USER MOD reduce.3.24.130724 H: found=0, std=0, add=963, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 961 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 73 THR OG1 : rot 85:sc= -0.306 USER MOD Set 1.2: A 92 HIS : no HD1:sc= -2.38! C(o=-2.7!,f=-4.5!) USER MOD Set 2.1: A 43 GLN : amide:sc= -0.235 X(o=-0.18,f=-0.42) USER MOD Set 2.2: A 46 GLN : amide:sc= 0.0564 K(o=-0.18,f=-1.1) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc=-0.00291 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 4:sc= 0.217 USER MOD Single : A 11 SER OG : rot 49:sc= 0.585 USER MOD Single : A 19 GLN : amide:sc= -2.61 K(o=-2.6,f=-10!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 HIS : no HD1:sc= 0.11 K(o=0.11,f=-1.9!) USER MOD Single : A 27 MET CE :methyl -144:sc= -1.98 (180deg=-4.27!) USER MOD Single : A 28 THR OG1 : rot -97:sc= 0.438 USER MOD Single : A 29 SER OG : rot 180:sc= 0.017 USER MOD Single : A 30 GLN : amide:sc= -1.84! K(o=-1.8!,f=-1) USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -57:sc= 0.267 USER MOD Single : A 44 GLN : amide:sc= -0.102 X(o=-0.1,f=-0.01) USER MOD Single : A 45 THR OG1 : rot -160:sc= -0.516 USER MOD Single : A 47 LYS NZ :NH3+ -149:sc=-0.00813 (180deg=-0.543) USER MOD Single : A 54 ASN : amide:sc= -1.24 K(o=-1.2,f=-16!) USER MOD Single : A 56 THR OG1 : rot 66:sc= 0.535 USER MOD Single : A 58 GLN : amide:sc= -2.09 K(o=-2.1,f=-1.4) USER MOD Single : A 63 ASN : amide:sc= -0.656 K(o=-0.66,f=-3.6!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= -2.96! X(o=-3!,f=-3.1) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= -8.97! C(o=-9!,f=-7.6!) USER MOD Single : A 81 TYR OH : rot -112:sc= 0.407 USER MOD Single : A 82 ASN : amide:sc= -4.85! C(o=-4.9!,f=-5.1!) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -1.46 K(o=-1.5,f=-0.28) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 HIS : no HD1:sc= -4.11 K(o=-4.1,f=-2.4) USER MOD Single : A 102 ASN : amide:sc= -2.65! C(o=-2.6!,f=-6!) USER MOD Single : A 106 TYR OH : rot -85:sc= 0.841 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 161:sc= -0.0364 (180deg=-0.302) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -28.256 13.412 -16.707 1.00 0.00 N ATOM 2 CA GLY A 1 -27.779 13.886 -17.993 1.00 0.00 C ATOM 3 C GLY A 1 -26.278 14.100 -18.011 1.00 0.00 C ATOM 4 O GLY A 1 -25.807 15.231 -18.134 1.00 0.00 O ATOM 0 H1 GLY A 1 -29.287 13.281 -16.746 1.00 0.00 H new ATOM 0 H2 GLY A 1 -27.800 12.505 -16.481 1.00 0.00 H new ATOM 0 H3 GLY A 1 -28.023 14.110 -15.972 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -28.050 13.166 -18.765 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -28.280 14.822 -18.240 1.00 0.00 H new ATOM 8 N SER A 2 -25.525 13.012 -17.888 1.00 0.00 N ATOM 9 CA SER A 2 -24.068 13.087 -17.885 1.00 0.00 C ATOM 10 C SER A 2 -23.465 11.956 -18.711 1.00 0.00 C ATOM 11 O SER A 2 -23.948 10.824 -18.681 1.00 0.00 O ATOM 12 CB SER A 2 -23.536 13.028 -16.452 1.00 0.00 C ATOM 13 OG SER A 2 -23.591 11.707 -15.942 1.00 0.00 O ATOM 0 H SER A 2 -25.899 12.068 -17.789 1.00 0.00 H new ATOM 0 HA SER A 2 -23.776 14.037 -18.334 1.00 0.00 H new ATOM 0 HB2 SER A 2 -22.508 13.388 -16.427 1.00 0.00 H new ATOM 0 HB3 SER A 2 -24.122 13.692 -15.816 1.00 0.00 H new ATOM 0 HG SER A 2 -23.244 11.695 -15.026 1.00 0.00 H new ATOM 19 N SER A 3 -22.404 12.270 -19.448 1.00 0.00 N ATOM 20 CA SER A 3 -21.735 11.282 -20.286 1.00 0.00 C ATOM 21 C SER A 3 -20.812 10.399 -19.452 1.00 0.00 C ATOM 22 O SER A 3 -19.606 10.632 -19.384 1.00 0.00 O ATOM 23 CB SER A 3 -20.936 11.976 -21.390 1.00 0.00 C ATOM 24 OG SER A 3 -20.091 11.058 -22.062 1.00 0.00 O ATOM 0 H SER A 3 -21.989 13.201 -19.482 1.00 0.00 H new ATOM 0 HA SER A 3 -22.498 10.651 -20.742 1.00 0.00 H new ATOM 0 HB2 SER A 3 -21.620 12.436 -22.104 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.337 12.779 -20.960 1.00 0.00 H new ATOM 0 HG SER A 3 -19.592 11.526 -22.764 1.00 0.00 H new ATOM 30 N GLY A 4 -21.388 9.381 -18.819 1.00 0.00 N ATOM 31 CA GLY A 4 -20.603 8.478 -17.998 1.00 0.00 C ATOM 32 C GLY A 4 -20.004 7.339 -18.799 1.00 0.00 C ATOM 33 O GLY A 4 -20.696 6.379 -19.140 1.00 0.00 O ATOM 0 H GLY A 4 -22.384 9.166 -18.860 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -19.803 9.036 -17.512 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -21.233 8.070 -17.207 1.00 0.00 H new ATOM 37 N SER A 5 -18.715 7.446 -19.103 1.00 0.00 N ATOM 38 CA SER A 5 -18.023 6.419 -19.874 1.00 0.00 C ATOM 39 C SER A 5 -18.151 5.056 -19.201 1.00 0.00 C ATOM 40 O SER A 5 -17.770 4.885 -18.043 1.00 0.00 O ATOM 41 CB SER A 5 -16.547 6.783 -20.039 1.00 0.00 C ATOM 42 OG SER A 5 -16.399 8.069 -20.614 1.00 0.00 O ATOM 0 H SER A 5 -18.128 8.233 -18.827 1.00 0.00 H new ATOM 0 HA SER A 5 -18.488 6.364 -20.858 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.052 6.756 -19.068 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.055 6.041 -20.668 1.00 0.00 H new ATOM 0 HG SER A 5 -15.446 8.278 -20.707 1.00 0.00 H new ATOM 48 N SER A 6 -18.691 4.088 -19.936 1.00 0.00 N ATOM 49 CA SER A 6 -18.873 2.741 -19.410 1.00 0.00 C ATOM 50 C SER A 6 -18.769 1.704 -20.525 1.00 0.00 C ATOM 51 O SER A 6 -19.084 1.985 -21.680 1.00 0.00 O ATOM 52 CB SER A 6 -20.229 2.622 -18.713 1.00 0.00 C ATOM 53 OG SER A 6 -20.249 3.364 -17.506 1.00 0.00 O ATOM 0 H SER A 6 -19.010 4.212 -20.897 1.00 0.00 H new ATOM 0 HA SER A 6 -18.082 2.551 -18.685 1.00 0.00 H new ATOM 0 HB2 SER A 6 -21.015 2.981 -19.377 1.00 0.00 H new ATOM 0 HB3 SER A 6 -20.443 1.574 -18.503 1.00 0.00 H new ATOM 0 HG SER A 6 -19.405 3.853 -17.409 1.00 0.00 H new ATOM 59 N GLY A 7 -18.323 0.503 -20.168 1.00 0.00 N ATOM 60 CA GLY A 7 -18.185 -0.558 -21.148 1.00 0.00 C ATOM 61 C GLY A 7 -17.066 -0.292 -22.136 1.00 0.00 C ATOM 62 O GLY A 7 -17.202 -0.572 -23.326 1.00 0.00 O ATOM 0 H GLY A 7 -18.055 0.246 -19.218 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -17.996 -1.501 -20.634 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -19.124 -0.673 -21.689 1.00 0.00 H new ATOM 66 N GLU A 8 -15.958 0.250 -21.641 1.00 0.00 N ATOM 67 CA GLU A 8 -14.813 0.556 -22.490 1.00 0.00 C ATOM 68 C GLU A 8 -13.556 -0.145 -21.982 1.00 0.00 C ATOM 69 O GLU A 8 -13.367 -0.304 -20.777 1.00 0.00 O ATOM 70 CB GLU A 8 -14.580 2.067 -22.546 1.00 0.00 C ATOM 71 CG GLU A 8 -13.336 2.463 -23.324 1.00 0.00 C ATOM 72 CD GLU A 8 -12.742 3.774 -22.845 1.00 0.00 C ATOM 73 OE1 GLU A 8 -13.450 4.801 -22.903 1.00 0.00 O ATOM 74 OE2 GLU A 8 -11.570 3.772 -22.414 1.00 0.00 O ATOM 0 H GLU A 8 -15.829 0.486 -20.657 1.00 0.00 H new ATOM 0 HA GLU A 8 -15.031 0.192 -23.494 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -15.449 2.543 -23.000 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -14.500 2.452 -21.529 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -12.589 1.675 -23.233 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -13.585 2.546 -24.382 1.00 0.00 H new ATOM 81 N GLU A 9 -12.701 -0.561 -22.911 1.00 0.00 N ATOM 82 CA GLU A 9 -11.463 -1.245 -22.556 1.00 0.00 C ATOM 83 C GLU A 9 -10.546 -0.329 -21.751 1.00 0.00 C ATOM 84 O GLU A 9 -10.293 0.818 -22.120 1.00 0.00 O ATOM 85 CB GLU A 9 -10.742 -1.727 -23.817 1.00 0.00 C ATOM 86 CG GLU A 9 -11.312 -3.013 -24.391 1.00 0.00 C ATOM 87 CD GLU A 9 -10.344 -3.716 -25.323 1.00 0.00 C ATOM 88 OE1 GLU A 9 -9.369 -4.316 -24.824 1.00 0.00 O ATOM 89 OE2 GLU A 9 -10.562 -3.665 -26.551 1.00 0.00 O ATOM 0 H GLU A 9 -12.843 -0.437 -23.913 1.00 0.00 H new ATOM 0 HA GLU A 9 -11.718 -2.107 -21.939 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.794 -0.946 -24.576 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -9.687 -1.878 -23.587 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -11.577 -3.685 -23.574 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -12.232 -2.789 -24.931 1.00 0.00 H new ATOM 96 N PRO A 10 -10.035 -0.846 -20.624 1.00 0.00 N ATOM 97 CA PRO A 10 -9.139 -0.093 -19.742 1.00 0.00 C ATOM 98 C PRO A 10 -7.769 0.141 -20.371 1.00 0.00 C ATOM 99 O PRO A 10 -6.893 -0.722 -20.312 1.00 0.00 O ATOM 100 CB PRO A 10 -9.015 -0.992 -18.510 1.00 0.00 C ATOM 101 CG PRO A 10 -9.291 -2.367 -19.014 1.00 0.00 C ATOM 102 CD PRO A 10 -10.294 -2.207 -20.123 1.00 0.00 C ATOM 0 HA PRO A 10 -9.525 0.902 -19.523 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -8.020 -0.924 -18.069 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -9.727 -0.704 -17.736 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -8.379 -2.840 -19.378 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -9.685 -3.002 -18.220 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -10.154 -2.956 -20.903 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -11.316 -2.313 -19.759 1.00 0.00 H new ATOM 110 N SER A 11 -7.592 1.313 -20.972 1.00 0.00 N ATOM 111 CA SER A 11 -6.329 1.659 -21.615 1.00 0.00 C ATOM 112 C SER A 11 -5.763 2.953 -21.039 1.00 0.00 C ATOM 113 O SER A 11 -6.006 4.038 -21.565 1.00 0.00 O ATOM 114 CB SER A 11 -6.524 1.802 -23.125 1.00 0.00 C ATOM 115 OG SER A 11 -7.530 2.755 -23.422 1.00 0.00 O ATOM 0 H SER A 11 -8.306 2.039 -21.027 1.00 0.00 H new ATOM 0 HA SER A 11 -5.619 0.855 -21.422 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.585 2.103 -23.589 1.00 0.00 H new ATOM 0 HB3 SER A 11 -6.795 0.837 -23.553 1.00 0.00 H new ATOM 0 HG SER A 11 -7.365 3.575 -22.911 1.00 0.00 H new ATOM 121 N GLY A 12 -5.006 2.829 -19.953 1.00 0.00 N ATOM 122 CA GLY A 12 -4.416 3.996 -19.322 1.00 0.00 C ATOM 123 C GLY A 12 -4.044 3.746 -17.874 1.00 0.00 C ATOM 124 O GLY A 12 -4.799 3.119 -17.131 1.00 0.00 O ATOM 0 H GLY A 12 -4.791 1.941 -19.499 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -3.526 4.294 -19.876 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -5.118 4.828 -19.375 1.00 0.00 H new ATOM 128 N VAL A 13 -2.876 4.237 -17.472 1.00 0.00 N ATOM 129 CA VAL A 13 -2.404 4.063 -16.103 1.00 0.00 C ATOM 130 C VAL A 13 -3.484 4.447 -15.097 1.00 0.00 C ATOM 131 O VAL A 13 -3.895 3.632 -14.273 1.00 0.00 O ATOM 132 CB VAL A 13 -1.144 4.906 -15.833 1.00 0.00 C ATOM 133 CG1 VAL A 13 -0.668 4.711 -14.401 1.00 0.00 C ATOM 134 CG2 VAL A 13 -0.044 4.550 -16.822 1.00 0.00 C ATOM 0 H VAL A 13 -2.239 4.758 -18.075 1.00 0.00 H new ATOM 0 HA VAL A 13 -2.159 3.008 -15.984 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.396 5.958 -15.967 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.223 5.314 -14.228 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -1.454 5.019 -13.711 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.432 3.660 -14.236 1.00 0.00 H new ATOM 0 HG21 VAL A 13 0.839 5.155 -16.617 1.00 0.00 H new ATOM 0 HG22 VAL A 13 0.208 3.494 -16.722 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -0.390 4.745 -17.837 1.00 0.00 H new ATOM 144 N GLU A 14 -3.939 5.694 -15.173 1.00 0.00 N ATOM 145 CA GLU A 14 -4.971 6.185 -14.268 1.00 0.00 C ATOM 146 C GLU A 14 -6.174 5.246 -14.252 1.00 0.00 C ATOM 147 O GLU A 14 -6.738 4.959 -13.197 1.00 0.00 O ATOM 148 CB GLU A 14 -5.414 7.591 -14.679 1.00 0.00 C ATOM 149 CG GLU A 14 -4.293 8.617 -14.644 1.00 0.00 C ATOM 150 CD GLU A 14 -4.750 9.995 -15.079 1.00 0.00 C ATOM 151 OE1 GLU A 14 -5.764 10.482 -14.536 1.00 0.00 O ATOM 152 OE2 GLU A 14 -4.095 10.587 -15.962 1.00 0.00 O ATOM 0 H GLU A 14 -3.610 6.381 -15.851 1.00 0.00 H new ATOM 0 HA GLU A 14 -4.549 6.223 -13.264 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -5.828 7.552 -15.686 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -6.216 7.918 -14.017 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -3.890 8.674 -13.633 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -3.482 8.286 -15.293 1.00 0.00 H new ATOM 159 N GLY A 15 -6.561 4.771 -15.432 1.00 0.00 N ATOM 160 CA GLY A 15 -7.694 3.869 -15.533 1.00 0.00 C ATOM 161 C GLY A 15 -7.741 2.867 -14.397 1.00 0.00 C ATOM 162 O GLY A 15 -8.788 2.661 -13.785 1.00 0.00 O ATOM 0 H GLY A 15 -6.111 4.994 -16.319 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -8.617 4.449 -15.540 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.646 3.335 -16.482 1.00 0.00 H new ATOM 166 N ALA A 16 -6.603 2.241 -14.115 1.00 0.00 N ATOM 167 CA ALA A 16 -6.518 1.255 -13.045 1.00 0.00 C ATOM 168 C ALA A 16 -7.311 1.703 -11.822 1.00 0.00 C ATOM 169 O ALA A 16 -8.112 0.943 -11.277 1.00 0.00 O ATOM 170 CB ALA A 16 -5.064 1.005 -12.672 1.00 0.00 C ATOM 0 H ALA A 16 -5.727 2.399 -14.613 1.00 0.00 H new ATOM 0 HA ALA A 16 -6.954 0.324 -13.407 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -5.015 0.267 -11.872 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -4.524 0.633 -13.543 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.610 1.936 -12.334 1.00 0.00 H new ATOM 176 N ALA A 17 -7.081 2.940 -11.394 1.00 0.00 N ATOM 177 CA ALA A 17 -7.775 3.489 -10.236 1.00 0.00 C ATOM 178 C ALA A 17 -9.269 3.187 -10.297 1.00 0.00 C ATOM 179 O ALA A 17 -9.894 2.891 -9.278 1.00 0.00 O ATOM 180 CB ALA A 17 -7.542 4.990 -10.143 1.00 0.00 C ATOM 0 H ALA A 17 -6.419 3.581 -11.832 1.00 0.00 H new ATOM 0 HA ALA A 17 -7.371 3.013 -9.342 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -8.066 5.386 -9.273 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -6.475 5.187 -10.044 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -7.918 5.473 -11.045 1.00 0.00 H new ATOM 186 N PHE A 18 -9.835 3.264 -11.496 1.00 0.00 N ATOM 187 CA PHE A 18 -11.256 3.000 -11.689 1.00 0.00 C ATOM 188 C PHE A 18 -11.714 1.829 -10.825 1.00 0.00 C ATOM 189 O PHE A 18 -12.559 1.988 -9.945 1.00 0.00 O ATOM 190 CB PHE A 18 -11.547 2.706 -13.163 1.00 0.00 C ATOM 191 CG PHE A 18 -12.949 2.231 -13.414 1.00 0.00 C ATOM 192 CD1 PHE A 18 -13.996 3.135 -13.502 1.00 0.00 C ATOM 193 CD2 PHE A 18 -13.221 0.881 -13.563 1.00 0.00 C ATOM 194 CE1 PHE A 18 -15.287 2.700 -13.732 1.00 0.00 C ATOM 195 CE2 PHE A 18 -14.511 0.440 -13.794 1.00 0.00 C ATOM 196 CZ PHE A 18 -15.545 1.351 -13.880 1.00 0.00 C ATOM 0 H PHE A 18 -9.332 3.507 -12.349 1.00 0.00 H new ATOM 0 HA PHE A 18 -11.809 3.889 -11.387 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -11.368 3.608 -13.747 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -10.847 1.951 -13.520 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -13.800 4.191 -13.390 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -12.416 0.164 -13.498 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -16.094 3.415 -13.796 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -14.710 -0.616 -13.907 1.00 0.00 H new ATOM 0 HZ PHE A 18 -16.553 1.010 -14.063 1.00 0.00 H new ATOM 206 N GLN A 19 -11.151 0.654 -11.085 1.00 0.00 N ATOM 207 CA GLN A 19 -11.502 -0.545 -10.333 1.00 0.00 C ATOM 208 C GLN A 19 -11.703 -0.220 -8.856 1.00 0.00 