0.00 O ATOM 0 H GLY A 111 2.857 20.177 -1.840 1.00 0.00 H new ATOM 0 HA2 GLY A 111 0.364 21.650 -1.302 1.00 0.00 H new ATOM 0 HA3 GLY A 111 1.842 22.567 -1.515 1.00 0.00 H new ATOM 1720 N GLN A 112 0.360 20.603 -3.726 1.00 0.00 N ATOM 1721 CA GLN A 112 0.119 20.418 -5.151 1.00 0.00 C ATOM 1722 C GLN A 112 -1.373 20.294 -5.441 1.00 0.00 C ATOM 1723 O GLN A 112 -2.204 20.431 -4.542 1.00 0.00 O ATOM 1724 CB GLN A 112 0.853 19.174 -5.657 1.00 0.00 C ATOM 1725 CG GLN A 112 2.367 19.314 -5.647 1.00 0.00 C ATOM 1726 CD GLN A 112 3.037 18.487 -6.726 1.00 0.00 C ATOM 1727 OE1 GLN A 112 3.237 18.953 -7.848 1.00 0.00 O ATOM 1728 NE2 GLN A 112 3.387 17.250 -6.392 1.00 0.00 N ATOM 0 H GLN A 112 -0.152 19.957 -3.124 1.00 0.00 H new ATOM 0 HA GLN A 112 0.500 21.295 -5.674 1.00 0.00 H new ATOM 0 HB2 GLN A 112 0.571 18.320 -5.040 1.00 0.00 H new ATOM 0 HB3 GLN A 112 0.523 18.956 -6.673 1.00 0.00 H new ATOM 0 HG2 GLN A 112 2.632 20.363 -5.781 1.00 0.00 H new ATOM 0 HG3 GLN A 112 2.750 19.011 -4.672 1.00 0.00 H new ATOM 0 HE21 GLN A 112 3.202 16.904 -5.450 1.00 0.00 H new ATOM 0 HE22 GLN A 112 3.841 16.646 -7.077 1.00 0.00 H new ATOM 1737 N THR A 113 -1.707 20.035 -6.701 1.00 0.00 N ATOM 1738 CA THR A 113 -3.100 19.896 -7.109 1.00 0.00 C ATOM 1739 C THR A 113 -3.622 18.495 -6.811 1.00 0.00 C ATOM 1740 O THR A 113 -2.909 17.500 -6.938 1.00 0.00 O ATOM 1741 CB THR A 113 -3.277 20.188 -8.611 1.00 0.00 C ATOM 1742 OG1 THR A 113 -2.615 19.183 -9.387 1.00 0.00 O ATOM 1743 CG2 THR A 113 -2.720 21.558 -8.965 1.00 0.00 C ATOM 0 H THR A 113 -1.032 19.917 -7.457 1.00 0.00 H new ATOM 0 HA THR A 113 -3.672 20.625 -6.535 1.00 0.00 H new ATOM 0 HB THR A 113 -4.343 20.177 -8.837 1.00 0.00 H new ATOM 0 HG1 THR A 113 -2.734 19.375 -10.341 1.00 0.00 H new ATOM 0 HG21 THR A 113 -2.856 21.742 -10.031 1.00 0.00 H new ATOM 0 HG22 THR A 113 -3.246 22.323 -8.394 1.00 0.00 H new ATOM 0 HG23 THR A 113 -1.658 21.592 -8.724 1.00 0.00 H new ATOM 1751 N PRO A 114 -4.897 18.413 -6.404 1.00 0.00 N ATOM 1752 CA PRO A 114 -5.544 17.138 -6.079 1.00 0.00 C ATOM 1753 C PRO A 114 -5.779 16.276 -7.316 1.00 0.00 C ATOM 1754 O PRO A 114 -5.431 16.664 -8.431 1.00 0.00 O ATOM 1755 CB PRO A 114 -6.879 17.563 -5.462 1.00 0.00 C ATOM 1756 CG PRO A 114 -7.150 18.910 -6.040 1.00 0.00 C ATOM 1757 CD PRO A 114 -5.807 19.558 -6.230 1.00 0.00 C ATOM 0 HA PRO A 114 -4.930 16.526 -5.418 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -7.673 16.858 -5.711 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -6.818 17.604 -4.374 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -7.681 18.828 -6.988 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -7.778 19.501 -5.373 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -5.797 20.215 -7.100 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -5.528 20.165 -5.369 1.00 0.00 H new ATOM 1765 N VAL A 115 -6.375 15.105 -7.111 1.00 0.00 N ATOM 1766 CA VAL A 115 -6.659 14.189 -8.210 1.00 0.00 C ATOM 1767 C VAL A 115 -8.101 14.331 -8.685 1.00 0.00 C ATOM 1768 O VAL A 115 -8.394 14.175 -9.871 1.00 0.00 O ATOM 1769 CB VAL A 115 -6.407 12.726 -7.800 1.00 0.00 C ATOM 1770 CG1 VAL A 115 -7.216 12.371 -6.562 1.00 0.00 C ATOM 1771 CG2 VAL A 115 -6.736 11.787 -8.950 1.00 0.00 C ATOM 0 H VAL A 115 -6.670 14.769 -6.194 1.00 0.00 H new ATOM 0 HA VAL A 115 -5.984 14.452 -9.024 1.00 0.00 H new ATOM 0 HB VAL A 115 -5.350 12.611 -7.558 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -7.025 11.334 -6.288 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -6.926 13.024 -5.738 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -8.278 12.501 -6.772 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -6.552 10.757 -8.643 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -7.784 11.902 -9.225 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -6.107 12.028 -9.807 1.00 0.00 H new ATOM 1781 N THR A 116 -8.998 14.631 -7.751 1.00 0.00 N ATOM 1782 CA THR A 116 -10.411 14.794 -8.074 1.00 0.00 C ATOM 1783 C THR A 116 -10.861 13.768 -9.108 1.00 0.00 C ATOM 1784 O THR A 116 -11.673 14.067 -9.983 1.00 0.00 O ATOM 1785 CB THR A 116 -10.705 16.208 -8.609 1.00 0.00 C ATOM 1786 OG1 THR A 116 -10.417 16.271 -10.010 1.00 0.00 O ATOM 1787 CG2 THR A 116 -9.880 17.249 -7.868 1.00 0.00 C ATOM 0 H THR A 116 -8.772 14.766 -6.766 1.00 0.00 H new ATOM 0 HA THR A 116 -10.966 14.641 -7.149 1.00 0.00 H new ATOM 0 HB THR A 116 -11.761 16.422 -8.446 1.00 0.00 H new ATOM 0 HG1 THR A 116 -10.987 15.634 -10.490 1.00 0.00 H new ATOM 0 HG21 THR A 116 -10.105 18.240 -8.263 1.00 0.00 H new ATOM 0 HG22 THR A 116 -10.124 17.218 -6.806 1.00 0.00 H new ATOM 0 HG23 THR A 116 -8.820 17.036 -8.003 1.00 0.00 H new ATOM 1795 N THR A 117 -10.328 12.554 -9.001 1.00 0.00 N ATOM 1796 CA THR A 117 -10.675 11.483 -9.927 1.00 0.00 C ATOM 1797 C THR A 117 -10.218 10.129 -9.397 1.00 0.00 C ATOM 1798 O THR A 117 -9.276 10.046 -8.607 1.00 0.00 O ATOM 1799 CB THR A 117 -10.049 11.716 -11.315 1.00 0.00 C ATOM 1800 OG1 THR A 117 -10.315 13.053 -11.754 1.00 0.00 O ATOM 1801 CG2 THR A 117 -10.599 10.725 -12.330 1.00 0.00 C ATOM 0 H THR A 117 -9.655 12.289 -8.282 1.00 0.00 H new ATOM 0 HA THR A 117 -11.761 11.486 -10.021 1.00 0.00 H new ATOM 0 HB THR A 117 -8.972 11.568 -11.233 1.00 0.00 H new ATOM 0 HG1 THR A 117 -11.225 13.308 -11.493 1.00 0.00 H new ATOM 0 HG21 THR A 117 -10.142 10.909 -13.302 1.00 0.00 H new ATOM 0 HG22 THR A 117 -10.370 9.709 -12.008 1.00 0.00 H new ATOM 0 HG23 THR A 117 -11.679 10.846 -12.408 1.00 0.00 H new ATOM 1809 N VAL A 118 -10.888 9.069 -9.837 1.00 0.00 N ATOM 1810 CA VAL A 118 -10.549 7.717 -9.408 1.00 0.00 C ATOM 1811 C VAL A 118 -11.246 6.675 -10.275 1.00 0.00 C ATOM 1812 O VAL A 118 -12.424 6.797 -10.611 1.00 0.00 O ATOM 1813 CB VAL A 118 -10.932 7.483 -7.935 1.00 0.00 C ATOM 1814 CG1 VAL A 118 -12.429 7.667 -7.737 1.00 0.00 C ATOM 1815 CG2 VAL A 118 -10.493 6.098 -7.485 1.00 0.00 C ATOM 0 H VAL A 118 -11.669 9.120 -10.491 1.00 0.00 H new ATOM 0 HA VAL A 118 -9.469 7.612 -9.516 1.00 0.00 H new ATOM 0 HB VAL A 118 -10.415 8.221 -7.321 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -12.681 7.498 -6.690 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -12.711 8.681 -8.019 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -12.969 6.954 -8.360 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -10.771 5.949 -6.442 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -10.981 5.343 -8.102 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -9.412 6.008 -7.588 1.00 0.00 H new ATOM 1825 N PRO A 119 -10.503 5.622 -10.647 1.00 0.00 N ATOM 1826 CA PRO A 119 -11.029 4.536 -11.479 1.00 0.00 C ATOM 1827 C PRO A 119 -12.047 3.678 -10.737 1.00 0.00 C ATOM 1828 O PRO A 119 -12.182 3.749 -9.516 1.00 0.00 O ATOM 1829 CB PRO A 119 -9.782 3.714 -11.818 1.00 0.00 C ATOM 1830 CG PRO A 119 -8.831 3.991 -10.706 1.00 0.00 C ATOM 1831 CD PRO A 119 -9.091 5.411 -10.283 1.00 0.00 C ATOM 0 HA PRO A 119 -11.559 4.913 -12.354 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -10.015 2.651 -11.884 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -9.363 4.009 -12.780 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -8.989 3.302 -9.877 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -7.799 3.864 -11.034 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -8.927 5.549 -9.214 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -8.434 6.111 -10.799 1.00 0.00 H new ATOM 1839 N PRO A 120 -12.783 2.848 -11.490 1.00 0.00 N ATOM 1840 CA PRO A 120 -13.802 1.959 -10.925 1.00 0.00 C ATOM 1841 C PRO A 120 -13.194 0.830 -10.099 1.00 0.00 C ATOM 1842 O PRO A 120 -12.720 -0.166 -10.645 1.00 0.00 O ATOM 1843 CB PRO A 120 -14.509 1.396 -12.160 1.00 0.00 C ATOM 1844 CG PRO A 120 -13.495 1.486 -13.249 1.00 0.00 C ATOM 1845 CD PRO A 120 -12.676 2.711 -12.953 1.00 0.00 C ATOM 0 HA PRO A 120 -14.466 2.486 -10.240 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -14.827 0.366 -11.999 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -15.402 1.972 -12.402 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -12.868 0.594 -13.273 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -13.976 1.564 -14.224 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -11.640 2.588 -13.270 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -13.066 3.589 -13.468 1.00 0.00 H new ATOM 1853 N GLY A 121 -13.210 0.993 -8.780 1.00 0.00 N ATOM 1854 CA GLY A 121 -12.658 -0.021 -7.901 1.00 0.00 C ATOM 1855 C GLY A 121 -11.938 0.576 -6.708 1.00 0.00 C ATOM 1856 O GLY A 121 -11.630 -0.125 -5.745 1.00 0.00 O ATOM 0 H GLY A 121 -13.595 1.809 -8.304 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -13.461 -0.669 -7.550 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -11.965 -0.647 -8.463 1.00 0.00 H new ATOM 1860 N ALA A 122 -11.666 1.876 -6.772 1.00 0.00 N ATOM 1861 CA ALA A 122 -10.978 2.567 -5.689 1.00 0.00 C ATOM 1862 C ALA A 122 -11.888 3.596 -5.029 1.00 0.00 C ATOM 1863 O ALA A 122 -12.832 4.090 -5.645 1.00 0.00 O ATOM 1864 CB ALA A 122 -9.712 3.234 -6.209 1.00 0.00 C ATOM 0 H ALA A 122 -11.912 2.471 -7.563 1.00 0.00 H new ATOM 0 HA ALA A 122 -10.703 1.828 -4.936 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -9.208 3.747 -5.390 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -9.048 2.478 -6.627 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.973 3.956 -6.983 1.00 0.00 H new ATOM 1870 N ARG A 123 -11.599 3.917 -3.772 1.00 0.00 N ATOM 1871 CA ARG A 123 -12.393 4.886 -3.027 1.00 0.00 C ATOM 1872 C ARG A 123 -11.497 5.793 -2.189 1.00 0.00 C ATOM 1873 O ARG A 123 -10.500 5.345 -1.623 1.00 0.00 O ATOM 1874 CB ARG A 123 -13.399 4.169 -2.126 1.00 0.00 C ATOM 1875 CG ARG A 123 -12.767 3.512 -0.910 1.00 0.00 C ATOM 1876 CD ARG A 123 -13.804 3.201 0.157 1.00 0.00 C ATOM 1877 NE ARG A 123 -15.076 2.778 -0.423 1.00 0.00 N ATOM 1878 CZ ARG A 123 -16.113 2.367 0.299 1.00 0.00 