USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 934 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 17 THR OG1 : rot 140:sc= 0 USER MOD Set 1.2: A 108 GLN : amide:sc= -0.873 K(o=-0.87,f=-1.4) USER MOD Set 2.1: A 90 THR OG1 : rot -68:sc= 0.0759 USER MOD Set 2.2: A 91 ASN : amide:sc= -2.34! K(o=-2.3!,f=-0.48) USER MOD Set 3.1: A 64 LYS NZ :NH3+ -112:sc= 0.0848 (180deg=0) USER MOD Set 3.2: A 75 HIS : no HD1:sc= -1.96 K(o=-1.9,f=-7.8!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 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 GLN : amide:sc= -0.0112 X(o=-0.011,f=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ -124:sc= -2.07 (180deg=-3.14!) USER MOD Single : A 27 GLN : amide:sc= 0.558 K(o=0.56,f=-0.18) USER MOD Single : A 34 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0621) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0126 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ -169:sc= -1.21 (180deg=-1.55) USER MOD Single : A 45 HIS : no HD1:sc= 0 X(o=0,f=-0.0019) USER MOD Single : A 47 SER OG : rot -54:sc= -0.38 USER MOD Single : A 48 HIS : no HE2:sc= -4.38! C(o=-4.4!,f=-6.8!) USER MOD Single : A 54 HIS : no HD1:sc= -0.225 K(o=-0.22,f=-0.86) USER MOD Single : A 55 SER OG : rot -16:sc= 0.145 USER MOD Single : A 58 GLN : amide:sc= -0.548 K(o=-0.55,f=-4!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 112:sc= 0.146 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -1.23! C(o=-1.2!,f=-7.9!) USER MOD Single : A 69 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.402 K(o=-0.4,f=-1.1) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.041) USER MOD Single : A 84 GLN : amide:sc= -0.0131 K(o=-0.013,f=-1.2) USER MOD Single : A 89 SER OG : rot -169:sc= 0.105 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0.0141 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= -0.101 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.745 15.577 0.243 1.00 0.00 N ATOM 2 CA GLY A 1 11.311 14.846 -0.876 1.00 0.00 C ATOM 3 C GLY A 1 12.531 15.530 -1.458 1.00 0.00 C ATOM 4 O GLY A 1 13.665 15.181 -1.128 1.00 0.00 O ATOM 0 H1 GLY A 1 9.913 15.068 0.605 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.455 15.661 0.998 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.460 16.527 -0.071 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.582 13.842 -0.550 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.555 14.735 -1.653 1.00 0.00 H new ATOM 8 N SER A 2 12.301 16.507 -2.329 1.00 0.00 N ATOM 9 CA SER A 2 13.391 17.239 -2.964 1.00 0.00 C ATOM 10 C SER A 2 14.424 16.278 -3.544 1.00 0.00 C ATOM 11 O SER A 2 15.630 16.490 -3.410 1.00 0.00 O ATOM 12 CB SER A 2 14.059 18.176 -1.956 1.00 0.00 C ATOM 13 OG SER A 2 14.714 19.247 -2.613 1.00 0.00 O ATOM 0 H SER A 2 11.369 16.810 -2.611 1.00 0.00 H new ATOM 0 HA SER A 2 12.973 17.831 -3.778 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.310 18.570 -1.269 1.00 0.00 H new ATOM 0 HB3 SER A 2 14.779 17.618 -1.357 1.00 0.00 H new ATOM 0 HG SER A 2 15.132 19.833 -1.947 1.00 0.00 H new ATOM 19 N SER A 3 13.943 15.221 -4.190 1.00 0.00 N ATOM 20 CA SER A 3 14.824 14.225 -4.789 1.00 0.00 C ATOM 21 C SER A 3 14.427 13.947 -6.235 1.00 0.00 C ATOM 22 O SER A 3 13.335 14.310 -6.672 1.00 0.00 O ATOM 23 CB SER A 3 14.785 12.927 -3.979 1.00 0.00 C ATOM 24 OG SER A 3 15.973 12.176 -4.161 1.00 0.00 O ATOM 0 H SER A 3 12.948 15.032 -4.312 1.00 0.00 H new ATOM 0 HA SER A 3 15.839 14.621 -4.780 1.00 0.00 H new ATOM 0 HB2 SER A 3 14.656 13.158 -2.922 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.924 12.331 -4.282 1.00 0.00 H new ATOM 0 HG SER A 3 15.924 11.353 -3.632 1.00 0.00 H new ATOM 30 N GLY A 4 15.323 13.301 -6.975 1.00 0.00 N ATOM 31 CA GLY A 4 15.049 12.985 -8.365 1.00 0.00 C ATOM 32 C GLY A 4 13.795 12.151 -8.533 1.00 0.00 C ATOM 33 O GLY A 4 13.392 11.431 -7.619 1.00 0.00 O ATOM 0 H GLY A 4 16.234 12.991 -6.637 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.945 13.911 -8.931 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.898 12.447 -8.787 1.00 0.00 H new ATOM 37 N SER A 5 13.174 12.248 -9.705 1.00 0.00 N ATOM 38 CA SER A 5 11.955 11.500 -9.988 1.00 0.00 C ATOM 39 C SER A 5 12.281 10.138 -10.594 1.00 0.00 C ATOM 40 O SER A 5 11.842 9.103 -10.093 1.00 0.00 O ATOM 41 CB SER A 5 11.056 12.292 -10.940 1.00 0.00 C ATOM 42 OG SER A 5 9.715 11.840 -10.868 1.00 0.00 O ATOM 0 H SER A 5 13.495 12.837 -10.473 1.00 0.00 H new ATOM 0 HA SER A 5 11.428 11.343 -9.047 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.100 13.352 -10.690 1.00 0.00 H new ATOM 0 HB3 SER A 5 11.423 12.190 -11.961 1.00 0.00 H new ATOM 0 HG SER A 5 9.160 12.363 -11.484 1.00 0.00 H new ATOM 48 N SER A 6 13.055 10.148 -11.675 1.00 0.00 N ATOM 49 CA SER A 6 13.438 8.915 -12.352 1.00 0.00 C ATOM 50 C SER A 6 14.949 8.850 -12.548 1.00 0.00 C ATOM 51 O SER A 6 15.600 9.866 -12.786 1.00 0.00 O ATOM 52 CB SER A 6 12.731 8.811 -13.705 1.00 0.00 C ATOM 53 OG SER A 6 11.333 8.652 -13.539 1.00 0.00 O ATOM 0 H SER A 6 13.429 10.996 -12.100 1.00 0.00 H new ATOM 0 HA SER A 6 13.134 8.076 -11.726 1.00 0.00 H new ATOM 0 HB2 SER A 6 12.931 9.707 -14.293 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.132 7.966 -14.265 1.00 0.00 H new ATOM 0 HG SER A 6 10.904 8.590 -14.418 1.00 0.00 H new ATOM 59 N GLY A 7 15.502 7.644 -12.446 1.00 0.00 N ATOM 60 CA GLY A 7 16.932 7.467 -12.614 1.00 0.00 C ATOM 61 C GLY A 7 17.423 7.964 -13.960 1.00 0.00 C ATOM 62 O GLY A 7 16.699 8.657 -14.674 1.00 0.00 O ATOM 0 H GLY A 7 14.984 6.787 -12.250 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.457 7.999 -11.820 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.179 6.411 -12.508 1.00 0.00 H new ATOM 66 N GLN A 8 18.657 7.610 -14.305 1.00 0.00 N ATOM 67 CA GLN A 8 19.244 8.027 -15.572 1.00 0.00 C ATOM 68 C GLN A 8 18.862 7.065 -16.692 1.00 0.00 C ATOM 69 O GLN A 8 18.243 7.462 -17.679 1.00 0.00 O ATOM 70 CB GLN A 8 20.767 8.107 -15.451 1.00 0.00 C ATOM 71 CG GLN A 8 21.467 8.408 -16.767 1.00 0.00 C ATOM 72 CD GLN A 8 22.880 8.923 -16.572 1.00 0.00 C ATOM 73 OE1 GLN A 8 23.852 8.242 -16.901 1.00 0.00 O ATOM 74 NE2 GLN A 8 23.000 10.131 -16.035 1.00 0.00 N ATOM 0 H GLN A 8 19.269 7.036 -13.725 1.00 0.00 H new ATOM 0 HA GLN A 8 18.853 9.015 -15.817 1.00 0.00 H new ATOM 0 HB2 GLN A 8 21.026 8.879 -14.727 1.00 0.00 H new ATOM 0 HB3 GLN A 8 21.142 7.162 -15.057 1.00 0.00 H new ATOM 0 HG2 GLN A 8 21.495 7.504 -17.375 1.00 0.00 H new ATOM 0 HG3 GLN A 8 20.888 9.147 -17.321 1.00 0.00 H new ATOM 0 HE21 GLN A 8 22.167 10.660 -15.778 1.00 0.00 H new ATOM 0 HE22 GLN A 8 23.926 10.530 -15.880 1.00 0.00 H new ATOM 83 N GLU A 9 19.234 5.799 -16.531 1.00 0.00 N ATOM 84 CA GLU A 9 18.930 4.781 -17.530 1.00 0.00 C ATOM 85 C GLU A 9 17.679 3.997 -17.145 1.00 0.00 C ATOM 86 O GLU A 9 17.597 3.434 -16.054 1.00 0.00 O ATOM 87 CB GLU A 9 20.114 3.825 -17.693 1.00 0.00 C ATOM 88 CG GLU A 9 21.277 4.423 -18.467 1.00 0.00 C ATOM 89 CD GLU A 9 22.185 3.365 -19.063 1.00 0.00 C ATOM 90 OE1 GLU A 9 22.653 2.489 -18.307 1.00 0.00 O ATOM 91 OE2 GLU A 9 22.429 3.415 -20.287 1.00 0.00 O ATOM 0 H GLU A 9 19.746 5.454 -15.719 1.00 0.00 H new ATOM 0 HA GLU A 9 18.745 5.284 -18.479 1.00 0.00 H new ATOM 0 HB2 GLU A 9 20.463 3.521 -16.706 1.00 0.00 H new ATOM 0 HB3 GLU A 9 19.775 2.923 -18.203 1.00 0.00 H new ATOM 0 HG2 GLU A 9 20.890 5.056 -19.265 1.00 0.00 H new ATOM 0 HG3 GLU A 9 21.858 5.064 -17.805 1.00 0.00 H new ATOM 98 N SER A 10 16.705 3.967 -18.050 1.00 0.00 N ATOM 99 CA SER A 10 15.455 3.256 -17.804 1.00 0.00 C ATOM 100 C SER A 10 15.705 1.760 -17.639 1.00 0.00 C ATOM 101 O SER A 10 16.399 1.142 -18.446 1.00 0.00 O ATOM 102 CB SER A 10 14.473 3.498 -18.951 1.00 0.00 C ATOM 103 OG SER A 10 13.132 3.363 -18.512 1.00 0.00 O ATOM 0 H SER A 10 16.757 4.426 -18.959 1.00 0.00 H new ATOM 0 HA SER A 10 15.023 3.638 -16.879 1.00 0.00 H new ATOM 0 HB2 SER A 10 14.626 4.497 -19.360 1.00 0.00 H new ATOM 0 HB3 SER A 10 14.668 2.790 -19.756 1.00 0.00 H new ATOM 0 HG SER A 10 12.524 3.524 -19.263 1.00 0.00 H new ATOM 109 N VAL A 11 15.132 1.184 -16.587 1.00 0.00 N ATOM 110 CA VAL A 11 15.290 -0.240 -16.315 1.00 0.00 C ATOM 111 C VAL A 11 13.938 -0.943 -16.263 1.00 0.00 C ATOM 112 O VAL A 11 13.759 -2.009 -16.851 1.00 0.00 O ATOM 113 CB VAL A 11 16.032 -0.479 -14.987 1.00 0.00 C ATOM 114 CG1 VAL A 11 16.157 -1.968 -14.705 1.00 0.00 C ATOM 115 CG2 VAL A 11 17.401 0.183 -15.016 1.00 0.00 C ATOM 0 H VAL A 11 14.554 1.681 -15.909 1.00 0.00 H new ATOM 0 HA VAL A 11 15.881 -0.654 -17.132 1.00 0.00 H new ATOM 0 HB VAL A 11 15.452 -0.029 -14.181 1.00 0.00 H new ATOM 0 HG11 VAL A 11 16.684 -2.117 -13.763 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.163 -2.410 -14.639 1.00 0.00 H new ATOM 0 HG13 VAL A 11 16.714 -2.446 -15.511 1.00 0.00 H new ATOM 0 HG21 VAL A 11 17.912 0.004 -14.070 1.00 0.00 H new ATOM 0 HG22 VAL A 11 17.991 -0.236 -15.831 1.00 0.00 H new ATOM 0 HG23 VAL A 11 17.283 1.256 -15.168 1.00 0.00 H new ATOM 125 N GLU A 12 12.989 -0.337 -15.555 1.00 0.00 N ATOM 126 CA GLU A 12 11.653 -0.906 -15.426 1.00 0.00 C ATOM 127 C GLU A 12 11.714 -2.430 -15.357 1.00 0.00 C ATOM 128 O GLU A 12 10.916 -3.123 -15.988 1.00 0.00 O ATOM 129 CB GLU A 12 10.774 -0.474 -16.602 1.00 0.00 C ATOM 130 CG GLU A 12 11.300 -0.928 -17.953 1.00 0.00 C ATOM 131 CD GLU A 12 10.228 -0.928 -19.026 1.00 0.00 C ATOM 132 OE1 GLU A 12 9.246 -1.687 -18.882 1.00 0.00 O ATOM 133 OE2 GLU A 12 10.370 -0.171 -20.008 1.00 0.00 O ATOM 0 H GLU A 12 13.121 0.547 -15.063 1.00 0.00 H new ATOM 0 HA GLU A 12 11.217 -0.534 -14.499 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.770 -0.873 -16.460 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.689 0.613 -16.601 1.00 0.00 H new ATOM 0 HG2 GLU A 12 12.116 -0.274 -18.260 1.00 0.00 H new ATOM 0 HG3 GLU A 12 11.715 -1.932 -17.859 1.00 0.00 H new ATOM 140 N ASP A 13 12.667 -2.943 -14.586 1.00 0.00 N ATOM 141 CA ASP A 13 12.833 -4.383 -14.433 1.00 0.00 C ATOM 142 C ASP A 13 12.570 -4.811 -12.992 1.00 0.00 C ATOM 143 O ASP A 13 11.681 -5.620 -12.727 1.00 0.00 O ATOM 144 CB ASP A 13 14.243 -4.803 -14.852 1.00 0.00 C ATOM 145 CG ASP A 13 14.328 -6.275 -15.203 1.00 0.00 C ATOM 146 OD1 ASP A 13 14.120 -6.616 -16.386 1.00 0.00 O ATOM 147 OD2 ASP A 13 14.603 -7.087 -14.294 1.00 0.00 O ATOM 0 H ASP A 13 13.336 -2.383 -14.058 1.00 0.00 H new ATOM 0 HA ASP A 13 12.107 -4.877 -15.079 1.00 0.00 H new ATOM 0 HB2 ASP A 13 14.556 -4.209 -15.711 1.00 0.00 H new ATOM 0 HB3 ASP A 13 14.940 -4.585 -14.043 1.00 0.00 H new ATOM 152 N SER A 14 13.348 -4.261 -12.065 1.00 0.00 N ATOM 153 CA SER A 14 13.202 -4.589 -10.652 1.00 0.00 C ATOM 154 C SER A 14 11.806 -4.229 -10.152 1.00 0.00 C ATOM 155 O SER A 14 11.315 -4.804 -9.180 1.00 0.00 O ATOM 156 CB SER A 14 14.258 -3.854 -9.825 1.00 0.00 C ATOM 157 OG SER A 14 15.541 -4.424 -10.013 1.00 0.00 O ATOM 0 H SER A 14 14.086 -3.586 -12.267 1.00 0.00 H new ATOM 0 HA SER A 14 13.344 -5.664 -10.537 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.279 -2.802 -10.109 1.00 0.00 H new ATOM 0 HB3 SER A 14 13.990 -3.894 -8.769 1.00 0.00 H new ATOM 0 HG SER A 14 16.198 -3.935 -9.475 1.00 0.00 H new ATOM 163 N LEU A 15 11.172 -3.274 -10.824 1.00 0.00 N ATOM 164 CA LEU A 15 9.832 -2.836 -10.450 1.00 0.00 C ATOM 165 C LEU A 15 8.842 -3.994 -10.518 1.00 0.00 C ATOM 166 O LEU A 15 9.019 -4.931 -11.296 1.00 0.00 O ATOM 167 CB LEU A 15 9.371 -1.701 -11.365 1.00 0.00 C ATOM 168 CG LEU A 15 9.730 -0.285 -10.912 1.00 0.00 C ATOM 169 CD1 LEU A 15 9.395 0.724 -12.000 1.00 0.00 C ATOM 170 CD2 LEU A 15 9.005 0.061 -9.620 1.00 0.00 C ATOM 0 H LEU A 15 11.564 -2.788 -11.631 1.00 0.00 H new ATOM 0 HA LEU A 15 9.868 -2.474 -9.423 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.798 -1.863 -12.355 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.288 -1.763 -11.470 1.00 0.00 H new ATOM 0 HG LEU A 15 10.803 -0.245 -10.725 1.00 0.00 H new ATOM 0 HD11 LEU A 15 9.657 1.726 -11.660 1.00 0.00 H new ATOM 0 HD12 LEU A 15 9.960 0.487 -12.902 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.328 0.683 -12.219 1.00 0.00 H new ATOM 0 HD21 LEU A 15 9.272 1.072 -9.312 1.00 0.00 H new ATOM 0 HD22 LEU A 15 7.928 0.003 -9.780 1.00 0.00 H new ATOM 0 HD23 LEU A 15 9.294 -0.644 -8.840 1.00 0.00 H new ATOM 182 N ALA A 16 7.797 -3.921 -9.700 1.00 0.00 N ATOM 183 CA ALA A 16 6.776 -4.961 -9.670 1.00 0.00 C ATOM 184 C ALA A 16 5.377 -4.355 -9.635 1.00 0.00 C ATOM 185 O ALA A 16 5.158 -3.305 -9.030 1.00 0.00 O ATOM 186 CB ALA A 16 6.988 -5.875 -8.473 1.00 0.00 C ATOM 0 H ALA A 16 7.635 -3.152 -9.049 1.00 0.00 H new ATOM 0 HA ALA A 16 6.866 -5.550 -10.583 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.218 -6.647 -8.464 1.00 0.00 H new ATOM 0 HB2 ALA A 16 7.970 -6.343 -8.542 1.00 0.00 H new ATOM 0 HB3 ALA A 16 6.928 -5.291 -7.554 1.00 0.00 H new ATOM 192 N THR A 17 4.431 -5.023 -10.287 1.00 0.00 N ATOM 193 CA THR A 17 3.053 -4.550 -10.332 1.00 0.00 C ATOM 194 C THR A 17 2.356 -4.758 -8.992 1.00 0.00 C ATOM 195 O THR A 17 1.753 -5.804 -8.751 1.00 0.00 O ATOM 196 CB THR A 17 2.248 -5.266 -11.433 1.00 0.00 C