C ATOM 209 O GLN A 19 -12.566 -0.799 -8.195 1.00 0.00 O ATOM 210 CB GLN A 19 -10.415 -1.608 -10.490 1.00 0.00 C ATOM 211 CG GLN A 19 -9.217 -1.394 -9.579 1.00 0.00 C ATOM 212 CD GLN A 19 -9.379 -2.071 -8.232 1.00 0.00 C ATOM 213 OE1 GLN A 19 -9.349 -1.418 -7.188 1.00 0.00 O ATOM 214 NE2 GLN A 19 -9.553 -3.387 -8.248 1.00 0.00 N ATOM 0 H GLN A 19 -10.450 0.506 -11.811 1.00 0.00 H new ATOM 0 HA GLN A 19 -12.439 -0.933 -10.732 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -10.845 -2.588 -10.286 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -10.076 -1.618 -11.526 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -8.321 -1.776 -10.068 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -9.067 -0.325 -9.428 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -9.571 -3.888 -9.136 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -9.668 -3.897 -7.372 1.00 0.00 H new ATOM 223 N SER A 20 -10.902 0.708 -8.345 1.00 0.00 N ATOM 224 CA SER A 20 -10.989 1.106 -6.945 1.00 0.00 C ATOM 225 C SER A 20 -11.833 2.368 -6.790 1.00 0.00 C ATOM 226 O SER A 20 -11.582 3.380 -7.445 1.00 0.00 O ATOM 227 CB SER A 20 -9.590 1.342 -6.371 1.00 0.00 C ATOM 228 OG SER A 20 -9.552 1.051 -4.985 1.00 0.00 O ATOM 0 H SER A 20 -10.185 1.199 -8.879 1.00 0.00 H new ATOM 0 HA SER A 20 -11.469 0.298 -6.393 1.00 0.00 H new ATOM 0 HB2 SER A 20 -8.868 0.718 -6.897 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.296 2.378 -6.536 1.00 0.00 H new ATOM 0 HG SER A 20 -8.647 1.208 -4.642 1.00 0.00 H new ATOM 234 N ARG A 21 -12.835 2.299 -5.919 1.00 0.00 N ATOM 235 CA ARG A 21 -13.717 3.434 -5.679 1.00 0.00 C ATOM 236 C ARG A 21 -13.006 4.514 -4.869 1.00 0.00 C ATOM 237 O ARG A 21 -13.276 4.693 -3.680 1.00 0.00 O ATOM 238 CB ARG A 21 -14.980 2.979 -4.944 1.00 0.00 C ATOM 239 CG ARG A 21 -15.916 2.144 -5.803 1.00 0.00 C ATOM 240 CD ARG A 21 -16.718 3.013 -6.760 1.00 0.00 C ATOM 241 NE ARG A 21 -17.840 2.287 -7.348 1.00 0.00 N ATOM 242 CZ ARG A 21 -19.024 2.162 -6.760 1.00 0.00 C ATOM 243 NH1 ARG A 21 -19.240 2.714 -5.573 1.00 0.00 N ATOM 244 NH2 ARG A 21 -19.996 1.486 -7.358 1.00 0.00 N ATOM 0 H ARG A 21 -13.056 1.469 -5.368 1.00 0.00 H new ATOM 0 HA ARG A 21 -13.998 3.854 -6.645 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -14.691 2.400 -4.067 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -15.517 3.857 -4.584 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -15.338 1.415 -6.370 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -16.596 1.583 -5.162 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -17.091 3.888 -6.229 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -16.065 3.376 -7.554 1.00 0.00 H new ATOM 0 HE ARG A 21 -17.707 1.852 -8.261 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -18.496 3.236 -5.110 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -20.150 2.617 -5.123 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -19.835 1.061 -8.271 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -20.905 1.391 -6.905 1.00 0.00 H new ATOM 258 N LEU A 22 -12.095 5.230 -5.519 1.00 0.00 N ATOM 259 CA LEU A 22 -11.344 6.293 -4.859 1.00 0.00 C ATOM 260 C LEU A 22 -10.678 7.206 -5.883 1.00 0.00 C ATOM 261 O LEU A 22 -10.360 6.798 -7.001 1.00 0.00 O ATOM 262 CB LEU A 22 -10.287 5.695 -3.929 1.00 0.00 C ATOM 263 CG LEU A 22 -8.991 5.232 -4.596 1.00 0.00 C ATOM 264 CD1 LEU A 22 -8.027 6.398 -4.755 1.00 0.00 C ATOM 265 CD2 LEU A 22 -8.347 4.113 -3.791 1.00 0.00 C ATOM 0 H LEU A 22 -11.858 5.094 -6.502 1.00 0.00 H new ATOM 0 HA LEU A 22 -12.043 6.887 -4.271 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -10.037 6.437 -3.171 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -10.728 4.845 -3.409 1.00 0.00 H new ATOM 0 HG LEU A 22 -9.232 4.848 -5.587 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.110 6.050 -5.231 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -8.487 7.169 -5.373 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.792 6.812 -3.774 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -7.426 3.796 -4.281 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.120 4.471 -2.787 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -9.033 3.269 -3.728 1.00 0.00 H new ATOM 277 N PRO A 23 -10.461 8.472 -5.495 1.00 0.00 N ATOM 278 CA PRO A 23 -9.829 9.468 -6.365 1.00 0.00 C ATOM 279 C PRO A 23 -8.349 9.181 -6.595 1.00 0.00 C ATOM 280 O PRO A 23 -7.584 9.010 -5.645 1.00 0.00 O ATOM 281 CB PRO A 23 -10.005 10.777 -5.590 1.00 0.00 C ATOM 282 CG PRO A 23 -10.122 10.361 -4.165 1.00 0.00 C ATOM 283 CD PRO A 23 -10.815 9.026 -4.178 1.00 0.00 C ATOM 0 HA PRO A 23 -10.274 9.482 -7.360 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -9.155 11.443 -5.739 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -10.894 11.316 -5.919 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -9.140 10.286 -3.699 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -10.693 11.091 -3.591 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -10.469 8.386 -3.366 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -11.894 9.132 -4.063 1.00 0.00 H new ATOM 291 N HIS A 24 -7.951 9.130 -7.862 1.00 0.00 N ATOM 292 CA HIS A 24 -6.561 8.865 -8.217 1.00 0.00 C ATOM 293 C HIS A 24 -5.734 10.146 -8.169 1.00 0.00 C ATOM 294 O HIS A 24 -4.545 10.141 -8.487 1.00 0.00 O ATOM 295 CB HIS A 24 -6.479 8.243 -9.612 1.00 0.00 C ATOM 296 CG HIS A 24 -7.410 8.870 -10.603 1.00 0.00 C ATOM 297 ND1 HIS A 24 -8.747 8.543 -10.691 1.00 0.00 N ATOM 298 CD2 HIS A 24 -7.191 9.811 -11.551 1.00 0.00 C ATOM 299 CE1 HIS A 24 -9.310 9.254 -11.652 1.00 0.00 C ATOM 300 NE2 HIS A 24 -8.387 10.032 -12.189 1.00 0.00 N ATOM 0 H HIS A 24 -8.571 9.269 -8.660 1.00 0.00 H new ATOM 0 HA HIS A 24 -6.153 8.163 -7.489 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -5.457 8.331 -9.980 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -6.702 7.178 -9.540 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -6.251 10.297 -11.766 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -10.348 9.207 -11.948 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -8.538 10.690 -12.953 1.00 0.00 H new ATOM 309 N ASP A 25 -6.371 11.241 -7.769 1.00 0.00 N ATOM 310 CA ASP A 25 -5.694 12.529 -7.679 1.00 0.00 C ATOM 311 C ASP A 25 -5.334 12.854 -6.232 1.00 0.00 C ATOM 312 O ASP A 25 -4.357 13.554 -5.967 1.00 0.00 O ATOM 313 CB ASP A 25 -6.577 13.635 -8.258 1.00 0.00 C ATOM 314 CG ASP A 25 -5.812 14.922 -8.496 1.00 0.00 C ATOM 315 OD1 ASP A 25 -4.672 14.849 -9.000 1.00 0.00 O ATOM 316 OD2 ASP A 25 -6.352 16.002 -8.177 1.00 0.00 O ATOM 0 H ASP A 25 -7.355 11.262 -7.502 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.773 12.469 -8.259 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.011 13.295 -9.198 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.405 13.829 -7.576 1.00 0.00 H new ATOM 321 N ARG A 26 -6.131 12.341 -5.300 1.00 0.00 N ATOM 322 CA ARG A 26 -5.898 12.578 -3.881 1.00 0.00 C ATOM 323 C ARG A 26 -5.996 11.277 -3.089 1.00 0.00 C ATOM 324 O ARG A 26 -6.329 10.228 -3.639 1.00 0.00 O ATOM 325 CB ARG A 26 -6.905 13.594 -3.339 1.00 0.00 C ATOM 326 CG ARG A 26 -8.335 13.079 -3.313 1.00 0.00 C ATOM 327 CD ARG A 26 -9.325 14.197 -3.023 1.00 0.00 C ATOM 328 NE ARG A 26 -9.286 14.613 -1.623 1.00 0.00 N ATOM 329 CZ ARG A 26 -8.462 15.543 -1.155 1.00 0.00 C ATOM 330 NH1 ARG A 26 -7.613 16.152 -1.971 1.00 0.00 N ATOM 331 NH2 ARG A 26 -8.487 15.867 0.131 1.00 0.00 N ATOM 0 H ARG A 26 -6.944 11.759 -5.503 1.00 0.00 H new ATOM 0 HA ARG A 26 -4.891 12.979 -3.766 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -6.612 13.880 -2.329 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -6.863 14.496 -3.950 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -8.575 12.619 -4.272 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -8.429 12.302 -2.554 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -9.103 15.052 -3.662 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -10.332 13.864 -3.274 1.00 0.00 H new ATOM 0 HE ARG A 26 -9.927 14.164 -0.969 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -7.592 15.906 -2.961 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -6.981 16.866 -1.609 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -9.140 15.402 0.762 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -7.853 16.582 0.489 1.00 0.00 H new ATOM 345 N MET A 27 -5.702 11.355 -1.795 1.00 0.00 N ATOM 346 CA MET A 27 -5.758 10.184 -0.928 1.00 0.00 C ATOM 347 C MET A 27 -7.076 10.137 -0.161 1.00 0.00 C ATOM 348 O MET A 27 -7.707 11.168 0.073 1.00 0.00 O ATOM 349 CB MET A 27 -4.584 10.193 0.053 1.00 0.00 C ATOM 350 CG MET A 27 -3.225 10.237 -0.626 1.00 0.00 C ATOM 351 SD MET A 27 -1.865 10.378 0.550 1.00 0.00 S ATOM 352 CE MET A 27 -1.780 8.700 1.172 1.00 0.00 C ATOM 0 H MET A 27 -5.423 12.216 -1.324 1.00 0.00 H new ATOM 0 HA MET A 27 -5.692 9.295 -1.555 1.00 0.00 H new ATOM 0 HB2 MET A 27 -4.679 11.055 0.713 1.00 0.00 H new ATOM 0 HB3 MET A 27 -4.639 9.304 0.681 1.00 0.00 H new ATOM 0 HG2 MET A 27 -3.092 9.335 -1.223 1.00 0.00 H new ATOM 0 HG3 MET A 27 -3.194 11.082 -1.314 1.00 0.00 H new ATOM 0 HE1 MET A 27 -1.524 8.717 2.231 1.00 0.00 H new ATOM 0 HE2 MET A 27 -2.746 8.214 1.040 1.00 0.00 H new ATOM 0 HE3 MET A 27 -1.017 8.147 0.624 1.00 0.00 H new ATOM 362 N THR A 28 -7.487 8.934 0.227 1.00 0.00 N ATOM 363 CA THR A 28 -8.731 8.753 0.965 1.00 0.00 C ATOM 364 C THR A 28 -8.459 8.477 2.439 1.00 0.00 C ATOM 365 O THR A 28 -7.328 8.190 2.829 1.00 0.00 O ATOM 366 CB THR A 28 -9.566 7.596 0.384 1.00 0.00 C ATOM 367 OG1 THR A 28 -8.857 6.360 0.527 1.00 0.00 O ATOM 368 CG2 THR A 28 -9.880 7.840 -1.085 1.00 0.00 C ATOM 0 H THR A 28 -6.977 8.070 0.042 1.00 0.00 H new ATOM 0 HA THR A 28 -9.294 9.681 0.869 1.00 0.00 H new ATOM 0 HB THR A 28 -10.505 7.541 0.936 1.00 0.00 H new ATOM 0 HG1 THR A 28 -8.387 6.154 -0.308 1.00 0.00 H new ATOM 0 HG21 THR A 28 -10.470 7.010 -1.474 1.00 0.00 H new ATOM 0 HG22 THR A 28 -10.445 8.766 -1.187 1.00 0.00 H new ATOM 0 HG23 THR A 28 -8.950 7.918 -1.648 1.00 0.00 H new ATOM 376 N SER A 29 -9.505 8.566 3.255 1.00 0.00 N ATOM 377 CA SER A 29 -9.378 8.330 4.689 1.00 0.00 C ATOM 378 C SER A 29 -8.363 7.226 4.970 1.00 0.00 C ATOM 379 O SER A 29 -7.433 7.409 5.753 1.00 0.00 O ATOM 380 CB SER A 29 -10.735 7.955 5.287 1.00 0.00 C ATOM 381 OG SER A 29 -11.746 8.852 4.860 1.00 0.00 O ATOM 0 H SER A 29 -10.449 8.800 2.948 1.00 0.00 H new ATOM 0 HA SER A 29 -9.026 9.251 5.154 1.00 0.00 H new ATOM 0 HB2 SER A 29 -10.998 6.939 4.992 1.00 0.00 H new ATOM 0 HB3 SER A 29 -10.672 7.965 6.375 1.00 0.00 H new ATOM 0 HG SER A 29 -12.604 8.590 5.254 1.00 0.00 H new ATOM 387 N GLN A 30 -8.552 6.080 4.323 1.00 0.00 N ATOM 388 CA GLN A 30 -7.653 4.945 4.504 1.00 0.00 C ATOM 389 C GLN A 30 -6.236 5.298 4.066 1.00 0.00 C ATOM 390 O GLN A 30 -5.330 5.405 4.892 1.00 0.00 O ATOM 391 CB GLN A 30 -8.158 3.737 3.713 1.00 0.00 C ATOM 392 CG GLN A 30 -7.786 2.402 4.337 1.00 0.00 C ATOM 393 CD GLN A 30 -7.879 2.420 5.850 1.00 0.00 C ATOM 394 OE1 GLN A 30 -8.904 2.054 6.425 1.00 0.00 O ATOM 395 NE2 GLN A 30 -6.805 2.846 6.505 1.00 0.00 N ATOM 0 H GLN A 30 -9.318 5.913 3.670 1.00 0.00 H new ATOM 0 HA GLN A 30 -7.634 4.694 5.565 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -9.243 3.798 3.626 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -7.754 3.781 2.702 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -8.444 1.626 3.945 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -6.770 2.138 4.042 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -5.976 3.140 5.989 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -6.809 2.879 7.524 1.00 0.00 H new ATOM 404 N GLU A 31 -6.052 5.478 2.761 1.00 0.00 N ATOM 405 CA GLU A 31 -4.744 5.817 2.215 1.00 0.00 C ATOM 406 C GLU A 31 -4.003 6.784 3.135 1.00 0.00 C ATOM 407 O GLU A 31 -2.800 6.649 3.355 1.00 0.00 O ATOM 408 CB GLU A 31 -4.893 6.435 0.823 1.00 0.00 C ATOM 409 CG GLU A 31 -5.572 5.519 -0.181 1.00 0.00 C ATOM 410 CD GLU A 31 -6.062 6.260 -1.409 1.00 0.00 C ATOM 411 OE1 GLU A 31 -5.340 7.160 -1.887 1.00 0.00 O ATOM 412 OE2 GLU A 31 -7.168 5.939 -1.893 1.00 0.00 O ATOM 0 H GLU A 31 -6.792 5.395 2.064 1.00 0.00 H new ATOM 0 HA GLU A 31 -4.162 4.898 2.138 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -5.466 7.359 0.904 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.906 6.704 0.447 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -4.874 4.740 -0.486 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -6.415 5.022 0.299 1.00 0.00 H new ATOM 419 N ALA A 32 -4.732 7.757 3.671 1.00 0.00 N ATOM 420 CA ALA A 32 -4.146 8.745 4.568 1.00 0.00 C ATOM 421 C ALA A 32 -3.632 8.089 5.845 1.00 0.00 C ATOM 422 O ALA A 32 -2.544 8.409 6.324 1.00 0.00 O ATOM 423 CB ALA A 32 -5.164 9.826 4.901 1.00 0.00 C ATOM 0 H ALA A 32 -5.730 7.882 3.500 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.299 9.204 4.059 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -4.712 10.557 5.572 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.481 10.322 3.984 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -6.029 9.374 5.386 1.00 0.00 H new ATOM 429 N ALA A 33 -4.421 7.171 6.393 1.00 0.00 N ATOM 430 CA ALA A 33 -4.045 6.470 7.614 1.00 0.00 C ATOM 431 C ALA A 33 -2.884 5.513 7.362 1.00 0.00 C ATOM 432 O ALA A 33 -1.961 5.415 8.171 1.00 0.00 O ATOM 433 CB ALA A 33 -5.239 5.716 8.179 1.00 0.00 C ATOM 0 H ALA A 33 -5.325 6.895 6.010 1.00 0.00 H new ATOM 0 HA ALA A 33 -3.719 7.212 8.343 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -4.943 5.197 9.091 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -6.040 6.420 8.405 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -5.591 4.990 7.446 1.00 0.00 H new ATOM 439 N CYS A 34 -2.937 4.810 6.236 1.00 0.00 N ATOM 440 CA CYS A 34 -1.890 3.860 5.878 1.00 0.00 C ATOM 441 C CYS A 34 -0.587 4.583 5.554 1.00 0.00 C ATOM 442 O CYS A 34 0.491 4.160 5.974 1.00 0.00 O ATOM 443 CB CYS A 34 -2.328 3.013 4.682 1.00 0.00 C ATOM 444 SG CYS A 34 -1.623 1.348 4.659 1.00 0.00 S ATOM 0 H CYS A 34 -3.694 4.880 5.556 1.00 0.00 H new ATOM 0 HA CYS A 34 -1.719 3.207 6.734 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -3.415 2.936 4.684 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -2.047 3.528 3.763 1.00 0.00 H new ATOM 0 HG CYS A 34 -2.053 0.709 3.612 1.00 0.00 H new ATOM 450 N PHE A 35 -0.692 5.674 4.804 1.00 0.00 N ATOM 451 CA PHE A 35 0.478 6.455 4.421 1.00 0.00 C ATOM 452 C PHE A 35 0.387 7.877 4.968 1.00 0.00 C ATOM 453 O PHE A 35 -0.059 8.802 4.290 1.00 0.00 O ATOM 454 CB PHE A 35 0.619 6.490 2.898 1.00 0.00 C ATOM 455 CG PHE A 35 0.632 5.128 2.265 1.00 