USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1086 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 19 MET CE :methyl -123:sc= -0.0291 (180deg=-0.543) USER MOD Set 1.2: A 115 MET CE :methyl -117:sc= -5.56! (180deg=-7.63!) USER MOD Single : A 1 GLY N :NH3+ -106:sc= 0.0563 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN :FLIP amide:sc= -1.48 F(o=-2.2!,f=-1.5) USER MOD Single : A 10 GLN :FLIP amide:sc= -0.26 F(o=-2.4,f=-0.26) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 170:sc= 1 (180deg=0.907) USER MOD Single : A 31 GLN : amide:sc= -0.473 K(o=-0.47,f=-2.6!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= -1.12! USER MOD Single : A 42 SER OG : rot -140:sc= -0.474 USER MOD Single : A 44 ASN : amide:sc= -0.296 K(o=-0.3,f=-6.3!) USER MOD Single : A 55 LYS NZ :NH3+ -121:sc= 0.759 (180deg=-0.416) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot -94:sc= 0.236 USER MOD Single : A 83 ASN : amide:sc= -0.154 X(o=-0.15,f=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot -89:sc= 0.18 USER MOD Single : A 89 TYR OH : rot -98:sc= 0.285 USER MOD Single : A 91 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00795) USER MOD Single : A 92 THR OG1 : rot 77:sc= 0.209 USER MOD Single : A 93 THR OG1 : rot 69:sc= 0.549 USER MOD Single : A 94 HIS : no HD1:sc= -0.0467 X(o=-0.047,f=-0.23) USER MOD Single : A 95 ASN : amide:sc= -0.16 K(o=-0.16,f=-1.6) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -137:sc= 0.0023 USER MOD Single : A 108 GLN : amide:sc= -5.75! C(o=-5.8!,f=-11!) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.0063) USER MOD Single : A 112 TYR OH : rot -161:sc= 0.79 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot -55:sc=0.000866 USER MOD Single : A 119 SER OG : rot 33:sc= -1.71! USER MOD Single : A 120 TYR OH : rot 153:sc= 0.101 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 152:sc= -0.151 USER MOD Single : A 130 GLN : amide:sc= -0.103 K(o=-0.1,f=-0.96) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -31.389 10.061 8.523 1.00 0.00 N ATOM 2 CA GLY A 1 -32.664 10.295 7.870 1.00 0.00 C ATOM 3 C GLY A 1 -32.841 9.452 6.623 1.00 0.00 C ATOM 4 O GLY A 1 -31.864 8.993 6.032 1.00 0.00 O ATOM 0 H1 GLY A 1 -31.539 9.502 9.387 1.00 0.00 H new ATOM 0 H2 GLY A 1 -30.759 9.541 7.879 1.00 0.00 H new ATOM 0 H3 GLY A 1 -30.954 10.972 8.771 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -33.472 10.078 8.569 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -32.745 11.349 7.606 1.00 0.00 H new ATOM 8 N SER A 2 -34.092 9.245 6.223 1.00 0.00 N ATOM 9 CA SER A 2 -34.394 8.446 5.041 1.00 0.00 C ATOM 10 C SER A 2 -34.380 9.309 3.784 1.00 0.00 C ATOM 11 O SER A 2 -34.917 8.923 2.746 1.00 0.00 O ATOM 12 CB SER A 2 -35.757 7.768 5.193 1.00 0.00 C ATOM 13 OG SER A 2 -36.807 8.719 5.152 1.00 0.00 O ATOM 0 H SER A 2 -34.912 9.619 6.700 1.00 0.00 H new ATOM 0 HA SER A 2 -33.624 7.681 4.943 1.00 0.00 H new ATOM 0 HB2 SER A 2 -35.894 7.036 4.397 1.00 0.00 H new ATOM 0 HB3 SER A 2 -35.792 7.223 6.136 1.00 0.00 H new ATOM 0 HG SER A 2 -37.668 8.260 5.249 1.00 0.00 H new ATOM 19 N SER A 3 -33.760 10.481 3.885 1.00 0.00 N ATOM 20 CA SER A 3 -33.678 11.402 2.757 1.00 0.00 C ATOM 21 C SER A 3 -32.472 11.081 1.880 1.00 0.00 C ATOM 22 O SER A 3 -32.615 10.769 0.699 1.00 0.00 O ATOM 23 CB SER A 3 -33.590 12.845 3.256 1.00 0.00 C ATOM 24 OG SER A 3 -34.683 13.160 4.102 1.00 0.00 O ATOM 0 H SER A 3 -33.307 10.815 4.736 1.00 0.00 H new ATOM 0 HA SER A 3 -34.582 11.286 2.158 1.00 0.00 H new ATOM 0 HB2 SER A 3 -32.654 12.990 3.796 1.00 0.00 H new ATOM 0 HB3 SER A 3 -33.576 13.527 2.406 1.00 0.00 H new ATOM 0 HG SER A 3 -34.602 14.087 4.409 1.00 0.00 H new ATOM 30 N GLY A 4 -31.282 11.160 2.468 1.00 0.00 N ATOM 31 CA GLY A 4 -30.067 10.876 1.727 1.00 0.00 C ATOM 32 C GLY A 4 -28.820 11.317 2.466 1.00 0.00 C ATOM 33 O GLY A 4 -28.454 12.492 2.433 1.00 0.00 O ATOM 0 H GLY A 4 -31.138 11.416 3.445 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -30.008 9.806 1.528 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -30.109 11.378 0.760 1.00 0.00 H new ATOM 37 N SER A 5 -28.166 10.374 3.137 1.00 0.00 N ATOM 38 CA SER A 5 -26.955 10.674 3.892 1.00 0.00 C ATOM 39 C SER A 5 -25.712 10.260 3.112 1.00 0.00 C ATOM 40 O SER A 5 -25.646 9.158 2.566 1.00 0.00 O ATOM 41 CB SER A 5 -26.984 9.960 5.245 1.00 0.00 C ATOM 42 OG SER A 5 -27.974 10.514 6.094 1.00 0.00 O ATOM 0 H SER A 5 -28.454 9.396 3.173 1.00 0.00 H new ATOM 0 HA SER A 5 -26.916 11.751 4.057 1.00 0.00 H new ATOM 0 HB2 SER A 5 -27.182 8.899 5.095 1.00 0.00 H new ATOM 0 HB3 SER A 5 -26.007 10.038 5.722 1.00 0.00 H new ATOM 0 HG SER A 5 -27.973 10.039 6.951 1.00 0.00 H new ATOM 48 N SER A 6 -24.726 11.151 3.064 1.00 0.00 N ATOM 49 CA SER A 6 -23.485 10.880 2.348 1.00 0.00 C ATOM 50 C SER A 6 -22.282 11.388 3.136 1.00 0.00 C ATOM 51 O SER A 6 -22.404 12.286 3.968 1.00 0.00 O ATOM 52 CB SER A 6 -23.517 11.535 0.966 1.00 0.00 C ATOM 53 OG SER A 6 -23.794 12.921 1.064 1.00 0.00 O ATOM 0 H SER A 6 -24.763 12.066 3.512 1.00 0.00 H new ATOM 0 HA SER A 6 -23.390 9.801 2.229 1.00 0.00 H new ATOM 0 HB2 SER A 6 -22.559 11.387 0.468 1.00 0.00 H new ATOM 0 HB3 SER A 6 -24.275 11.052 0.349 1.00 0.00 H new ATOM 0 HG SER A 6 -23.807 13.316 0.167 1.00 0.00 H new ATOM 59 N GLY A 7 -21.117 10.805 2.867 1.00 0.00 N ATOM 60 CA GLY A 7 -19.907 11.210 3.559 1.00 0.00 C ATOM 61 C GLY A 7 -18.683 10.460 3.073 1.00 0.00 C ATOM 62 O GLY A 7 -18.063 10.846 2.081 1.00 0.00 O ATOM 0 H GLY A 7 -20.990 10.060 2.182 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -19.753 12.280 3.419 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -20.031 11.043 4.629 1.00 0.00 H new ATOM 66 N SER A 8 -18.332 9.386 3.773 1.00 0.00 N ATOM 67 CA SER A 8 -17.170 8.583 3.410 1.00 0.00 C ATOM 68 C SER A 8 -17.205 8.215 1.930 1.00 0.00 C ATOM 69 O SER A 8 -16.187 8.277 1.241 1.00 0.00 O ATOM 70 CB SER A 8 -17.115 7.314 4.262 1.00 0.00 C ATOM 71 OG SER A 8 -16.844 7.622 5.618 1.00 0.00 O ATOM 0 H SER A 8 -18.836 9.052 4.595 1.00 0.00 H new ATOM 0 HA SER A 8 -16.275 9.177 3.597 1.00 0.00 H new ATOM 0 HB2 SER A 8 -18.063 6.782 4.189 1.00 0.00 H new ATOM 0 HB3 SER A 8 -16.345 6.646 3.876 1.00 0.00 H new ATOM 0 HG SER A 8 -16.816 6.794 6.142 1.00 0.00 H new ATOM 77 N GLN A 9 -18.383 7.832 1.449 1.00 0.00 N ATOM 78 CA GLN A 9 -18.551 7.453 0.051 1.00 0.00 C ATOM 79 C GLN A 9 -17.763 8.385 -0.864 1.00 0.00 C ATOM 80 O GLN A 9 -17.134 7.940 -1.823 1.00 0.00 O ATOM 81 CB GLN A 9 -20.032 7.476 -0.331 1.00 0.00 C ATOM 82 CG GLN A 9 -20.282 7.238 -1.811 1.00 0.00 C ATOM 83 CD GLN A 9 -21.738 6.948 -2.118 1.00 0.00 C ATOM 84 OE1 GLN A 9 -21.977 5.978 -2.993 1.00 0.00 O flip ATOM 85 NE2 GLN A 9 -22.638 7.589 -1.575 1.00 0.00 N flip ATOM 0 H GLN A 9 -19.235 7.776 2.007 1.00 0.00 H new ATOM 0 HA GLN A 9 -18.167 6.441 -0.074 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.559 6.715 0.245 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.456 8.440 -0.050 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -19.963 8.115 -2.375 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -19.670 6.402 -2.149 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -22.408 8.326 -0.908 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.613 7.383 -1.792 1.00 0.00 H new ATOM 94 N GLN A 10 -17.804 9.678 -0.560 1.00 0.00 N ATOM 95 CA GLN A 10 -17.094 10.672 -1.356 1.00 0.00 C ATOM 96 C GLN A 10 -15.594 10.398 -1.358 1.00 0.00 C ATOM 97 O GLN A 10 -14.961 10.361 -2.413 1.00 0.00 O ATOM 98 CB GLN A 10 -17.368 12.077 -0.818 1.00 0.00 C ATOM 99 CG GLN A 10 -18.846 12.427 -0.754 1.00 0.00 C ATOM 100 CD GLN A 10 -19.595 12.028 -2.010 1.00 0.00 C ATOM 101 OE1 GLN A 10 -19.980 10.759 -2.091 1.00 0.00 O flip ATOM 102 NE2 GLN A 10 -19.826 12.849 -2.897 1.00 0.00 N flip ATOM 0 H GLN A 10 -18.321 10.062 0.231 1.00 0.00 H new ATOM 0 HA GLN A 10 -17.457 10.606 -2.382 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -16.939 12.165 0.180 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -16.858 12.805 -1.449 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -19.296 11.931 0.106 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -18.955 13.500 -0.596 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -19.512 13.814 -2.793 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -20.332 12.565 -3.736 1.00 0.00 H new ATOM 111 N ARG A 11 -15.031 10.208 -0.169 1.00 0.00 N ATOM 112 CA ARG A 11 -13.604 9.940 -0.033 1.00 0.00 C ATOM 113 C ARG A 11 -13.210 8.689 -0.814 1.00 0.00 C ATOM 114 O ARG A 11 -12.235 8.696 -1.565 1.00 0.00 O ATOM 115 CB ARG A 11 -13.234 9.771 1.441 1.00 0.00 C ATOM 116 CG ARG A 11 -12.834 11.071 2.121 1.00 0.00 C ATOM 117 CD ARG A 11 -14.052 11.855 2.583 1.00 0.00 C ATOM 118 NE ARG A 11 -13.751 12.706 3.732 1.00 0.00 N ATOM 119 CZ ARG A 11 -14.484 13.758 4.078 1.00 0.00 C ATOM 120 NH1 ARG A 11 -15.555 14.087 3.369 1.00 0.00 N ATOM 121 NH2 ARG A 11 -14.147 14.483 5.137 1.00 0.00 N ATOM 0 H ARG A 11 -15.541 10.235 0.714 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.059 10.790 -0.442 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.082 9.339 1.972 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -12.411 9.061 1.521 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.194 10.854 2.976 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.249 11.679 1.431 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -14.420 12.471 1.762 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -14.852 11.162 2.845 1.00 0.00 H new ATOM 0 HE ARG A 11 -12.934 12.480 4.299 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -15.818 13.531 2.555 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -16.116 14.896 3.638 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -13.325 14.232 5.686 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -14.710 15.291 5.402 1.00 0.00 H new ATOM 135 N VAL A 12 -13.974 7.617 -0.630 1.00 0.00 N ATOM 136 CA VAL A 12 -13.705 6.360 -1.318 1.00 0.00 C ATOM 137 C VAL A 12 -13.531 6.579 -2.816 1.00 0.00 C ATOM 138 O VAL A 12 -12.531 6.165 -3.403 1.00 0.00 O ATOM 139 CB VAL A 12 -14.838 5.341 -1.087 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.532 4.033 -1.801 1.00 0.00 C ATOM 141 CG2 VAL A 12 -15.050 5.109 0.401 1.00 0.00 C ATOM 0 H VAL A 12 -14.784 7.594 -0.010 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.779 5.964 -0.902 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.760 5.747 -1.503 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -15.342 3.325 -1.627 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.434 4.217 -2.871 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.600 3.618 -1.417 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.854 4.387 0.546 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -14.132 4.723 0.844 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.317 6.050 0.882 1.00 0.00 H new ATOM 151 N LYS A 13 -14.511 7.233 -3.431 1.00 0.00 N ATOM 152 CA LYS A 13 -14.466 7.510 -4.862 1.00 0.00 C ATOM 153 C LYS A 13 -13.210 8.294 -5.226 1.00 0.00 C ATOM 154 O LYS A 13 -12.499 7.943 -6.167 1.00 0.00 O ATOM 155 CB LYS A 13 -15.710 8.292 -5.290 1.00 0.00 C ATOM 156 CG LYS A 13 -15.880 8.389 -6.796 1.00 0.00 C ATOM 157 CD LYS A 13 -16.517 7.133 -7.367 1.00 0.00 C ATOM 158 CE LYS A 13 -16.730 7.250 -8.869 1.00 0.00 C ATOM 159 NZ LYS A 13 -18.038 7.882 -9.196 1.00 0.00 N ATOM 0 H LYS A 13 -15.346 7.581 -2.960 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.443 6.557 -5.390 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.593 7.816 -4.863 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.658 9.298 -4.873 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.498 9.254 -7.038 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -14.908 8.550 -7.263 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -15.882 6.273 -7.154 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.473 6.953 -6.876 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -15.923 7.839 -9.305 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -16.682 6.259 -9.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -18.145 7.944 -10.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.810 7.307 -8.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -18.074 8.837 -8.787 1.00 0.00 H new ATOM 173 N ARG A 14 -12.942 9.356 -4.473 1.00 0.00 N ATOM 174 CA ARG A 14 -11.771 10.190 -4.716 1.00 0.00 C ATOM 175 C ARG A 14 -10.540 9.331 -4.991 1.00 0.00 C ATOM 176 O ARG A 14 -9.789 9.589 -5.931 1.00 0.00 O ATOM 177 CB ARG A 14 -11.511 11.104 -3.518 1.00 0.00 C ATOM 178 CG ARG A 14 -12.365 12.362 -3.514 1.00 0.00 C ATOM 179 CD ARG A 14 -11.882 13.366 -4.549 1.00 0.00 C ATOM 180 NE ARG A 14 -12.841 14.449 -4.749 1.00 0.00 N ATOM 181 CZ ARG A 14 -13.878 14.369 -5.576 1.00 0.00 C ATOM 182 NH1 ARG A 14 -14.089 13.262 -6.274 1.00 0.00 N ATOM 183 NH2 ARG A 14 -14.707 15.397 -5.704 1.00 0.00 N ATOM 0 H ARG A 14 -13.520 9.659 -3.689 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.969 10.803 -5.595 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -11.696 10.547 -2.600 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.459 11.389 -3.511 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -13.403 12.099 -3.717 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -12.339 12.817 -2.524 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -10.926 13.782 -4.232 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -11.709 12.855 -5.496 1.00 0.00 H new ATOM 0 HE ARG A 14 -12.708 15.314 -4.225 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -13.455 12.469 -6.177 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -14.886 13.203 -6.908 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -14.549 16.250 -5.167 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -15.503 15.334 -6.339 1.00 0.00 H new ATOM 197 N TRP A 15 -10.341 8.311 -4.164 1.00 0.00 N ATOM 198 CA TRP A 15 -9.201 7.415 -4.318 1.00 0.00 C ATOM 199 C TRP A 15 -9.190 6.780 -5.704 1.00 0.00 C ATOM 200 O TRP A 15 -8.176 6.805 -6.400 1.00 0.00 O ATOM 201 CB TRP A 15 -9.234 6.325 -3.245 1.00 0.00 C ATOM 202 CG TRP A 15 -9.727 6.814 -1.916 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.639 8.086 -1.427 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.383 6.039 -0.907 1.00 0.00 C ATOM 205 NE1 TRP A 15 -10.200 8.148 -0.175 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.664 6.906 0.167 1.00 0.00 C ATOM 207 CE3 TRP A 15 -10.761 4.697 -0.807 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -11.305 6.472 1.324 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.397 4.269 0.343 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.664 5.154 1.396 1.00 0.00 C ATOM 0 H TRP A 15 -10.954 8.084 -3.381 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.291 8.003 -4.201 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -9.874 5.510 -3.584 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.232 5.914 -3.124 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.194 8.921 -1.948 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -10.261 8.984 0.406 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -10.560 4.007 -1.613 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -11.512 7.152 2.137 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -11.693 3.234 0.432 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -12.163 4.789 2.281 1.00 0.00 H new ATOM 221 N GLY A 16 -10.325 6.212 -6.099 1.00 0.00 N ATOM 222 CA GLY A 16 -10.423 5.579 -7.401 1.00 0.00 C ATOM 223 C GLY A 16 -9.681 6.347 -8.477 1.00 0.00 C ATOM 224 O GLY A 16 -9.280 5.777 -9.492 1.00 0.00 O ATOM 0 H GLY A 16 -11.178 6.179 -5.541 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.023 4.567 -7.340 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.473 5.491 -7.680 1.00 0.00 H new ATOM 228 N PHE A 17 -9.499 7.644 -8.256 1.00 0.00 N ATOM 229 CA PHE A 17 -8.802 8.493 -9.216 1.00 0.00 C ATOM 230 C PHE A 17 -7.293 8.278 -9.137 1.00 0.00 C ATOM 231 O PHE A 17 -6.514 9.065 -9.672 1.00 0.00 O ATOM 232 CB PHE A 17 -9.132 9.965 -8.962 1.00 0.00 C ATOM 233 CG PHE A 17 -10.556 10.323 -9.280 1.00 0.00 C ATOM 234 CD1 PHE A 17 -11.039 10.215 -10.573 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.411 10.769 -8.284 1.00 0.00 C ATOM 236 CE1 PHE A 17 -12.349 10.543 -10.869 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.721 11.099 -8.574 1.00 0.00 C ATOM 238 CZ PHE A 17 -13.191 10.987 -9.868 1.00 0.00 C ATOM 0 H PHE A 17 -9.824 8.131 -7.421 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.139 8.220 -10.216 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.932 10.199 -7.916 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.467 10.587 -9.561 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.384 9.870 -11.360 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -11.049 