C ATOM 1879 NH1 ARG A 123 -16.029 2.325 1.621 1.00 0.00 N ATOM 1880 NH2 ARG A 123 -17.237 1.999 -0.302 1.00 0.00 N ATOM 0 H ARG A 123 -10.820 3.519 -3.248 1.00 0.00 H new ATOM 0 HA ARG A 123 -12.935 5.502 -3.744 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -14.150 4.885 -1.792 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -13.920 3.410 -2.709 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -12.266 2.592 -1.211 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -12.003 4.170 -0.496 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -13.426 2.417 0.812 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -13.964 4.084 0.776 1.00 0.00 H new ATOM 0 HE ARG A 123 -15.174 2.799 -1.438 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -15.167 2.609 2.087 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -16.827 2.009 2.173 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -17.306 2.031 -1.319 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -18.032 1.684 0.253 1.00 0.00 H new ATOM 1894 N TRP A 124 -11.860 7.068 -2.113 1.00 0.00 N ATOM 1895 CA TRP A 124 -11.088 8.038 -1.343 1.00 0.00 C ATOM 1896 C TRP A 124 -11.756 8.324 -0.003 1.00 0.00 C ATOM 1897 O TRP A 124 -12.814 8.951 0.053 1.00 0.00 O ATOM 1898 CB TRP A 124 -10.928 9.337 -2.135 1.00 0.00 C ATOM 1899 CG TRP A 124 -9.736 9.335 -3.045 1.00 0.00 C ATOM 1900 CD1 TRP A 124 -9.671 8.819 -4.307 1.00 0.00 C ATOM 1901 CD2 TRP A 124 -8.441 9.873 -2.761 1.00 0.00 C ATOM 1902 NE1 TRP A 124 -8.412 9.003 -4.825 1.00 0.00 N ATOM 1903 CE2 TRP A 124 -7.638 9.648 -3.897 1.00 0.00 C ATOM 1904 CE3 TRP A 124 -7.881 10.524 -1.659 1.00 0.00 C ATOM 1905 CZ2 TRP A 124 -6.307 10.052 -3.959 1.00 0.00 C ATOM 1906 CZ3 TRP A 124 -6.559 10.923 -1.722 1.00 0.00 C ATOM 1907 CH2 TRP A 124 -5.785 10.687 -2.866 1.00 0.00 C ATOM 0 H TRP A 124 -12.683 7.455 -2.575 1.00 0.00 H new ATOM 0 HA TRP A 124 -10.102 7.613 -1.153 1.00 0.00 H new ATOM 0 HB2 TRP A 124 -11.828 9.507 -2.727 1.00 0.00 H new ATOM 0 HB3 TRP A 124 -10.843 10.171 -1.438 1.00 0.00 H new ATOM 0 HD1 TRP A 124 -10.489 8.337 -4.822 1.00 0.00 H new ATOM 0 HE1 TRP A 124 -8.103 8.707 -5.751 1.00 0.00 H new ATOM 0 HE3 TRP A 124 -8.470 10.712 -0.774 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 -5.708 9.870 -4.839 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 -6.115 11.425 -0.875 1.00 0.00 H new ATOM 0 HH2 TRP A 124 -4.756 11.013 -2.885 1.00 0.00 H new ATOM 1918 N LEU A 125 -11.133 7.861 1.074 1.00 0.00 N ATOM 1919 CA LEU A 125 -11.667 8.068 2.416 1.00 0.00 C ATOM 1920 C LEU A 125 -10.636 8.742 3.315 1.00 0.00 C ATOM 1921 O LEU A 125 -9.467 8.869 2.951 1.00 0.00 O ATOM 1922 CB LEU A 125 -12.098 6.733 3.026 1.00 0.00 C ATOM 1923 CG LEU A 125 -11.108 5.577 2.878 1.00 0.00 C ATOM 1924 CD1 LEU A 125 -9.917 5.773 3.802 1.00 0.00 C ATOM 1925 CD2 LEU A 125 -11.795 4.248 3.163 1.00 0.00 C ATOM 0 H LEU A 125 -10.257 7.339 1.045 1.00 0.00 H new ATOM 0 HA LEU A 125 -12.535 8.722 2.338 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.290 6.887 4.088 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -13.043 6.436 2.571 1.00 0.00 H new ATOM 0 HG LEU A 125 -10.745 5.563 1.850 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -9.223 4.941 3.683 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -9.411 6.706 3.551 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -10.261 5.813 4.835 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -11.076 3.436 3.053 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -12.186 4.251 4.180 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -12.615 4.104 2.460 1.00 0.00 H new ATOM 1937 N THR A 126 -11.077 9.172 4.493 1.00 0.00 N ATOM 1938 CA THR A 126 -10.193 9.832 5.446 1.00 0.00 C ATOM 1939 C THR A 126 -9.436 8.813 6.292 1.00 0.00 C ATOM 1940 O THR A 126 -9.649 7.608 6.163 1.00 0.00 O ATOM 1941 CB THR A 126 -10.975 10.776 6.378 1.00 0.00 C ATOM 1942 OG1 THR A 126 -11.658 10.016 7.383 1.00 0.00 O ATOM 1943 CG2 THR A 126 -11.978 11.604 5.591 1.00 0.00 C ATOM 0 H THR A 126 -12.042 9.075 4.810 1.00 0.00 H new ATOM 0 HA THR A 126 -9.481 10.417 4.863 1.00 0.00 H new ATOM 0 HB THR A 126 -10.265 11.452 6.854 1.00 0.00 H new ATOM 0 HG1 THR A 126 -12.152 10.623 7.973 1.00 0.00 H new ATOM 0 HG21 THR A 126 -12.518 12.263 6.270 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.452 12.202 4.847 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.684 10.941 5.091 1.00 0.00 H new ATOM 1951 N GLN A 127 -8.554 9.305 7.154 1.00 0.00 N ATOM 1952 CA GLN A 127 -7.766 8.435 8.021 1.00 0.00 C ATOM 1953 C GLN A 127 -8.658 7.718 9.027 1.00 0.00 C ATOM 1954 O GLN A 127 -8.363 6.598 9.444 1.00 0.00 O ATOM 1955 CB GLN A 127 -6.697 9.247 8.755 1.00 0.00 C ATOM 1956 CG GLN A 127 -5.580 9.743 7.851 1.00 0.00 C ATOM 1957 CD GLN A 127 -4.409 10.310 8.628 1.00 0.00 C ATOM 1958 OE1 GLN A 127 -3.553 9.570 9.111 1.00 0.00 O ATOM 1959 NE2 GLN A 127 -4.365 11.632 8.752 1.00 