ATOM 197 OG1 THR A 17 2.965 -5.222 -12.671 1.00 0.00 O ATOM 198 CG2 THR A 17 0.881 -4.623 -11.610 1.00 0.00 C ATOM 0 H THR A 17 4.594 -5.894 -10.792 1.00 0.00 H new ATOM 0 HA THR A 17 3.093 -3.484 -10.557 1.00 0.00 H new ATOM 0 HB THR A 17 2.107 -6.304 -11.132 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.876 -6.082 -13.132 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.332 -5.146 -12.393 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.326 -4.685 -10.674 1.00 0.00 H new ATOM 0 HG23 THR A 17 1.005 -3.577 -11.890 1.00 0.00 H new ATOM 206 N VAL A 18 2.443 -3.756 -8.123 1.00 0.00 N ATOM 207 CA VAL A 18 1.819 -3.829 -6.807 1.00 0.00 C ATOM 208 C VAL A 18 0.471 -3.118 -6.799 1.00 0.00 C ATOM 209 O VAL A 18 0.403 -1.889 -6.839 1.00 0.00 O ATOM 210 CB VAL A 18 2.721 -3.209 -5.724 1.00 0.00 C ATOM 211 CG1 VAL A 18 2.016 -3.213 -4.376 1.00 0.00 C ATOM 212 CG2 VAL A 18 4.046 -3.952 -5.644 1.00 0.00 C ATOM 0 H VAL A 18 2.939 -2.884 -8.307 1.00 0.00 H new ATOM 0 HA VAL A 18 1.670 -4.886 -6.584 1.00 0.00 H new ATOM 0 HB VAL A 18 2.927 -2.174 -5.997 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.668 -2.771 -3.623 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.096 -2.632 -4.445 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.778 -4.238 -4.093 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.671 -3.500 -4.873 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.863 -4.997 -5.396 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.556 -3.892 -6.606 1.00 0.00 H new ATOM 222 N LYS A 19 -0.603 -3.899 -6.745 1.00 0.00 N ATOM 223 CA LYS A 19 -1.952 -3.345 -6.729 1.00 0.00 C ATOM 224 C LYS A 19 -2.350 -2.922 -5.318 1.00 0.00 C ATOM 225 O LYS A 19 -1.942 -3.541 -4.335 1.00 0.00 O ATOM 226 CB LYS A 19 -2.953 -4.371 -7.266 1.00 0.00 C ATOM 227 CG LYS A 19 -2.746 -4.712 -8.732 1.00 0.00 C ATOM 228 CD LYS A 19 -3.957 -5.421 -9.315 1.00 0.00 C ATOM 229 CE LYS A 19 -4.177 -6.777 -8.663 1.00 0.00 C ATOM 230 NZ LYS A 19 -3.352 -7.840 -9.302 1.00 0.00 N ATOM 0 H LYS A 19 -0.565 -4.918 -6.712 1.00 0.00 H new ATOM 0 HA LYS A 19 -1.964 -2.464 -7.371 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.878 -5.284 -6.675 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -3.964 -3.986 -7.130 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.551 -3.799 -9.295 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.866 -5.346 -8.838 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -4.843 -4.802 -9.177 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -3.822 -5.550 -10.389 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -3.931 -6.714 -7.603 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -5.231 -7.046 -8.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -3.970 -8.611 -9.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -2.841 -7.441 -10.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -2.669 -8.211 -8.611 1.00 0.00 H new ATOM 244 N VAL A 20 -3.150 -1.864 -5.226 1.00 0.00 N ATOM 245 CA VAL A 20 -3.605 -1.360 -3.936 1.00 0.00 C ATOM 246 C VAL A 20 -5.127 -1.313 -3.870 1.00 0.00 C ATOM 247 O VAL A 20 -5.796 -1.089 -4.879 1.00 0.00 O ATOM 248 CB VAL A 20 -3.045 0.047 -3.654 1.00 0.00 C ATOM 249 CG1 VAL A 20 -3.834 0.723 -2.543 1.00 0.00 C ATOM 250 CG2 VAL A 20 -1.568 -0.029 -3.299 1.00 0.00 C ATOM 0 H VAL A 20 -3.496 -1.340 -6.030 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.233 -2.049 -3.178 1.00 0.00 H new ATOM 0 HB VAL A 20 -3.148 0.648 -4.558 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -3.424 1.716 -2.358 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -4.879 0.812 -2.841 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.765 0.127 -1.633 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.189 0.974 -3.103 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.439 -0.646 -2.410 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -1.016 -0.469 -4.130 1.00 0.00 H new ATOM 260 N VAL A 21 -5.669 -1.524 -2.675 1.00 0.00 N ATOM 261 CA VAL A 21 -7.114 -1.504 -2.477 1.00 0.00 C ATOM 262 C VAL A 21 -7.487 -0.699 -1.237 1.00 0.00 C ATOM 263 O VAL A 21 -6.914 -0.891 -0.163 1.00 0.00 O ATOM 264 CB VAL A 21 -7.682 -2.929 -2.341 1.00 0.00 C ATOM 265 CG1 VAL A 21 -9.178 -2.884 -2.068 1.00 0.00 C ATOM 266 CG2 VAL A 21 -7.384 -3.742 -3.591 1.00 0.00 C ATOM 0 H VAL A 21 -5.130 -1.711 -1.830 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.548 -1.031 -3.358 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.197 -3.416 -1.495 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.562 -3.900 -1.975 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -9.363 -2.340 -1.142 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -9.683 -2.379 -2.892 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.792 -4.746 -3.478 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.840 -3.260 -4.456 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.306 -3.803 -3.737 1.00 0.00 H new ATOM 276 N LEU A 22 -8.451 0.202 -1.391 1.00 0.00 N ATOM 277 CA LEU A 22 -8.902 1.037 -0.283 1.00 0.00 C ATOM 278 C LEU A 22 -9.981 0.327 0.529 1.00 0.00 C ATOM 279 O LEU A 22 -11.017 -0.067 -0.007 1.00 0.00 O ATOM 280 CB LEU A 22 -9.437 2.370 -0.808 1.00 0.00 C ATOM 281 CG LEU A 22 -8.390 3.356 -1.327 1.00 0.00 C ATOM 282 CD1 LEU A 22 -9.061 4.534 -2.016 1.00 0.00 C ATOM 283 CD2 LEU A 22 -7.501 3.838 -0.189 1.00 0.00 C ATOM 0 H LEU A 22 -8.935 0.373 -2.272 1.00 0.00 H new ATOM 0 HA LEU A 22 -8.049 1.227 0.368 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -10.143 2.164 -1.613 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -9.998 2.854 -0.008 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.765 2.842 -2.057 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -8.300 5.225 -2.379 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.655 4.174 -2.856 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.710 5.048 -1.307 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.762 4.539 -0.577 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.112 4.335 0.565 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.992 2.986 0.261 1.00 0.00 H new ATOM 295 N ILE A 23 -9.731 0.170 1.825 1.00 0.00 N ATOM 296 CA ILE A 23 -10.683 -0.489 2.711 1.00 0.00 C ATOM 297 C ILE A 23 -11.907 0.388 2.952 1.00 0.00 C ATOM 298 O ILE A 23 -13.043 0.001 2.677 1.00 0.00 O ATOM 299 CB ILE A 23 -10.041 -0.838 4.067 1.00 0.00 C ATOM 300 CG1 ILE A 23 -9.435 -2.243 4.022 1.00 0.00 C ATOM 301 CG2 ILE A 23 -11.069 -0.735 5.183 1.00 0.00 C ATOM 302 CD1 ILE A 