0.00 C ATOM 456 CD1 PHE A 35 -0.547 4.424 2.082 1.00 0.00 C ATOM 457 CD2 PHE A 35 1.823 4.553 1.854 1.00 0.00 C ATOM 458 CE1 PHE A 35 -0.537 3.170 1.501 1.00 0.00 C ATOM 459 CE2 PHE A 35 1.839 3.299 1.272 1.00 0.00 C ATOM 460 CZ PHE A 35 0.657 2.607 1.094 1.00 0.00 C ATOM 0 H PHE A 35 -1.576 6.038 4.449 1.00 0.00 H new ATOM 0 HA PHE A 35 1.359 5.976 4.849 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.204 7.069 2.478 1.00 0.00 H new ATOM 0 HB3 PHE A 35 1.540 7.011 2.638 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.484 4.860 2.397 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.750 5.090 1.990 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -1.463 2.630 1.365 1.00 0.00 H new ATOM 0 HE2 PHE A 35 2.775 2.861 0.957 1.00 0.00 H new ATOM 0 HZ PHE A 35 0.666 1.628 0.638 1.00 0.00 H new ATOM 470 N PRO A 36 0.817 8.055 6.226 1.00 0.00 N ATOM 471 CA PRO A 36 0.794 9.360 6.893 1.00 0.00 C ATOM 472 C PRO A 36 1.811 10.331 6.302 1.00 0.00 C ATOM 473 O PRO A 36 1.541 11.525 6.173 1.00 0.00 O ATOM 474 CB PRO A 36 1.154 9.025 8.342 1.00 0.00 C ATOM 475 CG PRO A 36 1.936 7.759 8.255 1.00 0.00 C ATOM 476 CD PRO A 36 1.361 6.997 7.093 1.00 0.00 C ATOM 0 HA PRO A 36 -0.170 9.857 6.783 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.741 9.822 8.799 1.00 0.00 H new ATOM 0 HB3 PRO A 36 0.260 8.897 8.953 1.00 0.00 H new ATOM 0 HG2 PRO A 36 2.995 7.964 8.101 1.00 0.00 H new ATOM 0 HG3 PRO A 36 1.853 7.185 9.178 1.00 0.00 H new ATOM 0 HD2 PRO A 36 2.123 6.410 6.581 1.00 0.00 H new ATOM 0 HD3 PRO A 36 0.585 6.301 7.413 1.00 0.00 H new ATOM 484 N ASP A 37 2.981 9.811 5.946 1.00 0.00 N ATOM 485 CA ASP A 37 4.038 10.632 5.367 1.00 0.00 C ATOM 486 C ASP A 37 3.618 11.179 4.007 1.00 0.00 C ATOM 487 O ASP A 37 4.024 12.274 3.615 1.00 0.00 O ATOM 488 CB ASP A 37 5.326 9.819 5.228 1.00 0.00 C ATOM 489 CG ASP A 37 5.096 8.481 4.554 1.00 0.00 C ATOM 490 OD1 ASP A 37 4.260 7.701 5.056 1.00 0.00 O ATOM 491 OD2 ASP A 37 5.753 8.213 3.526 1.00 0.00 O ATOM 0 H ASP A 37 3.221 8.825 6.048 1.00 0.00 H new ATOM 0 HA ASP A 37 4.219 11.473 6.036 1.00 0.00 H new ATOM 0 HB2 ASP A 37 6.054 10.392 4.653 1.00 0.00 H new ATOM 0 HB3 ASP A 37 5.758 9.656 6.216 1.00 0.00 H new ATOM 496 N ILE A 38 2.805 10.410 3.291 1.00 0.00 N ATOM 497 CA ILE A 38 2.330 10.818 1.974 1.00 0.00 C ATOM 498 C ILE A 38 1.250 11.889 2.086 1.00 0.00 C ATOM 499 O ILE A 38 1.346 12.949 1.467 1.00 0.00 O ATOM 500 CB ILE A 38 1.771 9.622 1.182 1.00 0.00 C ATOM 501 CG1 ILE A 38 2.812 8.504 1.101 1.00 0.00 C ATOM 502 CG2 ILE A 38 1.349 10.061 -0.213 1.00 0.00 C ATOM 503 CD1 ILE A 38 4.020 8.861 0.263 1.00 0.00 C ATOM 0 H ILE A 38 2.461 9.501 3.600 1.00 0.00 H new ATOM 0 HA ILE A 38 3.189 11.226 1.442 1.00 0.00 H new ATOM 0 HB ILE A 38 0.893 9.239 1.703 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.141 8.252 2.109 1.00 0.00 H new ATOM 0 HG13 ILE A 38 2.343 7.612 0.686 1.00 0.00 H new ATOM 0 HG21 ILE A 38 0.956 9.204 -0.761 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.578 10.827 -0.136 1.00 0.00 H new ATOM 0 HG23 ILE A 38 2.211 10.466 -0.743 1.00 0.00 H new ATOM 0 HD11 ILE A 38 4.715 8.022 0.251 1.00 0.00 H new ATOM 0 HD12 ILE A 38 3.703 9.085 -0.756 1.00 0.00 H new ATOM 0 HD13 ILE A 38 4.513 9.734 0.689 1.00 0.00 H new ATOM 515 N ILE A 39 0.225 11.606 2.882 1.00 0.00 N ATOM 516 CA ILE A 39 -0.872 12.546 3.078 1.00 0.00 C ATOM 517 C ILE A 39 -0.394 13.807 3.790 1.00 0.00 C ATOM 518 O ILE A 39 -0.941 14.891 3.587 1.00 0.00 O ATOM 519 CB ILE A 39 -2.017 11.913 3.891 1.00 0.00 C ATOM 520 CG1 ILE A 39 -3.192 12.888 4.001 1.00 0.00 C ATOM 521 CG2 ILE A 39 -1.526 11.508 5.272 1.00 0.00 C ATOM 522 CD1 ILE A 39 -3.971 13.044 2.714 1.00 0.00 C ATOM 0 H ILE A 39 0.131 10.733 3.402 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.243 12.809 2.088 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.359 11.017 3.373 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.867 12.544 4.785 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.816 13.864 4.309 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -2.347 11.062 5.834 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.718 10.783 5.173 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -1.160 12.388 5.801 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.788 13.749 2.866 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.310 13.418 1.932 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.377 12.078 2.415 1.00 0.00 H new ATOM 534 N SER A 40 0.630 13.657 4.624 1.00 0.00 N ATOM 535 CA SER A 40 1.180 14.783 5.369 1.00 0.00 C ATOM 536 C SER A 40 2.400 15.361 4.656 1.00 0.00 C ATOM 537 O SER A 40 3.327 15.860 5.294 1.00 0.00 O ATOM 538 CB SER A 40 1.561 14.349 6.785 1.00 0.00 C ATOM 539 OG SER A 40 1.790 15.471 7.619 1.00 0.00 O ATOM 0 H SER A 40 1.095 12.767 4.801 1.00 0.00 H new ATOM 0 HA SER A 40 0.414 15.556 5.428 1.00 0.00 H new ATOM 0 HB2 SER A 40 0.765 13.735 7.207 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.457 13.729 6.750 1.00 0.00 H new ATOM 0 HG SER A 40 2.487 16.035 7.224 1.00 0.00 H new ATOM 545 N GLY A 41 2.392 15.289 3.329 1.00 0.00 N ATOM 546 CA GLY A 41 3.502 15.807 2.551 1.00 0.00 C ATOM 547 C GLY A 41 3.049 16.740 1.445 1.00 0.00 C ATOM 548 O GLY A 41 1.869 17.073 1.329 1.00 0.00 O ATOM 0 H GLY A 41 1.636 14.881 2.778 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.188 16.337 3.211 1.00 0.00 H new ATOM 0 HA3 GLY A 41 4.057 14.975 2.116 1.00 0.00 H new ATOM 552 N PRO A 42 4.001 17.178 0.608 1.00 0.00 N ATOM 553 CA PRO A 42 3.718 18.084 -0.509 1.00 0.00 C ATOM 554 C PRO A 42 2.918 17.407 -1.617 1.00 0.00 C ATOM 555 O PRO A 42 2.960 16.187 -1.767 1.00 0.00 O ATOM 556 CB PRO A 42 5.110 18.470 -1.014 1.00 0.00 C ATOM 557 CG PRO A 42 5.988 17.336 -0.610 1.00 0.00 C ATOM 558 CD PRO A 42 5.428 16.821 0.687 1.00 0.00 C ATOM 0 HA PRO A 42 3.111 18.935 -0.200 1.00 0.00 H new ATOM 0 HB2 PRO A 42 5.115 18.608 -2.095 1.00 0.00 H new ATOM 0 HB3 PRO A 42 5.446 19.408 -0.571 1.00 0.00 H new ATOM 0 HG2 PRO A 42 5.992 16.555 -1.371 1.00 0.00 H new ATOM 0 HG3 PRO A 42 7.019 17.666 -0.486 1.00 0.00 H new ATOM 0 HD2 PRO A 42 5.568 15.745 0.786 1.00 0.00 H new ATOM 0 HD3 PRO A 42 5.912 17.286 1.546 1.00 0.00 H new ATOM 566 N GLN A 43 2.190 18.208 -2.389 1.00 0.00 N ATOM 567 CA GLN A 43 1.381 17.685 -3.483 1.00 0.00 C ATOM 568 C GLN A 43 2.181 16.701 -4.330 1.00 0.00 C ATOM 569 O GLN A 43 1.665 15.664 -4.745 1.00 0.00 O ATOM 570 CB GLN A 43 0.867 18.829 -4.358 1.00 0.00 C ATOM 571 CG GLN A 43 -0.355 18.462 -5.184 1.00 0.00 C ATOM 572 CD GLN A 43 -1.458 17.840 -4.351 1.00 0.00 C ATOM 573 OE1 GLN A 43 -2.216 18.542 -3.681 1.00 0.00 O ATOM 574 NE2 GLN A 43 -1.554 16.516 -4.388 1.00 0.00 N ATOM 0 H GLN A 43 2.144 19.221 -2.277 1.00 0.00 H new ATOM 0 HA GLN A 43 0.531 17.157 -3.052 1.00 0.00 H new ATOM 0 HB2 GLN A 43 0.623 19.680 -3.722 1.00 0.00 H new ATOM 0 HB3 GLN A 43 1.665 19.150 -5.028 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -0.737 19.356 -5.677 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -0.062 17.766 -5.970 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -0.904 15.973 -4.957 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -2.277 16.042 -3.847 1.00 0.00 H new ATOM 583 N GLN A 44 3.443 17.034 -4.582 1.00 0.00 N ATOM 584 CA GLN A 44 4.313 16.180 -5.381 1.00 0.00 C ATOM 585 C GLN A 44 4.385 14.775 -4.793 1.00 0.00 C ATOM 586 O GLN A 44 4.191 13.784 -5.498 1.00 0.00 O ATOM 587 CB GLN A 44 5.716 16.783 -5.466 1.00 0.00 C ATOM 588 CG GLN A 44 6.704 15.920 -6.235 1.00 0.00 C ATOM 589 CD GLN A 44 6.379 15.839 -7.714 1.00 0.00 C ATOM 590 OE1 GLN A 44 6.978 16.537 -8.532 1.00 0.00 O ATOM 591 NE2 GLN A 44 5.426 14.983 -8.065 1.00 0.00 N ATOM 0 H GLN A 44 3.885 17.889 -4.244 1.00 0.00 H new ATOM 0 HA GLN A 44 3.893 16.113 -6.385 1.00 0.00 H new ATOM 0 HB2 GLN A 44 5.654 17.761 -5.942 1.00 0.00 H new ATOM 0 HB3 GLN A 44 6.095 16.943 -4.457 1.00 0.00 H new ATOM 0 HG2 GLN A 44 7.709 16.324 -6.109 1.00 0.00 H new ATOM 0 HG3 GLN A 44 6.709 14.915 -5.812 1.00 0.00 H new ATOM 0 HE21 GLN A 44 4.955 14.424 -7.353 1.00 0.00 H new ATOM 0 HE22 GLN A 44 5.165 14.885 -9.046 1.00 0.00 H new ATOM 600 N THR A 45 4.667 14.695 -3.496 1.00 0.00 N ATOM 601 CA THR A 45 4.766 13.411 -2.813 1.00 0.00 C ATOM 602 C THR A 45 3.497 12.588 -3.002 1.00 0.00 C ATOM 603 O THR A 45 3.555 11.427 -3.406 1.00 0.00 O ATOM 604 CB THR A 45 5.026 13.595 -1.306 1.00 0.00 C ATOM 605 OG1 THR A 45 6.282 14.251 -1.101 1.00 0.00 O ATOM 606 CG2 THR A 45 5.025 12.254 -0.589 1.00 0.00 C ATOM 0 H THR A 45 4.831 15.505 -2.898 1.00 0.00 H new ATOM 0 HA THR A 45 5.608 12.881 -3.257 1.00 0.00 H new ATOM 0 HB THR A 45 4.225 14.209 -0.895 1.00 0.00 H new ATOM 0 HG1 THR A 45 6.591 14.087 -0.186 1.00 0.00 H new ATOM 0 HG21 THR A 45 5.211 12.410 0.474 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.057 11.771 -0.721 1.00 0.00 H new ATOM 0 HG23 THR A 45 5.807 11.619 -1.005 1.00 0.00 H new ATOM 614 N GLN A 46 2.353 13.197 -2.708 1.00 0.00 N ATOM 615 CA GLN A 46 1.070 12.519 -2.846 1.00 0.00 C ATOM 616 C GLN A 46 0.940 11.875 -4.223 1.00 0.00 C ATOM 617 O GLN A 46 0.572 10.706 -4.341 1.00 0.00 O ATOM 618 CB GLN A 46 -0.078 13.504 -2.620 1.00 0.00 C ATOM 619 CG GLN A 46 -0.244 13.922 -1.168 1.00 0.00 C ATOM 620 CD GLN A 46 -1.392 14.893 -0.968 1.00 0.00 C ATOM 621 OE1 GLN A 46 -2.005 15.353 -1.931 1.00 0.00 O ATOM 622 NE2 GLN A 46 -1.688 15.208 0.287 1.00 0.00 N ATOM 0 H GLN A 46 2.289 14.158 -2.373 1.00 0.00 H new ATOM 0 HA GLN A 46 1.019 11.734 -2.092 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.092 14.393 -3.228 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -1.007 13.052 -2.968 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -0.412 13.036 -0.556 1.00 0.00 H new ATOM 0 HG3 GLN A 46 0.681 14.381 -0.818 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -1.153 14.802 1.055 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -2.451 15.856 0.484 1.00 0.00 H new ATOM 631 N LYS A 47 1.244 12.645 -5.262 1.00 0.00 N ATOM 632 CA LYS A 47 1.162 12.151 -6.631 1.00 0.00 C ATOM 633 C LYS A 47 2.047 10.923 -6.820 1.00 0.00 C ATOM 634 O LYS A 47 1.626 9.927 -7.410 1.00 0.00 O ATOM 635 CB LYS A 47 1.576 13.247 -7.616 1.00 0.00 C ATOM 636 CG LYS A 47 0.561 14.370 -7.738 1.00 0.00 C ATOM 637 CD LYS A 47 0.767 15.172 -9.012 1.00 0.00 C ATOM 638 CE LYS A 47 1.942 16.130 -8.884 1.00 0.00 C ATOM 639 NZ LYS A 47 1.519 17.458 -8.359 1.00 0.00 N ATOM 0 H LYS A 47 1.550 13.615 -5.182 1.00 0.00 H new ATOM 0 HA LYS A 47 0.128 11.866 -6.827 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.532 13.665 -7.301 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.732 12.801 -8.598 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -0.446 13.954 -7.728 1.00 0.00 H new ATOM 0 HG3 LYS A 47 0.642 15.030 -6.874 1.00 0.00 H new ATOM 0 HD2 LYS A 47 0.939 14.493 -9.847 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -0.139 15.734 -9.240 1.00 0.00 H new ATOM 0 HE2 LYS A 47 2.692 15.699 -8.220 1.00 0.00 H new ATOM 0 HE3 LYS A 47 2.414 16.258 -9.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.135 18.199 -8.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 0.534 17.644 -8.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 1.592 17.460 -7.322 1.00 0.00 H new ATOM 653 N VAL A 48 3.274 10.999 -6.314 1.00 0.00 N ATOM 654 CA VAL A 48 4.217 9.892 -6.425 1.00 0.00 C ATOM 655 C VAL A 48 3.598 8.591 -5.927 1.00 0.00 C ATOM 656 O VAL A 48 3.768 7.536 -6.538 1.00 0.00 O ATOM 657 CB VAL A 48 5.506 10.172 -5.630 1.00 0.00 C ATOM 658 CG1 VAL A 48 6.460 8.991 -5.727 1.00 0.00 C ATOM 659 CG2 VAL A 48 6.171 11.447 -6.126 1.00 0.00 C ATOM 0 H VAL A 48 3.638 11.816 -5.823 1.00 0.00 H new ATOM 0 HA VAL A 48 4.465 9.792 -7.482 1.00 0.00 H new ATOM 0 HB VAL A 48 5.243 10.311 -4.581 1.00 0.00 H new ATOM 0 HG11 VAL A 48 7.365 9.207 -5.159 1.00 0.00 H new ATOM 0 HG12 VAL A 48 5.980 8.101 -5.320 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.719 8.818 -6.771 1.00 0.00 H new ATOM 0 HG21 VAL A 48 7.080 11.630 -5.553 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.422 11.340 -7.181 1.00 0.00 H new ATOM 0 HG23 VAL A 48 5.488 12.287 -5.999 1.00 0.00 H new ATOM 669 N PHE A 49 2.877 8.673 -4.813 1.00 0.00 N ATOM 670 CA PHE A 49 2.232 7.502 -4.232 1.00 0.00 C ATOM 671 C PHE A 49 0.989 7.115 -5.027 1.00 0.00 C ATOM 672 O PHE A 49 0.723 5.932 -5.248 1.00 0.00 O ATOM 673 CB PHE A 49 1.855 7.772 -2.774 1.00 0.00 C ATOM 674 CG PHE A 49 0.670 6.977 -2.304 1.00 0.00 C ATOM 675 CD1 PHE A 49 -0.619 7.441 -2.512 1.00 0.00 C ATOM 676 CD2 PHE A 49 0.846 5.766 -1.654 1.00 0.00 C ATOM 677 CE1 PHE A 49 -1.711 6.712 -2.081 1.00 0.00 C ATOM 678 CE2 PHE A 49 -0.243 5.033 -1.221 1.00 0.00 C ATOM 679 CZ PHE A 49 -1.523 5.506 -1.434 1.00 0.00 C ATOM 0 H PHE A 49 2.725 9.538 -4.295 1.00 0.00 H new ATOM 0 HA PHE A 49 2.939 6.673 -4.270 1.00 0.00 H new ATOM 0 HB2 PHE A 49 2.710 7.545 -2.138 1.00 0.00 H new ATOM 0 HB3 PHE A 49 1.641 8.834 -2.653 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -0.772 8.383 -3.017 1.00 0.00 H new ATOM 0 HD2 PHE A 49 1.844 5.391 -1.484 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.710 7.085 -2.250 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -0.093 4.090 -0.716 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.375 4.935 -1.096 1.00 0.00 H new ATOM 689 N LEU A 50 0.231 8.118 -5.455 1.00 0.00 N ATOM 690 CA LEU A 50 -0.985 7.884 -6.226 1.00 0.00 C ATOM 691 C LEU A 50 -0.653 7.367 -7.622 1.00 0.00 C ATOM 692 O LEU A 50 -1.539 6.944 -8.365 1.00 0.00 O ATOM 693 CB LEU A 50 -1.804 9.172 -6.328 1.00 0.00 C ATOM 694 CG LEU A 50 -2.571 9.581 -5.070 1.00 0.00 C ATOM 695 CD1 LEU A 50 -3.095 11.003 -5.203 1.00 0.00 C ATOM 696 CD2 LEU A 50 -3.714 8.612 -4.803 1.00 0.00 C ATOM 0 H LEU A 50 0.437 9.102 -5.281 1.00 0.00 H new ATOM 0 HA LEU A 50 -1.574 7.127 -5.708 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.132 9.986 -6.600 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -2.518 9.061 -7.145 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.886 9.546 -4.223 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.638 11.277 -4.298 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -2.258 11.687 -5.345 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -3.764 11.065 -6.061 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -4.249 8.919 -3.904 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -4.399 8.615 -5.651 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.314 7.608 -4.662 1.00 0.00 H new ATOM 708 N PHE A 51 0.628 7.402 -7.972 1.00 0.00 N ATOM 709 CA PHE A 51 1.077 6.936 -9.278 1.00 0.00 C