0.00 N ATOM 0 H GLN A 127 -8.366 10.301 7.272 1.00 0.00 H new ATOM 0 HA GLN A 127 -7.279 7.685 7.398 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -7.170 10.103 9.237 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -6.267 8.633 9.547 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -5.232 8.921 7.225 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -5.972 10.509 7.182 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -5.096 12.208 8.335 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -3.600 12.071 9.264 1.00 0.00 H new ATOM 1968 N GLU A 128 -9.750 8.370 9.414 1.00 0.00 N ATOM 1969 CA GLU A 128 -10.684 7.793 10.373 1.00 0.00 C ATOM 1970 C GLU A 128 -11.600 6.777 9.697 1.00 0.00 C ATOM 1971 O GLU A 128 -11.780 5.664 10.190 1.00 0.00 O ATOM 1972 CB GLU A 128 -11.521 8.893 11.029 1.00 0.00 C ATOM 1973 CG GLU A 128 -10.707 9.847 11.888 1.00 0.00 C ATOM 1974 CD GLU A 128 -11.538 10.989 12.438 1.00 0.00 C ATOM 1975 OE1 GLU A 128 -12.594 10.717 13.048 1.00 0.00 O ATOM 1976 OE2 GLU A 128 -11.132 12.157 12.259 1.00 0.00 O ATOM 0 H GLU A 128 -10.009 9.298 9.078 1.00 0.00 H new ATOM 0 HA GLU A 128 -10.105 7.280 11.141 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -12.031 9.462 10.252 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -12.293 8.432 11.645 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -10.262 9.295 12.716 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -9.886 10.252 11.297 1.00 0.00 H new ATOM 1983 N GLU A 129 -12.176 7.170 8.565 1.00 0.00 N ATOM 1984 CA GLU A 129 -13.075 6.294 7.821 1.00 0.00 C ATOM 1985 C GLU A 129 -12.382 4.981 7.466 1.00 0.00 C ATOM 1986 O GLU A 129 -13.038 3.977 7.186 1.00 0.00 O ATOM 1987 CB GLU A 129 -13.562 6.988 6.549 1.00 0.00 C ATOM 1988 CG GLU A 129 -14.765 7.889 6.769 1.00 0.00 C ATOM 1989 CD GLU A 129 -16.080 7.138 6.678 1.00 0.00 C ATOM 1990 OE1 GLU A 129 -16.379 6.352 7.601 1.00 0.00 O ATOM 1991 OE2 GLU A 129 -16.809 7.336 5.684 1.00 0.00 O ATOM 0 H GLU A 129 -12.037 8.088 8.143 1.00 0.00 H new ATOM 0 HA GLU A 129 -13.934 6.072 8.455 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -12.747 7.580 6.133 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -13.817 6.231 5.807 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -14.687 8.360 7.749 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -14.756 8.689 6.029 1.00 0.00 H new ATOM 1998 N PHE A 130 -11.053 4.997 7.476 1.00 0.00 N ATOM 1999 CA PHE A 130 -10.272 3.809 7.153 1.00 0.00 C ATOM 2000 C PHE A 130 -10.357 2.780 8.276 1.00 0.00 C ATOM 2001 O PHE A 130 -10.870 1.677 8.086 1.00 0.00 O ATOM 2002 CB PHE A 130 -8.811 4.187 6.901 1.00 0.00 C ATOM 2003 CG PHE A 130 -7.867 3.022 6.989 1.00 0.00 C ATOM 2004 CD1 PHE A 130 -7.816 2.078 5.976 1.00 0.00 C ATOM 2005 CD2 PHE A 130 -7.032 2.870 8.083 1.00 0.00 C ATOM 2006 CE1 PHE A 130 -6.948 1.005 6.052 1.00 0.00 C ATOM 2007 CE2 PHE A 130 -6.161 1.800 8.165 1.00 0.00 C ATOM 2008 CZ PHE A 130 -6.120 0.865 7.149 1.00 0.00 C ATOM 0 H PHE A 130 -10.495 5.820 7.704 1.00 0.00 H new ATOM 0 HA PHE A 130 -10.687 3.367 6.247 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.726 4.639 5.913 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -8.510 4.944 7.625 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -8.462 2.182 5.117 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -7.062 3.596 8.882 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.917 0.277 5.255 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -5.513 1.695 9.023 1.00 0.00 H new ATOM 0 HZ PHE A 130 -5.442 0.027 7.212 1.00 0.00 H new ATOM 2018 N HIS A 131 -9.850 3.149 9.448 1.00 0.00 N ATOM 2019 CA HIS A 131 -9.868 2.259 10.604 1.00 0.00 C ATOM 2020 C HIS A 131 -11.156 1.441 10.640 1.00 0.00 C ATOM 2021 O HIS A 131 -11.128 0.227 10.844 1.00 0.00 O ATOM 2022 CB HIS A 131 -9.723 3.062 11.897 1.00 0.00 C ATOM 2023 CG HIS A 131 -8.300 3.277 12.312 1.00 0.00 C ATOM 2024 ND1 HIS A 131 -7.304 2.347 12.095 1.00 0.00 N ATOM 2025 CD2 HIS A 131 -7.707 4.324 12.932 1.00 0.00 C ATOM 2026 CE1 HIS A 131 -6.161 2.812 12.566 1.00 0.00 C ATOM 2027 NE2 HIS A 131 -6.378 4.010 13.080 1.00 0.00 N ATOM 0 H HIS A 131 -9.422 4.058 9.623 1.00 0.00 H new ATOM 0 HA HIS A 131 -9.025 1.573 10.516 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -10.206 4.031 11.769 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -10.252 2.545 12.697 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -8.189 5.236 13.251 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -5.210 2.300 12.536 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -5.673 4.605 13.516 1.00 0.00 H new ATOM 2036 N THR A 132 -12.284 2.116 10.442 1.00 0.00 N ATOM 2037 CA THR A 132 -13.582 1.454 10.455 1.00 0.00 C ATOM 2038 C THR A 132 -13.729 0.509 9.267 1.00 0.00 C ATOM 2039 O THR A 132 -14.139 -0.641 9.423 1.00 0.00 O ATOM 2040 CB THR A 132 -14.735 2.476 10.428 1.00 0.00 C ATOM 2041 OG1 THR A 132 -14.667 