23 -10.422 -3.313 3.610 1.00 0.00 C ATOM 0 H ILE A 23 -8.878 0.490 2.284 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.990 -1.410 2.216 1.00 0.00 H new ATOM 0 HB ILE A 23 -9.243 -0.124 4.268 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.596 -2.246 3.326 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -9.034 -2.489 5.005 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.599 -0.985 6.134 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.458 0.282 5.226 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.887 -1.429 4.989 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.924 -4.283 3.600 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -11.249 -3.337 4.319 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -10.805 -3.091 2.614 1.00 0.00 H new ATOM 314 N PRO A 24 -11.673 1.599 3.479 1.00 0.00 N ATOM 315 CA PRO A 24 -12.744 2.558 3.767 1.00 0.00 C ATOM 316 C PRO A 24 -13.373 3.123 2.497 1.00 0.00 C ATOM 317 O PRO A 24 -14.477 3.666 2.529 1.00 0.00 O ATOM 318 CB PRO A 24 -12.030 3.664 4.547 1.00 0.00 C ATOM 319 CG PRO A 24 -10.609 3.582 4.107 1.00 0.00 C ATOM 320 CD PRO A 24 -10.344 2.127 3.832 1.00 0.00 C ATOM 0 HA PRO A 24 -13.568 2.097 4.312 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.457 4.642 4.327 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -12.121 3.512 5.622 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.441 4.185 3.214 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -9.939 3.962 4.878 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.630 1.995 3.019 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.930 1.622 4.705 1.00 0.00 H new ATOM 328 N VAL A 25 -12.664 2.990 1.381 1.00 0.00 N ATOM 329 CA VAL A 25 -13.154 3.486 0.101 1.00 0.00 C ATOM 330 C VAL A 25 -13.579 2.337 -0.807 1.00 0.00 C ATOM 331 O VAL A 25 -14.733 2.257 -1.225 1.00 0.00 O ATOM 332 CB VAL A 25 -12.085 4.328 -0.622 1.00 0.00 C ATOM 333 CG1 VAL A 25 -12.730 5.237 -1.656 1.00 0.00 C ATOM 334 CG2 VAL A 25 -11.277 5.137 0.382 1.00 0.00 C ATOM 0 H VAL A 25 -11.748 2.543 1.337 1.00 0.00 H new ATOM 0 HA VAL A 25 -14.018 4.115 0.315 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.405 3.653 -1.142 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.959 5.824 -2.156 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -13.260 4.632 -2.392 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.433 5.908 -1.163 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.526 5.726 -0.145 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.942 5.804 0.931 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.783 4.461 1.080 1.00 0.00 H new ATOM 344 N GLY A 26 -12.637 1.448 -1.109 1.00 0.00 N ATOM 345 CA GLY A 26 -12.934 0.315 -1.965 1.00 0.00 C ATOM 346 C GLY A 26 -12.373 0.483 -3.363 1.00 0.00 C ATOM 347 O GLY A 26 -12.490 -0.416 -4.197 1.00 0.00 O ATOM 0 H GLY A 26 -11.674 1.493 -0.776 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -12.524 -0.591 -1.519 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -14.014 0.181 -2.024 1.00 0.00 H new ATOM 351 N GLN A 27 -11.765 1.636 -3.621 1.00 0.00 N ATOM 352 CA GLN A 27 -11.187 1.918 -4.930 1.00 0.00 C ATOM 353 C GLN A 27 -9.907 1.117 -5.144 1.00 0.00 C ATOM 354 O GLN A 27 -9.229 0.745 -4.187 1.00 0.00 O ATOM 355 CB GLN A 27 -10.896 3.413 -5.070 1.00 0.00 C ATOM 356 CG GLN A 27 -10.769 3.876 -6.513 1.00 0.00 C ATOM 357 CD GLN A 27 -10.511 5.365 -6.628 1.00 0.00 C ATOM 358 OE1 GLN A 27 -11.443 6.161 -6.748 1.00 0.00 O ATOM 359 NE2 GLN A 27 -9.241 5.750 -6.591 1.00 0.00 N ATOM 0 H GLN A 27 -11.660 2.390 -2.942 1.00 0.00 H new ATOM 0 HA GLN A 27 -11.910 1.622 -5.690 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -11.693 3.977 -4.585 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -9.973 3.646 -4.540 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -9.956 3.332 -6.995 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -11.683 3.627 -7.052 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -8.500 5.056 -6.490 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -9.006 6.740 -6.663 1.00 0.00 H new ATOM 368 N GLU A 28 -9.584 0.853 -6.406 1.00 0.00 N ATOM 369 CA GLU A 28 -8.386 0.094 -6.745 1.00 0.00 C ATOM 370 C GLU A 28 -7.364 0.978 -7.455 1.00 0.00 C ATOM 371 O GLU A 28 -7.697 1.691 -8.403 1.00 0.00 O ATOM 372 CB GLU A 28 -8.746 -1.101 -7.631 1.00 0.00 C ATOM 373 CG GLU A 28 -9.336 -2.272 -6.863 1.00 0.00 C ATOM 374 CD GLU A 28 -10.174 -3.181 -7.740 1.00 0.00 C ATOM 375 OE1 GLU A 28 -9.587 -3.940 -8.539 1.00 0.00 O ATOM 376 OE2 GLU A 28 -11.417 -3.133 -7.628 1.00 0.00 O ATOM 0 H GLU A 28 -10.135 1.153 -7.210 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.944 -0.270 -5.818 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.459 -0.778 -8.389 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.852 -1.436 -8.156 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.529 -2.850 -6.413 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -9.951 -1.893 -6.046 1.00 0.00 H new ATOM 383 N ILE A 29 -6.121 0.927 -6.989 1.00 0.00 N ATOM 384 CA ILE A 29 -5.051 1.722 -7.579 1.00 0.00 C ATOM 385 C ILE A 29 -3.825 0.864 -7.869 1.00 0.00 C ATOM 386 O ILE A 29 -3.372 0.100 -7.015 1.00 0.00 O ATOM 387 CB ILE A 29 -4.643 2.887 -6.658 1.00 0.00 C ATOM 388 CG1 ILE A 29 -5.871 3.713 -6.269 1.00 0.00 C ATOM 389 CG2 ILE A 29 -3.604 3.763 -7.342 1.00 0.00 C ATOM 390 CD1 ILE A 29 -5.579 4.781 -5.238 1.00 0.00 C ATOM 0 H ILE A 29 -5.830 0.344 -6.205 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.437 2.127 -8.514 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.203 2.476 -5.750 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.280 4.184 -7.163 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.640 3.045 -5.881 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -3.325 4.582 -6.679 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.721 3.167 -7.573 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.020 4.168 -8.264 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.495 5.327 -5.010 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.199 4.315 -4.329 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.833 5.472 -5.631 1.00 0.00 H new ATOM 402 N VAL A 30 -3.289 0.995 -9.078 1.00 0.00 N ATOM 403 CA VAL A 30 -2.113 0.234 -9.481 1.00 0.00 C ATOM 404 C VAL A 30 -0.904 1.146 -9.662 1.00 0.00 C ATOM 405 O VAL A 30 -0.973 2.151 -10.370 1.00 0.00 O ATOM 406 CB VAL A 30 -2.363 -0.535 -10.791 1.00 0.00 C ATOM 407 CG1 VAL A 30 -1.119 -1.308 -11.203 1.00 0.00 