ATOM 710 C PHE A 51 1.535 5.482 -9.209 1.00 0.00 C ATOM 711 O PHE A 51 1.130 4.654 -10.025 1.00 0.00 O ATOM 712 CB PHE A 51 2.217 7.817 -9.794 1.00 0.00 C ATOM 713 CG PHE A 51 2.867 7.288 -11.040 1.00 0.00 C ATOM 714 CD1 PHE A 51 3.643 6.142 -10.999 1.00 0.00 C ATOM 715 CD2 PHE A 51 2.702 7.938 -12.253 1.00 0.00 C ATOM 716 CE1 PHE A 51 4.243 5.652 -12.145 1.00 0.00 C ATOM 717 CE2 PHE A 51 3.298 7.453 -13.401 1.00 0.00 C ATOM 718 CZ PHE A 51 4.070 6.309 -13.347 1.00 0.00 C ATOM 0 H PHE A 51 1.374 7.749 -7.369 1.00 0.00 H new ATOM 0 HA PHE A 51 0.236 7.002 -9.968 1.00 0.00 H new ATOM 0 HB2 PHE A 51 1.831 8.817 -9.992 1.00 0.00 H new ATOM 0 HB3 PHE A 51 2.972 7.915 -9.014 1.00 0.00 H new ATOM 0 HD1 PHE A 51 3.781 5.625 -10.061 1.00 0.00 H new ATOM 0 HD2 PHE A 51 2.101 8.834 -12.301 1.00 0.00 H new ATOM 0 HE1 PHE A 51 4.846 4.757 -12.100 1.00 0.00 H new ATOM 0 HE2 PHE A 51 3.160 7.968 -14.340 1.00 0.00 H new ATOM 0 HZ PHE A 51 4.537 5.929 -14.243 1.00 0.00 H new ATOM 728 N ILE A 52 2.381 5.180 -8.230 1.00 0.00 N ATOM 729 CA ILE A 52 2.893 3.827 -8.053 1.00 0.00 C ATOM 730 C ILE A 52 1.756 2.815 -7.969 1.00 0.00 C ATOM 731 O ILE A 52 1.895 1.671 -8.402 1.00 0.00 O ATOM 732 CB ILE A 52 3.761 3.714 -6.786 1.00 0.00 C ATOM 733 CG1 ILE A 52 4.974 4.640 -6.888 1.00 0.00 C ATOM 734 CG2 ILE A 52 4.202 2.274 -6.573 1.00 0.00 C ATOM 735 CD1 ILE A 52 5.453 5.159 -5.550 1.00 0.00 C ATOM 0 H ILE A 52 2.726 5.854 -7.547 1.00 0.00 H new ATOM 0 HA ILE A 52 3.508 3.607 -8.925 1.00 0.00 H new ATOM 0 HB ILE A 52 3.165 4.021 -5.926 1.00 0.00 H new ATOM 0 HG12 ILE A 52 5.790 4.105 -7.374 1.00 0.00 H new ATOM 0 HG13 ILE A 52 4.722 5.486 -7.528 1.00 0.00 H new ATOM 0 HG21 ILE A 52 4.815 2.210 -5.674 1.00 0.00 H new ATOM 0 HG22 ILE A 52 3.324 1.638 -6.460 1.00 0.00 H new ATOM 0 HG23 ILE A 52 4.784 1.941 -7.433 1.00 0.00 H new ATOM 0 HD11 ILE A 52 6.315 5.809 -5.699 1.00 0.00 H new ATOM 0 HD12 ILE A 52 4.653 5.723 -5.071 1.00 0.00 H new ATOM 0 HD13 ILE A 52 5.737 4.320 -4.915 1.00 0.00 H new ATOM 747 N ARG A 53 0.629 3.245 -7.411 1.00 0.00 N ATOM 748 CA ARG A 53 -0.534 2.377 -7.270 1.00 0.00 C ATOM 749 C ARG A 53 -1.069 1.960 -8.637 1.00 0.00 C ATOM 750 O ARG A 53 -0.939 0.805 -9.039 1.00 0.00 O ATOM 751 CB ARG A 53 -1.632 3.085 -6.474 1.00 0.00 C ATOM 752 CG ARG A 53 -2.961 2.347 -6.481 1.00 0.00 C ATOM 753 CD ARG A 53 -4.135 3.312 -6.415 1.00 0.00 C ATOM 754 NE ARG A 53 -3.943 4.337 -5.393 1.00 0.00 N ATOM 755 CZ ARG A 53 -4.254 4.165 -4.113 1.00 0.00 C ATOM 756 NH1 ARG A 53 -4.767 3.014 -3.701 1.00 0.00 N ATOM 757 NH2 ARG A 53 -4.050 5.145 -3.242 1.00 0.00 N ATOM 0 H ARG A 53 0.497 4.189 -7.049 1.00 0.00 H new ATOM 0 HA ARG A 53 -0.225 1.481 -6.731 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -1.300 3.208 -5.443 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -1.779 4.085 -6.883 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -3.037 1.741 -7.384 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -3.003 1.663 -5.633 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -4.268 3.789 -7.386 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -5.049 2.757 -6.205 1.00 0.00 H new ATOM 0 HE ARG A 53 -3.549 5.234 -5.677 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -4.924 2.258 -4.367 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -5.005 2.885 -2.718 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -3.654 6.031 -3.555 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -4.289 5.012 -2.259 1.00 0.00 H new ATOM 771 N ASN A 54 -1.673 2.909 -9.345 1.00 0.00 N ATOM 772 CA ASN A 54 -2.229 2.640 -10.666 1.00 0.00 C ATOM 773 C ASN A 54 -1.258 1.818 -11.508 1.00 0.00 C ATOM 774 O ASN A 54 -1.632 0.799 -12.088 1.00 0.00 O ATOM 775 CB ASN A 54 -2.557 3.952 -11.381 1.00 0.00 C ATOM 776 CG ASN A 54 -3.813 4.608 -10.839 1.00 0.00 C ATOM 777 OD1 ASN A 54 -4.927 4.243 -11.214 1.00 0.00 O ATOM 778 ND2 ASN A 54 -3.637 5.581 -9.953 1.00 0.00 N ATOM 0 H ASN A 54 -1.790 3.871 -9.026 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.146 2.065 -10.536 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -1.717 4.639 -11.276 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -2.681 3.760 -12.447 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -4.445 6.059 -9.554 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -2.694 5.850 -9.672 1.00 0.00 H new ATOM 785 N ARG A 55 -0.009 2.269 -11.570 1.00 0.00 N ATOM 786 CA ARG A 55 1.016 1.576 -12.341 1.00 0.00 C ATOM 787 C ARG A 55 1.117 0.113 -11.920 1.00 0.00 C ATOM 788 O ARG A 55 1.169 -0.786 -12.761 1.00 0.00 O ATOM 789 CB ARG A 55 2.370 2.264 -12.164 1.00 0.00 C ATOM 790 CG ARG A 55 3.454 1.723 -13.082 1.00 0.00 C ATOM 791 CD ARG A 55 3.096 1.927 -14.546 1.00 0.00 C ATOM 792 NE ARG A 55 2.373 0.784 -15.097 1.00 0.00 N ATOM 793 CZ ARG A 55 2.349 0.484 -16.391 1.00 0.00 C ATOM 794 NH1 ARG A 55 3.006 1.238 -17.262 1.00 0.00 N ATOM 795 NH2 ARG A 55 1.669 -0.573 -16.816 1.00 0.00 N ATOM 0 H ARG A 55 0.317 3.111 -11.096 1.00 0.00 H new ATOM 0 HA ARG A 55 0.732 1.614 -13.393 1.00 0.00 H new ATOM 0 HB2 ARG A 55 2.252 3.332 -12.346 1.00 0.00 H new ATOM 0 HB3 ARG A 55 2.693 2.151 -11.129 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.399 2.221 -12.864 1.00 0.00 H new ATOM 0 HG3 ARG A 55 3.601 0.661 -12.887 1.00 0.00 H new ATOM 0 HD2 ARG A 55 2.487 2.825 -14.648 1.00 0.00 H new ATOM 0 HD3 ARG A 55 4.006 2.092 -15.122 1.00 0.00 H new ATOM 0 HE ARG A 55 1.858 0.183 -14.453 1.00 0.00 H new ATOM 0 HH11 ARG A 55 3.531 2.050 -16.939 1.00 0.00 H new ATOM 0 HH12 ARG A 55 2.986 1.005 -18.255 1.00 0.00 H new ATOM 0 HH21 ARG A 55 1.164 -1.156 -16.149 1.00 0.00 H new ATOM 0 HH22 ARG A 55 1.651 -0.802 -17.810 1.00 0.00 H new ATOM 809 N THR A 56 1.145 -0.120 -10.611 1.00 0.00 N ATOM 810 CA THR A 56 1.242 -1.473 -10.078 1.00 0.00 C ATOM 811 C THR A 56 0.082 -2.337 -10.556 1.00 0.00 C ATOM 812 O THR A 56 0.276 -3.479 -10.975 1.00 0.00 O ATOM 813 CB THR A 56 1.264 -1.469 -8.537 1.00 0.00 C ATOM 814 OG1 THR A 56 2.457 -0.835 -8.065 1.00 0.00 O ATOM 815 CG2 THR A 56 1.187 -2.887 -7.992 1.00 0.00 C ATOM 0 H THR A 56 1.102 0.611 -9.901 1.00 0.00 H new ATOM 0 HA THR A 56 2.178 -1.892 -10.447 1.00 0.00 H new ATOM 0 HB THR A 56 0.395 -0.913 -8.185 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.439 0.115 -8.304 1.00 0.00 H new ATOM 0 HG21 THR A 56 1.204 -2.859 -6.902 1.00 0.00 H new ATOM 0 HG22 THR A 56 0.263 -3.357 -8.329 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.039 -3.463 -8.354 1.00 0.00 H new ATOM 823 N LEU A 57 -1.126 -1.786 -10.493 1.00 0.00 N ATOM 824 CA LEU A 57 -2.319 -2.508 -10.921 1.00 0.00 C ATOM 825 C LEU A 57 -2.280 -2.783 -12.421 1.00 0.00 C ATOM 826 O LEU A 57 -2.573 -3.893 -12.865 1.00 0.00 O ATOM 827 CB LEU A 57 -3.575 -1.708 -10.570 1.00 0.00 C ATOM 828 CG LEU A 57 -4.185 -1.985 -9.196 1.00 0.00 C ATOM 829 CD1 LEU A 57 -5.109 -0.850 -8.783 1.00 0.00 C ATOM 830 CD2 LEU A 57 -4.934 -3.310 -9.202 1.00 0.00 C ATOM 0 H LEU A 57 -1.305 -0.842 -10.150 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.345 -3.463 -10.396 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.334 -0.647 -10.631 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.332 -1.907 -11.328 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.377 -2.051 -8.468 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.534 -1.065 -7.802 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.544 0.081 -8.737 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.913 -0.751 -9.513 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -5.362 -3.491 -8.216 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.733 -3.273 -9.943 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.245 -4.117 -9.452 1.00 0.00 H new ATOM 842 N GLN A 58 -1.914 -1.766 -13.195 1.00 0.00 N ATOM 843 CA GLN A 58 -1.836 -1.900 -14.644 1.00 0.00 C ATOM 844 C GLN A 58 -1.166 -3.214 -15.034 1.00 0.00 C ATOM 845 O GLN A 58 -1.778 -4.067 -15.678 1.00 0.00 O ATOM 846 CB GLN A 58 -1.065 -0.724 -15.245 1.00 0.00 C ATOM 847 CG GLN A 58 -1.891 0.546 -15.368 1.00 0.00 C ATOM 848 CD GLN A 58 -2.607 0.650 -16.700 1.00 0.00 C ATOM 849 OE1 GLN A 58 -1.974 0.712 -17.755 1.00 0.00 O ATOM 850 NE2 GLN A 58 -3.934 0.670 -16.660 1.00 0.00 N ATOM 0 H GLN A 58 -1.667 -0.841 -12.843 1.00 0.00 H new ATOM 0 HA GLN A 58 -2.852 -1.900 -15.039 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.190 -0.520 -14.627 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.699 -1.007 -16.232 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -2.624 0.577 -14.562 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.241 1.411 -15.241 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -4.418 0.616 -15.764 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -4.469 0.739 -17.525 1.00 0.00 H new ATOM 859 N LEU A 59 0.092 -3.371 -14.640 1.00 0.00 N ATOM 860 CA LEU A 59 0.846 -4.581 -14.949 1.00 0.00 C ATOM 861 C LEU A 59 0.044 -5.828 -14.589 1.00 0.00 C ATOM 862 O LEU A 59 0.108 -6.841 -15.285 1.00 0.00 O ATOM 863 CB LEU A 59 2.178 -4.583 -14.196 1.00 0.00 C ATOM 864 CG LEU A 59 3.034 -3.325 -14.345 1.00 0.00 C ATOM 865 CD1 LEU A 59 4.139 -3.304 -13.301 1.00 0.00 C ATOM 866 CD2 LEU A 59 3.621 -3.242 -15.747 1.00 0.00 C ATOM 0 H LEU A 59 0.612 -2.675 -14.105 1.00 0.00 H new ATOM 0 HA LEU A 59 1.042 -4.593 -16.021 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.973 -4.736 -13.136 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.763 -5.438 -14.534 1.00 0.00 H new ATOM 0 HG LEU A 59 2.397 -2.455 -14.187 1.00 0.00 H new ATOM 0 HD11 LEU A 59 4.738 -2.401 -13.423 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.698 -3.315 -12.304 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.775 -4.181 -13.426 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.227 -2.340 -15.835 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.243 -4.117 -15.933 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.813 -3.209 -16.478 1.00 0.00 H new ATOM 878 N TRP A 60 -0.711 -5.745 -13.499 1.00 0.00 N ATOM 879 CA TRP A 60 -1.527 -6.867 -13.048 1.00 0.00 C ATOM 880 C TRP A 60 -2.708 -7.091 -13.986 1.00 0.00 C ATOM 881 O TRP A 60 -3.050 -8.230 -14.308 1.00 0.00 O ATOM 882 CB TRP A 60 -2.029 -6.619 -11.625 1.00 0.00 C ATOM 883 CG TRP A 60 -3.329 -7.303 -11.326 1.00 0.00 C ATOM 884 CD1 TRP A 60 -4.577 -6.752 -11.379 1.00 0.00 C ATOM 885 CD2 TRP A 60 -3.507 -8.666 -10.925 1.00 0.00 C ATOM 886 NE1 TRP A 60 -5.520 -7.689 -11.036 1.00 0.00 N ATOM 887 CE2 TRP A 60 -4.890 -8.872 -10.754 1.00 0.00 C ATOM 888 CE3 TRP A 60 -2.633 -9.733 -10.697 1.00 0.00 C ATOM 889 CZ2 TRP A 60 -5.416 -10.101 -10.363 1.00 0.00 C ATOM 890 CZ3 TRP A 60 -3.157 -10.951 -10.309 1.00 0.00 C ATOM 891 CH2 TRP A 60 -4.538 -11.128 -10.146 1.00 0.00 C ATOM 0 H TRP A 60 -0.775 -4.913 -12.912 1.00 0.00 H new ATOM 0 HA TRP A 60 -0.906 -7.763 -13.055 1.00 0.00 H new ATOM 0 HB2 TRP A 60 -1.275 -6.962 -10.916 1.00 0.00 H new ATOM 0 HB3 TRP A 60 -2.147 -5.546 -11.471 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -4.791 -5.729 -11.651 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -6.527 -7.530 -10.997 1.00 0.00 H new ATOM 0 HE3 TRP A 60 -1.568 -9.607 -10.822 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 -6.480 -10.239 -10.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 -2.491 -11.782 -10.128 1.00 0.00 H new ATOM 0 HH2 TRP A 60 -4.916 -12.093 -9.843 1.00 0.00 H new ATOM 902 N LEU A 61 -3.329 -6.000 -14.420 1.00 0.00 N ATOM 903 CA LEU A 61 -4.474 -6.079 -15.321 1.00 0.00 C ATOM 904 C LEU A 61 -4.043 -6.542 -16.709 1.00 0.00 C ATOM 905 O LEU A 61 -4.854 -7.044 -17.487 1.00 0.00 O ATOM 906 CB LEU A 61 -5.167 -4.718 -15.417 1.00 0.00 C ATOM 907 CG LEU A 61 -6.217 -4.423 -14.346 1.00 0.00 C ATOM 908 CD1 LEU A 61 -6.653 -2.968 -14.413 1.00 0.00 C ATOM 909 CD2 LEU A 61 -7.415 -5.348 -14.504 1.00 0.00 C ATOM 0 H LEU A 61 -3.059 -5.050 -14.163 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.175 -6.809 -14.916 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.404 -3.940 -15.374 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -5.643 -4.643 -16.395 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.771 -4.603 -13.368 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -7.401 -2.776 -13.643 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.790 -2.322 -14.250 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -7.081 -2.761 -15.394 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -8.152 -5.124 -13.733 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -7.862 -5.200 -15.487 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -7.090 -6.384 -14.405 1.00 0.00 H new ATOM 921 N ASP A 62 -2.761 -6.370 -17.013 1.00 0.00 N ATOM 922 CA ASP A 62 -2.221 -6.773 -18.306 1.00 0.00 C ATOM 923 C ASP A 62 -1.671 -8.195 -18.246 1.00 0.00 C ATOM 924 O ASP A 62 -1.674 -8.915 -19.244 1.00 0.00 O ATOM 925 CB ASP A 62 -1.120 -5.807 -18.747 1.00 0.00 C ATOM 926 CG ASP A 62 -1.676 -4.559 -19.406 1.00 0.00 C ATOM 927 OD1 ASP A 62 -2.535 -4.694 -20.302 1.00 0.00 O ATOM 928 OD2 ASP A 62 -1.252 -3.449 -19.024 1.00 0.00 O ATOM 0 H ASP A 62 -2.077 -5.954 -16.381 1.00 0.00 H new ATOM 0 HA ASP A 62 -3.032 -6.746 -19.034 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -0.522 -5.522 -17.881 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -0.452 -6.315 -19.442 1.00 0.00 H new ATOM 933 N ASN A 63 -1.200 -8.593 -17.069 1.00 0.00 N ATOM 934 CA ASN A 63 -0.646 -9.929 -16.879 1.00 0.00 C ATOM 935 C ASN A 63 -1.201 -10.573 -15.612 1.00 0.00 C ATOM 936 O ASN A 63 -0.459 -11.036 -14.745 1.00 0.00 O ATOM 937 CB ASN A 63 0.881 -9.864 -16.805 1.00 0.00 C ATOM 938 CG ASN A 63 1.538 -11.136 -17.305 1.00 0.00 C ATOM 939 OD1 ASN A 63 0.963 -11.871 -18.107 1.00 0.00 O ATOM 940 ND2 ASN A 63 2.751 -11.401 -16.832 1.00 0.00 N ATOM 0 H ASN A 63 -1.191 -8.010 -16.232 1.00 0.00 H new ATOM 0 HA ASN A 63 -0.936 -10.541 -17.733 1.00 0.00 H new ATOM 0 HB2 ASN A 63 1.235 -9.019 -17.395 1.00 0.00 H new ATOM 0 HB3 ASN A 63 1.185 -9.682 -15.774 1.00 0.00 H new ATOM 0 HD21 ASN A 63 3.243 -12.242 -17.133 1.00 0.00 H new ATOM 0 HD22 ASN A 63 3.190 -10.763 -16.168 1.00 0.00 H new ATOM 947 N PRO A 64 -2.537 -10.605 -15.501 1.00 0.00 N ATOM 948 CA PRO A 64 -3.222 -11.191 -14.345 1.00 0.00 C ATOM 949 C PRO A 64 -3.084 -12.709 -14.298 1.00 0.00 C ATOM 950 O PRO A 64 -3.659 -13.369 -13.432 1.00 0.00 O ATOM 951 CB PRO A 64 -4.684 -10.794 -14.560 1.00 0.00 C ATOM 952 CG PRO A 64 -4.812 -10.599 -16.032 1.00 0.00 C ATOM 953 CD PRO A 64 -3.483 -10.072 -16.496 1.00 0.00 C ATOM 0 HA PRO A 64 -2.804 -10.838 -13.402 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -5.361 -11.570 -14.203 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -4.930 -9.882 -14.017 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -5.055 -11.537 -16.530 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -5.613 -9.897 -16.265 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -3.244 -10.416 -17.502 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -3.469 -8.982 -16.520 1.00 0.00 H new ATOM 961 N LYS A 65 -2.318 -13.258 -15.234 1.00 0.00 N ATOM 962 CA LYS A 65 -2.102 -14.699 -15.299 1.00 0.00 C ATOM 963 C LYS A 65 -0.985 -15.125 -14.352 1.00 0.00 C ATOM 964 O LYS A 65 -0.783 -16.316 -14.112 1.00 0.00 O ATOM 965 CB LYS A 65 -1.760 -15.120 -16.730 1.00 0.00 C ATOM 966 CG LYS A 65 -0.677 -14.270 -17.372 1.00 0.00 C ATOM 967 CD LYS A 65 0.178 -15.085 -18.328 1.00 0.00 C ATOM 968 CE LYS A 65 -0.592 -15.453 -19.588 1.00 0.00 C ATOM 969 NZ LYS A 65 0.287 -16.091 -20.607 1.00 0.00 N ATOM 0 H LYS A 65 -1.836 -12.727 -15.959 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.023 -15.194 -14.992 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.438 -16.161 -16.726 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.661 -15.067 -17.341 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.136 -13.440 -17.910 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.045 -13.837 -16.596 1.00 0.00 H new ATOM 0 HD2 LYS A 65 1.068 -14.516 -18.597 1.00 0.00 H new ATOM 0 HD3 LYS A 65 0.518 -15.993 -17.830 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.404 -16.133 -19.332 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -1.047 -14.557 -20.