3.259 9.230 1.00 0.00 O ATOM 2042 CG2 THR A 132 -14.674 3.391 11.641 1.00 0.00 C ATOM 0 H THR A 132 -12.324 3.121 10.271 1.00 0.00 H new ATOM 0 HA THR A 132 -13.635 0.882 11.381 1.00 0.00 H new ATOM 0 HB THR A 132 -15.678 1.929 10.452 1.00 0.00 H new ATOM 0 HG1 THR A 132 -15.404 3.905 9.219 1.00 0.00 H new ATOM 0 HG21 THR A 132 -15.497 4.104 11.601 1.00 0.00 H new ATOM 0 HG22 THR A 132 -14.754 2.795 12.550 1.00 0.00 H new ATOM 0 HG23 THR A 132 -13.727 3.930 11.643 1.00 0.00 H new ATOM 2050 N ALA A 133 -13.391 1.002 8.080 1.00 0.00 N ATOM 2051 CA ALA A 133 -13.482 0.199 6.866 1.00 0.00 C ATOM 2052 C ALA A 133 -12.909 -1.197 7.087 1.00 0.00 C ATOM 2053 O ALA A 133 -12.070 -1.403 7.961 1.00 0.00 O ATOM 2054 CB ALA A 133 -12.761 0.892 5.720 1.00 0.00 C ATOM 0 H ALA A 133 -13.052 1.953 7.933 1.00 0.00 H new ATOM 0 HA ALA A 133 -14.536 0.094 6.607 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -12.837 0.282 4.820 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -13.218 1.865 5.538 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -11.711 1.027 5.979 1.00 0.00 H new ATOM 2060 N ALA A 134 -13.372 -2.153 6.287 1.00 0.00 N ATOM 2061 CA ALA A 134 -12.903 -3.530 6.394 1.00 0.00 C ATOM 2062 C ALA A 134 -11.482 -3.670 5.861 1.00 0.00 C ATOM 2063 O ALA A 134 -11.262 -3.696 4.650 1.00 0.00 O ATOM 2064 CB ALA A 134 -13.843 -4.466 5.648 1.00 0.00 C ATOM 0 H ALA A 134 -14.070 -2.000 5.559 1.00 0.00 H new ATOM 0 HA ALA A 134 -12.895 -3.804 7.449 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -13.482 -5.491 5.736 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -14.843 -4.396 6.077 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -13.879 -4.183 4.596 1.00 0.00 H new ATOM 2070 N VAL A 135 -10.519 -3.759 6.773 1.00 0.00 N ATOM 2071 CA VAL A 135 -9.118 -3.897 6.395 1.00 0.00 C ATOM 2072 C VAL A 135 -8.451 -5.035 7.158 1.00 0.00 C ATOM 2073 O VAL A 135 -8.804 -5.318 8.303 1.00 0.00 O ATOM 2074 CB VAL A 135 -8.336 -2.594 6.650 1.00 0.00 C ATOM 2075 CG1 VAL A 135 -7.194 -2.454 5.656 1.00 0.00 C ATOM 2076 CG2 VAL A 135 -9.267 -1.393 6.580 1.00 0.00 C ATOM 0 H VAL A 135 -10.684 -3.738 7.779 1.00 0.00 H new ATOM 0 HA VAL A 135 -9.100 -4.120 5.328 1.00 0.00 H new ATOM 0 HB VAL A 135 -7.909 -2.636 7.652 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -6.653 -1.528 5.851 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -6.515 -3.300 5.761 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -7.594 -2.433 4.642 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -8.699 -0.481 6.762 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -9.724 -1.344 5.592 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -10.046 -1.492 7.336 1.00 0.00 H new ATOM 2086 N SER A 136 -7.486 -5.686 6.518 1.00 0.00 N ATOM 2087 CA SER A 136 -6.771 -6.797 7.135 1.00 0.00 C ATOM 2088 C SER A 136 -5.749 -6.288 8.148 1.00 0.00 C ATOM 2089 O SER A 136 -5.239 -5.174 8.029 1.00 0.00 O ATOM 2090 CB SER A 136 -6.071 -7.638 6.067 1.00 0.00 C ATOM 2091 OG SER A 136 -5.310 -8.679 6.655 1.00 0.00 O ATOM 0 H SER A 136 -7.181 -5.463 5.571 1.00 0.00 H new ATOM 0 HA SER A 136 -7.498 -7.419 7.657 1.00 0.00 H new ATOM 0 HB2 SER A 136 -6.813 -8.063 5.391 1.00 0.00 H new ATOM 0 HB3 SER A 136 -5.420 -7.002 5.467 1.00 0.00 H new ATOM 0 HG SER A 136 -4.874 -9.203 5.951 1.00 0.00 H new ATOM 2097 N THR A 137 -5.455 -7.114 9.148 1.00 0.00 N ATOM 2098 CA THR A 137 -4.496 -6.750 10.183 1.00 0.00 C ATOM 2099 C THR A 137 -3.274 -6.062 9.584 1.00 0.00 C ATOM 2100 O THR A 137 -3.052 -4.872 9.801 1.00 0.00 O ATOM 2101 CB THR A 137 -4.035 -7.984 10.982 1.00 0.00 C ATOM 2102 OG1 THR A 137 -5.173 -8.720 11.444 1.00 0.00 O ATOM 2103 CG2 THR A 137 -3.175 -7.572 12.166 1.00 0.00 C ATOM 0 H THR A 137 -5.868 -8.040 9.262 1.00 0.00 H new ATOM 0 HA THR A 137 -5.005 -6.060 10.856 1.00 0.00 H new ATOM 0 HB THR A 137 -3.438 -8.615 10.323 1.00 0.00 H new ATOM 0 HG1 THR A 137 -4.872 -9.504 11.950 1.00 0.00 H new ATOM 0 HG21 THR A 137 -2.862 -8.460 12.715 1.00 0.00 H new ATOM 0 HG22 THR A 137 -2.295 -7.037 11.808 1.00 0.00 H new ATOM 0 HG23 THR A 137 -3.751 -6.923 12.825 1.00 0.00 H new ATOM 2111 N ALA A 138 -2.487 -6.819 8.827 1.00 0.00 N ATOM 2112 CA ALA A 138 -1.290 -6.281 8.194 1.00 0.00 C ATOM 2113 C ALA A 138 -1.519 -4.854 7.709 1.00 0.00 C ATOM 2114 O ALA A 138 -0.819 -3.929 8.119 1.00 0.00 O ATOM 2115 CB ALA A 138 -0.859 -7.171 7.038 1.00 0.00 C ATOM 0 H ALA A 138 -2.657 -7.807 8.637 1.00 0.00 H new ATOM 0 HA ALA A 138 -0.494 -6.260 8.938 1.00 0.00 H new ATOM 0 HB1 ALA A 138 0.036 -6.757 6.574 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -0.645 -8.173 7.410 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.659 -7.222 6.300 1.00 0.00 H new ATOM 2121 N MET A 139 -2.503 -4.683 6.832 1.00 0.00 N ATOM 2122 CA MET A 139 -2.825 -3.368 6.291 1.00 0.00 C ATOM 2123 C MET A 139 -3.074 -2.365 7.413 1.00 0.00 C ATOM 2124 O MET A 139 -2.427 -1.320 7.480 1.00 0.00 