10.859 -7.270 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -12.714 10.452 -11.882 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -13.377 11.444 -7.789 1.00 0.00 H new ATOM 0 HZ PHE A 17 -14.214 11.246 -10.097 1.00 0.00 H new ATOM 248 N GLY A 18 -6.889 7.204 -8.465 1.00 0.00 N ATOM 249 CA GLY A 18 -5.476 6.904 -8.327 1.00 0.00 C ATOM 250 C GLY A 18 -5.040 6.816 -6.878 1.00 0.00 C ATOM 251 O GLY A 18 -5.798 7.165 -5.973 1.00 0.00 O ATOM 0 H GLY A 18 -7.515 6.537 -8.014 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.258 5.960 -8.827 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -4.893 7.674 -8.832 1.00 0.00 H new ATOM 255 N MET A 19 -3.816 6.347 -6.657 1.00 0.00 N ATOM 256 CA MET A 19 -3.282 6.214 -5.307 1.00 0.00 C ATOM 257 C MET A 19 -3.039 7.583 -4.680 1.00 0.00 C ATOM 258 O MET A 19 -3.342 7.802 -3.507 1.00 0.00 O ATOM 259 CB MET A 19 -1.980 5.411 -5.328 1.00 0.00 C ATOM 260 CG MET A 19 -1.615 4.809 -3.980 1.00 0.00 C ATOM 261 SD MET A 19 -0.596 3.330 -4.134 1.00 0.00 S ATOM 262 CE MET A 19 0.929 4.033 -4.759 1.00 0.00 C ATOM 0 H MET A 19 -3.176 6.053 -7.395 1.00 0.00 H new ATOM 0 HA MET A 19 -4.018 5.684 -4.703 1.00 0.00 H new ATOM 0 HB2 MET A 19 -2.068 4.610 -6.062 1.00 0.00 H new ATOM 0 HB3 MET A 19 -1.168 6.059 -5.659 1.00 0.00 H new ATOM 0 HG2 MET A 19 -1.083 5.552 -3.387 1.00 0.00 H new ATOM 0 HG3 MET A 19 -2.528 4.562 -3.437 1.00 0.00 H new ATOM 0 HE1 MET A 19 1.189 3.557 -5.704 1.00 0.00 H new ATOM 0 HE2 MET A 19 0.799 5.104 -4.916 1.00 0.00 H new ATOM 0 HE3 MET A 19 1.729 3.867 -4.037 1.00 0.00 H new ATOM 272 N ASP A 20 -2.491 8.501 -5.469 1.00 0.00 N ATOM 273 CA ASP A 20 -2.208 9.849 -4.992 1.00 0.00 C ATOM 274 C ASP A 20 -3.241 10.288 -3.960 1.00 0.00 C ATOM 275 O ASP A 20 -2.894 10.843 -2.918 1.00 0.00 O ATOM 276 CB ASP A 20 -2.187 10.834 -6.162 1.00 0.00 C ATOM 277 CG ASP A 20 -1.262 10.388 -7.277 1.00 0.00 C ATOM 278 OD1 ASP A 20 -1.706 9.599 -8.137 1.00 0.00 O ATOM 279 OD2 ASP A 20 -0.093 10.829 -7.290 1.00 0.00 O ATOM 0 H ASP A 20 -2.234 8.336 -6.442 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.227 9.841 -4.517 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.197 10.948 -6.555 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.872 11.814 -5.803 1.00 0.00 H new ATOM 284 N GLU A 21 -4.512 10.037 -4.258 1.00 0.00 N ATOM 285 CA GLU A 21 -5.596 10.408 -3.356 1.00 0.00 C ATOM 286 C GLU A 21 -5.576 9.546 -2.097 1.00 0.00 C ATOM 287 O GLU A 21 -5.745 10.047 -0.986 1.00 0.00 O ATOM 288 CB GLU A 21 -6.947 10.269 -4.061 1.00 0.00 C ATOM 289 CG GLU A 21 -7.274 11.431 -4.985 1.00 0.00 C ATOM 290 CD GLU A 21 -7.368 12.753 -4.248 1.00 0.00 C ATOM 291 OE1 GLU A 21 -8.111 12.821 -3.247 1.00 0.00 O ATOM 292 OE2 GLU A 21 -6.701 13.718 -4.673 1.00 0.00 O ATOM 0 H GLU A 21 -4.816 9.578 -5.117 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.452 11.449 -3.065 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.953 9.344 -4.638 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.732 10.181 -3.310 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.508 11.503 -5.757 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.219 11.233 -5.491 1.00 0.00 H new ATOM 299 N ALA A 22 -5.369 8.246 -2.281 1.00 0.00 N ATOM 300 CA ALA A 22 -5.325 7.314 -1.161 1.00 0.00 C ATOM 301 C ALA A 22 -4.138 7.606 -0.249 1.00 0.00 C ATOM 302 O ALA A 22 -4.206 7.394 0.962 1.00 0.00 O ATOM 303 CB ALA A 22 -5.262 5.881 -1.669 1.00 0.00 C ATOM 0 H ALA A 22 -5.229 7.815 -3.195 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.237 7.442 -0.578 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.230 5.196 -0.822 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.145 5.670 -2.273 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.367 5.749 -2.277 1.00 0.00 H new ATOM 309 N LEU A 23 -3.052 8.095 -0.838 1.00 0.00 N ATOM 310 CA LEU A 23 -1.849 8.416 -0.078 1.00 0.00 C ATOM 311 C LEU A 23 -2.060 9.663 0.775 1.00 0.00 C ATOM 312 O LEU A 23 -1.881 9.633 1.992 1.00 0.00 O ATOM 313 CB LEU A 23 -0.666 8.626 -1.024 1.00 0.00 C ATOM 314 CG LEU A 23 -0.412 7.511 -2.039 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.699 7.906 -3.000 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.066 6.211 -1.328 1.00 0.00 C ATOM 0 H LEU A 23 -2.980 8.278 -1.839 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.633 7.578 0.584 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -0.823 9.557 -1.569 1.00 0.00 H new ATOM 0 HB3 LEU A 23 0.235 8.756 -0.424 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.325 7.356 -2.615 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.865 7.100 -3.715 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.413 8.812 -3.535 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.616 8.090 -2.440 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.111 5.429 -2.066 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.832 6.353 -0.727 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.893 5.919 -0.681 1.00 0.00 H new ATOM 328 N LYS A 24 -2.445 10.758 0.128 1.00 0.00 N ATOM 329 CA LYS A 24 -2.684 12.015 0.826 1.00 0.00 C ATOM 330 C LYS A 24 -3.682 11.824 1.963 1.00 0.00 C ATOM 331 O LYS A 24 -3.584 12.476 3.003 1.00 0.00 O ATOM 332 CB LYS A 24 -3.204 13.073 -0.151 1.00 0.00 C ATOM 333 CG LYS A 24 -4.627 12.821 -0.620 1.00 0.00 C ATOM 334 CD LYS A 24 -5.140 13.962 -1.482 1.00 0.00 C ATOM 335 CE LYS A 24 -5.430 15.202 -0.650 1.00 0.00 C ATOM 336 NZ LYS A 24 -6.637 15.028 0.204 1.00 0.00 N ATOM 0 H LYS A 24 -2.598 10.800 -0.880 1.00 0.00 H new ATOM 0 HA LYS A 24 -1.738 12.353 1.249 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.156 14.052 0.327 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -2.545 13.109 -1.019 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.665 11.890 -1.186 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.279 12.695 0.244 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.402 14.201 -2.248 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.047 13.649 -1.999 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -4.569 15.426 -0.020 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.573 16.057 -1.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -6.705 15.820 0.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.487 15.009 -0.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.564 14.134 0.730 1.00 0.00 H new ATOM 350 N ASP A 25 -4.640 10.927 1.759 1.00 0.00 N ATOM 351 CA ASP A 25 -5.654 10.648 2.770 1.00 0.00 C ATOM 352 C ASP A 25 -5.225 9.491 3.666 1.00 0.00 C ATOM 353 O ASP A 25 -4.625 8.514 3.216 1.00 0.00 O ATOM 354 CB ASP A 25 -6.993 10.325 2.104 1.00 0.00 C ATOM 355 CG ASP A 25 -7.770 11.572 1.731 1.00 0.00 C ATOM 356 OD1 ASP A 25 -7.131 12.603 1.434 1.00 0.00 O ATOM 357 OD2 ASP A 25 -9.017 11.516 1.736 1.00 0.00 O ATOM 0 H ASP A 25 -4.736 10.381 0.903 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.770 11.538 3.388 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -6.816 9.730 1.208 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.593 9.715 2.779 1.00 0.00 H new ATOM 362 N PRO A 26 -5.538 9.600 4.965 1.00 0.00 N ATOM 363 CA PRO A 26 -5.194 8.572 5.952 1.00 0.00 C ATOM 364 C PRO A 26 -6.004 7.294 5.764 1.00 0.00 C ATOM 365 O PRO A 26 -5.446 6.199 5.693 1.00 0.00 O ATOM 366 CB PRO A 26 -5.541 9.233 7.289 1.00 0.00 C ATOM 367 CG PRO A 26 -6.584 10.242 6.953 1.00 0.00 C ATOM 368 CD PRO A 26 -6.253 10.736 5.572 1.00 0.00 C ATOM 0 HA PRO A 26 -4.152 8.263 5.872 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.914 8.502 8.007 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.666 9.703 7.737 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.579 9.798 6.981 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.580 11.061 7.672 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.152 10.991 5.011 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -5.632 11.631 5.604 1.00 0.00 H new ATOM 376 N VAL A 27 -7.323 7.441 5.684 1.00 0.00 N ATOM 377 CA VAL A 27 -8.209 6.298 5.503 1.00 0.00 C ATOM 378 C VAL A 27 -7.927 5.587 4.184 1.00 0.00 C ATOM 379 O VAL A 27 -7.856 4.360 4.130 1.00 0.00 O ATOM 380 CB VAL A 27 -9.689 6.724 5.537 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.596 5.527 5.297 1.00 0.00 C ATOM 382 CG2 VAL A 27 -10.019 7.396 6.861 1.00 0.00 C ATOM 0 H VAL A 27 -7.801 8.340 5.742 1.00 0.00 H new ATOM 0 HA VAL A 27 -8.016 5.614 6.330 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.860 7.444 4.737 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.637 5.848 5.325 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.376 5.093 4.321 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.426 4.780 6.073 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -11.068 7.691 6.868 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.832 6.700 7.679 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.393 8.280 6.986 1.00 0.00 H new ATOM 392 N GLY A 28 -7.765 6.368 3.120 1.00 0.00 N ATOM 393 CA GLY A 28 -7.492 5.795 1.814 1.00 0.00 C ATOM 394 C GLY A 28 -6.203 4.998 1.789 1.00 0.00 C ATOM 395 O GLY A 28 -6.064 4.054 1.011 1.00 0.00 O ATOM 0 H GLY A 28 -7.818 7.386 3.139 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.321 5.149 1.524 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.436 6.594 1.075 1.00 0.00 H new ATOM 399 N ARG A 29 -5.257 5.378 2.642 1.00 0.00 N ATOM 400 CA ARG A 29 -3.972 4.693 2.713 1.00 0.00 C ATOM 401 C ARG A 29 -4.133 3.295 3.305 1.00 0.00 C ATOM 402 O ARG A 29 -3.647 2.314 2.743 1.00 0.00 O ATOM 403 CB ARG A 29 -2.983 5.503 3.552 1.00 0.00 C ATOM 404 CG ARG A 29 -2.137 6.466 2.736 1.00 0.00 C ATOM 405 CD ARG A 29 -0.822 6.780 3.432 1.00 0.00 C ATOM 406 NE ARG A 29 0.130 7.431 2.536 1.00 0.00 N ATOM 407 CZ ARG A 29 1.196 8.103 2.959 1.00 0.00 C ATOM 408 NH1 ARG A 29 1.443 8.211 4.257 1.00 0.00 N ATOM 409 NH2 ARG A 29 2.016 8.667 2.082 1.00 0.00 N ATOM 0 H ARG A 29 -5.356 6.157 3.293 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.584 4.597 1.699 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.534 6.066 4.305 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.325 4.817 4.085 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.937 6.035 1.755 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -2.692 7.389 2.571 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.011 7.425 4.290 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.386 5.858 3.816 1.00 0.00 H new ATOM 0 HE ARG A 29 -0.032 7.366 1.531 1.00 0.00 H new ATOM 0 HH11 ARG A 29 0.814 7.778 4.934 1.00 0.00 H new ATOM 0 HH12 ARG A 29 2.262 8.727 4.579 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.829 8.585 1.083 1.00 0.00 H new ATOM 0 HH22 ARG A 29 2.834 9.183 2.407 1.00 0.00 H new ATOM 423 N GLU A 30 -4.817 3.215 4.442 1.00 0.00 N ATOM 424 CA GLU A 30 -5.040 1.938 5.110 1.00 0.00 C ATOM 425 C GLU A 30 -6.015 1.073 4.318 1.00 0.00 C ATOM 426 O GLU A 30 -5.795 -0.125 4.141 1.00 0.00 O ATOM 427 CB GLU A 30 -5.575 2.164 6.525 1.00 0.00 C ATOM 428 CG GLU A 30 -7.077 2.388 6.580 1.00 0.00 C ATOM 429 CD GLU A 30 -7.575 2.664 7.985 1.00 0.00 C ATOM 430 OE1 GLU A 30 -7.212 3.720 8.545 1.00 0.00 O ATOM 431 OE2 GLU A 30 -8.327 1.826 8.524 1.00 0.00 O ATOM 0 H GLU A 30 -5.226 4.018 4.919 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.085 1.417 5.170 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.322 1.302 7.142 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -5.071 3.027 6.961 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -7.339 3.226 5.934 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.586 1.509 6.184 1.00 0.00 H new ATOM 438 N GLN A 31 -7.094 1.689 3.844 1.00 0.00 N ATOM 439 CA GLN A 31 -8.104 0.974 3.072 1.00 0.00 C ATOM 440 C GLN A 31 -7.468 0.223 1.907 1.00 0.00 C ATOM 441 O GLN A 31 -7.549 -1.003 1.828 1.00 0.00 O ATOM 442 CB GLN A 31 -9.161 1.949 2.550 1.00 0.00 C ATOM 443 CG GLN A 31 -10.240 2.279 3.569 1.00 0.00 C ATOM 444 CD GLN A 31 -10.955 1.045 4.082 1.00 0.00 C ATOM 445 OE1 GLN A 31 -11.551 0.293 3.310 1.00 0.00 O ATOM 446 NE2 GLN A 31 -10.901 0.830 5.391 1.00 0.00 N ATOM 0 H GLN A 31 -7.291 2.680 3.981 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.582 0.248 3.730 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.671 2.872 2.240 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.629 1.524 1.662 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.791 2.810 4.409 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.967 2.954 3.117 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -10.396 1.479 5.994 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -11.365 0.016 5.794 1.00 0.00 H new ATOM 455 N PHE A 32 -6.836 0.966 1.005 1.00 0.00 N ATOM 456 CA PHE A 32 -6.187 0.370 -0.157 1.00 0.00 C ATOM 457 C PHE A 32 -5.197 -0.711 0.267 1.00 0.00 C ATOM 458 O PHE A 32 -5.050 -1.732 -0.405 1.00 0.00 O ATOM 459 CB PHE A 32 -5.467 1.446 -0.973 1.00 0.00 C ATOM 460 CG PHE A 32 -4.451 0.892 -1.931 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.832 0.014 -2.933 1.00 0.00 C ATOM 462 CD2 PHE A 32 -3.116 1.249 -1.829 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.899 -0.498 -3.815 1.00 0.00 C ATOM 464 CE2 PHE A 32 -2.179 0.740 -2.709 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.571 -0.133 -3.704 1.00 0.00 C ATOM 0 H PHE A 32 -6.759 1.982 1.056 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.957 -0.091 -0.776 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -6.205 2.022 -1.531 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.972 2.138 -0.291 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.869 -0.273 -3.026 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.804 1.933 -1.053 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.208 -1.183 -4.591 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -1.141 1.025 -2.618 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.841 -0.530 -4.394 1.00 0.00 H new ATOM 475 N LEU A 33 -4.521 -0.478 1.387 1.00 0.00 N ATOM 476 CA LEU A 33 -3.543 -1.431 1.902 1.00 0.00 C ATOM 477 C LEU A 33 -4.212 -2.751 2.270 1.00 0.00 C ATOM 478 O LEU A 33 -3.795 -3.818 1.819 1.00 0.00 O ATOM 479 CB LEU A 33 -2.830 -0.849 3.124 1.00 0.00 C ATOM 480 CG LEU A 33 -2.181 -1.862 4.068 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.746 -2.140 3.648 1.00 0.00 C ATOM 482 CD2 LEU A 33 -2.232 -1.362 5.504 1.00 0.00 C ATOM 0 H LEU A 33 -4.632 0.362 1.955 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.810 -1.622 1.118 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -2.059 -0.161 2.777 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.549 -0.261 3.694 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.742 -2.795 4.010 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -0.300 -2.863 4.331 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.735 -2.543 2.635 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -0.173 -1.213 3.676 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.766 -2.096 6.162 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.697 -0.415 5.579 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -3.270 -1.216 5.802 1.00 0.00 H new ATOM 494 N LYS A 34 -5.254 -2.672 3.092 1.00 0.00 N ATOM 495 CA LYS A 34 -5.984 -3.859 3.519 1.00 0.00 C ATOM 496 C LYS A 34 -6.064 -4.884 2.392 1.00 0.00 C ATOM 497 O LYS A 34 -5.685 -6.043 2.565 1.00 0.00 O ATOM 498 CB LYS A 34 -7.394 -3.479 3.976 1.00 0.00 C ATOM 499 CG LYS A 34 -7.414 -2.542 5.171 1.00 0.00 C ATOM 500 CD LYS A 34 -8.686 -2.703 5.986 1.00 0.00 C ATOM 501 CE LYS A 34 -8.648 -1.861 7.252 1.00 0.00 C ATOM 502 NZ LYS A 34 -9.894 -2.007 8.053 1.00 0.00 N ATOM 0 H LYS A 34 -5.611 -1.797 3.476 1.00 0.00 H new ATOM 0 HA LYS A 34 -5.445 -4.305 4.355 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.921 -3.008 3.146 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -7.942 -4.387 4.227 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.548 -2.739 5.803 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -7.329 -1.511 4.827 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -9.546 -2.414 5.381 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.820 -3.752 6.250 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.791 -2.154 7.858 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.507 -0.813 6.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -9.829 -1.418 8.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -10.710 -1.703 7.