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -0.274 -16.327 -21.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 1.048 -15.433 -20.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.702 -16.960 -20.213 1.00 0.00 H new ATOM 983 N ILE A 66 -0.264 -14.146 -13.816 1.00 0.00 N ATOM 984 CA ILE A 66 0.830 -14.420 -12.893 1.00 0.00 C ATOM 985 C ILE A 66 0.827 -13.436 -11.728 1.00 0.00 C ATOM 986 O ILE A 66 0.377 -12.299 -11.866 1.00 0.00 O ATOM 987 CB ILE A 66 2.195 -14.354 -13.603 1.00 0.00 C ATOM 988 CG1 ILE A 66 2.580 -12.900 -13.880 1.00 0.00 C ATOM 989 CG2 ILE A 66 2.159 -15.154 -14.896 1.00 0.00 C ATOM 990 CD1 ILE A 66 4.020 -12.728 -14.311 1.00 0.00 C ATOM 0 H ILE A 66 -0.418 -13.156 -14.005 1.00 0.00 H new ATOM 0 HA ILE A 66 0.676 -15.430 -12.512 1.00 0.00 H new ATOM 0 HB ILE A 66 2.950 -14.792 -12.949 1.00 0.00 H new ATOM 0 HG12 ILE A 66 1.927 -12.501 -14.656 1.00 0.00 H new ATOM 0 HG13 ILE A 66 2.405 -12.309 -12.981 1.00 0.00 H new ATOM 0 HG21 ILE A 66 3.131 -15.097 -15.386 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.925 -16.195 -14.673 1.00 0.00 H new ATOM 0 HG23 ILE A 66 1.395 -14.744 -15.557 1.00 0.00 H new ATOM 0 HD11 ILE A 66 4.223 -11.672 -14.490 1.00 0.00 H new ATOM 0 HD12 ILE A 66 4.681 -13.096 -13.526 1.00 0.00 H new ATOM 0 HD13 ILE A 66 4.195 -13.292 -15.227 1.00 0.00 H new ATOM 1002 N GLN A 67 1.334 -13.881 -10.583 1.00 0.00 N ATOM 1003 CA GLN A 67 1.390 -13.039 -9.395 1.00 0.00 C ATOM 1004 C GLN A 67 2.353 -11.873 -9.599 1.00 0.00 C ATOM 1005 O GLN A 67 3.426 -12.035 -10.180 1.00 0.00 O ATOM 1006 CB GLN A 67 1.819 -13.863 -8.179 1.00 0.00 C ATOM 1007 CG GLN A 67 3.319 -14.102 -8.105 1.00 0.00 C ATOM 1008 CD GLN A 67 3.865 -14.772 -9.350 1.00 0.00 C ATOM 1009 OE1 GLN A 67 3.487 -15.896 -9.681 1.00 0.00 O ATOM 1010 NE2 GLN A 67 4.761 -14.083 -10.049 1.00 0.00 N ATOM 0 H GLN A 67 1.712 -14.820 -10.453 1.00 0.00 H new ATOM 0 HA GLN A 67 0.392 -12.637 -9.219 1.00 0.00 H new ATOM 0 HB2 GLN A 67 1.496 -13.352 -7.272 1.00 0.00 H new ATOM 0 HB3 GLN A 67 1.307 -14.825 -8.203 1.00 0.00 H new ATOM 0 HG2 GLN A 67 3.828 -13.150 -7.957 1.00 0.00 H new ATOM 0 HG3 GLN A 67 3.542 -14.721 -7.236 1.00 0.00 H new ATOM 0 HE21 GLN A 67 5.046 -13.154 -9.738 1.00 0.00 H new ATOM 0 HE22 GLN A 67 5.164 -14.483 -10.896 1.00 0.00 H new ATOM 1019 N LEU A 68 1.961 -10.698 -9.118 1.00 0.00 N ATOM 1020 CA LEU A 68 2.789 -9.504 -9.248 1.00 0.00 C ATOM 1021 C LEU A 68 3.589 -9.254 -7.973 1.00 0.00 C ATOM 1022 O LEU A 68 3.082 -8.673 -7.013 1.00 0.00 O ATOM 1023 CB LEU A 68 1.918 -8.287 -9.564 1.00 0.00 C ATOM 1024 CG LEU A 68 2.661 -7.025 -10.002 1.00 0.00 C ATOM 1025 CD1 LEU A 68 3.365 -7.255 -11.331 1.00 0.00 C ATOM 1026 CD2 LEU A 68 1.702 -5.848 -10.102 1.00 0.00 C ATOM 0 H LEU A 68 1.076 -10.547 -8.635 1.00 0.00 H new ATOM 0 HA LEU A 68 3.489 -9.665 -10.068 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.216 -8.562 -10.351 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.328 -8.048 -8.679 1.00 0.00 H new ATOM 0 HG LEU A 68 3.414 -6.791 -9.250 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.889 -6.346 -11.627 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.082 -8.069 -11.227 1.00 0.00 H new ATOM 0 HD13 LEU A 68 2.629 -7.514 -12.092 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.249 -4.959 -10.415 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.925 -6.073 -10.833 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.244 -5.668 -9.129 1.00 0.00 H new ATOM 1038 N THR A 69 4.843 -9.696 -7.971 1.00 0.00 N ATOM 1039 CA THR A 69 5.713 -9.519 -6.815 1.00 0.00 C ATOM 1040 C THR A 69 6.156 -8.067 -6.677 1.00 0.00 C ATOM 1041 O THR A 69 5.968 -7.261 -7.588 1.00 0.00 O ATOM 1042 CB THR A 69 6.960 -10.418 -6.909 1.00 0.00 C ATOM 1043 OG1 THR A 69 7.824 -9.950 -7.950 1.00 0.00 O ATOM 1044 CG2 THR A 69 6.568 -11.863 -7.179 1.00 0.00 C ATOM 0 H THR A 69 5.278 -10.179 -8.757 1.00 0.00 H new ATOM 0 HA THR A 69 5.134 -9.804 -5.937 1.00 0.00 H new ATOM 0 HB THR A 69 7.485 -10.374 -5.955 1.00 0.00 H new ATOM 0 HG1 THR A 69 8.615 -10.526 -8.002 1.00 0.00 H new ATOM 0 HG21 THR A 69 7.466 -12.478 -7.241 1.00 0.00 H new ATOM 0 HG22 THR A 69 5.935 -12.226 -6.369 1.00 0.00 H new ATOM 0 HG23 THR A 69 6.022 -11.922 -8.121 1.00 0.00 H new ATOM 1052 N PHE A 70 6.745 -7.740 -5.532 1.00 0.00 N ATOM 1053 CA PHE A 70 7.215 -6.384 -5.274 1.00 0.00 C ATOM 1054 C PHE A 70 8.363 -6.018 -6.212 1.00 0.00 C ATOM 1055 O PHE A 70 8.413 -4.911 -6.745 1.00 0.00 O ATOM 1056 CB PHE A 70 7.667 -6.246 -3.819 1.00 0.00 C ATOM 1057 CG PHE A 70 8.625 -5.111 -3.594 1.00 0.00 C ATOM 1058 CD1 PHE A 70 9.992 -5.307 -3.708 1.00 0.00 C ATOM 1059 CD2 PHE A 70 8.158 -3.848 -3.267 1.00 0.00 C ATOM 1060 CE1 PHE A 70 10.876 -4.265 -3.502 1.00 0.00 C ATOM 1061 CE2 PHE A 70 9.038 -2.801 -3.061 1.00 0.00 C ATOM 1062 CZ PHE A 70 10.398 -3.011 -3.177 1.00 0.00 C ATOM 0 H PHE A 70 6.908 -8.395 -4.768 1.00 0.00 H new ATOM 0 HA PHE A 70 6.387 -5.699 -5.457 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.791 -6.102 -3.187 1.00 0.00 H new ATOM 0 HB3 PHE A 70 8.138 -7.177 -3.503 1.00 0.00 H new ATOM 0 HD1 PHE A 70 10.371 -6.286 -3.961 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.095 -3.679 -3.172 1.00 0.00 H new ATOM 0 HE1 PHE A 70 11.939 -4.431 -3.595 1.00 0.00 H new ATOM 0 HE2 PHE A 70 8.662 -1.820 -2.810 1.00 0.00 H new ATOM 0 HZ PHE A 70 11.087 -2.195 -3.014 1.00 0.00 H new ATOM 1072 N GLU A 71 9.282 -6.959 -6.406 1.00 0.00 N ATOM 1073 CA GLU A 71 10.430 -6.735 -7.278 1.00 0.00 C ATOM 1074 C GLU A 71 9.979 -6.312 -8.673 1.00 0.00 C ATOM 1075 O GLU A 71 10.284 -5.209 -9.127 1.00 0.00 O ATOM 1076 CB GLU A 71 11.284 -8.001 -7.368 1.00 0.00 C ATOM 1077 CG GLU A 71 12.099 -8.277 -6.116 1.00 0.00 C ATOM 1078 CD GLU A 71 11.354 -9.136 -5.113 1.00 0.00 C ATOM 1079 OE1 GLU A 71 10.106 -9.143 -5.149 1.00 0.00 O ATOM 1080 OE2 GLU A 71 12.019 -9.801 -4.291 1.00 0.00 O ATOM 0 H GLU A 71 9.254 -7.882 -5.972 1.00 0.00 H new ATOM 0 HA GLU A 71 11.029 -5.931 -6.849 1.00 0.00 H new ATOM 0 HB2 GLU A 71 10.634 -8.854 -7.563 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.960 -7.913 -8.219 1.00 0.00 H new ATOM 0 HG2 GLU A 71 13.029 -8.773 -6.394 1.00 0.00 H new ATOM 0 HG3 GLU A 71 12.371 -7.331 -5.648 1.00 0.00 H new ATOM 1087 N ALA A 72 9.252 -7.196 -9.347 1.00 0.00 N ATOM 1088 CA ALA A 72 8.757 -6.915 -10.689 1.00 0.00 C ATOM 1089 C ALA A 72 8.178 -5.507 -10.777 1.00 0.00 C ATOM 1090 O ALA A 72 8.635 -4.684 -11.571 1.00 0.00 O ATOM 1091 CB ALA A 72 7.712 -7.944 -11.093 1.00 0.00 C ATOM 0 H ALA A 72 8.992 -8.114 -8.986 1.00 0.00 H new ATOM 0 HA ALA A 72 9.598 -6.978 -11.380 1.00 0.00 H new ATOM 0 HB1 ALA A 72 7.351 -7.721 -12.097 1.00 0.00 H new ATOM 0 HB2 ALA A 72 8.157 -8.939 -11.079 1.00 0.00 H new ATOM 0 HB3 ALA A 72 6.878 -7.910 -10.392 1.00 0.00 H new ATOM 1097 N THR A 73 7.168 -5.236 -9.956 1.00 0.00 N ATOM 1098 CA THR A 73 6.525 -3.928 -9.942 1.00 0.00 C ATOM 1099 C THR A 73 7.556 -2.809 -9.849 1.00 0.00 C ATOM 1100 O THR A 73 7.441 -1.787 -10.527 1.00 0.00 O ATOM 1101 CB THR A 73 5.538 -3.800 -8.766 1.00 0.00 C ATOM 1102 OG1 THR A 73 4.570 -4.854 -8.822 1.00 0.00 O ATOM 1103 CG2 THR A 73 4.831 -2.453 -8.798 1.00 0.00 C ATOM 0 H THR A 73 6.778 -5.905 -9.292 1.00 0.00 H new ATOM 0 HA THR A 73 5.976 -3.836 -10.879 1.00 0.00 H new ATOM 0 HB THR A 73 6.102 -3.875 -7.836 1.00 0.00 H new ATOM 0 HG1 THR A 73 4.930 -5.652 -8.382 1.00 0.00 H new ATOM 0 HG21 THR A 73 4.139 -2.385 -7.958 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.568 -1.653 -8.726 1.00 0.00 H new ATOM 0 HG23 THR A 73 4.278 -2.354 -9.732 1.00 0.00 H new ATOM 1111 N LEU A 74 8.563 -3.008 -9.006 1.00 0.00 N ATOM 1112 CA LEU A 74 9.616 -2.015 -8.825 1.00 0.00 C ATOM 1113 C LEU A 74 10.439 -1.855 -10.100 1.00 0.00 C ATOM 1114 O LEU A 74 10.622 -0.744 -10.596 1.00 0.00 O ATOM 1115 CB LEU A 74 10.528 -2.415 -7.663 1.00 0.00 C ATOM 1116 CG LEU A 74 11.960 -1.883 -7.720 1.00 0.00 C ATOM 1117 CD1 LEU A 74 11.996 -0.407 -7.355 1.00 0.00 C ATOM 1118 CD2 LEU A 74 12.864 -2.685 -6.795 1.00 0.00 C ATOM 0 H LEU A 74 8.673 -3.848 -8.437 1.00 0.00 H new ATOM 0 HA LEU A 74 9.144 -1.059 -8.596 1.00 0.00 H new ATOM 0 HB2 LEU A 74 10.071 -2.073 -6.734 1.00 0.00 H new ATOM 0 HB3 LEU A 74 10.568 -3.503 -7.616 1.00 0.00 H new ATOM 0 HG LEU A 74 12.328 -1.993 -8.740 1.00 0.00 H new ATOM 0 HD11 LEU A 74 13.023 -0.046 -7.401 1.00 0.00 H new ATOM 0 HD12 LEU A 74 11.381 0.157 -8.057 1.00 0.00 H new ATOM 0 HD13 LEU A 74 11.609 -0.272 -6.345 1.00 0.00 H new ATOM 0 HD21 LEU A 74 13.879 -2.292 -6.848 1.00 0.00 H new ATOM 0 HD22 LEU A 74 12.498 -2.607 -5.771 1.00 0.00 H new ATOM 0 HD23 LEU A 74 12.863 -3.731 -7.102 1.00 0.00 H new ATOM 1130 N GLN A 75 10.930 -2.973 -10.625 1.00 0.00 N ATOM 1131 CA GLN A 75 11.732 -2.956 -11.843 1.00 0.00 C ATOM 1132 C GLN A 75 11.003 -2.223 -12.964 1.00 0.00 C ATOM 1133 O GLN A 75 11.551 -1.307 -13.577 1.00 0.00 O ATOM 1134 CB GLN A 75 12.062 -4.384 -12.281 1.00 0.00 C ATOM 1135 CG GLN A 75 13.023 -5.100 -11.347 1.00 0.00 C ATOM 1136 CD GLN A 75 13.748 -6.247 -12.023 1.00 0.00 C ATOM 1137 OE1 GLN A 75 13.315 -7.398 -11.952 1.00 0.00 O ATOM 1138 NE2 GLN A 75 14.857 -5.940 -12.685 1.00 0.00 N ATOM 0 H GLN A 75 10.787 -3.901 -10.227 1.00 0.00 H new ATOM 0 HA GLN A 75 12.660 -2.425 -11.630 1.00 0.00 H new ATOM 0 HB2 GLN A 75 11.138 -4.958 -12.347 1.00 0.00 H new ATOM 0 HB3 GLN A 75 12.493 -4.358 -13.282 1.00 0.00 H new ATOM 0 HG2 GLN A 75 13.754 -4.386 -10.967 1.00 0.00 H new ATOM 0 HG3 GLN A 75 12.472 -5.480 -10.487 1.00 0.00 H new ATOM 0 HE21 GLN A 75 15.180 -4.973 -12.718 1.00 0.00 H new ATOM 0 HE22 GLN A 75 15.386 -6.671 -13.160 1.00 0.00 H new ATOM 1147 N GLN A 76 9.766 -2.632 -13.227 1.00 0.00 N ATOM 1148 CA GLN A 76 8.963 -2.014 -14.275 1.00 0.00 C ATOM 1149 C GLN A 76 8.720 -0.539 -13.976 1.00 0.00 C ATOM 1150 O GLN A 76 8.684 0.292 -14.885 1.00 0.00 O ATOM 1151 CB GLN A 76 7.627 -2.745 -14.421 1.00 0.00 C ATOM 1152 CG GLN A 76 7.772 -4.208 -14.806 1.00 0.00 C ATOM 1153 CD GLN A 76 6.541 -5.025 -14.469 1.00 0.00 C ATOM 1154 OE1 GLN A 76 5.811 -5.465 -15.358 1.00 0.00 O ATOM 1155 NE2 GLN A 76 6.303 -5.234 -13.179 1.00 0.00 N ATOM 0 H GLN A 76 9.298 -3.389 -12.728 1.00 0.00 H new ATOM 0 HA GLN A 76 9.514 -2.089 -15.212 1.00 0.00 H new ATOM 0 HB2 GLN A 76 7.081 -2.678 -13.480 1.00 0.00 H new ATOM 0 HB3 GLN A 76 7.025 -2.238 -15.175 1.00 0.00 H new ATOM 0 HG2 GLN A 76 7.970 -4.280 -15.875 1.00 0.00 H new ATOM 0 HG3 GLN A 76 8.636 -4.631 -14.293 1.00 0.00 H new ATOM 0 HE21 GLN A 76 6.934 -4.851 -12.475 1.00 0.00 H new ATOM 0 HE22 GLN A 76 5.489 -5.778 -12.892 1.00 0.00 H new ATOM 1164 N LEU A 77 8.552 -0.219 -12.698 1.00 0.00 N ATOM 1165 CA LEU A 77 8.312 1.157 -12.278 1.00 0.00 C ATOM 1166 C LEU A 77 9.460 2.065 -12.705 1.00 0.00 C ATOM 1167 O LEU A 77 10.559 1.595 -12.999 1.00 0.00 O ATOM 1168 CB LEU A 77 8.130 1.224 -10.761 1.00 0.00 C ATOM 1169 CG LEU A 77 6.690 1.141 -10.253 1.00 0.00 C ATOM 1170 CD1 LEU A 77 6.655 0.590 -8.836 1.00 0.00 C ATOM 1171 CD2 LEU A 77 6.024 2.508 -10.312 1.00 0.00 C ATOM 0 H LEU A 77 8.578 -0.894 -11.934 1.00 0.00 H new ATOM 0 HA LEU A 77 7.399 1.504 -12.762 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.700 0.412 -10.311 1.00 0.00 H new ATOM 0 HB3 LEU A 77 8.567 2.156 -10.404 1.00 0.00 H new ATOM 0 HG LEU A 77 6.136 0.461 -10.899 1.00 0.00 H new ATOM 0 HD11 LEU A 77 5.622 0.538 -8.491 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.093 -0.408 -8.823 1.00 0.00 H new ATOM 0 HD13 LEU A 77 7.225 1.245 -8.177 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.000 2.430 -9.947 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.579 3.210 -9.690 1.00 0.00 H new ATOM 0 HD23 LEU A 77 6.016 2.864 -11.342 1.00 0.00 H new ATOM 1183 N GLU A 78 9.199 3.368 -12.734 1.00 0.00 N ATOM 1184 CA GLU A 78 10.212 4.342 -13.124 1.00 0.00 C ATOM 1185 C GLU A 78 10.286 5.483 -12.114 1.00 0.00 C ATOM 1186 O GLU A 78 9.294 6.163 -11.855 1.00 0.00 O ATOM 1187 CB GLU A 78 9.908 4.898 -14.517 1.00 0.00 C ATOM 1188 CG GLU A 78 8.547 5.563 -14.623 1.00 0.00 C ATOM 1189 CD GLU A 78 8.299 6.169 -15.990 1.00 0.00 C ATOM 1190 OE1 GLU A 78 9.285 6.478 -16.691 1.00 0.00 O ATOM 1191 OE2 GLU A 78 7.117 6.335 -16.360 1.00 0.00 O ATOM 0 H GLU A 78 8.295 3.774 -12.492 1.00 0.00 H new ATOM 0 HA GLU A 78 11.177 3.836 -13.146 1.00 0.00 H new ATOM 0 HB2 GLU A 78 10.678 5.621 -14.786 1.00 0.00 H new ATOM 0 HB3 GLU A 78 9.964 4.087 -15.243 1.00 0.00 H new ATOM 0 HG2 GLU A 78 7.770 4.829 -14.409 1.00 0.00 H new ATOM 0 HG3 GLU A 78 8.467 6.342 -13.865 1.00 0.00 H new ATOM 1198 N ALA A 79 11.470 5.687 -11.546 1.00 0.00 N ATOM 1199 CA ALA A 79 11.676 6.746 -10.565 1.00 0.00 C ATOM 1200 C ALA A 79 11.060 8.058 -11.038 1.00 0.00 C ATOM 1201 O ALA A 79 10.797 8.257 -12.224 1.00 0.00 O ATOM 1202 CB ALA A 79 13.161 6.927 -10.288 1.00 0.00 C ATOM 0 H ALA A 79 12.302 5.132 -11.748 1.00 0.00 H new ATOM 0 HA ALA A 79 11.179 6.454 -9.640 1.00 0.00 H new ATOM 0 HB1 ALA A 79 13.300 7.721 -9.554 1.00 0.00 H new ATOM 0 HB2 ALA