O ATOM 2125 CB MET A 139 -4.055 -3.452 5.385 1.00 0.00 C ATOM 2126 CG MET A 139 -3.990 -4.590 4.378 1.00 0.00 C ATOM 2127 SD MET A 139 -2.380 -4.718 3.577 1.00 0.00 S ATOM 2128 CE MET A 139 -2.227 -3.084 2.859 1.00 0.00 C ATOM 0 H MET A 139 -3.091 -5.439 6.481 1.00 0.00 H new ATOM 0 HA MET A 139 -1.973 -3.026 5.704 1.00 0.00 H new ATOM 0 HB2 MET A 139 -4.944 -3.575 6.003 1.00 0.00 H new ATOM 0 HB3 MET A 139 -4.167 -2.509 4.849 1.00 0.00 H new ATOM 0 HG2 MET A 139 -4.216 -5.529 4.882 1.00 0.00 H new ATOM 0 HG3 MET A 139 -4.758 -4.443 3.619 1.00 0.00 H new ATOM 0 HE1 MET A 139 -1.801 -3.164 1.859 1.00 0.00 H new ATOM 0 HE2 MET A 139 -3.211 -2.620 2.798 1.00 0.00 H new ATOM 0 HE3 MET A 139 -1.575 -2.472 3.483 1.00 0.00 H new ATOM 2138 N LYS A 140 -4.017 -2.689 8.291 1.00 0.00 N ATOM 2139 CA LYS A 140 -4.350 -1.817 9.412 1.00 0.00 C ATOM 2140 C LYS A 140 -3.092 -1.369 10.147 1.00 0.00 C ATOM 2141 O LYS A 140 -3.045 -0.274 10.708 1.00 0.00 O ATOM 2142 CB LYS A 140 -5.291 -2.537 10.382 1.00 0.00 C ATOM 2143 CG LYS A 140 -6.675 -2.795 9.809 1.00 0.00 C ATOM 2144 CD LYS A 140 -7.683 -3.100 10.903 1.00 0.00 C ATOM 2145 CE LYS A 140 -8.355 -1.834 11.411 1.00 0.00 C ATOM 2146 NZ LYS A 140 -8.910 -2.012 12.781 1.00 0.00 N ATOM 0 H LYS A 140 -4.564 -3.549 8.248 1.00 0.00 H new ATOM 0 HA LYS A 140 -4.851 -0.934 9.016 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -4.843 -3.488 10.671 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -5.388 -1.942 11.290 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -7.004 -1.923 9.243 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -6.631 -3.631 9.111 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -8.439 -3.786 10.521 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -7.183 -3.604 11.730 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -7.634 -1.017 11.415 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -9.156 -1.549 10.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -9.360 -1.127 13.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -9.617 -2.775 12.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -8.142 -2.259 13.437 1.00 0.00 H new ATOM 2160 N LYS A 141 -2.073 -2.221 10.140 1.00 0.00 N ATOM 2161 CA LYS A 141 -0.812 -1.911 10.804 1.00 0.00 C ATOM 2162 C LYS A 141 0.017 -0.938 9.970 1.00 0.00 C ATOM 2163 O LYS A 141 0.806 -0.161 10.508 1.00 0.00 O ATOM 2164 CB LYS A 141 -0.014 -3.195 11.052 1.00 0.00 C ATOM 2165 CG LYS A 141 -0.697 -4.158 12.006 1.00 0.00 C ATOM 2166 CD LYS A 141 -0.080 -5.546 11.932 1.00 0.00 C ATOM 2167 CE LYS A 141 1.097 -5.683 12.885 1.00 0.00 C ATOM 2168 NZ LYS A 141 2.106 -6.658 12.383 1.00 0.00 N ATOM 0 H LYS A 141 -2.095 -3.132 9.682 1.00 0.00 H new ATOM 0 HA LYS A 141 -1.039 -1.440 11.761 1.00 0.00 H new ATOM 0 HB2 LYS A 141 0.155 -3.698 10.100 1.00 0.00 H new ATOM 0 HB3 LYS A 141 0.965 -2.933 11.452 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -0.620 -3.778 13.025 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -1.759 -4.217 11.767 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -0.835 -6.294 12.174 1.00 0.00 H new ATOM 0 HD3 LYS A 141 0.251 -5.745 10.913 1.00 0.00 H new ATOM 0 HE2 LYS A 141 1.569 -4.710 13.022 1.00 0.00 H new ATOM 0 HE3 LYS A 141 0.737 -6.003 13.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 2.859 -6.774 13.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 1.647 -7.575 12.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 2.517 -6.306 11.495 1.00 0.00 H new ATOM 2182 N VAL A 142 -0.168 -0.987 8.655 1.00 0.00 N ATOM 2183 CA VAL A 142 0.561 -0.108 7.748 1.00 0.00 C ATOM 2184 C VAL A 142 0.183 1.352 7.976 1.00 0.00 C ATOM 2185 O VAL A 142 0.882 2.262 7.530 1.00 0.00 O ATOM 2186 CB VAL A 142 0.292 -0.472 6.276 1.00 0.00 C ATOM 2187 CG1 VAL A 142 0.687 0.677 5.360 1.00 0.00 C ATOM 2188 CG2 VAL A 142 1.034 -1.745 5.899 1.00 0.00 C ATOM 0 H VAL A 142 -0.816 -1.626 8.194 1.00 0.00 H new ATOM 0 HA VAL A 142 1.622 -0.244 7.960 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.776 -0.651 6.153 1.00 0.00 H new ATOM 0 HG11 VAL A 142 0.490 0.401 4.324 1.00 0.00 H new ATOM 0 HG12 VAL A 142 0.106 1.563 5.616 1.00 0.00 H new ATOM 0 HG13 VAL A 142 1.749 0.891 5.482 1.00 0.00 H new ATOM 0 HG21 VAL A 142 0.833 -1.988 4.856 1.00 0.00 H new ATOM 0 HG22 VAL A 142 2.105 -1.596 6.037 1.00 0.00 H new ATOM 0 HG23 VAL A 142 0.697 -2.564 6.534 1.00 0.00 H new ATOM 2198 N PHE A 143 -0.926 1.568 8.674 1.00 0.00 N ATOM 2199 CA PHE A 143 -1.398 2.918 8.962 1.00 0.00 C ATOM 2200 C PHE A 143 -0.700 3.487 10.194 1.00 0.00 C ATOM 2201 O PHE A 143 -0.123 4.574 10.147 1.00 0.00 O ATOM 2202 CB PHE A 143 -2.913 2.917 9.175 1.00 0.00 C ATOM 2203 CG PHE A 143 -3.454 4.240 9.639 1.00 0.00 C ATOM 2204 CD1 PHE A 143 -3.530 5.316 8.770 1.00 0.00 C ATOM 2205 CD2 PHE A 143 -3.885 4.406 10.945 1.00 0.00 C ATOM 2206 CE1 PHE A 143 -4.028 6.534 9.193 1.00 0.00 C ATOM 2207 CE2 PHE A 143 -4.384 5.623 