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -10.015 -3.003 8.328 1.00 0.00 H new ATOM 516 N PHE A 35 -6.556 -4.450 1.236 1.00 0.00 N ATOM 517 CA PHE A 35 -6.684 -5.330 0.081 1.00 0.00 C ATOM 518 C PHE A 35 -5.338 -5.948 -0.284 1.00 0.00 C ATOM 519 O PHE A 35 -5.243 -7.148 -0.544 1.00 0.00 O ATOM 520 CB PHE A 35 -7.245 -4.557 -1.115 1.00 0.00 C ATOM 521 CG PHE A 35 -7.083 -5.278 -2.423 1.00 0.00 C ATOM 522 CD1 PHE A 35 -7.779 -6.449 -2.675 1.00 0.00 C ATOM 523 CD2 PHE A 35 -6.234 -4.784 -3.401 1.00 0.00 C ATOM 524 CE1 PHE A 35 -7.632 -7.114 -3.878 1.00 0.00 C ATOM 525 CE2 PHE A 35 -6.084 -5.445 -4.606 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.783 -6.612 -4.844 1.00 0.00 C ATOM 0 H PHE A 35 -6.873 -3.494 1.075 1.00 0.00 H new ATOM 0 HA PHE A 35 -7.373 -6.133 0.342 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -8.304 -4.360 -0.946 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.747 -3.589 -1.178 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -8.444 -6.847 -1.923 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -5.684 -3.873 -3.220 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -8.181 -8.026 -4.062 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -5.421 -5.049 -5.361 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.666 -7.131 -5.784 1.00 0.00 H new ATOM 536 N LEU A 36 -4.299 -5.120 -0.302 1.00 0.00 N ATOM 537 CA LEU A 36 -2.957 -5.583 -0.635 1.00 0.00 C ATOM 538 C LEU A 36 -2.605 -6.843 0.150 1.00 0.00 C ATOM 539 O LEU A 36 -2.285 -7.879 -0.432 1.00 0.00 O ATOM 540 CB LEU A 36 -1.931 -4.486 -0.347 1.00 0.00 C ATOM 541 CG LEU A 36 -2.199 -3.129 -0.999 1.00 0.00 C ATOM 542 CD1 LEU A 36 -1.038 -2.178 -0.749 1.00 0.00 C ATOM 543 CD2 LEU A 36 -2.445 -3.293 -2.492 1.00 0.00 C ATOM 0 H LEU A 36 -4.361 -4.124 -0.090 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.936 -5.822 -1.698 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.874 -4.343 0.732 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.952 -4.837 -0.674 1.00 0.00 H new ATOM 0 HG LEU A 36 -3.095 -2.702 -0.549 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.246 -1.218 -1.220 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.909 -2.035 0.324 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.126 -2.599 -1.171 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.634 -2.317 -2.939 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.568 -3.742 -2.958 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.310 -3.938 -2.650 1.00 0.00 H new ATOM 555 N GLU A 37 -2.669 -6.746 1.474 1.00 0.00 N ATOM 556 CA GLU A 37 -2.358 -7.879 2.338 1.00 0.00 C ATOM 557 C GLU A 37 -2.962 -9.166 1.785 1.00 0.00 C ATOM 558 O GLU A 37 -2.345 -10.230 1.845 1.00 0.00 O ATOM 559 CB GLU A 37 -2.878 -7.626 3.755 1.00 0.00 C ATOM 560 CG GLU A 37 -2.263 -6.405 4.420 1.00 0.00 C ATOM 561 CD GLU A 37 -2.841 -6.138 5.796 1.00 0.00 C ATOM 562 OE1 GLU A 37 -4.083 -6.078 5.915 1.00 0.00 O ATOM 563 OE2 GLU A 37 -2.052 -5.988 6.752 1.00 0.00 O ATOM 0 H GLU A 37 -2.933 -5.896 1.971 1.00 0.00 H new ATOM 0 HA GLU A 37 -1.274 -7.991 2.371 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.960 -7.503 3.719 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.677 -8.504 4.369 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -1.185 -6.545 4.504 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.423 -5.532 3.787 1.00 0.00 H new ATOM 570 N SER A 38 -4.173 -9.062 1.248 1.00 0.00 N ATOM 571 CA SER A 38 -4.864 -10.218 0.688 1.00 0.00 C ATOM 572 C SER A 38 -4.080 -10.804 -0.482 1.00 0.00 C ATOM 573 O SER A 38 -3.835 -12.009 -0.536 1.00 0.00 O ATOM 574 CB SER A 38 -6.270 -9.826 0.230 1.00 0.00 C ATOM 575 OG SER A 38 -7.054 -10.973 -0.047 1.00 0.00 O ATOM 0 H SER A 38 -4.697 -8.189 1.189 1.00 0.00 H new ATOM 0 HA SER A 38 -4.942 -10.977 1.467 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.754 -9.229 1.002 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.205 -9.202 -0.661 1.00 0.00 H new ATOM 0 HG SER A 38 -7.948 -10.696 -0.336 1.00 0.00 H new ATOM 581 N GLU A 39 -3.691 -9.943 -1.417 1.00 0.00 N ATOM 582 CA GLU A 39 -2.936 -10.376 -2.587 1.00 0.00 C ATOM 583 C GLU A 39 -1.441 -10.421 -2.284 1.00 0.00 C ATOM 584 O GLU A 39 -0.617 -10.544 -3.189 1.00 0.00 O ATOM 585 CB GLU A 39 -3.201 -9.438 -3.767 1.00 0.00 C ATOM 586 CG GLU A 39 -2.488 -8.101 -3.654 1.00 0.00 C ATOM 587 CD GLU A 39 -3.209 -6.991 -4.394 1.00 0.00 C ATOM 588 OE1 GLU A 39 -3.234 -7.030 -5.642 1.00 0.00 O ATOM 589 OE2 GLU A 39 -3.748 -6.085 -3.726 1.00 0.00 O ATOM 0 H GLU A 39 -3.886 -8.942 -1.387 1.00 0.00 H new ATOM 0 HA GLU A 39 -3.266 -11.381 -2.850 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.889 -9.930 -4.688 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -4.274 -9.262 -3.847 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.395 -7.831 -2.602 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.477 -8.198 -4.049 1.00 0.00 H new ATOM 596 N PHE A 40 -1.100 -10.318 -1.003 1.00 0.00 N ATOM 597 CA PHE A 40 0.295 -10.346 -0.580 1.00 0.00 C ATOM 598 C PHE A 40 1.125 -9.343 -1.376 1.00 0.00 C ATOM 599 O PHE A 40 2.254 -9.632 -1.774 1.00 0.00 O ATOM 600 CB PHE A 40 0.874 -11.752 -0.748 1.00 0.00 C ATOM 601 CG PHE A 40 0.221 -12.541 -1.847 1.00 0.00 C ATOM 602 CD1 PHE A 40 -1.009 -13.147 -1.645 1.00 0.00 C ATOM 603 CD2 PHE A 40 0.837 -12.678 -3.080 1.00 0.00 C ATOM 604 CE1 PHE A 40 -1.613 -13.874 -2.654 1.00 0.00 C ATOM 605 CE2 PHE A 40 0.237 -13.403 -4.093 1.00 0.00 C ATOM 606 CZ PHE A 40 -0.988 -14.003 -3.879 1.00 0.00 C ATOM 0 H PHE A 40 -1.770 -10.215 -0.241 1.00 0.00 H new ATOM 0 HA PHE A 40 0.334 -10.069 0.473 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.942 -11.675 -0.952 1.00 0.00 H new ATOM 0 HB3 PHE A 40 0.767 -12.295 0.191 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -1.501 -13.050 -0.689 1.00 0.00 H new ATOM 0 HD2 PHE A 40 1.797 -12.213 -3.252 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -2.572 -14.340 -2.485 1.00 0.00 H new ATOM 0 HE2 PHE A 40 0.726 -13.500 -5.051 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.457 -14.572 -4.668 1.00 0.00 H new ATOM 616 N SER A 41 0.557 -8.164 -1.606 1.00 0.00 N ATOM 617 CA SER A 41 1.241 -7.119 -2.358 1.00 0.00 C ATOM 618 C SER A 41 1.461 -5.881 -1.493 1.00 0.00 C ATOM 619 O SER A 41 1.746 -4.797 -2.002 1.00 0.00 O ATOM 620 CB SER A 41 0.435 -6.747 -3.605 1.00 0.00 C ATOM 621 OG SER A 41 0.551 -7.746 -4.603 1.00 0.00 O ATOM 0 H SER A 41 -0.376 -7.908 -1.282 1.00 0.00 H new ATOM 0 HA SER A 41 2.214 -7.504 -2.664 1.00 0.00 H new ATOM 0 HB2 SER A 41 -0.614 -6.615 -3.338 1.00 0.00 H new ATOM 0 HB3 SER A 41 0.787 -5.793 -3.998 1.00 0.00 H new ATOM 0 HG SER A 41 0.026 -7.486 -5.389 1.00 0.00 H new ATOM 627 N SER A 42 1.326 -6.052 -0.182 1.00 0.00 N ATOM 628 CA SER A 42 1.506 -4.949 0.755 1.00 0.00 C ATOM 629 C SER A 42 2.965 -4.506 0.798 1.00 0.00 C ATOM 630 O SER A 42 3.260 -3.315 0.896 1.00 0.00 O ATOM 631 CB SER A 42 1.044 -5.361 2.154 1.00 0.00 C ATOM 632 OG SER A 42 -0.340 -5.115 2.327 1.00 0.00 O ATOM 0 H SER A 42 1.093 -6.943 0.255 1.00 0.00 H new ATOM 0 HA SER A 42 0.900 -4.110 0.412 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.251 -6.420 2.312 1.00 0.00 H new ATOM 0 HB3 SER A 42 1.611 -4.810 2.904 1.00 0.00 H new ATOM 0 HG SER A 42 -0.500 -4.766 3.229 1.00 0.00 H new ATOM 638 N GLU A 43 3.874 -5.473 0.726 1.00 0.00 N ATOM 639 CA GLU A 43 5.302 -5.183 0.758 1.00 0.00 C ATOM 640 C GLU A 43 5.628 -3.961 -0.096 1.00 0.00 C ATOM 641 O GLU A 43 6.321 -3.047 0.349 1.00 0.00 O ATOM 642 CB GLU A 43 6.102 -6.391 0.265 1.00 0.00 C ATOM 643 CG GLU A 43 5.587 -7.719 0.794 1.00 0.00 C ATOM 644 CD GLU A 43 5.504 -7.751 2.308 1.00 0.00 C ATOM 645 OE1 GLU A 43 5.086 -6.734 2.900 1.00 0.00 O ATOM 646 OE2 GLU A 43 5.858 -8.792 2.900 1.00 0.00 O ATOM 0 H GLU A 43 3.647 -6.464 0.645 1.00 0.00 H new ATOM 0 HA GLU A 43 5.580 -4.969 1.790 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.080 -6.410 -0.825 1.00 0.00 H new ATOM 0 HB3 GLU A 43 7.144 -6.271 0.561 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.600 -7.914 0.375 1.00 0.00 H new ATOM 0 HG3 GLU A 43 6.242 -8.521 0.453 1.00 0.00 H new ATOM 653 N ASN A 44 5.123 -3.954 -1.326 1.00 0.00 N ATOM 654 CA ASN A 44 5.361 -2.845 -2.243 1.00 0.00 C ATOM 655 C ASN A 44 5.112 -1.506 -1.555 1.00 0.00 C ATOM 656 O ASN A 44 5.990 -0.644 -1.513 1.00 0.00 O ATOM 657 CB ASN A 44 4.463 -2.973 -3.475 1.00 0.00 C ATOM 658 CG ASN A 44 4.551 -4.346 -4.114 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.068 -5.289 -3.516 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.044 -4.463 -5.336 1.00 0.00 N ATOM 0 H ASN A 44 4.547 -4.703 -1.710 1.00 0.00 H new ATOM 0 HA ASN A 44 6.404 -2.883 -2.556 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.430 -2.773 -3.191 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.745 -2.216 -4.207 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.074 -5.362 -5.817 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.625 -3.654 -5.794 1.00 0.00 H new ATOM 667 N LEU A 45 3.909 -1.339 -1.017 1.00 0.00 N ATOM 668 CA LEU A 45 3.543 -0.106 -0.330 1.00 0.00 C ATOM 669 C LEU A 45 4.344 0.059 0.958 1.00 0.00 C ATOM 670 O LEU A 45 5.000 1.080 1.166 1.00 0.00 O ATOM 671 CB LEU A 45 2.045 -0.099 -0.016 1.00 0.00 C ATOM 672 CG LEU A 45 1.523 1.126 0.737 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.447 2.329 -0.190 1.00 0.00 C ATOM 674 CD2 LEU A 45 0.161 0.834 1.349 1.00 0.00 C ATOM 0 H LEU A 45 3.171 -2.042 -1.043 1.00 0.00 H new ATOM 0 HA LEU A 45 3.774 0.730 -0.990 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.497 -0.185 -0.954 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.813 -0.988 0.571 1.00 0.00 H new ATOM 0 HG LEU A 45 2.219 1.358 1.543 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.074 3.191 0.363 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.440 2.551 -0.581 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.773 2.109 -1.017 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.196 1.716 1.881 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.545 0.576 0.559 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.246 0.000 2.046 1.00 0.00 H new ATOM 686 N ARG A 46 4.289 -0.954 1.817 1.00 0.00 N ATOM 687 CA ARG A 46 5.011 -0.922 3.083 1.00 0.00 C ATOM 688 C ARG A 46 6.354 -0.216 2.925 1.00 0.00 C ATOM 689 O ARG A 46 6.680 0.698 3.683 1.00 0.00 O ATOM 690 CB ARG A 46 5.227 -2.342 3.607 1.00 0.00 C ATOM 691 CG ARG A 46 3.958 -3.002 4.121 1.00 0.00 C ATOM 692 CD ARG A 46 3.714 -2.674 5.586 1.00 0.00 C ATOM 693 NE ARG A 46 3.551 -1.240 5.807 1.00 0.00 N ATOM 694 CZ ARG A 46 4.508 -0.458 6.295 1.00 0.00 C ATOM 695 NH1 ARG A 46 5.689 -0.970 6.612 1.00 0.00 N ATOM 696 NH2 ARG A 46 4.284 0.838 6.467 1.00 0.00 N ATOM 0 H ARG A 46 3.752 -1.807 1.659 1.00 0.00 H new ATOM 0 HA ARG A 46 4.410 -0.365 3.802 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.647 -2.954 2.809 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.963 -2.316 4.410 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.107 -2.670 3.526 1.00 0.00 H new ATOM 0 HG3 ARG A 46 4.032 -4.082 3.996 1.00 0.00 H new ATOM 0 HD2 ARG A 46 2.822 -3.197 5.931 1.00 0.00 H new ATOM 0 HD3 ARG A 46 4.549 -3.040 6.183 1.00 0.00 H new ATOM 0 HE ARG A 46 2.653 -0.815 5.574 1.00 0.00 H new ATOM 0 HH11 ARG A 46 5.865 -1.966 6.481 1.00 0.00 H new ATOM 0 HH12 ARG A 46 6.422 -0.368 6.986 1.00 0.00 H new ATOM 0 HH21 ARG A 46 3.376 1.235 6.225 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.019 1.437 6.842 1.00 0.00 H new ATOM 710 N PHE A 47 7.130 -0.646 1.936 1.00 0.00 N ATOM 711 CA PHE A 47 8.439 -0.057 1.680 1.00 0.00 C ATOM 712 C PHE A 47 8.310 1.421 1.325 1.00 0.00 C ATOM 713 O PHE A 47 9.092 2.252 1.787 1.00 0.00 O ATOM 714 CB PHE A 47 9.146 -0.805 0.547 1.00 0.00 C ATOM 715 CG PHE A 47 10.236 -0.008 -0.110 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.298 0.482 0.634 1.00 0.00 C ATOM 717 CD2 PHE A 47 10.199 0.252 -1.470 1.00 0.00 C ATOM 718 CE1 PHE A 47 12.302 1.217 0.032 1.00 0.00 C ATOM 719 CE2 PHE A 47 11.201 0.986 -2.078 1.00 0.00 C ATOM 720 CZ PHE A 47 12.254 1.468 -1.326 1.00 0.00 C ATOM 0 H PHE A 47 6.875 -1.400 1.299 1.00 0.00 H new ATOM 0 HA PHE A 47 9.033 -0.144 2.590 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.570 -1.729 0.941 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.410 -1.088 -0.205 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.341 0.287 1.695 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.378 -0.123 -2.063 1.00 0.00 H new ATOM 0 HE1 PHE A 47 13.123 1.595 0.623 1.00 0.00 H new ATOM 0 HE2 PHE A 47 11.160 1.182 -3.139 1.00 0.00 H new ATOM 0 HZ PHE A 47 13.039 2.040 -1.798 1.00 0.00 H new ATOM 730 N TRP A 48 7.319 1.741 0.501 1.00 0.00 N ATOM 731 CA TRP A 48 7.087 3.119 0.083 1.00 0.00 C ATOM 732 C TRP A 48 6.896 4.030 1.291 1.00 0.00 C ATOM 733 O TRP A 48 7.675 4.958 1.510 1.00 0.00 O ATOM 734 CB TRP A 48 5.862 3.198 -0.829 1.00 0.00 C ATOM 735 CG TRP A 48 5.714 4.524 -1.512 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.490 5.017 -2.522 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.731 5.526 -1.233 1.00 0.00 C ATOM 738 NE1 TRP A 48 6.049 6.265 -2.888 1.00 0.00 N ATOM 739 CE2 TRP A 48 4.970 6.601 -2.112 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.671 5.621 -0.327 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.188 7.753 -2.110 1.00 0.00 C ATOM 742 CZ3 TRP A 48 2.896 6.765 -0.326 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.157 7.818 -1.213 1.00 0.00 C ATOM 0 H TRP A 48 6.663 1.065 0.109 1.00 0.00 H new ATOM 0 HA TRP A 48 7.964 3.457 -0.469 1.00 0.00 H new ATOM 0 HB2 TRP A 48 5.929 2.414 -1.584 1.00 0.00 H new ATOM 0 HB3 TRP A 48 4.966 2.999 -0.241 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.328 4.501 -2.968 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.458 6.847 -3.619 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.461 4.815 0.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.388 8.566 -2.792 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.075 6.849 0.370 1.00 0.00 H new ATOM 0 HH2 TRP A 48 2.532 8.698 -1.188 1.00 0.00 H new ATOM 754 N LEU A 49 5.857 3.758 2.072 1.00 0.00 N ATOM 755 CA LEU A 49 5.564 4.554 3.260 1.00 0.00 C ATOM 756 C LEU A 49 6.801 4.690 4.142 1.00 0.00 C ATOM 757 O LEU A 49 7.132 5.783 4.600 1.00 0.00 O ATOM 758 CB LEU A 49 4.423 3.917 4.055 1.00 0.00 C ATOM 759 CG LEU A 49 3.027 4.043 3.444 1.00 0.00 C ATOM 760 CD1 LEU A 49 2.036 3.166 4.193 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.570 5.495 3.453 1.00 0.00 C ATOM 0 H LEU A 49 5.203 2.993 1.905 1.00 0.00 H new ATOM 0 HA LEU A 49 5.261 5.550 2.936 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.646 2.858 4.187 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.405 4.365 5.048 1.00 0.00 H new ATOM 0 HG LEU A 49 3.072 3.703 2.409 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.048 3.268 3.744 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.355 2.125 4.135 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.994 3.475 5.238 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.575 5.566 3.015 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.541 5.861 4.479 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.266 6.099 2.872 1.00 0.00 H new ATOM 773 N ALA A 50 7.481 3.572 4.376 1.00 0.00 N ATOM 774 CA ALA A 50 8.683 3.567 5.200 1.00 0.00 C ATOM 775 C ALA A 50 9.560 4.777 4.899 1.00 0.00 C ATOM 776 O ALA A 50 9.894 5.554 5.794 1.00 0.00 O ATOM 777 CB ALA A 50 9.465 2.280 4.985 1.00 0.00 C ATOM 0 H ALA A 50 7.219 2.658 4.006 1.00 0.00 H new ATOM 0 HA ALA A 50 8.377 3.623 6.245 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.360 2.290 5.607 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.844 1.427 5.257 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.752 2.200 3.937 1.00 0.00 H new ATOM 783 N VAL A 51 9.931 4.933 3.632 1.00 0.00 N ATOM 784 CA VAL A 51 10.770 6.049 3.212 1.00 0.00 C ATOM 785 C VAL A 51 10.121 7.384 3.560 1.00 0.00 C ATOM 786 O VAL A 51 10.729 8.227 4.220 1.00 0.00 O ATOM 787 CB VAL A 51 11.047 6.005 1.698 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.884 7.202 1.273 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.736 4.702 1.321 1.00 0.00 C ATOM 0 H VAL A 51 9.663 4.300 2.878 1.00 0.00 H new ATOM 0 HA VAL A 51 11.714 5.955 3.749 1.00 0.00 H new ATOM 0 HB VAL A 51 10.094 6.052 1.170 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.070 7.154 0.200 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.349 8.122 1.508 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.834 7.189 1.806 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.924 4.687 0.248 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.682 4.622 1.857 1.00 0.00 H new ATOM 0 HG23 VAL A 51 11.096 3.861 1.588 1.00 0.00 H new ATOM 799 N GLU A 52 8.883 7.570 3.112 1.00 0.00 N ATOM 800 CA GLU A 52 8.153 8.803 3.376 1.00 0.00 C ATOM 801 C GLU A 52 8.403 9.290 4.801 1.00 0.00 C ATOM 802 O GLU A 52 8.640 10.476 5.031 1.00 0.00 O ATOM 803 CB GLU A 52 6.654 8.592 3.154 1.00 0.00 C ATOM 804 CG GLU A 52 6.215 8.812 1.716 1.00 0.00 C ATOM 805 CD GLU A 52 6.636 10.165 1.178 1.00 0.00 C ATOM 806 OE1 GLU A 52 