C ATOM 408 CG2 VAL A 30 -3.555 -1.467 -10.642 1.00 0.00 C ATOM 0 H VAL A 30 -3.651 1.622 -9.796 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.910 -0.480 -8.683 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.590 0.185 -11.577 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.315 -1.845 -12.131 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.292 -0.614 -11.353 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.857 -2.020 -10.420 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.717 -2.003 -11.577 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.360 -2.183 -9.843 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.444 -0.885 -10.398 1.00 0.00 H new ATOM 418 N ILE A 31 0.202 0.788 -9.018 1.00 0.00 N ATOM 419 CA ILE A 31 1.426 1.573 -9.110 1.00 0.00 C ATOM 420 C ILE A 31 2.659 0.687 -8.973 1.00 0.00 C ATOM 421 O ILE A 31 2.748 -0.163 -8.087 1.00 0.00 O ATOM 422 CB ILE A 31 1.474 2.670 -8.030 1.00 0.00 C ATOM 423 CG1 ILE A 31 2.771 3.474 -8.146 1.00 0.00 C ATOM 424 CG2 ILE A 31 1.348 2.055 -6.644 1.00 0.00 C ATOM 425 CD1 ILE A 31 2.979 4.452 -7.010 1.00 0.00 C ATOM 0 H ILE A 31 0.275 -0.040 -8.427 1.00 0.00 H new ATOM 0 HA ILE A 31 1.426 2.042 -10.094 1.00 0.00 H new ATOM 0 HB ILE A 31 0.634 3.347 -8.183 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.615 2.785 -8.180 1.00 0.00 H new ATOM 0 HG13 ILE A 31 2.767 4.020 -9.089 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.384 2.843 -5.892 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.400 1.522 -6.567 1.00 0.00 H new ATOM 0 HG23 ILE A 31 2.170 1.358 -6.479 1.00 0.00 H new ATOM 0 HD11 ILE A 31 3.917 4.987 -7.158 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.155 5.165 -6.988 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.015 3.910 -6.065 1.00 0.00 H new ATOM 437 N PRO A 32 3.636 0.889 -9.870 1.00 0.00 N ATOM 438 CA PRO A 32 4.884 0.119 -9.868 1.00 0.00 C ATOM 439 C PRO A 32 5.773 0.459 -8.677 1.00 0.00 C ATOM 440 O PRO A 32 6.238 1.590 -8.539 1.00 0.00 O ATOM 441 CB PRO A 32 5.560 0.538 -11.176 1.00 0.00 C ATOM 442 CG PRO A 32 5.010 1.890 -11.472 1.00 0.00 C ATOM 443 CD PRO A 32 3.598 1.885 -10.953 1.00 0.00 C ATOM 0 HA PRO A 32 4.702 -0.953 -9.790 1.00 0.00 H new ATOM 0 HB2 PRO A 32 6.644 0.567 -11.069 1.00 0.00 H new ATOM 0 HB3 PRO A 32 5.337 -0.164 -11.979 1.00 0.00 H new ATOM 0 HG2 PRO A 32 5.601 2.667 -10.987 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.032 2.094 -12.542 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.302 2.867 -10.585 1.00 0.00 H new ATOM 0 HD3 PRO A 32 2.885 1.607 -11.730 1.00 0.00 H new ATOM 451 N PHE A 33 6.006 -0.529 -7.818 1.00 0.00 N ATOM 452 CA PHE A 33 6.839 -0.334 -6.638 1.00 0.00 C ATOM 453 C PHE A 33 8.087 -1.210 -6.703 1.00 0.00 C ATOM 454 O PHE A 33 8.091 -2.259 -7.347 1.00 0.00 O ATOM 455 CB PHE A 33 6.045 -0.652 -5.369 1.00 0.00 C ATOM 456 CG PHE A 33 6.719 -0.189 -4.109 1.00 0.00 C ATOM 457 CD1 PHE A 33 7.272 1.079 -4.029 1.00 0.00 C ATOM 458 CD2 PHE A 33 6.799 -1.021 -3.004 1.00 0.00 C ATOM 459 CE1 PHE A 33 7.892 1.509 -2.871 1.00 0.00 C ATOM 460 CE2 PHE A 33 7.418 -0.597 -1.843 1.00 0.00 C ATOM 461 CZ PHE A 33 7.966 0.669 -1.777 1.00 0.00 C ATOM 0 H PHE A 33 5.630 -1.472 -7.918 1.00 0.00 H new ATOM 0 HA PHE A 33 7.150 0.710 -6.612 1.00 0.00 H new ATOM 0 HB2 PHE A 33 5.062 -0.186 -5.438 1.00 0.00 H new ATOM 0 HB3 PHE A 33 5.884 -1.728 -5.311 1.00 0.00 H new ATOM 0 HD1 PHE A 33 7.218 1.739 -4.882 1.00 0.00 H new ATOM 0 HD2 PHE A 33 6.373 -2.012 -3.050 1.00 0.00 H new ATOM 0 HE1 PHE A 33 8.318 2.500 -2.822 1.00 0.00 H new ATOM 0 HE2 PHE A 33 7.473 -1.255 -0.988 1.00 0.00 H new ATOM 0 HZ PHE A 33 8.452 1.002 -0.871 1.00 0.00 H new ATOM 471 N LYS A 34 9.146 -0.771 -6.031 1.00 0.00 N ATOM 472 CA LYS A 34 10.401 -1.513 -6.011 1.00 0.00 C ATOM 473 C LYS A 34 10.353 -2.635 -4.979 1.00 0.00 C ATOM 474 O LYS A 34 9.953 -2.423 -3.834 1.00 0.00 O ATOM 475 CB LYS A 34 11.569 -0.573 -5.703 1.00 0.00 C ATOM 476 CG LYS A 34 11.743 0.536 -6.727 1.00 0.00 C ATOM 477 CD LYS A 34 12.370 0.016 -8.010 1.00 0.00 C ATOM 478 CE LYS A 34 13.160 1.102 -8.724 1.00 0.00 C ATOM 479 NZ LYS A 34 12.325 2.302 -9.006 1.00 0.00 N ATOM 0 H LYS A 34 9.160 0.095 -5.493 1.00 0.00 H new ATOM 0 HA LYS A 34 10.548 -1.955 -6.997 1.00 0.00 H new ATOM 0 HB2 LYS A 34 11.417 -0.128 -4.720 1.00 0.00 H new ATOM 0 HB3 LYS A 34 12.489 -1.155 -5.650 1.00 0.00 H new ATOM 0 HG2 LYS A 34 10.774 0.983 -6.949 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.369 1.324 -6.308 1.00 0.00 H new ATOM 0 HD2 LYS A 34 13.027 -0.823 -7.781 1.00 0.00 H new ATOM 0 HD3 LYS A 34 11.590 -0.362 -8.671 1.00 0.00 H new ATOM 0 HE2 LYS A 34 14.015 1.390 -8.113 1.00 0.00 H new ATOM 0 HE3 LYS A 34 13.556 0.707 -9.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 12.844 2.945 -9.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 11.439 2.008 -9.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 12.108 2.792 -8.114 1.00 0.00 H new ATOM 493 N VAL A 35 10.765 -3.830 -5.391 1.00 0.00 N ATOM 494 CA VAL A 35 10.771 -4.985 -4.501 1.00 0.00 C ATOM 495 C VAL A 35 11.954 -4.933 -3.541 1.00 0.00 C ATOM 496 O VAL A 35 11.909 -5.506 -2.452 1.00 0.00 O ATOM 497 CB VAL A 35 10.825 -6.304 -5.294 1.00 0.00 C ATOM 498 CG1 VAL A 35 9.713 -6.350 -6.331 1.00 0.00 C ATOM 499 CG2 VAL A 35 12.186 -6.474 -5.953 1.00 0.00 C ATOM 0 H VAL A 35 11.099 -4.023 -6.335 1.00 0.00 H new ATOM 0 HA VAL A 35 9.843 -4.950 -3.931 1.00 0.00 H new ATOM 0 HB VAL A 35 10.676 -7.131 -4.600 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.767 -7.289 -6.881 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.747 -6.277 -5.832 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.827 -5.516 -7.024 1.00 0.00 H new ATOM 0 HG21 VAL A 35 12.206 -7.411 -6.509 1.00 0.00 H new ATOM 0 HG22 VAL A 35 12.366 -5.643 -6.635 1.00 0.00 H new ATOM 0 HG23 VAL A 35 12.962 -6.489 -5.187 1.00 0.00 H new ATOM 509 N ASP A 36 13.013 -4.243 -3.952 1.00 0.00 N ATOM 510 CA ASP A 36 14.209 -4.114 -3.128 1.00 0.00 C ATOM 511 C ASP A 36 14.223 -2.776 -2.396 1.00 0.00 C ATOM 512 O ASP A 36 15.282 -2.191 -2.169 1.00 0.00 O ATOM 513 CB ASP A 36 15.465 -4.252 -3.990 1.00 0.00 C ATOM 514 CG ASP A 36 16.699 -4.566 -3.168 1.00 0.00 C ATOM 515 OD1 ASP A 36 16.556 -5.204 -2.104 1.00 0.00 O ATOM 516 OD2 ASP A 36 17.808 -4.174 -3.588 1.00 0.00 O ATOM 0 H ASP A 36 13.067 -3.764 -4.851 1.00 0.00 H new ATOM 0 HA ASP A 36 14.197 -4.913 -2.386 1.00 0.00 H new ATOM 0 HB2 ASP A 36 15.312 -5.041 -4.726 1.00 0.00 H new ATOM 0 HB3 ASP A 36 15.626 -3.327 -4.543 1.00 0.00 H new ATOM 521 N THR A 37 13.039 -2.296 -2.029 1.00 0.00 N ATOM 522 CA THR A 37 12.914 -1.026 -1.324 1.00 0.00 C ATOM 523 C THR A 37 11.897 -1.122 -0.193 1.00 0.00 C ATOM 524 O THR A 37 10.785 -1.615 -0.386 1.00 0.00 O ATOM 525 CB THR A 37 12.497 0.108 -2.280 1.00 0.00 C ATOM 526 OG1 THR A 37 13.479 0.266 -3.310 1.00 0.00 O ATOM 527 CG2 THR A 37 12.331 1.418 -1.525 1.00 0.00 C ATOM 0 H THR A 37 12.153 -2.768 -2.208 1.00 0.00 H new ATOM 0 HA THR A 37 13.895 -0.798 -0.907 1.00 0.00 H new ATOM 0 HB THR A 37 11.540 -0.158 -2.729 1.00 0.00 H new ATOM 0 HG1 THR A 37 13.206 0.987 -3.914 1.00 0.00 H new ATOM 0 HG21 THR A 37 12.036 2.204 -2.220 1.00 0.00 H new ATOM 0 HG22 THR A 37 11.562 1.303 -0.761 1.00 0.00 H new ATOM 0 HG23 THR A 37 13.275 1.687 -1.052 1.00 0.00 H new ATOM 535 N ILE A 38 12.284 -0.647 0.986 1.00 0.00 N ATOM 536 CA ILE A 38 11.403 -0.678 2.147 1.00 0.00 C ATOM 537 C ILE A 38 10.008 -0.177 1.793 1.00 0.00 C ATOM 538 O ILE A 38 9.850 0.719 0.962 1.00 0.00 O ATOM 539 CB ILE A 38 11.965 0.172 3.302 1.00 0.00 C ATOM 540 CG1 ILE A 38 12.466 1.519 2.776 1.00 0.00 C ATOM 541 CG2 ILE A 38 13.083 -0.573 4.015 1.00 0.00 C ATOM 542 CD1 ILE A 38 12.884 2.477 3.869 1.00 0.00 C ATOM 0 H ILE A 38 13.201 -0.236 1.162 1.00 0.00 H new ATOM 0 HA ILE A 38 11.341 -1.718 2.468 1.00 0.00 H new ATOM 0 HB ILE A 38 11.165 0.357 4.019 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.312 1.348 2.111 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.680 1.982 2.179 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.469 0.042 4.828 1.00 0.00 H new ATOM 0 HG22 ILE A 38 12.697 -1.509 4.419 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.886 -0.787 3.309 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.228 3.410 3.423 1.00 0.00 H new ATOM 0 HD12 ILE A 38 12.034 2.678 4.521 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.692 2.034 4.452 1.00 0.00 H new ATOM 554 N LEU A 39 8.997 -0.759 2.429 1.00 0.00 N ATOM 555 CA LEU A 39 7.613 -0.370 2.182 1.00 0.00 C ATOM 556 C LEU A 39 7.387 1.095 2.541 1.00 0.00 C ATOM 557 O LEU A 39 6.372 1.687 2.172 1.00 0.00 O ATOM 558 CB LEU A 39 6.662 -1.256 2.988 1.00 0.00 C ATOM 559 CG LEU A 39 6.718 -2.753 2.682 1.00 0.00 C ATOM 560 CD1 LEU A 39 6.361 -3.565 3.917 1.00 0.00 C ATOM 561 CD2 LEU A 39 5.787 -3.097 1.528 1.00 0.00 C ATOM 0 H LEU A 39 9.110 -1.502 3.119 1.00 0.00 H new ATOM 0 HA LEU A 39 7.409 -0.501 1.119 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.875 -1.114 4.047 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.643 -0.909 2.819 1.00 0.00 H new ATOM 0 HG LEU A 39 7.737 -3.006 2.389 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.406 -4.628 3.679 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.068 -3.341 4.716 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.353 -3.309 4.242 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.840 -4.166 1.324 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.764 -2.828 1.793 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.089 -2.543 0.639 1.00 0.00 H new ATOM 573 N LYS A 40 8.340 1.677 3.262 1.00 0.00 N ATOM 574 CA LYS A 40 8.248 3.074 3.668 1.00 0.00 C ATOM 575 C LYS A 40 8.080 3.983 2.455 1.00 0.00 C ATOM 576 O LYS A 40 7.192 4.835 2.424 1.00 0.00 O ATOM 577 CB LYS A 40 9.496 3.481 4.455 1.00 0.00 C ATOM 578 CG LYS A 40 9.239 4.571 5.481 1.00 0.00 C ATOM 579 CD LYS A 40 9.105 5.934 4.824 1.00 0.00 C ATOM 580 CE LYS A 40 10.465 6.546 4.527 1.00 0.00 C ATOM 581 NZ LYS A 40 11.046 7.215 5.724 1.00 0.00 N ATOM 0 H LYS A 40 9.186 1.202 3.577 1.00 0.00 H new ATOM 0 HA LYS A 40 7.371 3.184 4.306 1.00 0.00 H new ATOM 0 HB2 LYS A 40 9.898 2.604 4.962 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.260 3.823 3.757 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.329 4.342 6.036 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.056 4.593 6.203 1.00 0.00 H new ATOM 0 HD2 LYS A 40 8.538 5.838 3.898 1.00 0.00 H new ATOM 0 HD3 LYS A 40 8.540 6.600 5.477 1.00 0.00 H new ATOM 0 HE2 LYS A 40 11.145 5.768 4.180 1.00 0.00 H new ATOM 0 HE3 LYS A 40 10.369 7.270 3.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 11.973 7.619 5.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 10.410 7.974 6.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 11.162 6.519 6.488 1.00 0.00 H new ATOM 595 N TYR A 41 8.937 3.796 1.458 1.00 0.00 N ATOM 596 CA TYR A 41 8.884 4.601 0.243 1.00 0.00 C ATOM 597 C TYR A 41 7.444 4.787 -0.225 1.00 0.00 C ATOM 598 O TYR A 41 6.951 5.911 -0.323 1.00 0.00 O ATOM 599 CB TYR A 41 9.712 3.945 -0.864 1.00 0.00 C ATOM 600 CG TYR A 41 11.171 4.339 -0.844 1.00 0.00 C ATOM 601 CD1 TYR A 41 11.939 4.177 0.302 1.00 0.00 C ATOM 602 CD2 TYR A 41 11.783 4.873 -1.972 1.00 0.00 C ATOM 603 CE1 TYR A 41 13.273 4.536 0.326 1.00 0.00 C ATOM 604 CE2 TYR A 41 13.116 5.234 -1.958 1.00 0.00 C ATOM 605 CZ TYR A 41 13.857 5.064 -0.807 1.00 0.00 C ATOM 606 OH TYR A 41 15.185 5.422 -0.788 1.00 0.00 O ATOM 0 H TYR A 41 9.677 3.094 1.467 1.00 0.00 H new ATOM 0 HA TYR A 41 9.303 5.582 0.468 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.636 2.862 -0.770 1.00 0.00 H new ATOM 0 HB3 TYR A 41 9.286 4.211 -1.831 1.00 0.00 H new ATOM 0 HD1 TYR A 41 11.485 3.763 1.190 1.00 0.00 H new ATOM 0 HD2 TYR A 41 11.206 5.008 -2.875 1.00 0.00 H new ATOM 0 HE1 TYR A 41 13.855 4.404 1.226 1.00 0.00 H new ATOM 0 HE2 TYR A 41 13.576 5.647 -2.844 1.00 0.00 H new ATOM 0 HH TYR A 41 15.441 5.776 -1.665 1.00 0.00 H new ATOM 616 N LEU A 42 6.775 3.676 -0.512 1.00 0.00 N ATOM 617 CA LEU A 42 5.390 3.714 -0.969 1.00 0.00 C ATOM 618 C LEU A 42 4.467 4.231 0.130 1.00 0.00 C ATOM 619 O LEU A 42 3.481 4.916 -0.143 1.00 0.00 O ATOM 620 CB LEU A 42 4.940 2.321 -1.414 1.00 0.00 C ATOM 621 CG LEU A 42 3.643 2.260 -2.221 1.00 0.00 C ATOM 622 CD1 LEU A 42 3.863 2.799 -3.626 1.00 0.00 C ATOM 623 CD2 LEU A 42 3.113 0.835 -2.272 1.00 0.00 C ATOM 0 H LEU A 42 7.169 2.738 -0.436 1.00 0.00 H new ATOM 0 HA LEU A 42 5.333 4.396 -1.817 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.737 1.877 -2.011 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.822 1.699 -0.527 1.00 0.00 H new ATOM 0 HG LEU A 42 2.900 2.885 -1.726 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.929 2.748 -4.186 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.196 3.835 -3.570 1.00 0.00 H new ATOM 0 HD13 LEU A 42 4.622 2.201 -4.131 1.00 0.00 H new ATOM 0 HD21 LEU A 42 2.189 0.811 -2.850 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.853 0.188 -2.743 