A 79 13.575 5.997 -9.899 1.00 0.00 H new ATOM 0 HB3 ALA A 79 13.674 7.194 -11.212 1.00 0.00 H new ATOM 1208 N PRO A 80 10.822 8.977 -10.090 1.00 0.00 N ATOM 1209 CA PRO A 80 11.131 8.751 -8.675 1.00 0.00 C ATOM 1210 C PRO A 80 10.211 7.715 -8.039 1.00 0.00 C ATOM 1211 O PRO A 80 10.432 7.286 -6.906 1.00 0.00 O ATOM 1212 CB PRO A 80 10.907 10.126 -8.040 1.00 0.00 C ATOM 1213 CG PRO A 80 9.935 10.806 -8.940 1.00 0.00 C ATOM 1214 CD PRO A 80 10.235 10.306 -10.326 1.00 0.00 C ATOM 0 HA PRO A 80 12.139 8.360 -8.535 1.00 0.00 H new ATOM 0 HB2 PRO A 80 10.512 10.035 -7.028 1.00 0.00 H new ATOM 0 HB3 PRO A 80 11.840 10.686 -7.969 1.00 0.00 H new ATOM 0 HG2 PRO A 80 8.909 10.573 -8.654 1.00 0.00 H new ATOM 0 HG3 PRO A 80 10.043 11.889 -8.884 1.00 0.00 H new ATOM 0 HD2 PRO A 80 9.333 10.244 -10.935 1.00 0.00 H new ATOM 0 HD3 PRO A 80 10.928 10.964 -10.849 1.00 0.00 H new ATOM 1222 N TYR A 81 9.179 7.316 -8.774 1.00 0.00 N ATOM 1223 CA TYR A 81 8.224 6.331 -8.281 1.00 0.00 C ATOM 1224 C TYR A 81 8.942 5.168 -7.603 1.00 0.00 C ATOM 1225 O TYR A 81 8.741 4.907 -6.418 1.00 0.00 O ATOM 1226 CB TYR A 81 7.358 5.810 -9.429 1.00 0.00 C ATOM 1227 CG TYR A 81 6.802 6.904 -10.313 1.00 0.00 C ATOM 1228 CD1 TYR A 81 6.357 8.103 -9.770 1.00 0.00 C ATOM 1229 CD2 TYR A 81 6.721 6.738 -11.690 1.00 0.00 C ATOM 1230 CE1 TYR A 81 5.848 9.105 -10.573 1.00 0.00 C ATOM 1231 CE2 TYR A 81 6.215 7.735 -12.501 1.00 0.00 C ATOM 1232 CZ TYR A 81 5.779 8.917 -11.938 1.00 0.00 C ATOM 1233 OH TYR A 81 5.273 9.912 -12.742 1.00 0.00 O ATOM 0 H TYR A 81 8.982 7.660 -9.714 1.00 0.00 H new ATOM 0 HA TYR A 81 7.585 6.819 -7.545 1.00 0.00 H new ATOM 0 HB2 TYR A 81 7.950 5.127 -10.039 1.00 0.00 H new ATOM 0 HB3 TYR A 81 6.531 5.233 -9.016 1.00 0.00 H new ATOM 0 HD1 TYR A 81 6.410 8.254 -8.702 1.00 0.00 H new ATOM 0 HD2 TYR A 81 7.060 5.813 -12.134 1.00 0.00 H new ATOM 0 HE1 TYR A 81 5.506 10.031 -10.135 1.00 0.00 H new ATOM 0 HE2 TYR A 81 6.161 7.590 -13.570 1.00 0.00 H new ATOM 0 HH TYR A 81 4.423 9.618 -13.130 1.00 0.00 H new ATOM 1243 N ASN A 82 9.781 4.474 -8.365 1.00 0.00 N ATOM 1244 CA ASN A 82 10.530 3.339 -7.839 1.00 0.00 C ATOM 1245 C ASN A 82 11.646 3.807 -6.910 1.00 0.00 C ATOM 1246 O ASN A 82 11.968 3.141 -5.926 1.00 0.00 O ATOM 1247 CB ASN A 82 11.118 2.514 -8.986 1.00 0.00 C ATOM 1248 CG ASN A 82 12.503 2.985 -9.385 1.00 0.00 C ATOM 1249 OD1 ASN A 82 13.428 2.990 -8.573 1.00 0.00 O ATOM 1250 ND2 ASN A 82 12.652 3.383 -10.643 1.00 0.00 N ATOM 0 H ASN A 82 9.959 4.678 -9.348 1.00 0.00 H new ATOM 0 HA ASN A 82 9.843 2.716 -7.267 1.00 0.00 H new ATOM 0 HB2 ASN A 82 11.165 1.466 -8.690 1.00 0.00 H new ATOM 0 HB3 ASN A 82 10.455 2.572 -9.849 1.00 0.00 H new ATOM 0 HD21 ASN A 82 13.561 3.710 -10.970 1.00 0.00 H new ATOM 0 HD22 ASN A 82 11.857 3.362 -11.282 1.00 0.00 H new ATOM 1257 N SER A 83 12.232 4.956 -7.230 1.00 0.00 N ATOM 1258 CA SER A 83 13.314 5.512 -6.426 1.00 0.00 C ATOM 1259 C SER A 83 13.103 5.208 -4.946 1.00 0.00 C ATOM 1260 O SER A 83 13.998 4.695 -4.273 1.00 0.00 O ATOM 1261 CB SER A 83 13.411 7.024 -6.638 1.00 0.00 C ATOM 1262 OG SER A 83 14.538 7.562 -5.970 1.00 0.00 O ATOM 0 H SER A 83 11.976 5.520 -8.040 1.00 0.00 H new ATOM 0 HA SER A 83 14.246 5.047 -6.746 1.00 0.00 H new ATOM 0 HB2 SER A 83 13.479 7.241 -7.704 1.00 0.00 H new ATOM 0 HB3 SER A 83 12.504 7.505 -6.272 1.00 0.00 H new ATOM 0 HG SER A 83 14.578 8.529 -6.123 1.00 0.00 H new ATOM 1268 N ASP A 84 11.915 5.527 -4.446 1.00 0.00 N ATOM 1269 CA ASP A 84 11.584 5.287 -3.046 1.00 0.00 C ATOM 1270 C ASP A 84 10.998 3.892 -2.858 1.00 0.00 C ATOM 1271 O ASP A 84 9.784 3.727 -2.734 1.00 0.00 O ATOM 1272 CB ASP A 84 10.595 6.341 -2.546 1.00 0.00 C ATOM 1273 CG ASP A 84 11.242 7.699 -2.356 1.00 0.00 C ATOM 1274 OD1 ASP A 84 11.773 8.247 -3.345 1.00 0.00 O ATOM 1275 OD2 ASP A 84 11.217 8.213 -1.218 1.00 0.00 O ATOM 0 H ASP A 84 11.164 5.953 -4.989 1.00 0.00 H new ATOM 0 HA ASP A 84 12.503 5.357 -2.464 1.00 0.00 H new ATOM 0 HB2 ASP A 84 9.773 6.430 -3.257 1.00 0.00 H new ATOM 0 HB3 ASP A 84 10.165 6.011 -1.600 1.00 0.00 H new ATOM 1280 N THR A 85 11.870 2.887 -2.838 1.00 0.00 N ATOM 1281 CA THR A 85 11.439 1.505 -2.666 1.00 0.00 C ATOM 1282 C THR A 85 10.464 1.374 -1.502 1.00 0.00 C ATOM 1283 O THR A 85 9.435 0.707 -1.614 1.00 0.00 O ATOM 1284 CB THR A 85 12.638 0.569 -2.425 1.00 0.00 C ATOM 1285 OG1 THR A 85 13.448 1.075 -1.358 1.00 0.00 O ATOM 1286 CG2 THR A 85 13.479 0.432 -3.685 1.00 0.00 C ATOM 0 H THR A 85 12.878 3.005 -2.939 1.00 0.00 H new ATOM 0 HA THR A 85 10.939 1.212 -3.589 1.00 0.00 H new ATOM 0 HB THR A 85 12.254 -0.415 -2.154 1.00 0.00 H new ATOM 0 HG1 THR A 85 14.207 0.473 -1.210 1.00 0.00 H new ATOM 0 HG21 THR A 85 14.320 -0.234 -3.491 1.00 0.00 H new ATOM 0 HG22 THR A 85 12.868 0.019 -4.487 1.00 0.00 H new ATOM 0 HG23 THR A 85 13.853 1.412 -3.981 1.00 0.00 H new ATOM 1294 N VAL A 86 10.793 2.014 -0.385 1.00 0.00 N ATOM 1295 CA VAL A 86 9.945 1.969 0.800 1.00 0.00 C ATOM 1296 C VAL A 86 8.481 2.188 0.436 1.00 0.00 C ATOM 1297 O VAL A 86 7.596 1.481 0.922 1.00 0.00 O ATOM 1298 CB VAL A 86 10.369 3.029 1.834 1.00 0.00 C ATOM 1299 CG1 VAL A 86 9.926 4.415 1.392 1.00 0.00 C ATOM 1300 CG2 VAL A 86 9.803 2.691 3.205 1.00 0.00 C ATOM 0 H VAL A 86 11.641 2.570 -0.276 1.00 0.00 H new ATOM 0 HA VAL A 86 10.064 0.978 1.237 1.00 0.00 H new ATOM 0 HB VAL A 86 11.457 3.028 1.904 1.00 0.00 H new ATOM 0 HG11 VAL A 86 10.235 5.150 2.135 1.00 0.00 H new ATOM 0 HG12 VAL A 86 10.384 4.655 0.433 1.00 0.00 H new ATOM 0 HG13 VAL A 86 8.841 4.435 1.291 1.00 0.00 H new ATOM 0 HG21 VAL A 86 10.112 3.450 3.924 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.715 2.663 3.152 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.176 1.717 3.523 1.00 0.00 H new ATOM 1310 N LEU A 87 8.231 3.171 -0.422 1.00 0.00 N ATOM 1311 CA LEU A 87 6.872 3.484 -0.852 1.00 0.00 C ATOM 1312 C LEU A 87 6.307 2.367 -1.724 1.00 0.00 C ATOM 1313 O LEU A 87 5.149 1.976 -1.577 1.00 0.00 O ATOM 1314 CB LEU A 87 6.851 4.807 -1.620 1.00 0.00 C ATOM 1315 CG LEU A 87 5.512 5.543 -1.653 1.00 0.00 C ATOM 1316 CD1 LEU A 87 5.077 5.924 -0.246 1.00 0.00 C ATOM 1317 CD2 LEU A 87 5.603 6.778 -2.537 1.00 0.00 C ATOM 0 H LEU A 87 8.951 3.765 -0.834 1.00 0.00 H new ATOM 0 HA LEU A 87 6.248 3.577 0.037 1.00 0.00 H new ATOM 0 HB2 LEU A 87 7.597 5.470 -1.182 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.161 4.613 -2.647 1.00 0.00 H new ATOM 0 HG LEU A 87 4.762 4.873 -2.075 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.122 6.447 -0.290 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.970 5.023 0.358 1.00 0.00 H new ATOM 0 HD13 LEU A 87 5.827 6.575 0.203 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.640 7.289 -2.548 1.00 0.00 H new ATOM 0 HD22 LEU A 87 6.366 7.450 -2.145 1.00 0.00 H new ATOM 0 HD23 LEU A 87 5.868 6.480 -3.552 1.00 0.00 H new ATOM 1329 N VAL A 88 7.133 1.857 -2.632 1.00 0.00 N ATOM 1330 CA VAL A 88 6.717 0.783 -3.526 1.00 0.00 C ATOM 1331 C VAL A 88 6.373 -0.480 -2.745 1.00 0.00 C ATOM 1332 O VAL A 88 5.486 -1.241 -3.133 1.00 0.00 O ATOM 1333 CB VAL A 88 7.814 0.453 -4.556 1.00 0.00 C ATOM 1334 CG1 VAL A 88 7.348 -0.646 -5.499 1.00 0.00 C ATOM 1335 CG2 VAL A 88 8.208 1.701 -5.332 1.00 0.00 C ATOM 0 H VAL A 88 8.094 2.170 -2.768 1.00 0.00 H new ATOM 0 HA VAL A 88 5.829 1.135 -4.052 1.00 0.00 H new ATOM 0 HB VAL A 88 8.693 0.092 -4.022 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.136 -0.866 -6.219 1.00 0.00 H new ATOM 0 HG12 VAL A 88 7.120 -1.545 -4.926 1.00 0.00 H new ATOM 0 HG13 VAL A 88 6.454 -0.316 -6.028 1.00 0.00 H new ATOM 0 HG21 VAL A 88 8.984 1.450 -6.055 1.00 0.00 H new ATOM 0 HG22 VAL A 88 7.337 2.094 -5.856 1.00 0.00 H new ATOM 0 HG23 VAL A 88 8.586 2.455 -4.641 1.00 0.00 H new ATOM 1345 N HIS A 89 7.080 -0.698 -1.641 1.00 0.00 N ATOM 1346 CA HIS A 89 6.849 -1.869 -0.803 1.00 0.00 C ATOM 1347 C HIS A 89 5.576 -1.704 0.022 1.00 0.00 C ATOM 1348 O HIS A 89 4.875 -2.677 0.301 1.00 0.00 O ATOM 1349 CB HIS A 89 8.043 -2.104 0.122 1.00 0.00 C ATOM 1350 CG HIS A 89 7.870 -3.277 1.037 1.00 0.00 C ATOM 1351 ND1 HIS A 89 8.651 -4.412 0.963 1.00 0.00 N ATOM 1352 CD2 HIS A 89 7.000 -3.487 2.053 1.00 0.00 C ATOM 1353 CE1 HIS A 89 8.267 -5.269 1.892 1.00 0.00 C ATOM 1354 NE2 HIS A 89 7.267 -4.732 2.567 1.00 0.00 N ATOM 0 H HIS A 89 7.818 -0.079 -1.306 1.00 0.00 H new ATOM 0 HA HIS A 89 6.729 -2.734 -1.455 1.00 0.00 H new ATOM 0 HB2 HIS A 89 8.937 -2.255 -0.483 1.00 0.00 H new ATOM 0 HB3 HIS A 89 8.210 -1.208 0.720 1.00 0.00 H new ATOM 0 HD2 HIS A 89 6.238 -2.803 2.395 1.00 0.00 H new ATOM 0 HE1 HIS A 89 8.698 -6.243 2.069 1.00 0.00 H new ATOM 0 HE2 HIS A 89 6.773 -5.171 3.344 1.00 0.00 H new ATOM 1363 N ARG A 90 5.284 -0.467 0.410 1.00 0.00 N ATOM 1364 CA ARG A 90 4.097 -0.175 1.205 1.00 0.00 C ATOM 1365 C ARG A 90 2.845 -0.182 0.333 1.00 0.00 C ATOM 1366 O ARG A 90 1.823 -0.761 0.701 1.00 0.00 O ATOM 1367 CB ARG A 90 4.242 1.180 1.898 1.00 0.00 C ATOM 1368 CG ARG A 90 5.270 1.185 3.018 1.00 0.00 C ATOM 1369 CD ARG A 90 5.746 2.594 3.332 1.00 0.00 C ATOM 1370 NE ARG A 90 4.891 3.254 4.316 1.00 0.00 N ATOM 1371 CZ ARG A 90 5.300 4.250 5.094 1.00 0.00 C ATOM 1372 NH1 ARG A 90 6.545 4.699 5.003 1.00 0.00 N ATOM 1373 NH2 ARG A 90 4.464 4.800 5.965 1.00 0.00 N ATOM 0 H ARG A 90 5.853 0.349 0.187 1.00 0.00 H new ATOM 0 HA ARG A 90 3.996 -0.953 1.962 1.00 0.00 H new ATOM 0 HB2 ARG A 90 4.521 1.929 1.157 1.00 0.00 H new ATOM 0 HB3 ARG A 90 3.275 1.477 2.303 1.00 0.00 H new ATOM 0 HG2 ARG A 90 4.837 0.739 3.913 1.00 0.00 H new ATOM 0 HG3 ARG A 90 6.122 0.567 2.734 1.00 0.00 H new ATOM 0 HD2 ARG A 90 6.769 2.556 3.708 1.00 0.00 H new ATOM 0 HD3 ARG A 90 5.765 3.183 2.415 1.00 0.00 H new ATOM 0 HE ARG A 90 3.928 2.932 4.411 1.00 0.00 H new ATOM 0 HH11 ARG A 90 7.191 4.279 4.334 1.00 0.00 H new ATOM 0 HH12 ARG A 90 6.856 5.464 5.602 1.00 0.00 H new ATOM 0 HH21 ARG A 90 3.506 4.458 6.038 1.00 0.00 H new ATOM 0 HH22 ARG A 90 4.779 5.565 6.562 1.00 0.00 H new ATOM 1387 N VAL A 91 2.932 0.467 -0.824 1.00 0.00 N ATOM 1388 CA VAL A 91 1.806 0.536 -1.748 1.00 0.00 C ATOM 1389 C VAL A 91 1.407 -0.853 -2.233 1.00 0.00 C ATOM 1390 O VAL A 91 0.263 -1.276 -2.066 1.00 0.00 O ATOM 1391 CB VAL A 91 2.134 1.419 -2.967 1.00 0.00 C ATOM 1392 CG1 VAL A 91 1.039 1.308 -4.017 1.00 0.00 C ATOM 1393 CG2 VAL A 91 2.330 2.866 -2.539 1.00 0.00 C ATOM 0 H VAL A 91 3.770 0.952 -1.144 1.00 0.00 H new ATOM 0 HA VAL A 91 0.974 0.979 -1.201 1.00 0.00 H new ATOM 0 HB VAL A 91 3.065 1.066 -3.410 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.288 1.939 -4.870 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.952 0.272 -4.344 1.00 0.00 H new ATOM 0 HG13 VAL A 91 0.091 1.634 -3.590 1.00 0.00 H new ATOM 0 HG21 VAL A 91 2.561 3.476 -3.413 1.00 0.00 H new ATOM 0 HG22 VAL A 91 1.417 3.234 -2.071 1.00 0.00 H new ATOM 0 HG23 VAL A 91 3.153 2.926 -1.827 1.00 0.00 H new ATOM 1403 N HIS A 92 2.359 -1.560 -2.834 1.00 0.00 N ATOM 1404 CA HIS A 92 2.108 -2.904 -3.343 1.00 0.00 C ATOM 1405 C HIS A 92 1.474 -3.782 -2.268 1.00 0.00 C ATOM 1406 O HIS A 92 0.798 -4.764 -2.574 1.00 0.00 O ATOM 1407 CB HIS A 92 3.410 -3.538 -3.834 1.00 0.00 C ATOM 1408 CG HIS A 92 3.201 -4.765 -4.666 1.00 0.00 C ATOM 1409 ND1 HIS A 92 2.980 -6.014 -4.124 1.00 0.00 N ATOM 1410 CD2 HIS A 92 3.180 -4.930 -6.010 1.00 0.00 C ATOM 1411 CE1 HIS A 92 2.833 -6.894 -5.098 1.00 0.00 C ATOM 1412 NE2 HIS A 92 2.950 -6.262 -6.252 1.00 0.00 N ATOM 0 H HIS A 92 3.311 -1.225 -2.980 1.00 0.00 H new ATOM 0 HA HIS A 92 1.414 -2.825 -4.179 1.00 0.00 H new ATOM 0 HB2 HIS A 92 3.965 -2.803 -4.418 1.00 0.00 H new ATOM 0 HB3 HIS A 92 4.028 -3.794 -2.973 1.00 0.00 H new ATOM 0 HD2 HIS A 92 3.318 -4.158 -6.753 1.00 0.00 H new ATOM 0 HE1 HIS A 92 2.649 -7.951 -4.972 1.00 0.00 H new ATOM 0 HE2 HIS A 92 2.881 -6.694 -7.174 1.00 0.00 H new ATOM 1421 N SER A 93 1.697 -3.421 -1.008 1.00 0.00 N ATOM 1422 CA SER A 93 1.152 -4.179 0.112 1.00 0.00 C ATOM 1423 C SER A 93 -0.340 -3.905 0.278 1.00 0.00 C ATOM 1424 O SER A 93 -1.160 -4.821 0.225 1.00 0.00 O ATOM 1425 CB SER A 93 1.894 -3.827 1.403 1.00 0.00 C ATOM 1426 OG SER A 93 1.700 -4.824 2.390 1.00 0.00 O ATOM 0 H SER A 93 2.251 -2.609 -0.738 1.00 0.00 H new ATOM 0 HA SER A 93 1.288 -5.240 -0.098 1.00 0.00 H new ATOM 0 HB2 SER A 93 2.959 -3.718 1.196 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.542 -2.866 1.778 1.00 0.00 H new ATOM 0 HG SER A 93 2.185 -4.577 3.205 1.00 0.00 H new ATOM 1432 N TYR A 94 -0.683 -2.638 0.480 1.00 0.00 N ATOM 1433 CA TYR A 94 -2.075 -2.241 0.656 1.00 0.00 C ATOM 1434 C TYR A 94 -2.962 -2.878 -0.409 1.00 0.00 C ATOM 1435 O TYR A 94 -4.106 -3.248 -0.142 1.00 0.00 O ATOM 1436 CB TYR A 94 -2.204 -0.718 0.600 1.00 0.00 C ATOM 1437 CG TYR A 94 -3.543 -0.243 0.081 1.00 0.00 C ATOM 1438 CD1 TYR A 94 -3.812 -0.215 -1.281 1.00 0.00 C ATOM 1439 CD2 TYR A 94 -4.539 0.176 0.955 1.00 0.00 C ATOM 1440 CE1 TYR A 94 -5.033 0.219 -1.759 1.00 0.00 C ATOM 1441 CE2 TYR A 94 -5.764 0.611 0.485 1.00 0.00 C ATOM 1442 CZ TYR A 94 -6.006 0.631 -0.872 1.00 0.00 C ATOM 1443 OH TYR A 94 -7.224 1.062 -1.345 1.00 0.00 O ATOM 0 H TYR A 94 -0.016 -1.868 0.526 1.00 0.00 H new ATOM 0 HA TYR A 94 -2.405 -2.591 1.634 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -2.046 -0.311 1.599 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -1.414 -0.318 -0.036 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -3.053 -0.538 -1.979 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -4.353 0.162 2.019 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -5.225 0.236 -2.822 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -6.528 0.934 1.177 1.00 0.00 H new ATOM 0 HH TYR A 94 -7.797 1.316 -0.591 1.00 0.00 H new ATOM 1453 N LEU A 95 -2.426 -3.004 -1.618 1.00 0.00 N ATOM 1454 CA LEU A 95 -3.167 -3.596 -2.726 1.00 0.00 C ATOM 1455 C LEU A 95 -3.347 -5.097 -2.520 1.00 0.00 C ATOM 1456 O LEU A 95 -4.469 -5.582 -2.374 1.00 0.00 O ATOM 1457 CB LEU A 95 -2.442 -3.335 -4.048 1.00 0.00 C ATOM 1458 CG LEU A 95 -2.446 -1.888 -4.541 1.00 0.00 C ATOM 1459 CD1 LEU A 95 -1.355 -1.675 -5.579 1.00 0.00 C ATOM 1460 CD2 LEU A 95 -3.808 -1.523 -5.113 1.00 0.00 C ATOM 0 H LEU A 95 -1.481 -2.704 -1.856 1.00 0.00 H new ATOM 0 HA LEU A 95 -4.152 -3.131 -2.761 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.407 -3.659 -3.942 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.894 -3.961 -4.817 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.244 -1.235 -3.692 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -1.373 -0.639 -5.919 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -0.384 -1.895 -5.136 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -1.525 -2.338 -6.427 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -3.792 -0.489 -5.459 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.040 -2.182 -5.950 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.569 -1.635 -4.341 1.00 0.00 H new ATOM 1472 N GLU A 96 -2.235 -5.825 -2.506 1.00 0.00 N ATOM 1473 CA GLU A 96 -2.272 -7.270 -2.316 1.00 0.00 C ATOM 1474 C GLU A 96 -2.968 -7.629 -1.006 1.00 0.00 C ATOM 1475 O GLU A 96 -3.985 -8.323 -1.001 1.00 0.00 O ATOM 1476 CB GLU A 96 -0.853 -7.844 -2.326 1.00 0.00 C ATOM 1477 CG GLU A 96 -0.802 -9.345 -2.092 1.00 0.00 C ATOM 1478 CD GLU A 96 -0.733 -9.704 -0.620 1.00 0.00 C ATOM 1479 OE1 GLU A 96 0.322 -9.458 0.001 1.00 0.00 O ATOM 1480 OE2 GLU A 96 -1.733 -10.232 -0.090 1.00 0.00 O ATOM 0 H GLU A 96 -1.299 -5.438 -2.624 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.839 -7.705 -3.139 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -0.385 -7.618 -3.284 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.263 -7.345 -1.558 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.684 -9.808 -2.534 1.00 0.00 H new ATOM 0 HG3 GLU A 96 0.066 -9.760 -2.604 1.00 0.00 H new ATOM 1487 N ARG A 97 -2.412 -7.152 0.103 1.00 0.00 N ATOM 1488 CA ARG A 97 -2.978 -7.424 1.419 1.00 0.00 C ATOM 1489 C ARG A 97 -4.497 -7.284 1.397 1.00 0.00 C ATOM 1490 O ARG A 97 -5.218 -8.148 1.897 1.00 0.00 O ATOM 1491 CB ARG A 97 -2.382 -6.473 2.459 1.00 0.00 C ATOM 1492 CG ARG A 97 -0.928 -6.766 2.790 1.00 0.00 C ATOM 1493 CD ARG A 97 -0.785 -8.061 3.575 1.00 0.00 C ATOM 1494 NE ARG A 97 0.367 -8.032 4.472 1.00 0.00 N ATOM 1495 CZ ARG A 97 0.354 -7.448 5.666 1.00 0.00 C ATOM 1496 NH1 ARG A 97 -0.745 -6.848 6.102 1.00 0.00 N ATOM 1497 NH2 ARG A 97 1.442 -7.464 6.425 1.00 0.00 N ATOM 0 H ARG A 97 -1.571 -6.576 0.116 1.00 0.00 H new ATOM 0 HA ARG A 97 -2.729 -8.450 1.690 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -2.463 -5.450 2.092 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -2.973 -6.532 3.373 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -0.350 -6.832 1.868 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -0.512 -5.941 3.368 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -1.692 -8.236 4.154 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -0.684 -8.896 2.882 1.00 0.00 H new ATOM 0 HE ARG A 97 1.228 -8.484 4.166 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -1.583 -6.834 5.521 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -0.752 -6.401 7.019 1.00 0.00 H new ATOM 0 HH21 ARG A 97 2.289 -7.925 6.092 1.00 0.00 H new ATOM 0 HH22 ARG A 97 1.431 -7.016 7.341 1.00 0.00 H new ATOM 1511 N HIS A 98 -4.977 -6.190 0.815 1.00 0.00 N ATOM 1512 CA HIS A 98 -6.411 -5.937 0.727 1.00 0.00 C ATOM 1513 C HIS A 98 -7.092 -6.970 -0.165 1.00 0.00 C ATOM 1514 O HIS A 98 -8.176 -7.459 0.150 1.00 0.00 O ATOM 1515 CB HIS A 98 -6.670 -4.530 0.188 1.00 0.00 C ATOM 1516 CG HIS A 98 -6.495 -3.453 1.214 1.00 0.00 C ATOM 1517 ND1 HIS A 98 -7.328 -2.358 1.305 1.00 0.00 N ATOM 1518 CD2 HIS A 98 -5.577 -3.308 2.198 1.00 0.00 C ATOM 1519 CE1 HIS A 98 -6.929 -1.585 2.299 1.00 0.00 C ATOM 1520 NE2 HIS A 98 -5.868 -2.140 2.858 1.00 0.00 N ATOM 0 H HIS A 98 -4.394 -5.464 0.397 1.00 0.00 H new ATOM 0 HA HIS A 98 -6.831 -6.017 1.730 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -5.994 -4.339 -0.646 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -7.685 -4.482 -0.207 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -4.766 -3.985 2.422 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -7.391 -0.657 2.603 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -5.350 -1.762 3.651 1.00 0.00 H new ATOM 1529 N GLY A 99 -6.448 -7.297 -1.281 1.00 0.00 N ATOM 1530 CA GLY A 99 -7.007 -8.270 -2.202 1.00 0.00 C ATOM 1531 C GLY A 99 -7.383 -7.655 -3.536 1.00 0.00 C ATOM 1532 O GLY A 99 -8.369 -8.055 -4.156 1.00 0.00 O ATOM 0 H GLY A 99 -5.549 -6.906 -1.564 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -6.284 -9.069 -2.365 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -7.890 -8.725 -1.753 1.00 0.00 H new ATOM 1536 N LEU A 100 -6.597 -6.680 -3.979 1.00 0.00 N ATOM 1537 CA LEU A 100 -6.853 -6.007 -5.248 1.00 0.00 C ATOM 1538 C LEU A 100 -5.946 -6.553 -6.346 1.00 0.00 C ATOM 1539 O LEU A 100 -6.178 -6.315 -7.532 1.00 0.00 O ATOM 1540 CB LEU A 100 -6.644 -4.499 -5.100 1.00 0.00 C ATOM 1541 CG LEU A 100 -7.217 -3.864 -3.832 1.00 0.00 C ATOM 1542 CD1 LEU A 100 -7.583 -2.409 -4.082 1.00 0.00 C ATOM 1543 CD2 LEU A 100 -8.429 -4.644 -3.345 1.00 0.00 C ATOM 0 H LEU A 100 -5.777 -6.338 -3.478 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.889 -6.197 -5.530 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.574 -4.296 -5.133 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.089 -4.004 -5.963 1.00 0.00 H new ATOM 0 HG LEU A 100 -6.453 -3.897 -3.056 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.989 -1.974 -3.169 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.693 -1.856 -4.383 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.330 -2.353 -4.874 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.823 -4.178 -2.442 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -9.197 -4.643 -4.119 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.137 -5.671 -3.125 1.00 0.00 H new ATOM 1555 N ILE A 101 -4.913 -7.285 -5.943 1.00 0.00 N ATOM 1556 CA ILE A 101 -3.973 -7.866 -6.893 1.00 0.00 C ATOM 1557 C ILE A 101 -3.558 -9.270 -6.467 1.00 0.00 C ATOM 1558 O ILE A 101 -3.411 -9.551 -5.278 1.00 0.00 O ATOM 1559 CB ILE A 101 -2.712 -6.994 -7.044 1.00 0.00 C ATOM 1560 CG1 ILE A 101 -1.979 -6.885 -5.705 1.00 0.00 C ATOM 1561 CG2 ILE A 101 -3.082 -5.614 -7.566 1.00 0.00 C ATOM 1562 CD1 ILE A 101 -0.516 -6.528 -5.846 1.00 0.00 C ATOM 0 H ILE A 101 -4.706 -7.490 -4.965 1.00 0.00 H new ATOM 0 HA ILE A 101 -4.487 -7.917 -7.853 1.00 0.00 H new ATOM 0 HB ILE A 101 -2.045 -7.466 -7.765 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -2.471 -6.131 -5.091 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -2.064 -7.834 -5.175 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -2.181 -5.010 -7.667 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -3.566 -5.710 -8.538 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -3.765 -5.132 -6.867 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -0.059 -6.468 -4.858 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -0.010 -7.294 -6.434 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -0.423 -5.565 -6.348 1.00 0.00 H new ATOM 1574 N ASN A 102 -3.368 -10.149 -7.447 1.00 0.00 N ATOM 1575 CA ASN A 102 -2.968 -11.524 -7.173 1.00 0.00 C ATOM 1576 C ASN A 102 -4.041 -12.253 -6.370 1.00 0.00 C ATOM 1577 O ASN A 102 -3.768 -12.801 -5.302 1.00 0.00 O ATOM 1578 CB ASN A 102 -1.641 -11.550 -6.413 1.00 0.00 C ATOM 1579 CG ASN A 102 -0.577 -10.698 -7.078 1.00 0.00 C ATOM 1580 OD1 ASN A 102 -0.841 -10.018 -8.069 1.00 0.00 O ATOM 1581 ND2 ASN A 102 0.634 -10.732 -6.533 1.00 0.00 N ATOM 0 H ASN A 102 -3.485 -9.933 -8.437 1.00 0.00 H new ATOM 0 HA ASN A 102 -2.842 -12.036 -8.127 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -1.802 -11.196 -5.395 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -1.287 -12.578 -6.341 1.00 0.00 H new ATOM 0 HD21 ASN A 102 1.391 -10.180 -6.936 1.00 0.00 H new ATOM 0 HD22 ASN A 102 0.807 -11.311 -5.711 1.00 0.00 H new ATOM 1588 N PHE A 103 -5.264 -12.256 -6.892 1.00 0.00 N ATOM 1589 CA PHE A 103 -6.379 -12.917 -6.224 1.00 0.00 C ATOM 1590 C PHE A 103 -6.984 -13.997 -7.116 1.00 0.00 C ATOM 1591 O PHE A 103 -8.178 -14.281 -7.042 1.00 0.00 O ATOM 1592 CB PHE A 103 -7.451 -11.895 -5.843 1.00 0.00 C ATOM 1593 CG PHE A 103 -7.802 -10.950 -6.957 1.00 0.00 C ATOM 1594 CD1 PHE A 103 -8.240 -11.433 -8.180 1.00 0.00 C ATOM 1595 CD2 PHE A 103 -7.694 -9.580 -6.781 1.00 0.00 C ATOM 1596 CE1 PHE A 103 -8.564 -10.566 -9.207 1.00 0.00 C ATOM 1597 CE2 PHE A 103 -8.017 -8.709 -7.805 1.00 0.00 C ATOM 1598 CZ PHE A 103 -8.451 -9.203 -9.019 1.00 0.00 C ATOM 0 H PHE A 103 -5.507 -11.808 -7.775 1.00 0.00 H new ATOM 0 HA PHE A 103 -5.999 -13.389 -5.318 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -8.351 -12.424 -5.529 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -7.104 -11.319 -4.985 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -8.329 -12.498 -8.332 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -7.354 -9.188 -5.834 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -8.905 -10.955 -10.155 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -7.930 -7.643 -7.655 1.00 0.00 H new ATOM 0 HZ PHE A 103 -8.702 -8.524 -9.821 1.00 0.00 H new ATOM 1608 N GLY A 104 -6.149 -14.596 -7.960 1.00 0.00 N ATOM 1609 CA GLY A 104 -6.619 -15.637 -8.855 1.00 0.00 C ATOM 1610 C GLY A 104 -5.495 -16.523 -9.355 1.00 0.00 C ATOM 1611 O GLY A 104 -5.550 -17.745 -9.216 1.00 0.00 O ATOM 0 H GLY A 104 -5.156 -14.379 -8.040 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -7.358 -16.250 -8.338 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -7.123 -15.180 -9.706 1.00 0.00 H new ATOM 1615 N ILE A 105 -4.473 -15.906 -9.939 1.00 0.00 N ATOM 1616 CA ILE A 105 -3.332 -16.647 -10.462 1.00 0.00 C ATOM 1617 C ILE A 105 -3.010 -17.852 -9.584 1.00 0.00 C ATOM 1618 O ILE A 105 -2.595 -18.901 -10.078 1.00 0.00 O ATOM 1619 CB ILE A 105 -2.081 -15.755 -10.568 1.00 0.00 C ATOM 1620 CG1 ILE A 105 -1.555 -15.409 -9.173 1.00 0.00 C ATOM 1621 CG2 ILE A 105 -2.399 -14.488 -11.348 1.00 0.00 C ATOM 1622 CD1 ILE A 105 -2.449 -14.459 -8.408 1.00 0.00 C ATOM 0 H ILE A 105 -4.412 -14.895 -10.062 1.00 0.00 H new ATOM 0 HA ILE A 105 -3.609 -16.990 -11.459 1.00 0.00 H new ATOM 0 HB ILE A 105 -1.306 -16.304 -11.103 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -1.440 -16.328 -8.599 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.564 -14.966 -9.267 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -1.505 -13.868 -11.415 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.733 -14.753 -12.351 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -3.187 -13.935 -10.838 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -2.014 -14.259 -7.429 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -2.544 -13.524 -8.961 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -3.434 -14.908 -8.282 1.00 0.00 H new ATOM 1634 N TYR A 106 -3.205 -17.695 -8.279 1.00 0.00 N ATOM 1635 CA TYR A 106 -2.935 -18.769 -7.331 1.00 0.00 C ATOM 1636 C TYR A 106 -4.084 -18.922 -6.339 1.00 0.00 C ATOM 1637 O TYR A 106 -4.680 -17.936 -5.904 1.00 0.00 O ATOM 1638 CB TYR A 106 -1.630 -18.500 -6.580 1.00 0.00 C ATOM 1639 CG TYR A 106 -1.626 -17.189 -5.826 1.00 0.00 C ATOM 1640 CD1 TYR A 106 -2.443 -16.999 -4.719 1.00 0.00 C ATOM 1641 CD2 TYR A 106 -0.805 -16.140 -6.222 1.00 0.00 C ATOM 1642 CE1 TYR A 106 -2.443 -15.803 -4.027 1.00 0.00 C ATOM 1643 CE2 TYR A 106 -0.797 -14.941 -5.535 1.00 0.00 C ATOM 1644 CZ TYR A 106 -1.618 -14.778 -4.439 1.00 0.00 C ATOM 1645 OH TYR A 106 -1.614 -13.585 -3.753 1.00 0.00 O ATOM 0 H TYR A 106 -3.549 -16.834 -7.854 1.00 0.00 H new ATOM 0 HA TYR A 106 -2.838 -19.698 -7.893 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -1.450 -19.314 -5.878 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -0.804 -18.503 -7.291 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -3.090 -17.800 -4.393 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -0.162 -16.264 -7.081 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -3.085 -15.672 -3.169 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -0.152 -14.136 -5.855 1.00 0.00 H new ATOM 0 HH TYR A 106 -2.332 -13.011 -4.092 1.00 0.00 H new ATOM 1655 N LYS A 107 -4.389 -20.166 -5.985 1.00 0.00 N ATOM 1656 CA LYS A 107 -5.465 -20.451 -5.042 1.00 0.00 C ATOM 1657 C LYS A 107 -5.189 -19.802 -3.690 1.00 0.00 C ATOM 1658 O LYS A 107 -4.424 -20.329 -2.883 1.00 0.00 O ATOM 1659 CB LYS A 107 -5.633 -21.962 -4.870 1.00 0.00 C ATOM 1660 CG LYS A 107 -6.447 -22.613 -5.975 1.00 0.00 C ATOM 1661 CD LYS A 107 -7.928 -22.637 -5.636 1.00 0.00 C ATOM 1662 CE LYS A 107 -8.624 -21.363 -6.090 1.00 0.00 C ATOM 1663 NZ LYS A 107 -10.105 -21.511 -6.093 1.00 0.00 N ATOM 0 H LYS A 107 -3.906 -20.993 -6.337 1.00 0.00 H new ATOM 0 HA LYS A 107 -6.388 -20.033 -5.444 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -4.648 -22.427 -4.834 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -6.114 -22.159 -3.912 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -6.295 -22.070 -6.908 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -6.093 -23.631 -6.137 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -8.397 -23.498 -6.111 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -8.054 -22.758 -4.560 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -8.343 -20.541 -5.432 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -8.283 -21.100 -7.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -10.542 -20.622 -6.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -10.376 -22.278 -6.