6.752 11.114 1.981 1.00 0.00 O ATOM 807 OE2 GLU A 52 6.850 10.275 -0.048 1.00 0.00 O ATOM 0 H GLU A 52 8.365 6.882 2.565 1.00 0.00 H new ATOM 0 HA GLU A 52 8.513 9.563 2.682 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.390 7.578 3.455 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.100 9.271 3.802 1.00 0.00 H new ATOM 0 HG2 GLU A 52 6.637 8.028 1.087 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.131 8.722 1.653 1.00 0.00 H new ATOM 814 N ASP A 53 8.349 8.365 5.753 1.00 0.00 N ATOM 815 CA ASP A 53 8.570 8.698 7.155 1.00 0.00 C ATOM 816 C ASP A 53 10.045 8.982 7.420 1.00 0.00 C ATOM 817 O ASP A 53 10.388 9.917 8.145 1.00 0.00 O ATOM 818 CB ASP A 53 8.088 7.559 8.055 1.00 0.00 C ATOM 819 CG ASP A 53 7.686 8.041 9.435 1.00 0.00 C ATOM 820 OD1 ASP A 53 8.580 8.457 10.202 1.00 0.00 O ATOM 821 OD2 ASP A 53 6.478 8.003 9.748 1.00 0.00 O ATOM 0 H ASP A 53 8.154 7.379 5.579 1.00 0.00 H new ATOM 0 HA ASP A 53 7.998 9.597 7.383 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.239 7.063 7.585 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.879 6.815 8.149 1.00 0.00 H new ATOM 826 N LEU A 54 10.914 8.169 6.830 1.00 0.00 N ATOM 827 CA LEU A 54 12.354 8.332 7.002 1.00 0.00 C ATOM 828 C LEU A 54 12.733 9.809 7.052 1.00 0.00 C ATOM 829 O LEU A 54 13.495 10.236 7.919 1.00 0.00 O ATOM 830 CB LEU A 54 13.105 7.639 5.864 1.00 0.00 C ATOM 831 CG LEU A 54 14.632 7.698 5.934 1.00 0.00 C ATOM 832 CD1 LEU A 54 15.143 6.895 7.120 1.00 0.00 C ATOM 833 CD2 LEU A 54 15.245 7.189 4.638 1.00 0.00 C ATOM 0 H LEU A 54 10.647 7.390 6.228 1.00 0.00 H new ATOM 0 HA LEU A 54 12.636 7.871 7.949 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.802 6.592 5.840 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.787 8.084 4.921 1.00 0.00 H new ATOM 0 HG LEU A 54 14.931 8.737 6.070 1.00 0.00 H new ATOM 0 HD11 LEU A 54 16.231 6.948 7.154 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.731 7.305 8.042 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.834 5.855 7.016 1.00 0.00 H new ATOM 0 HD21 LEU A 54 16.332 7.238 4.706 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.938 6.156 4.471 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.905 7.807 3.807 1.00 0.00 H new ATOM 845 N LYS A 55 12.193 10.584 6.118 1.00 0.00 N ATOM 846 CA LYS A 55 12.471 12.014 6.056 1.00 0.00 C ATOM 847 C LYS A 55 12.024 12.711 7.337 1.00 0.00 C ATOM 848 O LYS A 55 12.782 13.472 7.939 1.00 0.00 O ATOM 849 CB LYS A 55 11.767 12.640 4.850 1.00 0.00 C ATOM 850 CG LYS A 55 12.529 12.473 3.547 1.00 0.00 C ATOM 851 CD LYS A 55 12.265 11.117 2.915 1.00 0.00 C ATOM 852 CE LYS A 55 10.937 11.096 2.174 1.00 0.00 C ATOM 853 NZ LYS A 55 10.952 11.992 0.985 1.00 0.00 N ATOM 0 H LYS A 55 11.560 10.246 5.393 1.00 0.00 H new ATOM 0 HA LYS A 55 13.548 12.145 5.948 1.00 0.00 H new ATOM 0 HB2 LYS A 55 10.779 12.192 4.744 1.00 0.00 H new ATOM 0 HB3 LYS A 55 11.616 13.703 5.039 1.00 0.00 H new ATOM 0 HG2 LYS A 55 12.240 13.261 2.852 1.00 0.00 H new ATOM 0 HG3 LYS A 55 13.597 12.587 3.732 1.00 0.00 H new ATOM 0 HD2 LYS A 55 13.072 10.873 2.224 1.00 0.00 H new ATOM 0 HD3 LYS A 55 12.264 10.348 3.688 1.00 0.00 H new ATOM 0 HE2 LYS A 55 10.713 10.077 1.858 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.139 11.403 2.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 10.203 12.707 1.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 11.876 12.465 0.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 10.787 11.431 0.125 1.00 0.00 H new ATOM 867 N LYS A 56 10.789 12.446 7.749 1.00 0.00 N ATOM 868 CA LYS A 56 10.241 13.045 8.960 1.00 0.00 C ATOM 869 C LYS A 56 11.104 12.709 10.172 1.00 0.00 C ATOM 870 O LYS A 56 11.321 13.551 11.044 1.00 0.00 O ATOM 871 CB LYS A 56 8.808 12.560 9.191 1.00 0.00 C ATOM 872 CG LYS A 56 7.853 12.930 8.069 1.00 0.00 C ATOM 873 CD LYS A 56 7.327 14.346 8.230 1.00 0.00 C ATOM 874 CE LYS A 56 6.516 14.781 7.019 1.00 0.00 C ATOM 875 NZ LYS A 56 5.701 15.995 7.303 1.00 0.00 N ATOM 0 H LYS A 56 10.148 11.820 7.262 1.00 0.00 H new ATOM 0 HA LYS A 56 10.235 14.127 8.829 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.815 11.476 9.309 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.437 12.980 10.126 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.363 12.837 7.110 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.018 12.230 8.055 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.707 14.405 9.125 1.00 0.00 H new ATOM 0 HD3 LYS A 56 8.162 15.031 8.375 1.00 0.00 H new ATOM 0 HE2 LYS A 56 7.188 14.982 6.185 1.00 0.00 H new ATOM 0 HE3 LYS A 56 5.860 13.967 6.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 5.163 16.259 6.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 5.041 15.796 8.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.329 16.779 7.573 1.00 0.00 H new ATOM 889 N ARG A 57 11.594 11.475 10.220 1.00 0.00 N ATOM 890 CA ARG A 57 12.434 11.028 11.325 1.00 0.00 C ATOM 891 C ARG A 57 13.592 11.995 11.553 1.00 0.00 C ATOM 892 O ARG A 57 14.058 12.672 10.636 1.00 0.00 O ATOM 893 CB ARG A 57 12.975 9.624 11.047 1.00 0.00 C ATOM 894 CG ARG A 57 11.920 8.534 11.149 1.00 0.00 C ATOM 895 CD ARG A 57 11.448 8.348 12.582 1.00 0.00 C ATOM 896 NE ARG A 57 10.305 9.200 12.898 1.00 0.00 N ATOM 897 CZ ARG A 57 9.862 9.408 14.132 1.00 0.00 C ATOM 898 NH1 ARG A 57 10.462 8.828 15.162 1.00 0.00 N ATOM 899 NH2 ARG A 57 8.815 10.197 14.339 1.00 0.00 N ATOM 0 H ARG A 57 11.424 10.766 9.506 1.00 0.00 H new ATOM 0 HA ARG A 57 11.822 11.002 12.226 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.412 9.603 10.049 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.779 9.407 11.751 1.00 0.00 H new ATOM 0 HG2 ARG A 57 11.070 8.788 10.515 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.328 7.595 10.774 1.00 0.00 H new ATOM 0 HD2 ARG A 57 11.177 7.304 12.742 1.00 0.00 H new ATOM 0 HD3 ARG A 57 12.267 8.573 13.265 1.00 0.00 H new ATOM 0 HE ARG A 57 9.820 9.661 12.128 1.00 0.00 H new ATOM 0 HH11 ARG A 57 11.266 8.220 15.007 1.00 0.00 H new ATOM 0 HH12 ARG A 57 10.119 8.990 16.109 1.00 0.00 H new ATOM 0 HH21 ARG A 57 8.350 10.644 13.549 1.00 0.00 H new ATOM 0 HH22 ARG A 57 8.476 10.356 15.288 1.00 0.00 H new ATOM 913 N PRO A 58 14.070 12.062 12.804 1.00 0.00 N ATOM 914 CA PRO A 58 15.179 12.943 13.182 1.00 0.00 C ATOM 915 C PRO A 58 16.509 12.484 12.595 1.00 0.00 C ATOM 916 O PRO A 58 16.643 11.341 12.157 1.00 0.00 O ATOM 917 CB PRO A 58 15.206 12.844 14.710 1.00 0.00 C ATOM 918 CG PRO A 58 14.596 11.519 15.014 1.00 0.00 C ATOM 919 CD PRO A 58 13.563 11.284 13.947 1.00 0.00 C ATOM 0 HA PRO A 58 15.039 13.958 12.810 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.224 12.908 15.093 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.641 13.655 15.169 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.350 10.732 15.008 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.141 11.517 16.005 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.471 10.226 13.703 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.577 11.626 14.260 1.00 0.00 H new ATOM 927 N ILE A 59 17.490 13.381 12.591 1.00 0.00 N ATOM 928 CA ILE A 59 18.810 13.066 12.059 1.00 0.00 C ATOM 929 C ILE A 59 19.414 11.857 12.766 1.00 0.00 C ATOM 930 O ILE A 59 20.219 11.126 12.190 1.00 0.00 O ATOM 931 CB ILE A 59 19.772 14.261 12.196 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.017 14.043 11.334 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.159 14.464 13.654 1.00 0.00 C ATOM 934 CD1 ILE A 59 21.955 12.991 11.882 1.00 0.00 C ATOM 0 H ILE A 59 17.395 14.331 12.950 1.00 0.00 H new ATOM 0 HA ILE A 59 18.677 12.836 11.002 1.00 0.00 H new ATOM 0 HB ILE A 59 19.264 15.160 11.846 1.00 0.00 H new ATOM 0 HG12 ILE A 59 20.707 13.754 10.330 1.00 0.00 H new ATOM 0 HG13 ILE A 59 21.556 14.986 11.243 1.00 0.00 H new ATOM 0 HG21 ILE A 59 20.839 15.312 13.735 1.00 0.00 H new ATOM 0 HG22 ILE A 59 19.264 14.659 14.244 1.00 0.00 H new ATOM 0 HG23 ILE A 59 20.652 13.567 14.028 1.00 0.00 H new ATOM 0 HD11 ILE A 59 22.815 12.890 11.220 1.00 0.00 H new ATOM 0 HD12 ILE A 59 22.294 13.287 12.875 1.00 0.00 H new ATOM 0 HD13 ILE A 59 21.433 12.036 11.947 1.00 0.00 H new ATOM 946 N LYS A 60 19.017 11.652 14.018 1.00 0.00 N ATOM 947 CA LYS A 60 19.516 10.531 14.804 1.00 0.00 C ATOM 948 C LYS A 60 18.911 9.216 14.322 1.00 0.00 C ATOM 949 O LYS A 60 19.542 8.164 14.409 1.00 0.00 O ATOM 950 CB LYS A 60 19.196 10.738 16.286 1.00 0.00 C ATOM 951 CG LYS A 60 17.708 10.771 16.589 1.00 0.00 C ATOM 952 CD LYS A 60 17.392 11.717 17.735 1.00 0.00 C ATOM 953 CE LYS A 60 18.362 11.534 18.892 1.00 0.00 C ATOM 954 NZ LYS A 60 17.754 11.931 20.193 1.00 0.00 N ATOM 0 H LYS A 60 18.351 12.248 14.509 1.00 0.00 H new ATOM 0 HA LYS A 60 20.597 10.482 14.675 1.00 0.00 H new ATOM 0 HB2 LYS A 60 19.658 9.938 16.864 1.00 0.00 H new ATOM 0 HB3 LYS A 60 19.647 11.673 16.619 1.00 0.00 H new ATOM 0 HG2 LYS A 60 17.162 11.082 15.699 1.00 0.00 H new ATOM 0 HG3 LYS A 60 17.365 9.767 16.840 1.00 0.00 H new ATOM 0 HD2 LYS A 60 17.437 12.747 17.381 1.00 0.00 H new ATOM 0 HD3 LYS A 60 16.373 11.543 18.082 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.676 10.491 18.941 1.00 0.00 H new ATOM 0 HE3 LYS A 60 19.258 12.129 18.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 18.446 11.792 20.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 17.477 12.933 20.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 16.914 11.346 20.376 1.00 0.00 H new ATOM 968 N GLU A 61 17.685 9.286 13.813 1.00 0.00 N ATOM 969 CA GLU A 61 16.996 8.100 13.317 1.00 0.00 C ATOM 970 C GLU A 61 16.965 8.088 11.791 1.00 0.00 C ATOM 971 O GLU A 61 16.278 7.270 11.180 1.00 0.00 O ATOM 972 CB GLU A 61 15.569 8.044 13.868 1.00 0.00 C ATOM 973 CG GLU A 61 15.501 7.713 15.349 1.00 0.00 C ATOM 974 CD GLU A 61 16.313 6.485 15.710 1.00 0.00 C ATOM 975 OE1 GLU A 61 16.190 5.464 15.002 1.00 0.00 O ATOM 976 OE2 GLU A 61 17.071 6.544 16.701 1.00 0.00 O ATOM 0 H GLU A 61 17.149 10.150 13.733 1.00 0.00 H new ATOM 0 HA GLU A 61 17.544 7.222 13.659 1.00 0.00 H new ATOM 0 HB2 GLU A 61 15.084 9.005 13.697 1.00 0.00 H new ATOM 0 HB3 GLU A 61 15.003 7.298 13.311 1.00 0.00 H new ATOM 0 HG2 GLU A 61 15.862 8.565 15.925 1.00 0.00 H new ATOM 0 HG3 GLU A 61 14.461 7.553 15.634 1.00 0.00 H new ATOM 983 N VAL A 62 17.714 9.001 11.183 1.00 0.00 N ATOM 984 CA VAL A 62 17.774 9.096 9.729 1.00 0.00 C ATOM 985 C VAL A 62 18.615 7.970 9.139 1.00 0.00 C ATOM 986 O VAL A 62 18.148 7.174 8.324 1.00 0.00 O ATOM 987 CB VAL A 62 18.357 10.448 9.278 1.00 0.00 C ATOM 988 CG1 VAL A 62 19.123 10.291 7.973 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.252 11.484 9.136 1.00 0.00 C ATOM 0 H VAL A 62 18.288 9.686 11.674 1.00 0.00 H new ATOM 0 HA VAL A 62 16.750 9.011 9.364 1.00 0.00 H new ATOM 0 HB VAL A 62 19.054 10.796 10.041 1.00 0.00 H new ATOM 0 HG11 VAL A 62 19.528 11.257 7.670 1.00 0.00 H new ATOM 0 HG12 VAL A 62 19.940 9.583 8.114 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.451 9.920 7.199 1.00 0.00 H new ATOM 0 HG21 VAL A 62 17.682 12.433 8.817 1.00 0.00 H new ATOM 0 HG22 VAL A 62 16.529 11.145 8.394 1.00 0.00 H new ATOM 0 HG23 VAL A 62 16.752 11.617 10.096 1.00 0.00 H new ATOM 999 N PRO A 63 19.887 7.899 9.559 1.00 0.00 N ATOM 1000 CA PRO A 63 20.820 6.873 9.086 1.00 0.00 C ATOM 1001 C PRO A 63 20.468 5.483 9.606 1.00 0.00 C ATOM 1002 O PRO A 63 20.372 4.528 8.836 1.00 0.00 O ATOM 1003 CB PRO A 63 22.167 7.330 9.653 1.00 0.00 C ATOM 1004 CG PRO A 63 21.817 8.143 10.851 1.00 0.00 C ATOM 1005 CD PRO A 63 20.511 8.814 10.529 1.00 0.00 C ATOM 0 HA PRO A 63 20.807 6.781 8.000 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.793 6.479 9.921 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.724 7.918 8.924 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.725 7.514 11.736 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.592 8.879 11.063 1.00 0.00 H new ATOM 0 HD2 PRO A 63 19.893 8.939 11.418 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.663 9.806 10.105 1.00 0.00 H new ATOM 1013 N SER A 64 20.275 5.379 10.917 1.00 0.00 N ATOM 1014 CA SER A 64 19.936 4.105 11.541 1.00 0.00 C ATOM 1015 C SER A 64 18.815 3.408 10.776 1.00 0.00 C ATOM 1016 O SER A 64 18.786 2.181 10.677 1.00 0.00 O ATOM 1017 CB SER A 64 19.519 4.321 12.996 1.00 0.00 C ATOM 1018 OG SER A 64 20.652 4.458 13.837 1.00 0.00 O ATOM 0 H SER A 64 20.348 6.161 11.568 1.00 0.00 H new ATOM 0 HA SER A 64 20.820 3.468 11.515 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.897 5.213 13.071 1.00 0.00 H new ATOM 0 HB3 SER A 64 18.912 3.480 13.332 1.00 0.00 H new ATOM 0 HG SER A 64 20.358 4.597 14.762 1.00 0.00 H new ATOM 1024 N ARG A 65 17.892 4.199 10.238 1.00 0.00 N ATOM 1025 CA ARG A 65 16.768 3.659 9.484 1.00 0.00 C ATOM 1026 C ARG A 65 17.194 3.282 8.068 1.00 0.00 C ATOM 1027 O ARG A 65 16.823 2.225 7.557 1.00 0.00 O ATOM 1028 CB ARG A 65 15.626 4.676 9.431 1.00 0.00 C ATOM 1029 CG ARG A 65 14.705 4.620 10.639 1.00 0.00 C ATOM 1030 CD ARG A 65 13.661 3.524 10.493 1.00 0.00 C ATOM 1031 NE ARG A 65 12.536 3.946 9.663 1.00 0.00 N ATOM 1032 CZ ARG A 65 11.317 3.427 9.758 1.00 0.00 C ATOM 1033 NH1 ARG A 65 11.067 2.472 10.644 1.00 0.00 N ATOM 1034 NH2 ARG A 65 10.345 3.863 8.967 1.00 0.00 N ATOM 0 H ARG A 65 17.901 5.216 10.311 1.00 0.00 H new ATOM 0 HA ARG A 65 16.421 2.759 9.992 1.00 0.00 H new ATOM 0 HB2 ARG A 65 16.047 5.678 9.351 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.039 4.504 8.529 1.00 0.00 H new ATOM 0 HG2 ARG A 65 15.294 4.445 11.539 1.00 0.00 H new ATOM 0 HG3 ARG A 65 14.209 5.582 10.765 1.00 0.00 H new ATOM 0 HD2 ARG A 65 14.123 2.639 10.055 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.296 3.237 11.479 1.00 0.00 H new ATOM 0 HE ARG A 65 12.695 4.680 8.972 1.00 0.00 H new ATOM 0 HH11 ARG A 65 11.812 2.135 11.254 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.130 2.075 10.715 1.00 0.00 H new ATOM 0 HH21 ARG A 65 10.533 4.598 8.285 1.00 0.00 H new ATOM 0 HH22 ARG A 65 9.409 3.464 9.041 1.00 0.00 H new ATOM 1048 N VAL A 66 17.974 4.155 7.438 1.00 0.00 N ATOM 1049 CA VAL A 66 18.451 3.914 6.082 1.00 0.00 C ATOM 1050 C VAL A 66 18.673 2.427 5.833 1.00 0.00 C ATOM 1051 O VAL A 66 17.997 1.819 5.003 1.00 0.00 O ATOM 1052 CB VAL A 66 19.764 4.671 5.806 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.446 4.122 4.562 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.499 6.162 5.664 1.00 0.00 C ATOM 0 H VAL A 66 18.289 5.035 7.845 1.00 0.00 H new ATOM 0 HA VAL A 66 17.679 4.281 5.406 1.00 0.00 H new ATOM 0 HB VAL A 66 20.433 4.523 6.653 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.372 4.669 4.383 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.671 3.065 4.707 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.785 4.238 3.703 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.437 6.681 5.469 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.811 6.332 4.835 1.00 0.00 H new ATOM 0 HG23 VAL A 66 19.058 6.543 6.585 1.00 0.00 H new ATOM 1064 N GLN A 67 19.623 1.847 6.558 1.00 0.00 N ATOM 1065 CA GLN A 67 19.934 0.429 6.416 1.00 0.00 C ATOM 1066 C GLN A 67 18.717 -0.430 6.740 1.00 0.00 C ATOM 1067 O GLN A 67 18.375 -1.345 5.991 1.00 0.00 O ATOM 1068 CB GLN A 67 21.101 0.047 7.328 1.00 0.00 C ATOM 1069 CG GLN A 67 20.718 -0.052 8.796 1.00 0.00 C ATOM 1070 CD GLN A 67 21.922 -0.209 9.704 1.00 0.00 C ATOM 1071 OE1 GLN A 67 23.011 -0.564 9.254 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.731 0.056 10.991 1.00 0.00 N ATOM 0 H GLN A 67 20.191 2.336 7.250 1.00 0.00 H new ATOM 0 HA GLN A 67 20.218 0.247 5.380 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.508 -0.910 7.002 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.895 0.786 7.217 1.00 0.00 H new ATOM 0 HG2 GLN A 67 20.164 0.842 9.084 1.00 0.00 H new ATOM 0 HG3 GLN A 67 20.049 -0.901 8.936 1.00 0.00 H new ATOM 0 HE21 GLN A 67 20.811 0.347 11.321 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.505 -0.032 11.650 1.00 0.00 H new ATOM 1081 N GLU A 68 18.067 -0.130 7.860 1.00 0.00 N ATOM 1082 CA GLU A 68 16.889 -0.877 8.283 1.00 0.00 C ATOM 1083 C GLU A 68 15.927 -1.082 7.116 1.00 0.00 C ATOM 1084 O GLU A 68 15.608 -2.215 6.753 1.00 0.00 O ATOM 1085 CB GLU A 68 16.176 -0.145 9.422 1.00 0.00 C ATOM 1086 CG GLU A 68 16.777 -0.418 10.791 1.00 0.00 C ATOM 1087 CD GLU A 68 16.713 -1.884 11.174 1.00 0.00 C ATOM 1088 OE1 GLU A 68 15.633 -2.337 11.607 1.00 0.00 O ATOM 1089 OE2 GLU A 68 17.743 -2.578 11.042 1.00 0.00 O ATOM 0 H GLU A 68 18.337 0.625 8.491 1.00 0.00 H new ATOM 0 HA GLU A 68 17.218 -1.854 8.637 1.00 0.00 H new ATOM 0 HB2 GLU A 68 16.206 0.927 9.229 1.00 0.00 H new ATOM 0 HB3 GLU A 68 15.126 -0.438 9.430 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.816 -0.089 10.800 1.00 0.00 H new ATOM 0 HG3 GLU A 68 16.249 0.173 11.540 1.00 0.00 H new ATOM 1096 N ILE A 69 15.469 0.021 6.533 1.00 0.00 N ATOM 1097 CA ILE A 69 14.545 -0.038 5.408 1.00 0.00 C ATOM 1098 C ILE A 69 15.070 -0.961 4.313 1.00 0.00 C ATOM 1099 O ILE A 69 14.315 -1.735 3.725 1.00 0.00 O ATOM 1100 CB ILE A 69 14.296 1.359 4.810 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.636 2.271 5.846 1.00 0.00 C ATOM 1102 CG2 ILE A 69 13.433 1.255 3.561 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.937 3.739 5.638 1.00 0.00 C ATOM 0 H ILE A 69 15.723 0.966 6.821 1.00 0.00 H new ATOM 0 HA ILE A 69 13.605 -0.433 5.793 1.00 0.00 H new ATOM 0 HB ILE A 69 15.255 1.794 4.529 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.557 2.122 5.814 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.969 1.978 6.841 1.00 0.00 H new ATOM 0 HG21 ILE A 69 13.266 2.251 3.150 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.939 0.637 2.820 1.00 0.00 H new ATOM 0 HG23 ILE A 69 12.475 0.803 3.817 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.437 4.326 6.408 1.00 0.00 H new ATOM 0 HD12 ILE A 69 15.013 3.902 5.699 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.578 4.048 4.656 1.00 0.00 H new ATOM 1115 N TRP A 70 16.368 -0.874 4.046 1.00 0.00 N ATOM 1116 CA TRP A 70 16.994 -1.703 3.023 1.00 0.00 C ATOM 1117 C TRP A 70 17.132 -3.145 3.499 1.00 0.00 C ATOM 1118 O TRP A 70 17.322 -4.057 2.696 1.00 0.00 O ATOM 1119 CB TRP A 70 18.369 -1.142 2.654 1.00 0.00 C ATOM 1120 CG TRP A 70 19.388 -2.204 2.373 1.00 0.00 C ATOM 1121 CD1 TRP A 70 20.068 -2.951 3.292 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.843 -2.636 1.086 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.919 -3.821 2.653 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.799 -3.648 1.300 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.535 -2.268 -0.227 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.448 -4.293 0.250 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 20.180 -2.908 -1.267 1.00 0.00 C ATOM 1128 CH2 TRP A 70 21.127 -3.912 -1.024 1.00 0.00 C ATOM 0 H TRP A 70 17.007 -0.238 4.523 1.00 0.00 H new ATOM 0 HA TRP A 70 16.355 -1.691 2.140 1.00 0.00 H new ATOM 0 HB2 TRP A 70 18.269 -0.503 1.777 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.727 -0.512 3.468 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.954 -2.870 4.363 1.00 0.00 H new ATOM 0 HE1 TRP A 70 21.539 -4.488 3.112 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.805 -1.497 -0.425 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 22.179 -5.066 0.