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.916 0.484 -1.259 1.00 0.00 H new ATOM 635 N LYS A 43 4.796 3.902 1.375 1.00 0.00 N ATOM 636 CA LYS A 43 4.000 4.336 2.517 1.00 0.00 C ATOM 637 C LYS A 43 3.838 5.852 2.522 1.00 0.00 C ATOM 638 O LYS A 43 2.761 6.372 2.227 1.00 0.00 O ATOM 639 CB LYS A 43 4.653 3.878 3.823 1.00 0.00 C ATOM 640 CG LYS A 43 3.853 4.238 5.062 1.00 0.00 C ATOM 641 CD LYS A 43 4.075 3.235 6.181 1.00 0.00 C ATOM 642 CE LYS A 43 3.156 2.031 6.042 1.00 0.00 C ATOM 643 NZ LYS A 43 1.721 2.414 6.147 1.00 0.00 N ATOM 0 H LYS A 43 5.609 3.336 1.619 1.00 0.00 H new ATOM 0 HA LYS A 43 3.012 3.883 2.433 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.791 2.797 3.791 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.645 4.323 3.899 1.00 0.00 H new ATOM 0 HG2 LYS A 43 4.137 5.233 5.403 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.793 4.277 4.813 1.00 0.00 H new ATOM 0 HD2 LYS A 43 5.113 2.904 6.173 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.901 3.717 7.143 1.00 0.00 H new ATOM 0 HE2 LYS A 43 3.334 1.548 5.081 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.395 1.301 6.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 1.138 1.557 6.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 1.582 3.014 6.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 1.439 2.939 5.295 1.00 0.00 H new ATOM 657 N ASP A 44 4.913 6.557 2.858 1.00 0.00 N ATOM 658 CA ASP A 44 4.889 8.014 2.899 1.00 0.00 C ATOM 659 C ASP A 44 4.190 8.582 1.668 1.00 0.00 C ATOM 660 O ASP A 44 3.506 9.603 1.744 1.00 0.00 O ATOM 661 CB ASP A 44 6.313 8.566 2.992 1.00 0.00 C ATOM 662 CG ASP A 44 6.346 10.006 3.465 1.00 0.00 C ATOM 663 OD1 ASP A 44 5.538 10.815 2.963 1.00 0.00 O ATOM 664 OD2 ASP A 44 7.180 10.324 4.338 1.00 0.00 O ATOM 0 H ASP A 44 5.812 6.143 3.106 1.00 0.00 H new ATOM 0 HA ASP A 44 4.330 8.318 3.784 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.895 7.948 3.676 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.791 8.497 2.015 1.00 0.00 H new ATOM 669 N HIS A 45 4.366 7.913 0.533 1.00 0.00 N ATOM 670 CA HIS A 45 3.752 8.351 -0.716 1.00 0.00 C ATOM 671 C HIS A 45 2.251 8.561 -0.539 1.00 0.00 C ATOM 672 O HIS A 45 1.730 9.643 -0.811 1.00 0.00 O ATOM 673 CB HIS A 45 4.008 7.326 -1.821 1.00 0.00 C ATOM 674 CG HIS A 45 3.987 7.913 -3.199 1.00 0.00 C ATOM 675 ND1 HIS A 45 5.131 8.169 -3.925 1.00 0.00 N ATOM 676 CD2 HIS A 45 2.952 8.294 -3.984 1.00 0.00 C ATOM 677 CE1 HIS A 45 4.801 8.683 -5.096 1.00 0.00 C ATOM 678 NE2 HIS A 45 3.484 8.769 -5.157 1.00 0.00 N ATOM 0 H HIS A 45 4.928 7.066 0.452 1.00 0.00 H new ATOM 0 HA HIS A 45 4.203 9.302 -1.000 1.00 0.00 H new ATOM 0 HB2 HIS A 45 4.976 6.854 -1.651 1.00 0.00 H new ATOM 0 HB3 HIS A 45 3.255 6.540 -1.758 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.903 8.235 -3.734 1.00 0.00 H new ATOM 0 HE1 HIS A 45 5.490 8.982 -5.872 1.00 0.00 H new ATOM 0 HE2 HIS A 45 2.949 9.130 -5.947 1.00 0.00 H new ATOM 687 N PHE A 46 1.563 7.521 -0.081 1.00 0.00 N ATOM 688 CA PHE A 46 0.122 7.592 0.131 1.00 0.00 C ATOM 689 C PHE A 46 -0.207 8.442 1.355 1.00 0.00 C ATOM 690 O PHE A 46 -1.187 9.187 1.362 1.00 0.00 O ATOM 691 CB PHE A 46 -0.460 6.187 0.301 1.00 0.00 C ATOM 692 CG PHE A 46 -0.831 5.530 -0.998 1.00 0.00 C ATOM 693 CD1 PHE A 46 0.150 5.064 -1.859 1.00 0.00 C ATOM 694 CD2 PHE A 46 -2.160 5.379 -1.358 1.00 0.00 C ATOM 695 CE1 PHE A 46 -0.188 4.459 -3.055 1.00 0.00 C ATOM 696 CE2 PHE A 46 -2.504 4.775 -2.553 1.00 0.00 C ATOM 697 CZ PHE A 46 -1.517 4.315 -3.402 1.00 0.00 C ATOM 0 H PHE A 46 1.980 6.619 0.150 1.00 0.00 H new ATOM 0 HA PHE A 46 -0.326 8.060 -0.746 1.00 0.00 H new ATOM 0 HB2 PHE A 46 0.266 5.562 0.820 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.344 6.243 0.936 1.00 0.00 H new ATOM 0 HD1 PHE A 46 1.191 5.175 -1.592 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -2.936 5.737 -0.698 1.00 0.00 H new ATOM 0 HE1 PHE A 46 0.586 4.100 -3.717 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -3.544 4.663 -2.822 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.784 3.843 -4.336 1.00 0.00 H new ATOM 707 N SER A 47 0.620 8.325 2.389 1.00 0.00 N ATOM 708 CA SER A 47 0.415 9.078 3.620 1.00 0.00 C ATOM 709 C SER A 47 0.279 10.570 3.328 1.00 0.00 C ATOM 710 O SER A 47 -0.784 11.159 3.527 1.00 0.00 O ATOM 711 CB SER A 47 1.577 8.841 4.587 1.00 0.00 C ATOM 712 OG SER A 47 1.155 8.975 5.934 1.00 0.00 O ATOM 0 H SER A 47 1.438 7.716 2.398 1.00 0.00 H new ATOM 0 HA SER A 47 -0.509 8.729 4.080 1.00 0.00 H new ATOM 0 HB2 SER A 47 1.988 7.844 4.429 1.00 0.00 H new ATOM 0 HB3 SER A 47 2.377 9.552 4.381 1.00 0.00 H new ATOM 0 HG SER A 47 0.723 9.846 6.056 1.00 0.00 H new ATOM 718 N HIS A 48 1.364 11.175 2.855 1.00 0.00 N ATOM 719 CA HIS A 48 1.367 12.598 2.534 1.00 0.00 C ATOM 720 C HIS A 48 0.223 12.944 1.586 1.00 0.00 C ATOM 721 O HIS A 48 -0.592 13.821 1.874 1.00 0.00 O ATOM 722 CB HIS A 48 2.703 12.998 1.907 1.00 0.00 C ATOM 723 CG HIS A 48 2.724 12.876 0.414 1.00 0.00 C ATOM 724 ND1 HIS A 48 3.180 11.753 -0.243 1.00 0.00 N ATOM 725 CD2 HIS A 48 2.340 13.745 -0.550 1.00 0.00 C ATOM 726 CE1 HIS A 48 3.078 11.937 -1.547 1.00 0.00 C ATOM 727 NE2 HIS A 48 2.570 13.137 -1.760 1.00 0.00 N ATOM 0 H HIS A 48 2.252 10.702 2.686 1.00 0.00 H new ATOM 0 HA HIS A 48 1.228 13.154 3.461 1.00 0.00 H new ATOM 0 HB2 HIS A 48 2.931 14.028 2.182 1.00 0.00 H new ATOM 0 HB3 HIS A 48 3.493 12.374 2.326 1.00 0.00 H new ATOM 0 HD1 HIS A 48 3.540 10.912 0.207 1.00 0.00 H new ATOM 0 HD2 HIS A 48 1.929 14.732 -0.396 1.00 0.00 H new ATOM 0 HE1 HIS A 48 3.362 11.227 -2.309 1.00 0.00 H new ATOM 736 N LEU A 49 0.167 12.249 0.455 1.00 0.00 N ATOM 737 CA LEU A 49 -0.877 12.483 -0.536 1.00 0.00 C ATOM 738 C LEU A 49 -2.249 12.560 0.126 1.00 0.00 C ATOM 739 O LEU A 49 -2.952 13.564 0.007 1.00 0.00 O ATOM 740 CB LEU A 49 -0.867 11.372 -1.587 1.00 0.00 C ATOM 741 CG LEU A 49 -1.739 11.608 -2.821 1.00 0.00 C ATOM 742 CD1 LEU A 49 -3.182 11.862 -2.415 1.00 0.00 C ATOM 743 CD2 LEU A 49 -1.200 12.772 -3.640 1.00 0.00 C ATOM 0 H LEU A 49 0.833 11.519 0.202 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.675 13.437 -1.022 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.161 11.220 -1.917 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.189 10.446 -1.111 1.00 0.00 H new ATOM 0 HG LEU A 49 -1.710 10.711 -3.439 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.787 12.028 -3.306 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.565 10.998 -1.872 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.230 