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -10.433 -21.737 -5.132 1.00 0.00 H new ATOM 1677 N ARG A 108 -5.819 -18.657 -3.448 1.00 0.00 N ATOM 1678 CA ARG A 108 -5.642 -17.937 -2.193 1.00 0.00 C ATOM 1679 C ARG A 108 -6.754 -18.282 -1.207 1.00 0.00 C ATOM 1680 O ARG A 108 -7.898 -18.509 -1.601 1.00 0.00 O ATOM 1681 CB ARG A 108 -5.618 -16.428 -2.445 1.00 0.00 C ATOM 1682 CG ARG A 108 -4.760 -15.659 -1.454 1.00 0.00 C ATOM 1683 CD ARG A 108 -5.560 -15.243 -0.229 1.00 0.00 C ATOM 1684 NE ARG A 108 -4.698 -14.794 0.861 1.00 0.00 N ATOM 1685 CZ ARG A 108 -4.236 -13.553 0.969 1.00 0.00 C ATOM 1686 NH1 ARG A 108 -4.552 -12.643 0.058 1.00 0.00 N ATOM 1687 NH2 ARG A 108 -3.457 -13.221 1.990 1.00 0.00 N ATOM 0 H ARG A 108 -6.457 -18.208 -4.105 1.00 0.00 H new ATOM 0 HA ARG A 108 -4.689 -18.241 -1.760 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -5.248 -16.242 -3.453 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -6.638 -16.045 -2.404 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -3.916 -16.276 -1.146 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.348 -14.774 -1.938 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -6.248 -14.442 -0.500 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -6.166 -16.083 0.111 1.00 0.00 H new ATOM 0 HE ARG A 108 -4.436 -15.470 1.579 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -5.151 -12.895 -0.728 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -4.196 -11.691 0.143 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -3.212 -13.919 2.693 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -3.103 -12.268 2.072 1.00 0.00 H new ATOM 1701 N ILE A 109 -6.409 -18.319 0.076 1.00 0.00 N ATOM 1702 CA ILE A 109 -7.378 -18.635 1.118 1.00 0.00 C ATOM 1703 C ILE A 109 -8.312 -17.458 1.376 1.00 0.00 C ATOM 1704 O ILE A 109 -8.387 -16.944 2.493 1.00 0.00 O ATOM 1705 CB ILE A 109 -6.681 -19.022 2.436 1.00 0.00 C ATOM 1706 CG1 ILE A 109 -5.659 -20.134 2.191 1.00 0.00 C ATOM 1707 CG2 ILE A 109 -7.708 -19.458 3.470 1.00 0.00 C ATOM 1708 CD1 ILE A 109 -4.470 -20.079 3.124 1.00 0.00 C ATOM 0 H ILE A 109 -5.466 -18.134 0.418 1.00 0.00 H new ATOM 0 HA ILE A 109 -7.960 -19.485 0.761 1.00 0.00 H new ATOM 0 HB ILE A 109 -6.154 -18.149 2.821 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -6.152 -21.100 2.301 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -5.306 -20.071 1.162 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -7.200 -19.728 4.396 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -8.401 -18.639 3.662 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -8.260 -20.320 3.094 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -3.788 -20.897 2.892 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -3.953 -19.128 2.998 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -4.812 -20.173 4.155 1.00 0.00 H new ATOM 1720 N LYS A 110 -9.023 -17.035 0.337 1.00 0.00 N ATOM 1721 CA LYS A 110 -9.956 -15.920 0.450 1.00 0.00 C ATOM 1722 C LYS A 110 -11.016 -15.984 -0.644 1.00 0.00 C ATOM 1723 O LYS A 110 -10.716 -16.170 -1.823 1.00 0.00 O ATOM 1724 CB LYS A 110 -9.204 -14.589 0.369 1.00 0.00 C ATOM 1725 CG LYS A 110 -10.095 -13.406 0.033 1.00 0.00 C ATOM 1726 CD LYS A 110 -9.569 -12.119 0.646 1.00 0.00 C ATOM 1727 CE LYS A 110 -9.721 -12.122 2.160 1.00 0.00 C ATOM 1728 NZ LYS A 110 -9.481 -10.772 2.743 1.00 0.00 N ATOM 0 H LYS A 110 -8.971 -17.448 -0.594 1.00 0.00 H new ATOM 0 HA LYS A 110 -10.453 -15.992 1.417 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -8.710 -14.402 1.323 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -8.421 -14.669 -0.385 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -10.160 -13.294 -1.049 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -11.105 -13.596 0.395 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.518 -11.993 0.385 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -10.106 -11.268 0.227 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -10.723 -12.459 2.424 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -9.020 -12.835 2.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -9.594 -10.815 3.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -8.516 -10.461 2.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -10.166 -10.096 2.348 1.00 0.00 H new ATOM 1742 N PRO A 111 -12.288 -15.825 -0.247 1.00 0.00 N ATOM 1743 CA PRO A 111 -13.418 -15.859 -1.179 1.00 0.00 C ATOM 1744 C PRO A 111 -13.450 -14.642 -2.097 1.00 0.00 C ATOM 1745 O PRO A 111 -12.701 -13.684 -1.901 1.00 0.00 O ATOM 1746 CB PRO A 111 -14.639 -15.865 -0.256 1.00 0.00 C ATOM 1747 CG PRO A 111 -14.167 -15.219 1.001 1.00 0.00 C ATOM 1748 CD PRO A 111 -12.719 -15.599 1.143 1.00 0.00 C ATOM 0 HA PRO A 111 -13.368 -16.718 -1.848 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -15.471 -15.314 -0.696 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -14.991 -16.880 -0.072 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -14.283 -14.136 0.951 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -14.747 -15.563 1.858 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -12.141 -14.807 1.619 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -12.596 -16.494 1.752 1.00 0.00 H new ATOM 1756 N LEU A 112 -14.322 -14.685 -3.098 1.00 0.00 N ATOM 1757 CA LEU A 112 -14.452 -13.584 -4.047 1.00 0.00 C ATOM 1758 C LEU A 112 -15.689 -13.762 -4.922 1.00 0.00 C ATOM 1759 O LEU A 112 -16.185 -14.872 -5.119 1.00 0.00 O ATOM 1760 CB LEU A 112 -13.202 -13.491 -4.924 1.00 0.00 C ATOM 1761 CG LEU A 112 -12.697 -14.808 -5.515 1.00 0.00 C ATOM 1762 CD1 LEU A 112 -13.595 -15.260 -6.656 1.00 0.00 C ATOM 1763 CD2 LEU A 112 -11.259 -14.662 -5.991 1.00 0.00 C ATOM 0 H LEU A 112 -14.949 -15.470 -3.274 1.00 0.00 H new ATOM 0 HA LEU A 112 -14.561 -12.659 -3.480 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -13.408 -12.803 -5.744 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -12.400 -13.050 -4.333 1.00 0.00 H new ATOM 0 HG LEU A 112 -12.725 -15.569 -4.735 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -13.220 -16.199 -7.064 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -14.610 -15.405 -6.285 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -13.600 -14.501 -7.438 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -10.916 -15.609 -6.409 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -11.206 -13.887 -6.756 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -10.624 -14.385 -5.150 1.00 0.00 H new ATOM 1775 N PRO A 113 -16.198 -12.645 -5.461 1.00 0.00 N ATOM 1776 CA PRO A 113 -17.381 -12.652 -6.326 1.00 0.00 C ATOM 1777 C PRO A 113 -17.106 -13.298 -7.680 1.00 0.00 C ATOM 1778 O PRO A 113 -15.974 -13.679 -7.980 1.00 0.00 O ATOM 1779 CB PRO A 113 -17.704 -11.166 -6.498 1.00 0.00 C ATOM 1780 CG PRO A 113 -16.404 -10.469 -6.284 1.00 0.00 C ATOM 1781 CD PRO A 113 -15.657 -11.289 -5.269 1.00 0.00 C ATOM 0 HA PRO A 113 -18.197 -13.232 -5.895 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -18.105 -10.960 -7.490 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -18.453 -10.837 -5.777 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -15.843 -10.395 -7.215 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -16.561 -9.452 -5.925 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -14.581 -11.258 -5.440 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -15.829 -10.928 -4.255 1.00 0.00 H new ATOM 1789 N THR A 114 -18.149 -13.418 -8.496 1.00 0.00 N ATOM 1790 CA THR A 114 -18.019 -14.018 -9.818 1.00 0.00 C ATOM 1791 C THR A 114 -17.279 -13.089 -10.774 1.00 0.00 C ATOM 1792 O THR A 114 -17.371 -11.866 -10.663 1.00 0.00 O ATOM 1793 CB THR A 114 -19.397 -14.361 -10.417 1.00 0.00 C ATOM 1794 OG1 THR A 114 -19.232 -15.053 -11.659 1.00 0.00 O ATOM 1795 CG2 THR A 114 -20.220 -13.100 -10.637 1.00 0.00 C ATOM 0 H THR A 114 -19.093 -13.108 -8.264 1.00 0.00 H new ATOM 0 HA THR A 114 -17.446 -14.937 -9.693 1.00 0.00 H new ATOM 0 HB THR A 114 -19.926 -15.002 -9.712 1.00 0.00 H new ATOM 0 HG1 THR A 114 -20.112 -15.269 -12.033 1.00 0.00 H new ATOM 0 HG21 THR A 114 -21.188 -13.367 -11.060 1.00 0.00 H new ATOM 0 HG22 THR A 114 -20.368 -12.591 -9.684 1.00 0.00 H new ATOM 0 HG23 THR A 114 -19.694 -12.437 -11.324 1.00 0.00 H new ATOM 1803 N LYS A 115 -16.546 -13.676 -11.713 1.00 0.00 N ATOM 1804 CA LYS A 115 -15.791 -12.902 -12.691 1.00 0.00 C ATOM 1805 C LYS A 115 -16.725 -12.237 -13.697 1.00 0.00 C ATOM 1806 O LYS A 115 -17.933 -12.477 -13.691 1.00 0.00 O ATOM 1807 CB LYS A 115 -14.792 -13.801 -13.422 1.00 0.00 C ATOM 1808 CG LYS A 115 -13.524 -14.072 -12.631 1.00 0.00 C ATOM 1809 CD LYS A 115 -13.687 -15.270 -11.711 1.00 0.00 C ATOM 1810 CE LYS A 115 -12.356 -15.961 -11.455 1.00 0.00 C ATOM 1811 NZ LYS A 115 -12.061 -16.995 -12.486 1.00 0.00 N ATOM 0 H LYS A 115 -16.458 -14.687 -11.818 1.00 0.00 H new ATOM 0 HA LYS A 115 -15.246 -12.123 -12.158 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -15.274 -14.750 -13.656 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -14.525 -13.337 -14.371 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -12.696 -14.249 -13.318 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -13.266 -13.192 -12.042 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -14.118 -14.947 -10.764 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -14.387 -15.978 -12.155 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -11.557 -15.219 -11.446 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -12.371 -16.425 -10.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -11.146 -17.443 -12.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -12.810 -17.717 -12.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -12.021 -16.548 -13.424 1.00 0.00 H new ATOM 1825 N LYS A 116 -16.158 -11.403 -14.562 1.00 0.00 N ATOM 1826 CA LYS A 116 -16.939 -10.706 -15.577 1.00 0.00 C ATOM 1827 C LYS A 116 -17.638 -11.697 -16.502 1.00 0.00 C ATOM 1828 O LYS A 116 -17.024 -12.250 -17.415 1.00 0.00 O ATOM 1829 CB LYS A 116 -16.038 -9.777 -16.395 1.00 0.00 C ATOM 1830 CG LYS A 116 -16.778 -8.609 -17.022 1.00 0.00 C ATOM 1831 CD LYS A 116 -17.163 -7.569 -15.982 1.00 0.00 C ATOM 1832 CE LYS A 116 -15.992 -6.658 -15.646 1.00 0.00 C ATOM 1833 NZ LYS A 116 -15.644 -5.760 -16.781 1.00 0.00 N ATOM 0 H LYS A 116 -15.160 -11.193 -14.580 1.00 0.00 H new ATOM 0 HA LYS A 116 -17.699 -10.112 -15.070 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -15.247 -9.392 -15.751 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -15.554 -10.355 -17.183 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -16.151 -8.147 -17.785 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -17.675 -8.972 -17.524 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -17.995 -6.972 -16.354 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -17.509 -8.068 -15.077 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -16.239 -6.058 -14.770 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -15.125 -7.264 -15.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -15.084 -4.957 -16.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -15.089 -6.288 -17.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -16.516 -5.406 -17.224 1.00 0.00 H new ATOM 1847 N THR A 117 -18.927 -11.917 -16.261 1.00 0.00 N ATOM 1848 CA THR A 117 -19.709 -12.841 -17.072 1.00 0.00 C ATOM 1849 C THR A 117 -19.902 -12.304 -18.486 1.00 0.00 C ATOM 1850 O THR A 117 -19.876 -13.060 -19.456 1.00 0.00 O ATOM 1851 CB THR A 117 -21.090 -13.109 -16.445 1.00 0.00 C ATOM 1852 OG1 THR A 117 -21.851 -13.982 -17.288 1.00 0.00 O ATOM 1853 CG2 THR A 117 -21.851 -11.808 -16.235 1.00 0.00 C ATOM 0 H THR A 117 -19.451 -11.467 -15.510 1.00 0.00 H new ATOM 0 HA THR A 117 -19.149 -13.775 -17.114 1.00 0.00 H new ATOM 0 HB THR A 117 -20.938 -13.583 -15.475 1.00 0.00 H new ATOM 0 HG1 THR A 117 -22.727 -14.148 -16.881 1.00 0.00 H new ATOM 0 HG21 THR A 117 -22.823 -12.023 -15.791 1.00 0.00 H new ATOM 0 HG22 THR A 117 -21.284 -11.158 -15.569 1.00 0.00 H new ATOM 0 HG23 THR A 117 -21.992 -11.310 -17.194 1.00 0.00 H new ATOM 1861 N GLY A 118 -20.093 -10.993 -18.595 1.00 0.00 N ATOM 1862 CA GLY A 118 -20.287 -10.378 -19.895 1.00 0.00 C ATOM 1863 C GLY A 118 -21.538 -9.524 -19.952 1.00 0.00 C ATOM 1864 O GLY A 118 -22.638 -10.036 -20.157 1.00 0.00 O ATOM 0 H GLY A 118 -20.117 -10.346 -17.807 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -19.420 -9.763 -20.135 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -20.347 -11.156 -20.656 1.00 0.00 H new ATOM 1868 N SER A 119 -21.370 -8.218 -19.769 1.00 0.00 N ATOM 1869 CA SER A 119 -22.496 -7.292 -19.795 1.00 0.00 C ATOM 1870 C SER A 119 -22.014 -5.848 -19.697 1.00 0.00 C ATOM 1871 O SER A 119 -20.972 -5.568 -19.105 1.00 0.00 O ATOM 1872 CB SER A 119 -23.463 -7.598 -18.650 1.00 0.00 C ATOM 1873 OG SER A 119 -24.567 -6.711 -18.663 1.00 0.00 O ATOM 0 H SER A 119 -20.465 -7.778 -19.601 1.00 0.00 H new ATOM 0 HA SER A 119 -23.017 -7.419 -20.744 1.00 0.00 H new ATOM 0 HB2 SER A 119 -23.817 -8.625 -18.734 1.00 0.00 H new ATOM 0 HB3 SER A 119 -22.940 -7.518 -17.697 1.00 0.00 H new ATOM 0 HG SER A 119 -25.171 -6.929 -17.922 1.00 0.00 H new ATOM 1879 N GLY A 120 -22.781 -4.933 -20.282 1.00 0.00 N ATOM 1880 CA GLY A 120 -22.417 -3.529 -20.249 1.00 0.00 C ATOM 1881 C GLY A 120 -23.250 -2.736 -19.261 1.00 0.00 C ATOM 1882 O GLY A 120 -22.836 -2.485 -18.129 1.00 0.00 O ATOM 0 H GLY A 120 -23.648 -5.139 -20.778 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -21.363 -3.436 -19.987 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -22.537 -3.102 -21.245 1.00 0.00 H new ATOM 1886 N PRO A 121 -24.453 -2.328 -19.689 1.00 0.00 N ATOM 1887 CA PRO A 121 -25.371 -1.552 -18.849 1.00 0.00 C ATOM 1888 C PRO A 121 -25.950 -2.379 -17.706 1.00 0.00 C ATOM 1889 O PRO A 121 -26.986 -3.026 -17.858 1.00 0.00 O ATOM 1890 CB PRO A 121 -26.477 -1.137 -19.822 1.00 0.00 C ATOM 1891 CG PRO A 121 -26.449 -2.173 -20.892 1.00 0.00 C ATOM 1892 CD PRO A 121 -25.011 -2.591 -21.026 1.00 0.00 C ATOM 0 HA PRO A 121 -24.871 -0.712 -18.367 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -27.448 -1.105 -19.327 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -26.294 -0.143 -20.229 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -27.079 -3.022 -20.629 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -26.828 -1.773 -21.832 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -24.922 -3.643 -21.299 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -24.496 -2.017 -21.796 1.00 0.00 H new ATOM 1900 N SER A 122 -25.274 -2.353 -16.562 1.00 0.00 N ATOM 1901 CA SER A 122 -25.720 -3.104 -15.394 1.00 0.00 C ATOM 1902 C SER A 122 -27.168 -2.768 -15.053 1.00 0.00 C ATOM 1903 O SER A 122 -28.002 -3.659 -14.889 1.00 0.00 O ATOM 1904 CB SER A 122 -24.819 -2.803 -14.194 1.00 0.00 C ATOM 1905 OG SER A 122 -23.477 -3.177 -14.458 1.00 0.00 O ATOM 0 H SER A 122 -24.416 -1.820 -16.419 1.00 0.00 H new ATOM 0 HA SER A 122 -25.657 -4.166 -15.630 1.00 0.00 H new ATOM 0 HB2 SER A 122 -24.864 -1.740 -13.959 1.00 0.00 H new ATOM 0 HB3 SER A 122 -25.184 -3.339 -13.318 1.00 0.00 H new ATOM 0 HG SER A 122 -22.921 -2.973 -13.677 1.00 0.00 H new ATOM 1911 N SER A 123 -27.460 -1.475 -14.947 1.00 0.00 N ATOM 1912 CA SER A 123 -28.807 -1.020 -14.622 1.00 0.00 C ATOM 1913 C SER A 123 -29.528 -0.520 -15.870 1.00 0.00 C ATOM 1914 O SER A 123 -30.668 -0.898 -16.136 1.00 0.00 O ATOM 1915 CB SER A 123 -28.753 0.090 -13.571 1.00 0.00 C ATOM 1916 OG SER A 123 -28.604 -0.447 -12.268 1.00 0.00 O ATOM 0 H SER A 123 -26.782 -0.725 -15.081 1.00 0.00 H new ATOM 0 HA SER A 123 -29.362 -1.867 -14.218 1.00 0.00 H new ATOM 0 HB2 SER A 123 -27.922 0.761 -13.788 1.00 0.00 H new ATOM 0 HB3 SER A 123 -29.664 0.686 -13.620 1.00 0.00 H new ATOM 0 HG SER A 123 -28.570 0.283 -11.615 1.00 0.00 H new ATOM 1922 N GLY A 124 -28.853 0.334 -16.634 1.00 0.00 N ATOM 1923 CA GLY A 124 -29.443 0.873 -17.845 1.00 0.00 C ATOM 1924 C GLY A 124 -29.901 -0.212 -18.799 1.00 0.00 C ATOM 1925 O GLY A 124 -29.624 -1.392 -18.586 1.00 0.00 O ATOM 0 H GLY A 124 -27.908 0.662 -16.435 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -30.292 1.504 -17.582 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -28.716 1.511 -18.347 1.00 0.00 H new TER 1929 GLY A 124