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 19.951 -2.630 -2.285 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.613 -4.395 -1.859 1.00 0.00 H new ATOM 1139 N GLN A 71 17.034 -3.343 4.810 1.00 0.00 N ATOM 1140 CA GLN A 71 17.147 -4.675 5.392 1.00 0.00 C ATOM 1141 C GLN A 71 15.772 -5.306 5.581 1.00 0.00 C ATOM 1142 O GLN A 71 15.657 -6.437 6.050 1.00 0.00 O ATOM 1143 CB GLN A 71 17.879 -4.607 6.733 1.00 0.00 C ATOM 1144 CG GLN A 71 19.354 -4.261 6.605 1.00 0.00 C ATOM 1145 CD GLN A 71 20.168 -4.725 7.797 1.00 0.00 C ATOM 1146 OE1 GLN A 71 20.117 -4.124 8.870 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.926 -5.800 7.614 1.00 0.00 N ATOM 0 H GLN A 71 16.877 -2.598 5.489 1.00 0.00 H new ATOM 0 HA GLN A 71 17.719 -5.297 4.704 1.00 0.00 H new ATOM 0 HB2 GLN A 71 17.394 -3.863 7.365 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.782 -5.567 7.239 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.753 -4.716 5.698 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.462 -3.182 6.494 1.00 0.00 H new ATOM 0 HE21 GLN A 71 20.938 -6.267 6.707 1.00 0.00 H new ATOM 0 HE22 GLN A 71 21.496 -6.158 8.380 1.00 0.00 H new ATOM 1156 N GLU A 72 14.731 -4.565 5.212 1.00 0.00 N ATOM 1157 CA GLU A 72 13.363 -5.053 5.343 1.00 0.00 C ATOM 1158 C GLU A 72 12.827 -5.535 3.998 1.00 0.00 C ATOM 1159 O GLU A 72 12.212 -6.598 3.907 1.00 0.00 O ATOM 1160 CB GLU A 72 12.457 -3.954 5.901 1.00 0.00 C ATOM 1161 CG GLU A 72 10.981 -4.314 5.884 1.00 0.00 C ATOM 1162 CD GLU A 72 10.196 -3.613 6.976 1.00 0.00 C ATOM 1163 OE1 GLU A 72 10.438 -2.409 7.201 1.00 0.00 O ATOM 1164 OE2 GLU A 72 9.340 -4.269 7.604 1.00 0.00 O ATOM 0 H GLU A 72 14.809 -3.626 4.821 1.00 0.00 H new ATOM 0 HA GLU A 72 13.369 -5.895 6.035 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.757 -3.733 6.926 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.607 -3.043 5.322 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.559 -4.053 4.914 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.873 -5.392 5.999 1.00 0.00 H new ATOM 1171 N PHE A 73 13.064 -4.746 2.956 1.00 0.00 N ATOM 1172 CA PHE A 73 12.604 -5.091 1.615 1.00 0.00 C ATOM 1173 C PHE A 73 13.784 -5.273 0.665 1.00 0.00 C ATOM 1174 O PHE A 73 13.778 -6.162 -0.187 1.00 0.00 O ATOM 1175 CB PHE A 73 11.666 -4.006 1.081 1.00 0.00 C ATOM 1176 CG PHE A 73 10.789 -3.398 2.137 1.00 0.00 C ATOM 1177 CD1 PHE A 73 11.294 -2.453 3.016 1.00 0.00 C ATOM 1178 CD2 PHE A 73 9.459 -3.770 2.251 1.00 0.00 C ATOM 1179 CE1 PHE A 73 10.489 -1.892 3.989 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.649 -3.213 3.223 1.00 0.00 C ATOM 1181 CZ PHE A 73 9.165 -2.272 4.092 1.00 0.00 C ATOM 0 H PHE A 73 13.572 -3.863 3.014 1.00 0.00 H new ATOM 0 HA PHE A 73 12.061 -6.034 1.675 1.00 0.00 H new ATOM 0 HB2 PHE A 73 12.261 -3.219 0.617 1.00 0.00 H new ATOM 0 HB3 PHE A 73 11.037 -4.433 0.300 1.00 0.00 H new ATOM 0 HD1 PHE A 73 12.328 -2.152 2.940 1.00 0.00 H new ATOM 0 HD2 PHE A 73 9.050 -4.504 1.572 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.895 -1.157 4.668 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.615 -3.513 3.303 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.534 -1.834 4.851 1.00 0.00 H new ATOM 1191 N LEU A 74 14.794 -4.424 0.818 1.00 0.00 N ATOM 1192 CA LEU A 74 15.982 -4.489 -0.027 1.00 0.00 C ATOM 1193 C LEU A 74 16.984 -5.500 0.521 1.00 0.00 C ATOM 1194 O LEU A 74 18.162 -5.478 0.164 1.00 0.00 O ATOM 1195 CB LEU A 74 16.636 -3.110 -0.129 1.00 0.00 C ATOM 1196 CG LEU A 74 15.720 -1.963 -0.558 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.491 -0.653 -0.607 1.00 0.00 C ATOM 1198 CD2 LEU A 74 15.087 -2.263 -1.909 1.00 0.00 C ATOM 0 H LEU A 74 14.815 -3.683 1.519 1.00 0.00 H new ATOM 0 HA LEU A 74 15.674 -4.812 -1.021 1.00 0.00 H new ATOM 0 HB2 LEU A 74 17.066 -2.861 0.841 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.462 -3.173 -0.837 1.00 0.00 H new ATOM 0 HG LEU A 74 14.924 -1.864 0.180 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.823 0.151 -0.914 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.895 -0.432 0.381 1.00 0.00 H new ATOM 0 HD13 LEU A 74 17.309 -0.739 -1.323 1.00 0.00 H new ATOM 0 HD21 LEU A 74 14.438 -1.436 -2.199 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.869 -2.390 -2.657 1.00 0.00 H new ATOM 0 HD23 LEU A 74 14.499 -3.178 -1.840 1.00 0.00 H new ATOM 1210 N ALA A 75 16.508 -6.387 1.389 1.00 0.00 N ATOM 1211 CA ALA A 75 17.362 -7.409 1.983 1.00 0.00 C ATOM 1212 C ALA A 75 16.861 -8.808 1.641 1.00 0.00 C ATOM 1213 O ALA A 75 15.659 -9.067 1.582 1.00 0.00 O ATOM 1214 CB ALA A 75 17.433 -7.226 3.491 1.00 0.00 C ATOM 0 H ALA A 75 15.536 -6.419 1.696 1.00 0.00 H new ATOM 0 HA ALA A 75 18.363 -7.298 1.567 1.00 0.00 H new ATOM 0 HB1 ALA A 75 18.074 -7.996 3.921 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.844 -6.243 3.719 1.00 0.00 H new ATOM 0 HB3 ALA A 75 16.432 -7.308 3.915 1.00 0.00 H new ATOM 1220 N PRO A 76 17.804 -9.734 1.409 1.00 0.00 N ATOM 1221 CA PRO A 76 17.482 -11.123 1.068 1.00 0.00 C ATOM 1222 C PRO A 76 16.884 -11.885 2.246 1.00 0.00 C ATOM 1223 O PRO A 76 17.349 -11.761 3.378 1.00 0.00 O ATOM 1224 CB PRO A 76 18.839 -11.717 0.681 1.00 0.00 C ATOM 1225 CG PRO A 76 19.838 -10.881 1.404 1.00 0.00 C ATOM 1226 CD PRO A 76 19.256 -9.496 1.462 1.00 0.00 C ATOM 0 HA PRO A 76 16.733 -11.186 0.279 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.911 -12.764 0.976 1.00 0.00 H new ATOM 0 HB3 PRO A 76 18.996 -11.678 -0.397 1.00 0.00 H new ATOM 0 HG2 PRO A 76 20.020 -11.270 2.406 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.796 -10.880 0.884 1.00 0.00 H new ATOM 0 HD2 PRO A 76 19.545 -8.977 2.376 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.594 -8.883 0.626 1.00 0.00 H new ATOM 1234 N GLY A 77 15.851 -12.675 1.971 1.00 0.00 N ATOM 1235 CA GLY A 77 15.207 -13.446 3.018 1.00 0.00 C ATOM 1236 C GLY A 77 14.228 -12.619 3.829 1.00 0.00 C ATOM 1237 O GLY A 77 13.390 -13.164 4.546 1.00 0.00 O ATOM 0 H GLY A 77 15.448 -12.795 1.041 1.00 0.00 H new ATOM 0 HA2 GLY A 77 14.682 -14.291 2.572 1.00 0.00 H new ATOM 0 HA3 GLY A 77 15.967 -13.858 3.682 1.00 0.00 H new ATOM 1241 N ALA A 78 14.336 -11.299 3.716 1.00 0.00 N ATOM 1242 CA ALA A 78 13.453 -10.396 4.443 1.00 0.00 C ATOM 1243 C ALA A 78 11.989 -10.755 4.214 1.00 0.00 C ATOM 1244 O ALA A 78 11.635 -11.431 3.248 1.00 0.00 O ATOM 1245 CB ALA A 78 13.716 -8.955 4.030 1.00 0.00 C ATOM 0 H ALA A 78 15.026 -10.832 3.128 1.00 0.00 H new ATOM 0 HA ALA A 78 13.663 -10.502 5.507 1.00 0.00 H new ATOM 0 HB1 ALA A 78 13.050 -8.291 4.581 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.751 -8.696 4.252 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.536 -8.844 2.961 1.00 0.00 H new ATOM 1251 N PRO A 79 11.117 -10.295 5.123 1.00 0.00 N ATOM 1252 CA PRO A 79 9.676 -10.557 5.041 1.00 0.00 C ATOM 1253 C PRO A 79 9.017 -9.811 3.886 1.00 0.00 C ATOM 1254 O PRO A 79 8.210 -10.378 3.148 1.00 0.00 O ATOM 1255 CB PRO A 79 9.146 -10.043 6.381 1.00 0.00 C ATOM 1256 CG PRO A 79 10.134 -9.015 6.811 1.00 0.00 C ATOM 1257 CD PRO A 79 11.469 -9.484 6.300 1.00 0.00 C ATOM 0 HA PRO A 79 9.462 -11.610 4.858 1.00 0.00 H new ATOM 0 HB2 PRO A 79 8.150 -9.614 6.274 1.00 0.00 H new ATOM 0 HB3 PRO A 79 9.070 -10.848 7.112 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.882 -8.036 6.403 1.00 0.00 H new ATOM 0 HG3 PRO A 79 10.145 -8.914 7.896 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.114 -8.647 6.033 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.002 -10.071 7.048 1.00 0.00 H new ATOM 1265 N SER A 80 9.365 -8.537 3.734 1.00 0.00 N ATOM 1266 CA SER A 80 8.804 -7.713 2.670 1.00 0.00 C ATOM 1267 C SER A 80 9.788 -7.577 1.512 1.00 0.00 C ATOM 1268 O SER A 80 9.662 -6.681 0.678 1.00 0.00 O ATOM 1269 CB SER A 80 8.437 -6.329 3.208 1.00 0.00 C ATOM 1270 OG SER A 80 7.676 -6.429 4.399 1.00 0.00 O ATOM 0 H SER A 80 10.033 -8.053 4.334 1.00 0.00 H new ATOM 0 HA SER A 80 7.902 -8.203 2.302 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.345 -5.758 3.400 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.870 -5.782 2.455 1.00 0.00 H new ATOM 0 HG SER A 80 6.721 -6.397 4.181 1.00 0.00 H new ATOM 1276 N ALA A 81 10.767 -8.474 1.467 1.00 0.00 N ATOM 1277 CA ALA A 81 11.772 -8.457 0.411 1.00 0.00 C ATOM 1278 C ALA A 81 11.126 -8.268 -0.957 1.00 0.00 C ATOM 1279 O ALA A 81 10.543 -9.200 -1.512 1.00 0.00 O ATOM 1280 CB ALA A 81 12.590 -9.739 0.440 1.00 0.00 C ATOM 0 H ALA A 81 10.886 -9.222 2.150 1.00 0.00 H new ATOM 0 HA ALA A 81 12.437 -7.612 0.589 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.336 -9.712 -0.354 1.00 0.00 H new ATOM 0 HB2 ALA A 81 13.089 -9.830 1.405 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.931 -10.594 0.290 1.00 0.00 H new ATOM 1286 N ILE A 82 11.234 -7.058 -1.496 1.00 0.00 N ATOM 1287 CA ILE A 82 10.661 -6.749 -2.800 1.00 0.00 C ATOM 1288 C ILE A 82 11.672 -6.988 -3.915 1.00 0.00 C ATOM 1289 O ILE A 82 12.795 -7.426 -3.666 1.00 0.00 O ATOM 1290 CB ILE A 82 10.173 -5.290 -2.869 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.340 -4.328 -2.642 1.00 0.00 C ATOM 1292 CG2 ILE A 82 9.075 -5.050 -1.843 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.157 -2.986 -3.316 1.00 0.00 C ATOM 0 H ILE A 82 11.713 -6.276 -1.050 1.00 0.00 H new ATOM 0 HA ILE A 82 9.809 -7.415 -2.936 1.00 0.00 H new ATOM 0 HB ILE A 82 9.763 -5.106 -3.862 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.469 -4.173 -1.571 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.257 -4.788 -3.010 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.740 -4.014 -1.904 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.236 -5.715 -2.046 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.462 -5.248 -0.843 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.022 -2.355 -3.112 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.058 -3.130 -4.392 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.258 -2.505 -2.930 1.00 0.00 H new ATOM 1305 N ASN A 83 11.266 -6.697 -5.147 1.00 0.00 N ATOM 1306 CA ASN A 83 12.138 -6.879 -6.302 1.00 0.00 C ATOM 1307 C ASN A 83 12.238 -5.592 -7.116 1.00 0.00 C ATOM 1308 O ASN A 83 11.247 -4.887 -7.307 1.00 0.00 O ATOM 1309 CB ASN A 83 11.619 -8.015 -7.185 1.00 0.00 C ATOM 1310 CG ASN A 83 12.546 -8.315 -8.347 1.00 0.00 C ATOM 1311 OD1 ASN A 83 13.431 -9.164 -8.246 1.00 0.00 O ATOM 1312 ND2 ASN A 83 12.346 -7.616 -9.458 1.00 0.00 N ATOM 0 H ASN A 83 10.339 -6.334 -5.371 1.00 0.00 H new ATOM 0 HA ASN A 83 13.133 -7.136 -5.938 1.00 0.00 H new ATOM 0 HB2 ASN A 83 11.496 -8.914 -6.581 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.633 -7.752 -7.569 1.00 0.00 H new ATOM 0 HD21 ASN A 83 12.939 -7.773 -10.273 1.00 0.00 H new ATOM 0 HD22 ASN A 83 11.600 -6.922 -9.496 1.00 0.00 H new ATOM 1319 N LEU A 84 13.441 -5.294 -7.595 1.00 0.00 N ATOM 1320 CA LEU A 84 13.671 -4.092 -8.390 1.00 0.00 C ATOM 1321 C LEU A 84 14.388 -4.431 -9.693 1.00 0.00 C ATOM 1322 O LEU A 84 14.735 -5.586 -9.940 1.00 0.00 O ATOM 1323 CB LEU A 84 14.492 -3.078 -7.591 1.00 0.00 C ATOM 1324 CG LEU A 84 13.755 -2.357 -6.463 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.734 -1.586 -5.592 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.694 -1.424 -7.030 1.00 0.00 C ATOM 0 H LEU A 84 14.272 -5.867 -7.447 1.00 0.00 H new ATOM 0 HA LEU A 84 12.702 -3.655 -8.633 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.353 -3.593 -7.164 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.879 -2.329 -8.282 1.00 0.00 H new ATOM 0 HG LEU A 84 13.260 -3.104 -5.843 1.00 0.00 H new ATOM 0 HD11 LEU A 84 14.191 -1.079 -4.795 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.456 -2.277 -5.157 1.00 0.00 H new ATOM 0 HD13 LEU A 84 15.258 -0.848 -6.199 1.00 0.00 H new ATOM 0 HD21 LEU A 84 12.179 -0.919 -6.213 1.00 0.00 H new ATOM 0 HD22 LEU A 84 13.168 -0.683 -7.674 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.974 -2.001 -7.610 1.00 0.00 H new ATOM 1338 N ASP A 85 14.608 -3.416 -10.522 1.00 0.00 N ATOM 1339 CA ASP A 85 15.287 -3.605 -11.798 1.00 0.00 C ATOM 1340 C ASP A 85 16.801 -3.564 -11.620 1.00 0.00 C ATOM 1341 O ASP A 85 17.336 -2.661 -10.977 1.00 0.00 O ATOM 1342 CB ASP A 85 14.849 -2.533 -12.797 1.00 0.00 C ATOM 1343 CG ASP A 85 15.396 -2.780 -14.189 1.00 0.00 C ATOM 1344 OD1 ASP A 85 15.719 -3.945 -14.502 1.00 0.00 O ATOM 1345 OD2 ASP A 85 15.500 -1.808 -14.966 1.00 0.00 O ATOM 0 H ASP A 85 14.326 -2.454 -10.333 1.00 0.00 H new ATOM 0 HA ASP A 85 15.012 -4.586 -12.186 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.760 -2.502 -12.838 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.183 -1.556 -12.447 1.00 0.00 H new ATOM 1350 N SER A 86 17.486 -4.549 -12.193 1.00 0.00 N ATOM 1351 CA SER A 86 18.939 -4.628 -12.093 1.00 0.00 C ATOM 1352 C SER A 86 19.563 -3.236 -12.132 1.00 0.00 C ATOM 1353 O SER A 86 20.548 -2.965 -11.445 1.00 0.00 O ATOM 1354 CB SER A 86 19.504 -5.484 -13.229 1.00 0.00 C ATOM 1355 OG SER A 86 18.906 -6.768 -13.244 1.00 0.00 O ATOM 0 H SER A 86 17.058 -5.303 -12.731 1.00 0.00 H new ATOM 0 HA SER A 86 19.188 -5.092 -11.139 1.00 0.00 H new ATOM 0 HB2 SER A 86 19.331 -4.987 -14.184 1.00 0.00 H new ATOM 0 HB3 SER A 86 20.583 -5.583 -13.112 1.00 0.00 H new ATOM 0 HG SER A 86 19.282 -7.295 -13.979 1.00 0.00 H new ATOM 1361 N LYS A 87 18.981 -2.356 -12.940 1.00 0.00 N ATOM 1362 CA LYS A 87 19.477 -0.991 -13.070 1.00 0.00 C ATOM 1363 C LYS A 87 19.206 -0.191 -11.800 1.00 0.00 C ATOM 1364 O LYS A 87 20.135 0.232 -11.111 1.00 0.00 O ATOM 1365 CB LYS A 87 18.823 -0.301 -14.269 1.00 0.00 C ATOM 1366 CG LYS A 87 18.987 1.209 -14.265 1.00 0.00 C ATOM 1367 CD LYS A 87 20.446 1.612 -14.398 1.00 0.00 C ATOM 1368 CE LYS A 87 20.587 3.081 -14.767 1.00 0.00 C ATOM 1369 NZ LYS A 87 20.330 3.972 -13.602 1.00 0.00 N ATOM 0 H LYS A 87 18.165 -2.564 -13.515 1.00 0.00 H new ATOM 0 HA LYS A 87 20.555 -1.036 -13.228 1.00 0.00 H new ATOM 0 HB2 LYS A 87 19.252 -0.702 -15.187 1.00 0.00 H new ATOM 0 HB3 LYS A 87 17.760 -0.543 -14.282 1.00 0.00 H new ATOM 0 HG2 LYS A 87 18.413 1.640 -15.085 1.00 0.00 H new ATOM 0 HG3 LYS A 87 18.579 1.618 -13.341 1.00 0.00 H new ATOM 0 HD2 LYS A 87 20.965 1.420 -13.459 1.00 0.00 H new ATOM 0 HD3 LYS A 87 20.927 0.997 -15.159 1.00 0.00 H new ATOM 0 HE2 LYS A 87 21.591 3.265 -15.150 1.00 0.00 H new ATOM 0 HE3 LYS A 87 19.890 3.322 -15.