11.375 1.00 0.00 C ATOM 2208 CZ PHE A 143 -4.454 6.687 10.498 1.00 0.00 C ATOM 0 H PHE A 143 -1.515 0.826 9.051 1.00 0.00 H new ATOM 0 HA PHE A 143 -1.159 3.550 8.107 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -3.403 2.640 8.241 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -3.168 2.152 9.908 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -3.196 5.202 7.749 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -3.831 3.577 11.635 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -4.084 7.364 8.505 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -4.718 5.740 12.395 1.00 0.00 H new ATOM 0 HZ PHE A 143 -4.842 7.638 10.832 1.00 0.00 H new ATOM 2218 N ARG A 144 -0.757 2.745 11.294 1.00 0.00 N ATOM 2219 CA ARG A 144 -0.133 3.175 12.539 1.00 0.00 C ATOM 2220 C ARG A 144 1.371 3.357 12.359 1.00 0.00 C ATOM 2221 O ARG A 144 2.024 4.039 13.148 1.00 0.00 O ATOM 2222 CB ARG A 144 -0.405 2.158 13.650 1.00 0.00 C ATOM 2223 CG ARG A 144 0.551 0.976 13.640 1.00 0.00 C ATOM 2224 CD ARG A 144 0.118 -0.098 14.625 1.00 0.00 C ATOM 2225 NE ARG A 144 0.544 0.205 15.989 1.00 0.00 N ATOM 2226 CZ ARG A 144 -0.135 0.995 16.812 1.00 0.00 C ATOM 2227 NH1 ARG A 144 -1.266 1.559 16.412 1.00 0.00 N ATOM 2228 NH2 ARG A 144 0.317 1.222 18.039 1.00 0.00 N ATOM 0 H ARG A 144 -1.229 1.843 11.349 1.00 0.00 H new ATOM 0 HA ARG A 144 -0.567 4.135 12.820 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -0.339 2.660 14.615 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -1.426 1.790 13.552 1.00 0.00 H new ATOM 0 HG2 ARG A 144 0.598 0.553 12.636 1.00 0.00 H new ATOM 0 HG3 ARG A 144 1.556 1.317 13.890 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -0.967 -0.198 14.598 1.00 0.00 H new ATOM 0 HD3 ARG A 144 0.534 -1.058 14.320 1.00 0.00 H new ATOM 0 HE ARG A 144 1.410 -0.213 16.328 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -1.617 1.386 15.470 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -1.786 2.166 17.046 1.00 0.00 H new ATOM 0 HH21 ARG A 144 1.187 0.789 18.350 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -0.205 1.829 18.671 1.00 0.00 H new ATOM 2242 N VAL A 145 1.915 2.741 11.314 1.00 0.00 N ATOM 2243 CA VAL A 145 3.342 2.835 11.029 1.00 0.00 C ATOM 2244 C VAL A 145 3.656 4.076 10.201 1.00 0.00 C ATOM 2245 O VAL A 145 4.762 4.613 10.263 1.00 0.00 O ATOM 2246 CB VAL A 145 3.848 1.588 10.278 1.00 0.00 C ATOM 2247 CG1 VAL A 145 5.295 1.775 9.848 1.00 0.00 C ATOM 2248 CG2 VAL A 145 3.696 0.348 11.145 1.00 0.00 C ATOM 0 H VAL A 145 1.389 2.172 10.651 1.00 0.00 H new ATOM 0 HA VAL A 145 3.853 2.904 11.989 1.00 0.00 H new ATOM 0 HB VAL A 145 3.243 1.453 9.382 1.00 0.00 H new ATOM 0 HG11 VAL A 145 5.635 0.885 9.319 1.00 0.00 H new ATOM 0 HG12 VAL A 145 5.370 2.640 9.188 1.00 0.00 H new ATOM 0 HG13 VAL A 145 5.918 1.935 10.728 1.00 0.00 H new ATOM 0 HG21 VAL A 145 4.058 -0.524 10.600 1.00 0.00 H new ATOM 0 HG22 VAL A 145 4.276 0.470 12.060 1.00 0.00 H new ATOM 0 HG23 VAL A 145 2.645 0.207 11.398 1.00 0.00 H new ATOM 2258 N TYR A 146 2.677 4.527 9.426 1.00 0.00 N ATOM 2259 CA TYR A 146 2.849 5.704 8.583 1.00 0.00 C ATOM 2260 C TYR A 146 2.783 6.982 9.413 1.00 0.00 C ATOM 2261 O TYR A 146 3.496 7.948 9.142 1.00 0.00 O ATOM 2262 CB TYR A 146 1.779 5.736 7.490 1.00 0.00 C ATOM 2263 CG TYR A 146 1.425 7.132 7.030 1.00 0.00 C ATOM 2264 CD1 TYR A 146 2.291 7.858 6.221 1.00 0.00 C ATOM 2265 CD2 TYR A 146 0.226 7.726 7.405 1.00 0.00 C ATOM 2266 CE1 TYR A 146 1.973 9.133 5.798 1.00 0.00 C ATOM 2267 CE2 TYR A 146 -0.101 9.000 6.986 1.00 0.00 C ATOM 2268 CZ TYR A 146 0.775 9.700 6.182 1.00 0.00 C ATOM 2269 OH TYR A 146 0.453 10.971 5.764 1.00 0.00 O ATOM 0 H TYR A 146 1.755 4.095 9.364 1.00 0.00 H new ATOM 0 HA TYR A 146 3.833 5.645 8.117 1.00 0.00 H new ATOM 0 HB2 TYR A 146 2.128 5.158 6.634 1.00 0.00 H new ATOM 0 HB3 TYR A 146 0.879 5.245 7.860 1.00 0.00 H new ATOM 0 HD1 TYR A 146 3.229 7.417 5.918 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -0.462 7.182 8.035 1.00 0.00 H new ATOM 0 HE1 TYR A 146 2.658 9.684 5.170 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -1.038 9.446 7.286 1.00 0.00 H new ATOM 0 HH TYR A 146 -0.518 11.094 5.808 1.00 0.00 H new ATOM 2279 N GLN A 147 1.922 6.979 10.426 1.00 0.00 N ATOM 2280 CA GLN A 147 1.762 8.138 11.295 1.00 0.00 C ATOM 2281 C GLN A 147 3.081 8.500 11.969 1.00 0.00 C ATOM 2282 O GLN A 147 3.351 9.669 12.240 1.00 0.00 O ATOM 2283 CB GLN A 147 0.693 7.864 12.355 1.00 0.00 C ATOM 2284 CG GLN A 147 -0.707 7.711 11.782 1.00 0.00 C ATOM 2285 CD GLN A 147 -1.790 7.989 12.806 1.00 0.00 C ATOM 2286 OE1 GLN A 147 -2.598 6.978 13.103 1.00 0.00 O flip ATOM 2287 NE2 GLN A 147 -1.899 9.101 13.324 1.00 0.00 N flip ATOM 0 H GLN A 147 1.325 6.187 10.665 1.00 0.00 H new ATOM 0 HA GLN A 147 1.446 8.980 10.679 1.00 0.00 H new ATOM 0 HB2 GLN A 147 0.956 6.956 12.898 1.00 0.00 H new ATOM 0 HB3 GLN A 147 0.693 8.679 13.079 1.00 0.00 H new ATOM 0 HG2 GLN A 147 -0.827 8.391 10.939 1.00 0.00 H new ATOM 0 HG3 GLN A 147 -0.829 6.699 11.395 1.00 0.00 H new ATOM 0 HE21 GLN A 147 -1.256 9.849 13.066 1.00 0.00 H new ATOM 0 HE22 GLN A 147 -2.633 9.274 14.011 1.00 0.00 H new ATOM 2296 N GLY A 148 3.901 7.487 12.236 1.00 0.00 N ATOM 2297 CA GLY A 148 5.182 7.719 12.876 1.00 0.00 C ATOM 2298 C GLY A 148 5.880 8.956 12.346 1.00 0.00 C ATOM 2299 O GLY A 148 6.537 9.675 13.097 1.00 0.00 O ATOM 0 H GLY A 148 3.700 6.510 12.020 1.00 0.00 H new ATOM 0 HA2 GLY A 148 5.034 7.822 13.951 1.00 0.00 H new ATOM 0 HA3 GLY A 148 5.823 6.851 12.724 1.00 0.00 H new ATOM 2303 N GLN A 149 5.739 9.201 11.046 1.00 0.00 N ATOM 2304 CA GLN A 149 6.364 10.357 10.416 1.00 0.00 C ATOM 2305 C GLN A 149 5.472 10.928 9.318 1.00 0.00 C ATOM 2306 O GLN A 149 5.289 10.310 8.270 1.00 0.00 O ATOM 2307 CB GLN A 149 7.725 9.974 9.835 1.00 0.00 C ATOM 2308 CG GLN A 149 8.723 9.502 10.881 1.00 0.00 C ATOM 2309 CD GLN A 149 10.141 9.439 10.348 1.00 0.00 C ATOM 2310 OE1 GLN A 149 10.618 10.376 9.706 1.00 0.00 O ATOM 2311 NE2 GLN A 149 10.825 8.332 10.613 1.00 0.00 N ATOM 0 H GLN A 149 5.198 8.615 10.410 1.00 0.00 H new ATOM 0 HA GLN A 149 6.505 11.122 11.179 1.00 0.00 H new ATOM 0 HB2 GLN A 149 7.586 9.185 9.096 1.00 0.00 H new ATOM 0 HB3 GLN A 149 8.141 10.834 9.310 1.00 0.00 H new ATOM 0 HG2 GLN A 149 8.691 10.175 11.738 1.00 0.00 H new ATOM 0 HG3 GLN A 149 8.429 8.515 11.239 1.00 0.00 H new ATOM 0 HE21 GLN A 149 10.391 7.580 11.148 1.00 0.00 H new ATOM 0 HE22 GLN A 149 11.784 8.234 10.281 1.00 0.00 H new ATOM 2320 N SER A 150 4.917 12.110 9.568 1.00 0.00 N ATOM 2321 CA SER A 150 4.039 12.762 8.603 1.00 0.00 C ATOM 2322 C SER A 150 4.852 13.478 7.528 1.00 0.00 C ATOM 2323 O SER A 150 4.770 13.143 6.347 1.00 0.00 O ATOM 2324 CB SER A 150 3.118 13.757 9.311 1.00 0.00 C ATOM 2325 OG SER A 150 1.941 13.987 8.557 1.00 0.00 O ATOM 0 H SER A 150 5.060 12.636 10.430 1.00 0.00 H new ATOM 0 HA SER A 150 3.431 11.995 8.124 1.00 0.00 H new ATOM 0 HB2 SER A 150 2.853 13.375 10.297 1.00 0.00 H new ATOM 0 HB3 SER A 150 3.645 14.699 9.465 1.00 0.00 H new ATOM 0 HG SER A 150 1.368 14.625 9.031 1.00 0.00 H new ATOM 2331 N GLY A 151 5.635 14.466 7.947 1.00 0.00 N ATOM 2332 CA GLY A 151 6.452 15.215 7.009 1.00 0.00 C ATOM 2333 C GLY A 151 7.127 16.410 7.652 1.00 0.00 C ATOM 2334 O GLY A 151 8.225 16.308 8.199 1.00 0.00 O ATOM 0 H GLY A 151 5.719 14.762 8.919 1.00 0.00 H new ATOM 0 HA2 GLY A 151 7.211 14.556 6.587 1.00 0.00 H new ATOM 0 HA3 GLY A 151 5.830 15.555 6.181 1.00 0.00 H new ATOM 2338 N PRO A 152 6.464 17.574 7.590 1.00 0.00 N ATOM 2339 CA PRO A 152 6.989 18.815 8.165 1.00 0.00 C ATOM 2340 C PRO A 152 6.998 18.790 9.690 1.00 0.00 C ATOM 2341 O PRO A 152 7.839 19.425 10.326 1.00 0.00 O ATOM 2342 CB PRO A 152 6.018 19.882 7.653 1.00 0.00 C ATOM 2343 CG PRO A 152 4.748 19.147 7.397 1.00 0.00 C ATOM 2344 CD PRO A 152 5.151 17.768 6.953 1.00 0.00 C ATOM 0 HA PRO A 152 8.026 18.990 7.878 1.00 0.00 H new ATOM 0 HB2 PRO A 152 5.876 20.674 8.389 1.00 0.00 H new ATOM 0 HB3 PRO A 152 6.392 20.354 6.745 1.00 0.00 H new ATOM 0 HG2 PRO A 152 4.134 19.104 8.297 1.00 0.00 H new ATOM 0 HG3 PRO A 152 4.156 19.646 6.630 1.00 0.00 H new ATOM 0 HD2 PRO A 152 4.432 17.016 7.277 1.00 0.00 H new ATOM 0 HD3 PRO A 152 5.217 17.699 5.867 1.00 0.00 H new ATOM 2352 N SER A 153 6.057 18.052 10.270 1.00 0.00 N ATOM 2353 CA SER A 153 5.954 17.946 11.721 1.00 0.00 C ATOM 2354 C SER A 153 5.562 16.532 12.137 1.00 0.00 C ATOM 2355 O SER A 153 4.857 15.833 11.408 1.00 0.00 O ATOM 2356 CB SER A 153 4.930 18.950 12.256 1.00 0.00 C ATOM 2357 OG SER A 153 5.490 20.250 12.345 1.00 0.00 O ATOM 0 H SER A 153 5.355 17.518 9.757 1.00 0.00 H new ATOM 0 HA SER A 153 6.931 18.173 12.147 1.00 0.00 H new ATOM 0 HB2 SER A 153 4.059 18.970 11.601 1.00 0.00 H new ATOM 0 HB3 SER A 153 4.583 18.632 13.239 1.00 0.00 H new ATOM 0 HG SER A 153 6.318 20.286 11.822 1.00 0.00 H new ATOM 2363 N SER A 154 6.023 16.117 13.312 1.00 0.00 N ATOM 2364 CA SER A 154 5.725 14.786 13.823 1.00 0.00 C ATOM 2365 C SER A 154 4.794 14.862 15.030 1.00 0.00 C ATOM 2366 O SER A 154 3.677 14.348 15.000 1.00 0.00 O ATOM 2367 CB SER A 154 7.017 14.061 14.208 1.00 0.00 C ATOM 2368 OG SER A 154 6.782 12.681 14.429 1.00 0.00 O ATOM 0 H SER A 154 6.605 16.685 13.928 1.00 0.00 H new ATOM 0 HA SER A 154 5.224 14.226 13.033 1.00 0.00 H new ATOM 0 HB2 SER A 154 7.757 14.185 13.417 1.00 0.00 H new ATOM 0 HB3 SER A 154 7.435 14.511 15.109 1.00 0.00 H new ATOM 0 HG SER A 154 7.623 12.241 14.672 1.00 0.00 H new ATOM 2374 N GLY A 155 5.263 15.512 16.090 1.00 0.00 N ATOM 2375 CA GLY A 155 4.462 15.646 17.293 1.00 0.00 C ATOM 2376 C GLY A 155 5.304 15.907 18.526 1.00 0.00 C ATOM 2377 O GLY A 155 6.035 15.029 18.984 1.00 0.00 O ATOM 0 H GLY A 155 6.184 15.948 16.138 1.00 0.00 H new ATOM 0 HA2 GLY A 155 3.751 16.462 17.163 1.00 0.00 H new ATOM 0 HA3 GLY A 155 3.880 14.737 17.441 1.00 0.00 H new TER 2381 GLY A 155