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 20.436 4.965 -13.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 19.363 3.815 -13.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 21.011 3.759 -12.845 1.00 0.00 H new ATOM 1383 N SER A 88 17.928 0.011 -11.494 1.00 0.00 N ATOM 1384 CA SER A 88 17.535 0.762 -10.308 1.00 0.00 C ATOM 1385 C SER A 88 18.182 0.177 -9.056 1.00 0.00 C ATOM 1386 O SER A 88 18.840 0.886 -8.294 1.00 0.00 O ATOM 1387 CB SER A 88 16.013 0.760 -10.158 1.00 0.00 C ATOM 1388 OG SER A 88 15.406 1.619 -11.107 1.00 0.00 O ATOM 0 H SER A 88 17.147 -0.335 -12.052 1.00 0.00 H new ATOM 0 HA SER A 88 17.879 1.789 -10.428 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.633 -0.254 -10.285 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.743 1.077 -9.151 1.00 0.00 H new ATOM 0 HG SER A 88 15.343 2.524 -10.736 1.00 0.00 H new ATOM 1394 N TYR A 89 17.989 -1.121 -8.850 1.00 0.00 N ATOM 1395 CA TYR A 89 18.550 -1.803 -7.689 1.00 0.00 C ATOM 1396 C TYR A 89 20.028 -1.464 -7.521 1.00 0.00 C ATOM 1397 O TYR A 89 20.465 -1.059 -6.443 1.00 0.00 O ATOM 1398 CB TYR A 89 18.375 -3.316 -7.826 1.00 0.00 C ATOM 1399 CG TYR A 89 18.676 -4.078 -6.555 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.704 -4.251 -5.579 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.934 -4.624 -6.331 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.975 -4.946 -4.416 1.00 0.00 C ATOM 1403 CE2 TYR A 89 20.214 -5.321 -5.172 1.00 0.00 C ATOM 1404 CZ TYR A 89 19.231 -5.479 -4.217 1.00 0.00 C ATOM 1405 OH TYR A 89 19.506 -6.172 -3.061 1.00 0.00 O ATOM 0 H TYR A 89 17.448 -1.722 -9.472 1.00 0.00 H new ATOM 0 HA TYR A 89 18.014 -1.461 -6.804 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.351 -3.528 -8.133 1.00 0.00 H new ATOM 0 HB3 TYR A 89 19.028 -3.678 -8.620 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.719 -3.835 -5.731 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.706 -4.501 -7.076 1.00 0.00 H new ATOM 0 HE1 TYR A 89 17.207 -5.071 -3.667 1.00 0.00 H new ATOM 0 HE2 TYR A 89 21.197 -5.740 -5.014 1.00 0.00 H new ATOM 0 HH TYR A 89 19.958 -5.580 -2.424 1.00 0.00 H new ATOM 1415 N ASP A 90 20.793 -1.632 -8.594 1.00 0.00 N ATOM 1416 CA ASP A 90 22.222 -1.343 -8.567 1.00 0.00 C ATOM 1417 C ASP A 90 22.488 0.024 -7.946 1.00 0.00 C ATOM 1418 O ASP A 90 23.218 0.139 -6.960 1.00 0.00 O ATOM 1419 CB ASP A 90 22.801 -1.395 -9.982 1.00 0.00 C ATOM 1420 CG ASP A 90 24.276 -1.049 -10.017 1.00 0.00 C ATOM 1421 OD1 ASP A 90 25.104 -1.958 -9.797 1.00 0.00 O ATOM 1422 OD2 ASP A 90 24.604 0.131 -10.264 1.00 0.00 O ATOM 0 H ASP A 90 20.447 -1.967 -9.493 1.00 0.00 H new ATOM 0 HA ASP A 90 22.710 -2.102 -7.955 1.00 0.00 H new ATOM 0 HB2 ASP A 90 22.655 -2.393 -10.395 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.253 -0.703 -10.621 1.00 0.00 H new ATOM 1427 N LYS A 91 21.894 1.060 -8.528 1.00 0.00 N ATOM 1428 CA LYS A 91 22.065 2.420 -8.032 1.00 0.00 C ATOM 1429 C LYS A 91 21.761 2.497 -6.540 1.00 0.00 C ATOM 1430 O LYS A 91 22.542 3.050 -5.764 1.00 0.00 O ATOM 1431 CB LYS A 91 21.156 3.383 -8.799 1.00 0.00 C ATOM 1432 CG LYS A 91 21.498 4.847 -8.579 1.00 0.00 C ATOM 1433 CD LYS A 91 22.502 5.346 -9.605 1.00 0.00 C ATOM 1434 CE LYS A 91 22.913 6.783 -9.328 1.00 0.00 C ATOM 1435 NZ LYS A 91 21.807 7.741 -9.608 1.00 0.00 N ATOM 0 H LYS A 91 21.289 0.983 -9.345 1.00 0.00 H new ATOM 0 HA LYS A 91 23.104 2.709 -8.189 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.220 3.160 -9.864 1.00 0.00 H new ATOM 0 HB3 LYS A 91 20.122 3.211 -8.499 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.589 5.446 -8.637 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.905 4.980 -7.576 1.00 0.00 H new ATOM 0 HD2 LYS A 91 23.384 4.706 -9.594 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.069 5.276 -10.603 1.00 0.00 H new ATOM 0 HE2 LYS A 91 23.221 6.878 -8.287 1.00 0.00 H new ATOM 0 HE3 LYS A 91 23.778 7.038 -9.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 22.143 8.713 -9.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 21.496 7.633 -10.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 21.009 7.546 -8.970 1.00 0.00 H new ATOM 1449 N THR A 92 20.623 1.938 -6.142 1.00 0.00 N ATOM 1450 CA THR A 92 20.216 1.944 -4.743 1.00 0.00 C ATOM 1451 C THR A 92 21.277 1.297 -3.859 1.00 0.00 C ATOM 1452 O THR A 92 21.828 1.937 -2.963 1.00 0.00 O ATOM 1453 CB THR A 92 18.879 1.205 -4.543 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.900 1.709 -5.459 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.378 1.369 -3.116 1.00 0.00 C ATOM 0 H THR A 92 19.966 1.475 -6.770 1.00 0.00 H new ATOM 0 HA THR A 92 20.093 2.988 -4.455 1.00 0.00 H new ATOM 0 HB THR A 92 19.043 0.144 -4.733 1.00 0.00 H new ATOM 0 HG1 THR A 92 18.067 1.341 -6.352 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.433 0.839 -2.999 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.113 0.959 -2.423 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.229 2.427 -2.902 1.00 0.00 H new ATOM 1463 N THR A 93 21.561 0.024 -4.118 1.00 0.00 N ATOM 1464 CA THR A 93 22.556 -0.709 -3.346 1.00 0.00 C ATOM 1465 C THR A 93 23.721 0.192 -2.954 1.00 0.00 C ATOM 1466 O THR A 93 24.053 0.318 -1.774 1.00 0.00 O ATOM 1467 CB THR A 93 23.098 -1.917 -4.132 1.00 0.00 C ATOM 1468 OG1 THR A 93 22.013 -2.655 -4.706 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.916 -2.828 -3.229 1.00 0.00 C ATOM 0 H THR A 93 21.116 -0.520 -4.857 1.00 0.00 H new ATOM 0 HA THR A 93 22.057 -1.065 -2.445 1.00 0.00 H new ATOM 0 HB THR A 93 23.744 -1.545 -4.927 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.596 -2.124 -5.416 1.00 0.00 H new ATOM 0 HG21 THR A 93 24.288 -3.674 -3.807 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.758 -2.271 -2.817 1.00 0.00 H new ATOM 0 HG23 THR A 93 23.289 -3.192 -2.415 1.00 0.00 H new ATOM 1477 N HIS A 94 24.339 0.820 -3.949 1.00 0.00 N ATOM 1478 CA HIS A 94 25.468 1.711 -3.707 1.00 0.00 C ATOM 1479 C HIS A 94 25.031 2.935 -2.908 1.00 0.00 C ATOM 1480 O HIS A 94 25.691 3.328 -1.947 1.00 0.00 O ATOM 1481 CB HIS A 94 26.092 2.150 -5.033 1.00 0.00 C ATOM 1482 CG HIS A 94 27.134 1.204 -5.545 1.00 0.00 C ATOM 1483 ND1 HIS A 94 28.205 0.781 -4.787 1.00 0.00 N ATOM 1484 CD2 HIS A 94 27.265 0.598 -6.749 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.950 -0.043 -5.501 1.00 0.00 C ATOM 1486 NE2 HIS A 94 28.401 -0.172 -6.696 1.00 0.00 N ATOM 0 H HIS A 94 24.077 0.728 -4.931 1.00 0.00 H new ATOM 0 HA HIS A 94 26.212 1.166 -3.127 1.00 0.00 H new ATOM 0 HB2 HIS A 94 25.305 2.250 -5.780 1.00 0.00 H new ATOM 0 HB3 HIS A 94 26.539 3.136 -4.906 1.00 0.00 H new ATOM 0 HD2 HIS A 94 26.600 0.701 -7.594 1.00 0.00 H new ATOM 0 HE1 HIS A 94 29.854 -0.529 -5.165 1.00 0.00 H new ATOM 0 HE2 HIS A 94 28.762 -0.749 -7.455 1.00 0.00 H new ATOM 1494 N ASN A 95 23.916 3.534 -3.313 1.00 0.00 N ATOM 1495 CA ASN A 95 23.392 4.714 -2.634 1.00 0.00 C ATOM 1496 C ASN A 95 23.258 4.465 -1.135 1.00 0.00 C ATOM 1497 O ASN A 95 23.620 5.313 -0.319 1.00 0.00 O ATOM 1498 CB ASN A 95 22.034 5.105 -3.222 1.00 0.00 C ATOM 1499 CG ASN A 95 22.161 5.767 -4.580 1.00 0.00 C ATOM 1500 OD1 ASN A 95 23.202 5.680 -5.231 1.00 0.00 O ATOM 1501 ND2 ASN A 95 21.098 6.434 -5.014 1.00 0.00 N ATOM 0 H ASN A 95 23.358 3.222 -4.108 1.00 0.00 H new ATOM 0 HA ASN A 95 24.095 5.533 -2.786 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.410 4.216 -3.311 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.526 5.783 -2.536 1.00 0.00 H new ATOM 0 HD21 ASN A 95 21.124 6.900 -5.921 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.256 6.480 -4.441 1.00 0.00 H new ATOM 1508 N VAL A 96 22.734 3.296 -0.779 1.00 0.00 N ATOM 1509 CA VAL A 96 22.553 2.934 0.621 1.00 0.00 C ATOM 1510 C VAL A 96 23.809 3.232 1.433 1.00 0.00 C ATOM 1511 O VAL A 96 23.733 3.738 2.552 1.00 0.00 O ATOM 1512 CB VAL A 96 22.199 1.443 0.774 1.00 0.00 C ATOM 1513 CG1 VAL A 96 22.065 1.074 2.244 1.00 0.00 C ATOM 1514 CG2 VAL A 96 20.920 1.119 0.016 1.00 0.00 C ATOM 0 H VAL A 96 22.427 2.584 -1.442 1.00 0.00 H new ATOM 0 HA VAL A 96 21.727 3.537 0.999 1.00 0.00 H new ATOM 0 HB VAL A 96 23.008 0.850 0.347 1.00 0.00 H new ATOM 0 HG11 VAL A 96 21.815 0.017 2.332 1.00 0.00 H new ATOM 0 HG12 VAL A 96 23.008 1.268 2.755 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.276 1.673 2.699 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.685 0.061 0.135 1.00 0.00 H new ATOM 0 HG22 VAL A 96 20.101 1.720 0.411 1.00 0.00 H new ATOM 0 HG23 VAL A 96 21.057 1.344 -1.042 1.00 0.00 H new ATOM 1524 N LYS A 97 24.966 2.915 0.860 1.00 0.00 N ATOM 1525 CA LYS A 97 26.240 3.150 1.528 1.00 0.00 C ATOM 1526 C LYS A 97 26.191 4.428 2.360 1.00 0.00 C ATOM 1527 O LYS A 97 26.594 4.437 3.523 1.00 0.00 O ATOM 1528 CB LYS A 97 27.369 3.242 0.499 1.00 0.00 C ATOM 1529 CG LYS A 97 27.515 1.996 -0.356 1.00 0.00 C ATOM 1530 CD LYS A 97 28.456 0.988 0.282 1.00 0.00 C ATOM 1531 CE LYS A 97 29.085 0.075 -0.759 1.00 0.00 C ATOM 1532 NZ LYS A 97 30.216 0.738 -1.466 1.00 0.00 N ATOM 0 H LYS A 97 25.047 2.495 -0.066 1.00 0.00 H new ATOM 0 HA LYS A 97 26.432 2.310 2.196 1.00 0.00 H new ATOM 0 HB2 LYS A 97 27.189 4.099 -0.150 1.00 0.00 H new ATOM 0 HB3 LYS A 97 28.309 3.428 1.019 1.00 0.00 H new ATOM 0 HG2 LYS A 97 26.537 1.539 -0.504 1.00 0.00 H new ATOM 0 HG3 LYS A 97 27.890 2.272 -1.342 1.00 0.00 H new ATOM 0 HD2 LYS A 97 29.240 1.515 0.827 1.00 0.00 H new ATOM 0 HD3 LYS A 97 27.909 0.389 1.010 1.00 0.00 H new ATOM 0 HE2 LYS A 97 29.442 -0.835 -0.276 1.00 0.00 H new ATOM 0 HE3 LYS A 97 28.329 -0.224 -1.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 30.618 0.084 -2.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 29.871 1.593 -1.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 30.950 1.001 -0.777 1.00 0.00 H new ATOM 1546 N GLU A 98 25.693 5.503 1.757 1.00 0.00 N ATOM 1547 CA GLU A 98 25.592 6.785 2.444 1.00 0.00 C ATOM 1548 C GLU A 98 24.165 7.032 2.927 1.00 0.00 C ATOM 1549 O GLU A 98 23.232 7.180 2.137 1.00 0.00 O ATOM 1550 CB GLU A 98 26.032 7.921 1.518 1.00 0.00 C ATOM 1551 CG GLU A 98 25.357 7.894 0.158 1.00 0.00 C ATOM 1552 CD GLU A 98 25.571 9.174 -0.626 1.00 0.00 C ATOM 1553 OE1 GLU A 98 26.680 9.357 -1.171 1.00 0.00 O ATOM 1554 OE2 GLU A 98 24.631 9.994 -0.694 1.00 0.00 O ATOM 0 H GLU A 98 25.354 5.511 0.795 1.00 0.00 H new ATOM 0 HA GLU A 98 26.252 6.757 3.311 1.00 0.00 H new ATOM 0 HB2 GLU A 98 25.819 8.875 2.001 1.00 0.00 H new ATOM 0 HB3 GLU A 98 27.112 7.868 1.379 1.00 0.00 H new ATOM 0 HG2 GLU A 98 25.741 7.052 -0.417 1.00 0.00 H new ATOM 0 HG3 GLU A 98 24.288 7.728 0.291 1.00 0.00 H new ATOM 1561 N PRO A 99 23.990 7.076 4.256 1.00 0.00 N ATOM 1562 CA PRO A 99 22.681 7.305 4.875 1.00 0.00 C ATOM 1563 C PRO A 99 22.180 8.729 4.663 1.00 0.00 C ATOM 1564 O PRO A 99 22.811 9.691 5.100 1.00 0.00 O ATOM 1565 CB PRO A 99 22.942 7.045 6.361 1.00 0.00 C ATOM 1566 CG PRO A 99 24.395 7.316 6.544 1.00 0.00 C ATOM 1567 CD PRO A 99 25.057 6.908 5.257 1.00 0.00 C ATOM 0 HA PRO A 99 21.909 6.666 4.445 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.336 7.697 6.989 1.00 0.00 H new ATOM 0 HB3 PRO A 99 22.693 6.019 6.633 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.572 8.370 6.757 1.00 0.00 H new ATOM 0 HG3 PRO A 99 24.795 6.750 7.385 1.00 0.00 H new ATOM 0 HD2 PRO A 99 25.920 7.535 5.033 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.412 5.878 5.297 1.00 0.00 H new ATOM 1575 N GLY A 100 21.041 8.857 3.989 1.00 0.00 N ATOM 1576 CA GLY A 100 20.475 10.168 3.731 1.00 0.00 C ATOM 1577 C GLY A 100 18.970 10.196 3.916 1.00 0.00 C ATOM 1578 O GLY A 100 18.427 9.471 4.750 1.00 0.00 O ATOM 0 H GLY A 100 20.500 8.076 3.617 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.934 10.897 4.399 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.719 10.472 2.713 1.00 0.00 H new ATOM 1582 N ARG A 101 18.296 11.036 3.138 1.00 0.00 N ATOM 1583 CA ARG A 101 16.845 11.158 3.223 1.00 0.00 C ATOM 1584 C ARG A 101 16.186 10.725 1.917 1.00 0.00 C ATOM 1585 O ARG A 101 15.117 10.115 1.921 1.00 0.00 O ATOM 1586 CB ARG A 101 16.452 12.599 3.552 1.00 0.00 C ATOM 1587 CG ARG A 101 16.415 12.896 5.042 1.00 0.00 C ATOM 1588 CD ARG A 101 16.010 14.336 5.314 1.00 0.00 C ATOM 1589 NE ARG A 101 16.363 14.758 6.667 1.00 0.00 N ATOM 1590 CZ ARG A 101 15.994 15.920 7.194 1.00 0.00 C ATOM 1591 NH1 ARG A 101 15.264 16.771 6.486 1.00 0.00 N ATOM 1592 NH2 ARG A 101 16.354 16.232 8.433 1.00 0.00 N ATOM 0 H ARG A 101 18.731 11.642 2.442 1.00 0.00 H new ATOM 0 HA ARG A 101 16.496 10.502 4.021 1.00 0.00 H new ATOM 0 HB2 ARG A 101 17.158 13.277 3.073 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.471 12.805 3.125 1.00 0.00 H new ATOM 0 HG2 ARG A 101 15.713 12.221 5.531 1.00 0.00 H new ATOM 0 HG3 ARG A 101 17.396 12.705 5.477 1.00 0.00 H new ATOM 0 HD2 ARG A 101 16.496 14.992 4.591 1.00 0.00 H new ATOM 0 HD3 ARG A 101 14.935 14.444 5.170 1.00 0.00 H new ATOM 0 HE ARG A 101 16.924 14.126 7.238 1.00 0.00 H new ATOM 0 HH11 ARG A 101 14.984 16.534 5.534 1.00 0.00 H new ATOM 0 HH12 ARG A 101 14.982 17.663 6.893 1.00 0.00 H new ATOM 0 HH21 ARG A 101 16.914 15.579 8.981 1.00 0.00 H new ATOM 0 HH22 ARG A 101 16.070 17.125 8.837 1.00 0.00 H new ATOM 1606 N TYR A 102 16.831 11.046 0.800 1.00 0.00 N ATOM 1607 CA TYR A 102 16.306 10.692 -0.513 1.00 0.00 C ATOM 1608 C TYR A 102 17.156 9.606 -1.166 1.00 0.00 C ATOM 1609 O TYR A 102 17.096 9.397 -2.378 1.00 0.00 O ATOM 1610 CB TYR A 102 16.258 11.927 -1.415 1.00 0.00 C ATOM 1611 CG TYR A 102 15.035 12.789 -1.196 1.00 0.00 C ATOM 1612 CD1 TYR A 102 14.625 13.136 0.085 1.00 0.00 C ATOM 1613 CD2 TYR A 102 14.287 13.255 -2.271 1.00 0.00 C ATOM 1614 CE1 TYR A 102 13.508 13.922 0.290 1.00 0.00 C ATOM 1615 CE2 TYR A 102 13.170 14.043 -2.076 1.00 0.00 C ATOM 1616 CZ TYR A 102 12.784 14.373 -0.794 1.00 0.00 C ATOM 1617 OH TYR A 102 11.670 15.157 -0.595 1.00 0.00 O ATOM 0 H TYR A 102 17.717 11.550 0.778 1.00 0.00 H new ATOM 0 HA TYR A 102 15.295 10.306 -0.380 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.151 12.528 -1.243 1.00 0.00 H new ATOM 0 HB3 TYR A 102 16.285 11.607 -2.457 1.00 0.00 H new ATOM 0 HD1 TYR A 102 15.190 12.785 0.936 1.00 0.00 H new ATOM 0 HD2 TYR A 102 14.585 12.996 -3.276 1.00 0.00 H new ATOM 0 HE1 TYR A 102 13.203 14.182 1.293 1.00 0.00 H new ATOM 0 HE2 TYR A 102 12.602 14.399 -2.923 1.00 0.00 H new ATOM 0 HH TYR A 102 11.276 15.391 -1.461 1.00 0.00 H new ATOM 1627 N THR A 103 17.949 8.916 -0.352 1.00 0.00 N ATOM 1628 CA THR A 103 18.812 7.851 -0.847 1.00 0.00 C ATOM 1629 C THR A 103 18.024 6.849 -1.683 1.00 0.00 C ATOM 1630 O THR A 103 18.494 6.387 -2.723 1.00 0.00 O ATOM 1631 CB THR A 103 19.505 7.106 0.310 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.133 8.044 1.190 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.542 6.128 -0.221 1.00 0.00 C ATOM 0 H THR A 103 18.011 9.076 0.653 1.00 0.00 H new ATOM 0 HA THR A 103 19.571 8.323 -1.471 1.00 0.00 H new ATOM 0 HB THR A 103 18.747 6.546 0.858 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.023 7.717 1.436 1.00 0.00 H new ATOM 0 HG21 THR A 103 21.018 5.614 0.614 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.056 5.397 -0.867 1.00 0.00 H new ATOM 0 HG23 THR A 103 21.296 6.671 -0.790 1.00 0.00 H new ATOM 1641 N PHE A 104 16.823 6.516 -1.222 1.00 0.00 N ATOM 1642 CA PHE A 104 15.969 5.567 -1.928 1.00 0.00 C ATOM 1643 C PHE A 104 15.042 6.289 -2.900 1.00 0.00 C ATOM 1644 O PHE A 104 14.037 5.734 -3.344 1.00 0.00 O ATOM 1645 CB PHE A 104 15.145 4.750 -0.930 1.00 0.00 C ATOM 1646 CG PHE A 104 15.973 4.102 0.143 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.239 4.768 1.328 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.485 2.827 -0.034 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.001 4.175 2.317 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.247 2.228 0.951 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.505 2.902 2.128 1.00 0.00 C ATOM 0 H PHE A 104 16.419 6.889 -0.363 1.00 0.00 H new ATOM 0 HA PHE A 104 16.609 4.893 -2.497 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.405 5.400 -0.464 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.596 3.978 -1.470 1.00 0.00 H new ATOM 0 HD1 PHE A 104 15.846 5.762 1.481 1.00 0.00 H new ATOM 0 HD2 PHE A 104 16.286 2.295 -0.953 1.00 0.00 H new ATOM 0 HE1 PHE A 104 17.202 4.705 3.236 1.00 0.00 H new ATOM 0 HE2 PHE A 104 17.640 1.234 0.800 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.100 2.435 2.900 1.00 0.00 H new ATOM 1661 N GLU A 105 15.386 7.531 -3.226 1.00 0.00 N ATOM 1662 CA GLU A 105 14.584 8.330 -4.145 1.00 0.00 C ATOM 1663 C GLU A 105 14.218 7.525 -5.389 1.00 0.00 C ATOM 1664 O GLU A 105 13.053 7.463 -5.781 1.00 0.00 O ATOM 1665 CB GLU A 105 15.340 9.598 -4.548 1.00 0.00 C ATOM 1666 CG GLU A 105 14.645 10.401 -5.635 1.00 0.00 C ATOM 1667 CD GLU A 105 13.211 10.742 -5.282 1.00 0.00 C ATOM 1668 OE1 GLU A 105 13.006 11.573 -4.372 1.00 0.00 O ATOM 1669 OE2 GLU A 105 12.293 10.179 -5.914 1.00 0.00 O ATOM 0 H GLU A 105 16.215 8.006 -2.867 1.00 0.00 H new ATOM 0 HA GLU A 105 13.664 8.612 -3.633 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.469 10.229 -3.669 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.337 9.323 -4.892 1.00 0.00 H new ATOM 0 HG2 GLU A 105 15.200 11.322 -5.812 1.00 0.00 H new ATOM 0 HG3 GLU A 105 14.661 9.835 -6.566 1.00 0.00 H new ATOM 1676 N ASP A 106 15.223 6.912 -6.005 1.00 0.00 N ATOM 1677 CA ASP A 106 15.008 6.110 -7.204 1.00 0.00 C ATOM 1678 C ASP A 106 14.050 4.957 -6.924 1.00 0.00 C ATOM 1679 O ASP A 106 12.948 4.906 -7.469 1.00 0.00 O ATOM 1680 CB ASP A 106 16.340 5.567 -7.725 1.00 0.00 C ATOM 1681 CG ASP A 106 16.170 4.298 -8.537 1.00 0.00 C ATOM 1682 OD1 ASP A 106 15.460 4.341 -9.564 1.00 0.00 O ATOM 1683 OD2 ASP A 106 16.747 3.262 -8.145 1.00 0.00 O ATOM 0 H ASP A 106 16.194 6.955 -5.694 1.00 0.00 H new ATOM 0 HA ASP A 106 14.562 6.751 -7.964 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.823 6.326 -8.340 1.00 0.00 H new ATOM 0 HB3 ASP A 106 17.003 5.370 -6.883 1.00 0.00 H new ATOM 1688 N ALA A 107 14.477 4.033 -6.069 1.00 0.00 N ATOM 1689 CA ALA A 107 13.657 2.882 -5.716 1.00 0.00 C ATOM 1690 C ALA A 107 12.253 3.313 -5.305 1.00 0.00 C ATOM 1691 O ALA A 107 11.273 2.982 -5.971 1.00 0.00 O ATOM 1692 CB ALA A 107 14.316 2.088 -4.597 1.00 0.00 C ATOM 0 H ALA A 107 15.387 4.060 -5.608 1.00 0.00 H new ATOM 0 HA ALA A 107 13.570 2.245 -6.597 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.692 1.231 -4.343 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.295 1.740 -4.926 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.433 2.724 -3.720 1.00 0.00 H new ATOM 1698 N GLN A 108 12.165 4.053 -4.205 1.00 0.00 N ATOM 1699 CA GLN A 108 10.880 4.528 -3.706 1.00 0.00 C ATOM 1700 C GLN A 108 9.959 4.918 -4.857 1.00 0.00 C ATOM 1701 O GLN A 108 8.771 4.597 -4.850 1.00 0.00 O ATOM 1702 CB GLN A 108 11.081 5.723 -2.772 1.00 0.00 C ATOM 1703 CG GLN A 108 9.787 6.423 -2.390 1.00 0.00 C ATOM 1704 CD GLN A 108 9.165 5.853 -1.131 1.00 0.00 C ATOM 1705 OE1 GLN A 108 9.631 4.848 -0.594 1.00 0.00 O ATOM 1706 NE2 GLN A 108 8.105 6.495 -0.651 1.00 0.00 N ATOM 0 H GLN A 108 12.967 4.337 -3.643 1.00 0.00 H new ATOM 0 HA GLN A 108 10.413 3.715 -3.150 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.582 5.384 -1.865 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.744 6.442 -3.253 1.00 0.00 H new ATOM 0 HG2 GLN A 108 9.982 7.486 -2.245 1.00 0.00 H new ATOM 0 HG3 GLN A 108 9.076 6.339 -3.212 1.00 0.00 H new ATOM 0 HE21 GLN A 108 7.752 7.324 -1.128 1.00 0.00 H new ATOM 0 HE22 GLN A 108 7.645 6.158 0.195 1.00 0.00 H new ATOM 1715 N GLU A 109 10.515 5.612 -5.845 1.00 0.00 N ATOM 1716 CA GLU A 109 9.742 6.047 -7.003 1.00 0.00 C ATOM 1717 C GLU A 109 9.323 4.853 -7.855 1.00 0.00 C ATOM 1718 O GLU A 109 8.133 4.601 -8.049 1.00 0.00 O ATOM 1719 CB GLU A 109 10.555 7.030 -7.847 1.00 0.00 C ATOM 1720 CG GLU A 109 9.989 7.250 -9.239 1.00 0.00 C ATOM 1721 CD GLU A 109 10.677 8.382 -9.977 1.00 0.00 C ATOM 1722 OE1 GLU A 109 11.777 8.153 -10.523 1.00 0.00 O ATOM 1723 OE2 GLU A 109 10.115 9.497 -10.009 1.00 0.00 O ATOM 0 H GLU A 109 11.498 5.885 -5.867 1.00 0.00 H new ATOM 0 HA GLU A 109 8.844 6.547 -6.642 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.604 7.987 -7.328 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.577 6.662 -7.934 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.089 6.331 -9.817 1.00 0.00 H new ATOM 0 HG3 GLU A 109 8.923 7.465 -9.164 1.00 0.00 H new ATOM 1730 N HIS A 110 10.309 4.120 -8.364 1.00 0.00 N ATOM 1731 CA HIS A 110 10.043 2.953 -9.196 1.00 0.00 C ATOM 1732 C HIS A 110 8.809 2.203 -8.703 1.00 0.00 C ATOM 1733 O HIS A 110 7.874 1.958 -9.466 1.00 0.00 O ATOM 1734 CB HIS A 110 11.253 2.018 -9.202 1.00 0.00 C ATOM 1735 CG HIS A 110 11.255 1.047 -10.342 1.00 0.00 C ATOM 1736 ND1 HIS A 110 11.383 1.434 -11.660 1.00 0.00 N ATOM 1737 CD2 HIS A 110 11.145 -0.302 -10.357 1.00 0.00 C ATOM 1738 CE1 HIS A 110 11.350 0.365 -12.435 1.00 0.00 C ATOM 1739 NE2 HIS A 110 11.207 -0.701 -11.669 1.00 0.00 N ATOM 0 H HIS A 110 11.299 4.314 -8.214 1.00 0.00 H new ATOM 0 HA HIS A 110 9.854 3.298 -10.212 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.163 2.616 -9.243 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.278 1.464 -8.264 1.00 0.00 H new ATOM 0 HD2 HIS A 110 11.030 -0.945 -9.497 1.00 0.00 H new ATOM 0 HE1 HIS A 110 11.427 0.363 -13.512 1.00 0.00 H new ATOM 0 HE2 HIS A 110 11.152 -1.665 -11.999 1.00 0.00 H new ATOM 1747 N ILE A 111 8.814 1.842 -7.424 1.00 0.00 N ATOM 1748 CA ILE A 111 7.695 1.121 -6.830 1.00 0.00 C ATOM 1749 C ILE A 111 6.388 1.884 -7.019 1.00 0.00 C ATOM 1750 O ILE A 111 5.355 1.296 -7.343 1.00 0.00 O ATOM 1751 CB ILE A 111 7.919 0.874 -5.327 1.00 0.00 C ATOM 1752 CG1 ILE A 111 9.190 0.050 -5.108 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.714 0.170 -4.721 1.00 0.00 C ATOM 1754 CD1 ILE A 111 9.144 -1.316 -5.757 1.00 0.00 C ATOM 0 H ILE A 111 9.580 2.037 -6.780 1.00 0.00 H new ATOM 0 HA ILE A 111 7.630 0.161 -7.342 1.00 0.00 H new ATOM 0 HB ILE A 111 8.041 1.836 -4.829 1.00 0.00 H new ATOM 0 HG12 ILE A 111 10.043 0.602 -5.502 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.355 -0.071 -4.037 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.887 0.002 -3.658 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.827 0.790 -4.851 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.563 -0.787 -5.220 1.00 0.00 H new ATOM 0 HD11 ILE A 111 10.077 -1.844 -5.561 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.311 -1.886 -5.346 1.00 0.00 H new ATOM 0 HD13 ILE A 111 9.010 -1.203 -6.833 1.00 0.00 H new ATOM 1766 N TYR A 112 6.440 3.195 -6.816 1.00 0.00 N ATOM 1767 CA TYR A 112 5.260 4.039 -6.963 1.00 0.00 C ATOM 1768 C TYR A 112 4.639 3.872 -8.347 1.00 0.00 C ATOM 1769 O TYR A 112 3.464 3.529 -8.477 1.00 0.00 O ATOM 1770 CB TYR A 112 5.623 5.506 -6.729 1.00 0.00 C ATOM 1771 CG TYR A 112 4.516 6.470 -7.092 1.00 0.00 C ATOM 1772 CD1 TYR A 112 4.238 6.772 -8.419 1.00 0.00 C ATOM 1773 CD2 TYR A 112 3.748 7.078 -6.107 1.00 0.00 C ATOM 1774 CE1 TYR A 112 3.228 7.652 -8.755 1.00 0.00 C ATOM 1775 CE2 TYR A 112 2.734 7.959 -6.433 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.479 8.243 -7.759 1.00 0.00 C ATOM 1777 OH TYR A 112 1.471 9.119 -8.089 1.00 0.00 O ATOM 0 H TYR A 112 7.287 3.697 -6.549 1.00 0.00 H new ATOM 0 HA TYR A 112 4.529 3.729 -6.216 1.00 0.00 H new ATOM 0 HB2 TYR A 112 5.884 5.644 -5.680 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.511 5.749 -7.313 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.822 6.311 -9.202 1.00 0.00 H new ATOM 0 HD2 TYR A 112 3.947 6.859 -5.068 1.00 0.00 H new ATOM 0 HE1 TYR A 112 3.026 7.876 -9.792 1.00 0.00 H new ATOM 0 HE2 TYR A 112 2.145 8.422 -5.655 1.00 0.00 H new ATOM 0 HH TYR A 112 1.246 9.668 -7.309 1.00 0.00 H new ATOM 1787 N LYS A 113 5.439 4.117 -9.380 1.00 0.00 N ATOM 1788 CA LYS A 113 4.972 3.992 -10.755 1.00 0.00 C ATOM 1789 C LYS A 113 4.391 2.605 -11.009 1.00 0.00 C ATOM 1790 O LYS A 113 3.707 2.380 -12.009 1.00 0.00 O ATOM 1791 CB LYS A 113 6.119 4.263 -11.731 1.00 0.00 C ATOM 1792 CG LYS A 113 6.580 5.710 -11.742 1.00 0.00 C ATOM 1793 CD LYS A 113 7.921 5.873 -11.045 1.00 0.00 C ATOM 1794 CE LYS A 113 9.058 5.316 -11.888 1.00 0.00 C ATOM 1795 NZ LYS A 113 9.595 6.331 -12.837 1.00 0.00 N ATOM 0 H LYS A 113 6.414 4.403 -9.290 1.00 0.00 H new ATOM 0 HA LYS A 113 4.186 4.730 -10.914 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.963 3.624 -11.473 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.803 3.984 -12.736 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.659 6.060 -12.771 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.834 6.334 -11.249 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.101 6.929 -10.842 1.00 0.00 H new ATOM 0 HD3 LYS A 113 7.896 5.363 -10.082 1.00 0.00 H new ATOM 0 HE2 LYS A 113 9.859 4.971 -11.234 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.705 4.448 -12.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.368 5.912 -13.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 8.837 6.642 -13.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 9.955 7.148 -12.304 1.00 0.00 H new ATOM 1809 N LEU A 114 4.667 1.677 -10.099 1.00 0.00 N ATOM 1810 CA LEU A 114 4.170 0.311 -10.224 1.00 0.00 C ATOM 1811 C LEU A 114 2.854 0.140 -9.472 1.00 0.00 C ATOM 1812 O LEU A 114 1.795 -0.009 -10.081 1.00 0.00 O ATOM 1813 CB LEU A 114 5.207 -0.680 -9.693 1.00 0.00 C ATOM 1814 CG LEU A 114 4.684 -2.072 -9.336 1.00 0.00 C ATOM 1815 CD1 LEU A 114 4.764 -2.997 -10.540 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.463 -2.650 -8.163 1.00 0.00 C ATOM 0 H LEU A 114 5.232 1.846 -9.267 1.00 0.00 H new ATOM 0 HA LEU A 114 3.992 0.110 -11.280 1.00 0.00 H new ATOM 0 HB2 LEU A 114 5.992 -0.790 -10.441 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.671 -0.249 -8.805 1.00 0.00 H new ATOM 0 HG LEU A 114 3.638 -1.982 -9.042 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.388 -3.983 -10.267 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.161 -2.590 -11.352 1.00 0.00 H new ATOM 0 HD13 LEU A 114 5.801 -3.082 -10.865 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.077 -3.641 -7.923 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.517 -2.726 -8.428 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.353 -1.998 -7.296 1.00 0.00 H new ATOM 1828 N MET A 115 2.929 0.164 -8.146 1.00 0.00 N ATOM 1829 CA MET A 115 1.742 0.014 -7.311 1.00 0.00 C ATOM 1830 C MET A 115 0.591 0.859 -7.847 1.00 0.00 C ATOM 1831 O MET A 115 -0.572 0.463 -7.769 1.00 0.00 O ATOM 1832 CB MET A 115 2.054 0.414 -5.867 1.00 0.00 C ATOM 1833 CG MET A 115 3.220 -0.353 -5.263 1.00 0.00 C ATOM 1834 SD MET A 115 3.672 0.249 -3.625 1.00 0.00 S ATOM 1835 CE MET A 115 4.177 1.924 -4.007 1.00 0.00 C ATOM 0 H MET A 115 3.798 0.286 -7.626 1.00 0.00 H new ATOM 0 HA MET A 115 1.442 -1.034 -7.334 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.275 1.481 -5.834 1.00 0.00 H new ATOM 0 HB3 MET A 115 1.167 0.253 -5.254 1.00 0.00 H new ATOM 0 HG2 MET A 115 2.961 -1.410 -5.199 1.00 0.00 H new ATOM 0 HG3 MET A 115 4.083 -0.276 -5.925 1.00 0.00 H new ATOM 0 HE1 MET A 115 5.232 2.050 -3.765 1.00 0.00 H new ATOM 0 HE2 MET A 115 4.023 2.117 -5.069 1.00 0.00 H new ATOM 0 HE3 MET A 115 3.584 2.626 -3.421 1.00 0.00 H new ATOM 1845 N LYS A 116 0.922 2.025 -8.390 1.00 0.00 N ATOM 1846 CA LYS A 116 -0.084 2.926 -8.940 1.00 0.00 C ATOM 1847 C LYS A 116 -0.998 2.191 -9.915 1.00 0.00 C ATOM 1848 O LYS A 116 -2.222 2.287 -9.826 1.00 0.00 O ATOM 1849 CB LYS A 116 0.589 4.106 -9.646 1.00 0.00 C ATOM 1850 CG LYS A 116 1.329 3.714 -10.913 1.00 0.00 C ATOM 1851 CD LYS A 116 1.924 4.927 -11.609 1.00 0.00 C ATOM 1852 CE LYS A 116 0.886 5.648 -12.456 1.00 0.00 C ATOM 1853 NZ LYS A 116 1.496 6.295 -13.650 1.00 0.00 N ATOM 0 H LYS A 116 1.880 2.369 -8.461 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.689 3.301 -8.115 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.168 4.851 -9.893 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.289 4.579 -8.958 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.123 3.008 -10.668 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.646 3.203 -11.591 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.328 5.613 -10.865 1.00 0.00 H new ATOM 0 HD3 LYS A 116 2.756 4.614 -12.240 1.00 0.00 H new ATOM 0 HE2 LYS A 116 0.123 4.939 -12.777 1.00 0.00 H new ATOM 0 HE3 LYS A 116 0.384 6.403 -11.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.756 6.775 -14.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 2.206 6.990 -13.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 1.953 5.572 -14.241 1.00 0.00 H new ATOM 1867 N SER A 117 -0.396 1.457 -10.845 1.00 0.00 N ATOM 1868 CA SER A 117 -1.156 0.707 -11.838 1.00 0.00 C ATOM 1869 C SER A 117 -0.914 -0.792 -11.690 1.00 0.00 C ATOM 1870 O SER A 117 -1.183 -1.569 -12.606 1.00 0.00 O ATOM 1871 CB SER A 117 -0.777 1.160 -13.250 1.00 0.00 C ATOM 1872 OG SER A 117 -1.847 0.952 -14.156 1.00 0.00 O ATOM 0 H SER A 117 0.616 1.366 -10.932 1.00 0.00 H new ATOM 0 HA SER A 117 -2.215 0.904 -11.673 1.00 0.00 H new ATOM 0 HB2 SER A 117 -0.508 2.216 -13.237 1.00 0.00 H new ATOM 0 HB3 SER A 117 0.102 0.611 -13.588 1.00 0.00 H new ATOM 0 HG SER A 117 -2.121 0.012 -14.128 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.402 -1.190 -10.530 1.00 0.00 N ATOM 1879 CA ASP A 118 -0.124 -2.596 -10.260 1.00 0.00 C ATOM 1880 C ASP A 118 -1.256 -3.230 -9.458 1.00 0.00 C ATOM 1881 O ASP A 118 -1.979 -4.090 -9.960 1.00 0.00 O ATOM 1882 CB ASP A 118 1.197 -2.739 -9.502 1.00 0.00 C ATOM 1883 CG ASP A 118 1.667 -4.179 -9.426 1.00 0.00 C ATOM 1884 OD1 ASP A 118 0.837 -5.087 -9.639 1.00 0.00 O ATOM 1885 OD2 ASP A 118 2.866 -4.397 -9.155 1.00 0.00 O ATOM 0 H ASP A 118 -0.171 -0.559 -9.762 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.045 -3.116 -11.215 1.00 0.00 H new ATOM 0 HB2 ASP A 118 1.961 -2.136 -9.992 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.078 -2.345 -8.493 1.00 0.00 H new ATOM 1890 N SER A 119 -1.402 -2.800 -8.209 1.00 0.00 N ATOM 1891 CA SER A 119 -2.443 -3.330 -7.336 1.00 0.00 C ATOM 1892 C SER A 119 -3.679 -2.434 -7.359 1.00 0.00 C ATOM 1893 O SER A 119 -4.800 -2.909 -7.543 1.00 0.00 O ATOM 1894 CB SER A 119 -1.920 -3.459 -5.904 1.00 0.00 C ATOM 1895 OG SER A 119 -2.540 -4.541 -5.230 1.00 0.00 O ATOM 0 H SER A 119 -0.813 -2.087 -7.779 1.00 0.00 H new ATOM 0 HA SER A 119 -2.724 -4.317 -7.703 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.840 -3.607 -5.920 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.107 -2.533 -5.360 1.00 0.00 H new ATOM 0 HG SER A 119 -2.742 -5.254 -5.872 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.465 -1.137 -7.170 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.560 -0.174 -7.166 1.00 0.00 C ATOM 1903 C TYR A 120 -5.646 -0.581 -8.158 1.00 0.00 C ATOM 1904 O TYR A 120 -6.832 -0.628 -7.833 1.00 0.00 O ATOM 1905 CB TYR A 120 -4.039 1.223 -7.507 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.705 2.327 -6.717 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -4.407 2.524 -5.374 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -5.632 3.173 -7.313 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -5.013 3.530 -4.648 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -6.243 4.183 -6.595 1.00 0.00 C ATOM 1911 CZ TYR A 120 -5.930 4.357 -5.263 1.00 0.00 C ATOM 1912 OH TYR A 120 -6.535 5.362 -4.543 1.00 0.00 O ATOM 0 H TYR A 120 -2.543 -0.728 -7.018 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.994 -0.158 -6.166 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -2.965 1.255 -7.326 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -4.189 1.408 -8.571 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -3.689 1.879 -4.890 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -5.879 3.039 -8.356 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -4.771 3.669 -3.605 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -6.961 4.832 -7.074 1.00 0.00 H new ATOM 0 HH TYR A 120 -6.793 6.088 -5.148 1.00 0.00 H new ATOM 1922 N PRO A 121 -5.231 -0.882 -9.397 1.00 0.00 N ATOM 1923 CA PRO A 121 -6.151 -1.291 -10.463 1.00 0.00 C ATOM 1924 C PRO A 121 -7.125 -2.372 -10.004 1.00 0.00 C ATOM 1925 O PRO A 121 -8.340 -2.217 -10.123 1.00 0.00 O ATOM 1926 CB PRO A 121 -5.219 -1.836 -11.547 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.924 -1.134 -11.322 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.832 -0.847 -9.854 1.00 0.00 C ATOM 0 HA PRO A 121 -6.779 -0.466 -10.798 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -5.103 -2.917 -11.463 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.611 -1.634 -12.544 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -3.088 -1.753 -11.647 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.880 -0.210 -11.899 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.225 -1.591 -9.339 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.374 0.124 -9.665 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.582 -3.466 -9.480 1.00 0.00 N ATOM 1937 CA ARG A 122 -7.403 -4.573 -9.005 1.00 0.00 C ATOM 1938 C ARG A 122 -8.345 -4.114 -7.895 1.00 0.00 C ATOM 1939 O ARG A 122 -9.497 -4.542 -7.828 1.00 0.00 O ATOM 1940 CB ARG A 122 -6.517 -5.712 -8.498 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.823 -6.484 -9.608 1.00 0.00 C ATOM 1942 CD ARG A 122 -5.099 -7.707 -9.067 1.00 0.00 C ATOM 1943 NE ARG A 122 -4.367 -8.417 -10.113 1.00 0.00 N ATOM 1944 CZ ARG A 122 -4.390 -9.737 -10.260 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -5.105 -10.487 -9.432 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -3.698 -10.309 -11.237 1.00 0.00 N ATOM 0 H ARG A 122 -5.578 -3.609 -9.374 1.00 0.00 H new ATOM 0 HA ARG A 122 -8.002 -4.933 -9.841 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.763 -5.303 -7.825 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -7.126 -6.402 -7.913 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -6.557 -6.794 -10.351 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -5.111 -5.833 -10.115 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -4.406 -7.401 -8.283 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -5.821 -8.382 -8.608 1.00 0.00 H new ATOM 0 HE ARG A 122 -3.807 -7.869 -10.766 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -5.639 -10.050 -8.680 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -5.121 -11.500 -9.547 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -3.148 -9.735 -11.876 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -3.716 -11.323 -11.349 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.846 -3.242 -7.026 1.00 0.00 N ATOM 1961 CA PHE A 123 -8.641 -2.726 -5.918 1.00 0.00 C ATOM 1962 C PHE A 123 -10.006 -2.247 -6.405 1.00 0.00 C ATOM 1963 O PHE A 123 -11.032 -2.533 -5.788 1.00 0.00 O ATOM 1964 CB PHE A 123 -7.904 -1.580 -5.223 1.00 0.00 C ATOM 1965 CG PHE A 123 -8.458 -1.245 -3.867 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -8.710 -2.244 -2.941 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -8.727 0.069 -3.520 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -9.220 -1.939 -1.693 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -9.237 0.380 -2.274 1.00 0.00 C ATOM 1970 CZ PHE A 123 -9.484 -0.625 -1.359 1.00 0.00 C ATOM 0 H PHE A 123 -6.894 -2.878 -7.068 1.00 0.00 H new ATOM 0 HA PHE A 123 -8.793 -3.536 -5.205 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.851 -1.844 -5.121 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -7.950 -0.693 -5.855 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -8.506 -3.273 -3.197 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -8.536 0.859 -4.231 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -9.412 -2.727 -0.980 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.442 1.408 -2.016 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.883 -0.384 -0.385 1.00 0.00 H new ATOM 1980 N ILE A 124 -10.007 -1.516 -7.514 1.00 0.00 N ATOM 1981 CA ILE A 124 -11.245 -0.997 -8.085 1.00 0.00 C ATOM 1982 C ILE A 124 -12.141 -2.129 -8.575 1.00 0.00 C ATOM 1983 O ILE A 124 -13.310 -2.215 -8.200 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.965 -0.035 -9.254 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -10.140 1.161 -8.774 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -12.271 0.432 -9.879 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -8.647 0.937 -8.858 1.00 0.00 C ATOM 0 H ILE A 124 -9.166 -1.269 -8.035 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.755 -0.452 -7.291 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.391 -0.566 -10.013 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -10.402 2.035 -9.370 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -10.408 1.386 -7.742 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -12.057 1.111 -10.704 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.824 -0.430 -10.253 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.869 0.949 -9.129 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -8.125 1.825 -8.502 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.372 0.082 -8.240 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -8.366 0.742 -9.893 1.00 0.00 H new ATOM 1999 N ARG A 125 -11.584 -2.996 -9.414 1.00 0.00 N ATOM 2000 CA ARG A 125 -12.333 -4.124 -9.955 1.00 0.00 C ATOM 2001 C ARG A 125 -12.964 -4.946 -8.835 1.00 0.00 C ATOM 2002 O ARG A 125 -14.127 -5.339 -8.919 1.00 0.00 O ATOM 2003 CB ARG A 125 -11.418 -5.012 -10.801 1.00 0.00 C ATOM 2004 CG ARG A 125 -11.242 -4.520 -12.228 1.00 0.00 C ATOM 2005 CD ARG A 125 -10.539 -3.172 -12.270 1.00 0.00 C ATOM 2006 NE ARG A 125 -11.485 -2.060 -12.221 1.00 0.00 N ATOM 2007 CZ ARG A 125 -12.327 -1.769 -13.206 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -12.342 -2.503 -14.310 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -13.158 -0.741 -13.088 1.00 0.00 N ATOM 0 H ARG A 125 -10.617 -2.939 -9.734 1.00 0.00 H new ATOM 0 HA ARG A 125 -13.130 -3.730 -10.585 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.440 -5.072 -10.323 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.825 -6.023 -10.822 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -10.666 -5.250 -12.797 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -12.217 -4.438 -12.709 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -9.848 -3.097 -11.431 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -9.944 -3.102 -13.180 1.00 0.00 H new ATOM 0 HE ARG A 125 -11.500 -1.475 -11.385 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -11.705 -3.294 -14.405 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -12.990 -2.276 -15.064 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -13.150 -0.174 -12.240 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -13.804 -0.518 -13.845 1.00 0.00 H new ATOM 2023 N SER A 126 -12.187 -5.202 -7.787 1.00 0.00 N ATOM 2024 CA SER A 126 -12.668 -5.981 -6.651 1.00 0.00 C ATOM 2025 C SER A 126 -13.826 -5.270 -5.957 1.00 0.00 C ATOM 2026 O SER A 126 -13.894 -4.041 -5.939 1.00 0.00 O ATOM 2027 CB SER A 126 -11.533 -6.224 -5.655 1.00 0.00 C ATOM 2028 OG SER A 126 -11.915 -7.165 -4.667 1.00 0.00 O ATOM 0 H SER A 126 -11.222 -4.882 -7.701 1.00 0.00 H new ATOM 0 HA SER A 126 -13.025 -6.941 -7.025 1.00 0.00 H new ATOM 0 HB2 SER A 126 -10.651 -6.585 -6.184 1.00 0.00 H new ATOM 0 HB3 SER A 126 -11.256 -5.284 -5.178 1.00 0.00 H new ATOM 0 HG SER A 126 -11.172 -7.304 -4.043 1.00 0.00 H new ATOM 2034 N SER A 127 -14.735 -6.053 -5.386 1.00 0.00 N ATOM 2035 CA SER A 127 -15.893 -5.501 -4.692 1.00 0.00 C ATOM 2036 C SER A 127 -15.469 -4.773 -3.421 1.00 0.00 C ATOM 2037 O SER A 127 -16.030 -3.736 -3.069 1.00 0.00 O ATOM 2038 CB SER A 127 -16.888 -6.612 -4.350 1.00 0.00 C ATOM 2039 OG SER A 127 -17.771 -6.856 -5.431 1.00 0.00 O ATOM 0 H SER A 127 -14.692 -7.072 -5.390 1.00 0.00 H new ATOM 0 HA SER A 127 -16.375 -4.784 -5.356 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.347 -7.526 -4.105 1.00 0.00 H new ATOM 0 HB3 SER A 127 -17.460 -6.333 -3.465 1.00 0.00 H new ATOM 0 HG SER A 127 -18.396 -7.571 -5.188 1.00 0.00 H new ATOM 2045 N ALA A 128 -14.474 -5.326 -2.734 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.972 -4.729 -1.503 1.00 0.00 C ATOM 2047 C ALA A 128 -13.995 -3.206 -1.581 1.00 0.00 C ATOM 2048 O ALA A 128 -14.334 -2.531 -0.609 1.00 0.00 O ATOM 2049 CB ALA A 128 -12.562 -5.224 -1.213 1.00 0.00 C ATOM 0 H ALA A 128 -14.000 -6.186 -3.010 1.00 0.00 H new ATOM 0 HA ALA A 128 -14.627 -5.034 -0.687 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -12.199 -4.770 -0.291 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -12.572 -6.308 -1.104 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.903 -4.948 -2.036 1.00 0.00 H new ATOM 2055 N TYR A 129 -13.631 -2.673 -2.742 1.00 0.00 N ATOM 2056 CA TYR A 129 -13.607 -1.229 -2.945 1.00 0.00 C ATOM 2057 C TYR A 129 -15.023 -0.661 -2.986 1.00 0.00 C ATOM 2058 O TYR A 129 -15.384 0.191 -2.175 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.872 -0.888 -4.242 1.00 0.00 C ATOM 2060 CG TYR A 129 -13.004 0.562 -4.650 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -14.072 0.990 -5.428 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -12.060 1.503 -4.258 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -14.197 2.314 -5.804 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -12.178 2.829 -4.628 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.248 3.229 -5.401 1.00 0.00 C ATOM 2066 OH TYR A 129 -13.368 4.549 -5.772 1.00 0.00 O ATOM 0 H TYR A 129 -13.349 -3.219 -3.556 1.00 0.00 H new ATOM 0 HA TYR A 129 -13.078 -0.778 -2.105 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.815 -1.129 -4.125 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -13.256 -1.519 -5.044 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -14.818 0.276 -5.745 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.220 1.193 -3.654 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -15.033 2.630 -6.410 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -11.436 3.548 -4.314 1.00 0.00 H new ATOM 0 HH TYR A 129 -12.939 5.118 -5.100 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.819 -1.141 -3.936 1.00 0.00 N ATOM 2077 CA GLN A 130 -17.195 -0.681 -4.083 1.00 0.00 C ATOM 2078 C GLN A 130 -17.924 -0.710 -2.744 1.00 0.00 C ATOM 2079 O GLN A 130 -18.638 0.230 -2.396 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.938 -1.548 -5.102 1.00 0.00 C ATOM 2081 CG GLN A 130 -17.259 -1.607 -6.461 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.710 -0.496 -7.388 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.886 -0.129 -7.410 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.777 0.048 -8.160 1.00 0.00 N ATOM 0 H GLN A 130 -15.535 -1.848 -4.615 1.00 0.00 H new ATOM 0 HA GLN A 130 -17.172 0.348 -4.441 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -18.030 -2.560 -4.707 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.949 -1.161 -5.227 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -16.179 -1.546 -6.326 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -17.469 -2.570 -6.926 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -15.815 -0.286 -8.110 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -17.022 0.800 -8.803 1.00 0.00 H new ATOM 2093 N GLU A 131 -17.741 -1.796 -1.999 1.00 0.00 N ATOM 2094 CA GLU A 131 -18.384 -1.947 -0.699 1.00 0.00 C ATOM 2095 C GLU A 131 -18.458 -0.608 0.030 1.00 0.00 C ATOM 2096 O GLU A 131 -19.483 -0.265 0.620 1.00 0.00 O ATOM 2097 CB GLU A 131 -17.624 -2.964 0.155 1.00 0.00 C ATOM 2098 CG GLU A 131 -17.521 -4.339 -0.483 1.00 0.00 C ATOM 2099 CD GLU A 131 -17.517 -5.458 0.540 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -18.427 -5.483 1.395 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -16.604 -6.308 0.486 1.00 0.00 O ATOM 0 H GLU A 131 -17.153 -2.583 -2.273 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.399 -2.308 -0.864 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.620 -2.586 0.347 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -18.120 -3.057 1.121 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -18.357 -4.481 -1.168 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -16.609 -4.392 -1.078 1.00 0.00 H new ATOM 2108 N LEU A 132 -17.364 0.144 -0.015 1.00 0.00 N ATOM 2109 CA LEU A 132 -17.303 1.446 0.641 1.00 0.00 C ATOM 2110 C LEU A 132 -18.206 2.453 -0.063 1.00 0.00 C ATOM 2111 O LEU A 132 -18.975 3.170 0.580 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.863 1.962 0.662 1.00 0.00 C ATOM 2113 CG LEU A 132 -14.783 0.926 0.977 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -13.403 1.562 0.925 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -15.031 0.296 2.340 1.00 0.00 C ATOM 0 H LEU A 132 -16.507 -0.125 -0.499 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.654 1.326 1.666 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.642 2.403 -0.310 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.796 2.763 1.398 1.00 0.00 H new ATOM 0 HG LEU A 132 -14.827 0.141 0.222 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -12.647 0.810 1.152 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -13.226 1.966 -0.072 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -13.345 2.367 1.658 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -14.253 -0.439 2.548 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -15.014 1.070 3.107 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -16.004 -0.195 2.342 1.00 0.00 H new ATOM 2127 N LEU A 133 -18.111 2.502 -1.387 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.921 3.420 -2.180 1.00 0.00 C ATOM 2129 C LEU A 133 -20.378 3.387 -1.730 1.00 0.00 C ATOM 2130 O LEU A 133 -20.929 4.401 -1.301 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.825 3.064 -3.664 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.598 3.598 -4.404 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -17.526 3.015 -5.807 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.627 5.118 -4.458 1.00 0.00 C ATOM 0 H LEU A 133 -17.481 1.916 -1.934 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.536 4.429 -2.030 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.837 1.978 -3.758 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.718 3.438 -4.165 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.706 3.291 -3.858 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -16.647 3.406 -6.319 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -17.458 1.929 -5.747 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -18.422 3.292 -6.362 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -16.746 5.480 -4.988 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.526 5.446 -4.980 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -17.630 5.518 -3.444 1.00 0.00 H new ATOM 2146 N SER A 134 -20.997 2.214 -1.829 1.00 0.00 N ATOM 2147 CA SER A 134 -22.391 2.049 -1.435 1.00 0.00 C ATOM 2148 C SER A 134 -22.583 2.400 0.038 1.00 0.00 C ATOM 2149 O SER A 134 -23.358 3.292 0.379 1.00 0.00 O ATOM 2150 CB SER A 134 -22.849 0.613 -1.693 1.00 0.00 C ATOM 2151 OG SER A 134 -24.191 0.423 -1.278 1.00 0.00 O ATOM 0 H SER A 134 -20.554 1.364 -2.179 1.00 0.00 H new ATOM 0 HA SER A 134 -22.996 2.729 -2.035 1.00 0.00 H new ATOM 0 HB2 SER A 134 -22.758 0.384 -2.755 1.00 0.00 H new ATOM 0 HB3 SER A 134 -22.199 -0.081 -1.160 1.00 0.00 H new ATOM 0 HG SER A 134 -24.460 -0.502 -1.455 1.00 0.00 H new ATOM 2157 N GLY A 135 -21.871 1.689 0.907 1.00 0.00 N ATOM 2158 CA GLY A 135 -21.977 1.938 2.333 1.00 0.00 C ATOM 2159 C GLY A 135 -23.307 1.486 2.903 1.00 0.00 C ATOM 2160 O GLY A 135 -24.162 2.297 3.260 1.00 0.00 O ATOM 0 H GLY A 135 -21.223 0.945 0.649 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -21.169 1.421 2.850 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -21.847 3.003 2.523 1.00 0.00 H new ATOM 2164 N PRO A 136 -23.497 0.161 2.993 1.00 0.00 N ATOM 2165 CA PRO A 136 -24.731 -0.427 3.522 1.00 0.00 C ATOM 2166 C PRO A 136 -24.882 -0.205 5.023 1.00 0.00 C ATOM 2167 O PRO A 136 -25.641 -0.907 5.691 1.00 0.00 O ATOM 2168 CB PRO A 136 -24.572 -1.919 3.216 1.00 0.00 C ATOM 2169 CG PRO A 136 -23.100 -2.136 3.142 1.00 0.00 C ATOM 2170 CD PRO A 136 -22.521 -0.864 2.586 1.00 0.00 C ATOM 0 HA PRO A 136 -25.619 0.022 3.078 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -25.024 -2.533 3.995 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -25.059 -2.185 2.278 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -22.688 -2.354 4.127 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -22.863 -2.985 2.502 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -21.531 -0.661 2.994 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -22.415 -0.911 1.502 1.00 0.00 H new ATOM 2178 N SER A 137 -24.155 0.777 5.548 1.00 0.00 N ATOM 2179 CA SER A 137 -24.206 1.089 6.971 1.00 0.00 C ATOM 2180 C SER A 137 -24.373 2.590 7.192 1.00 0.00 C ATOM 2181 O SER A 137 -24.373 3.372 6.241 1.00 0.00 O ATOM 2182 CB SER A 137 -22.936 0.598 7.669 1.00 0.00 C ATOM 2183 OG SER A 137 -21.783 1.213 7.122 1.00 0.00 O ATOM 0 H SER A 137 -23.524 1.370 5.009 1.00 0.00 H new ATOM 0 HA SER A 137 -25.068 0.577 7.399 1.00 0.00 H new ATOM 0 HB2 SER A 137 -22.996 0.815 8.735 1.00 0.00 H new ATOM 0 HB3 SER A 137 -22.857 -0.484 7.568 1.00 0.00 H new ATOM 0 HG SER A 137 -20.985 0.884 7.586 1.00 0.00 H new ATOM 2189 N SER A 138 -24.515 2.984 8.453 1.00 0.00 N ATOM 2190 CA SER A 138 -24.686 4.390 8.800 1.00 0.00 C ATOM 2191 C SER A 138 -23.350 5.125 8.765 1.00 0.00 C ATOM 2192 O SER A 138 -23.244 6.217 8.210 1.00 0.00 O ATOM 2193 CB SER A 138 -25.318 4.521 10.188 1.00 0.00 C ATOM 2194 OG SER A 138 -26.620 3.963 10.210 1.00 0.00 O ATOM 0 H SER A 138 -24.515 2.350 9.252 1.00 0.00 H new ATOM 0 HA SER A 138 -25.349 4.843 8.063 1.00 0.00 H new ATOM 0 HB2 SER A 138 -24.691 4.019 10.925 1.00 0.00 H new ATOM 0 HB3 SER A 138 -25.365 5.572 10.472 1.00 0.00 H new ATOM 0 HG SER A 138 -27.001 4.058 11.108 1.00 0.00 H new ATOM 2200 N GLY A 139 -22.331 4.516 9.364 1.00 0.00 N ATOM 2201 CA GLY A 139 -21.014 5.126 9.391 1.00 0.00 C ATOM 2202 C GLY A 139 -19.911 4.115 9.631 1.00 0.00 C ATOM 2203 O GLY A 139 -20.174 2.919 9.759 1.00 0.00 O ATOM 0 H GLY A 139 -22.394 3.611 9.831 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -20.834 5.637 8.445 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -20.984 5.884 10.174 1.00 0.00 H new TER 2207 GLY A 139