12.743 -1.775 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.833 12.926 -4.514 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.198 13.676 -3.030 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.183 12.550 -3.963 1.00 0.00 H new ATOM 755 N LEU A 50 -2.623 11.495 0.826 1.00 0.00 N ATOM 756 CA LEU A 50 -3.910 11.442 1.510 1.00 0.00 C ATOM 757 C LEU A 50 -4.055 12.603 2.488 1.00 0.00 C ATOM 758 O LEU A 50 -5.166 13.019 2.814 1.00 0.00 O ATOM 759 CB LEU A 50 -4.062 10.113 2.252 1.00 0.00 C ATOM 760 CG LEU A 50 -4.030 8.853 1.386 1.00 0.00 C ATOM 761 CD1 LEU A 50 -3.572 7.655 2.203 1.00 0.00 C ATOM 762 CD2 LEU A 50 -5.399 8.592 0.774 1.00 0.00 C ATOM 0 H LEU A 50 -2.053 10.656 0.935 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.696 11.523 0.759 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.266 10.041 2.993 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.005 10.131 2.798 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.316 9.009 0.577 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.556 6.768 1.570 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -2.571 7.841 2.593 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.261 7.496 3.033 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -5.358 7.692 0.161 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.133 8.457 1.568 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.688 9.440 0.154 1.00 0.00 H new ATOM 774 N GLY A 51 -2.923 13.124 2.953 1.00 0.00 N ATOM 775 CA GLY A 51 -2.945 14.233 3.888 1.00 0.00 C ATOM 776 C GLY A 51 -2.851 13.778 5.330 1.00 0.00 C ATOM 777 O GLY A 51 -2.924 14.592 6.251 1.00 0.00 O ATOM 0 H GLY A 51 -1.991 12.797 2.698 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.116 14.906 3.668 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.864 14.803 3.749 1.00 0.00 H new ATOM 781 N ILE A 52 -2.690 12.474 5.528 1.00 0.00 N ATOM 782 CA ILE A 52 -2.587 11.912 6.869 1.00 0.00 C ATOM 783 C ILE A 52 -1.230 11.251 7.085 1.00 0.00 C ATOM 784 O ILE A 52 -0.592 10.766 6.150 1.00 0.00 O ATOM 785 CB ILE A 52 -3.697 10.879 7.134 1.00 0.00 C ATOM 786 CG1 ILE A 52 -3.605 9.730 6.128 1.00 0.00 C ATOM 787 CG2 ILE A 52 -5.065 11.542 7.065 1.00 0.00 C ATOM 788 CD1 ILE A 52 -4.708 8.705 6.278 1.00 0.00 C ATOM 0 H ILE A 52 -2.628 11.787 4.777 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.700 12.741 7.568 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.562 10.472 8.136 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.635 10.139 5.118 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.641 9.234 6.242 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.839 10.799 7.254 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.126 12.329 7.816 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -5.211 11.973 6.075 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.579 7.920 5.533 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.666 8.268 7.276 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -5.675 9.187 6.134 1.00 0.00 H new ATOM 800 N PRO A 53 -0.777 11.228 8.347 1.00 0.00 N ATOM 801 CA PRO A 53 0.508 10.626 8.716 1.00 0.00 C ATOM 802 C PRO A 53 0.494 9.106 8.590 1.00 0.00 C ATOM 803 O PRO A 53 -0.565 8.495 8.443 1.00 0.00 O ATOM 804 CB PRO A 53 0.686 11.039 10.179 1.00 0.00 C ATOM 805 CG PRO A 53 -0.699 11.262 10.681 1.00 0.00 C ATOM 806 CD PRO A 53 -1.484 11.787 9.511 1.00 0.00 C ATOM 0 HA PRO A 53 1.316 10.958 8.063 1.00 0.00 H new ATOM 0 HB2 PRO A 53 1.194 10.262 10.751 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.289 11.943 10.265 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -1.132 10.335 11.057 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -0.705 11.974 11.506 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -2.523 11.460 9.545 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -1.493 12.877 9.490 1.00 0.00 H new ATOM 814 N HIS A 54 1.676 8.501 8.649 1.00 0.00 N ATOM 815 CA HIS A 54 1.799 7.051 8.542 1.00 0.00 C ATOM 816 C HIS A 54 1.664 6.392 9.911 1.00 0.00 C ATOM 817 O HIS A 54 1.523 5.174 10.013 1.00 0.00 O ATOM 818 CB HIS A 54 3.141 6.677 7.912 1.00 0.00 C ATOM 819 CG HIS A 54 4.320 7.276 8.616 1.00 0.00 C ATOM 820 ND1 HIS A 54 4.756 6.847 9.852 1.00 0.00 N ATOM 821 CD2 HIS A 54 5.156 8.275 8.249 1.00 0.00 C ATOM 822 CE1 HIS A 54 5.809 7.557 10.216 1.00 0.00 C ATOM 823 NE2 HIS A 54 6.072 8.431 9.260 1.00 0.00 N ATOM 0 H HIS A 54 2.562 8.992 8.770 1.00 0.00 H new ATOM 0 HA HIS A 54 0.993 6.689 7.903 1.00 0.00 H new ATOM 0 HB2 HIS A 54 3.242 5.592 7.910 1.00 0.00 H new ATOM 0 HB3 HIS A 54 3.147 7.000 6.871 1.00 0.00 H new ATOM 0 HD2 HIS A 54 5.111 8.844 7.332 1.00 0.00 H new ATOM 0 HE1 HIS A 54 6.361 7.443 11.137 1.00 0.00 H new ATOM 0 HE2 HIS A 54 6.832 9.111 9.271 1.00 0.00 H new ATOM 832 N SER A 55 1.709 7.206 10.961 1.00 0.00 N ATOM 833 CA SER A 55 1.597 6.702 12.325 1.00 0.00 C ATOM 834 C SER A 55 0.226 6.074 12.561 1.00 0.00 C ATOM 835 O SER A 55 0.030 5.327 13.519 1.00 0.00 O ATOM 836 CB SER A 55 1.834 7.830 13.330 1.00 0.00 C ATOM 837 OG SER A 55 1.620 7.384 14.658 1.00 0.00 O ATOM 0 H SER A 55 1.822 8.217 10.893 1.00 0.00 H new ATOM 0 HA SER A 55 2.358 5.935 12.466 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.853 8.204 13.228 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.166 8.663 13.111 1.00 0.00 H new ATOM 0 HG SER A 55 1.123 6.540 14.643 1.00 0.00 H new ATOM 843 N VAL A 56 -0.719 6.385 11.680 1.00 0.00 N ATOM 844 CA VAL A 56 -2.072 5.852 11.790 1.00 0.00 C ATOM 845 C VAL A 56 -2.399 4.937 10.615 1.00 0.00 C ATOM 846 O VAL A 56 -3.313 4.114 10.691 1.00 0.00 O ATOM 847 CB VAL A 56 -3.117 6.982 11.853 1.00 0.00 C ATOM 848 CG1 VAL A 56 -2.983 7.761 13.153 1.00 0.00 C ATOM 849 CG2 VAL A 56 -2.977 7.904 10.652 1.00 0.00 C ATOM 0 H VAL A 56 -0.573 7.003 10.882 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.112 5.278 12.716 1.00 0.00 H new ATOM 0 HB VAL A 56 -4.111 6.536 11.826 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -3.729 8.555 13.180 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.137 7.089 13.997 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -1.986 8.198 13.214 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -3.723 8.696 10.713 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.980 8.344 10.645 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -3.128 7.333 9.736 1.00 0.00 H new ATOM 859 N LEU A 57 -1.648 5.084 9.530 1.00 0.00 N ATOM 860 CA LEU A 57 -1.857 4.270 8.338 1.00 0.00 C ATOM 861 C LEU A 57 -1.014 3.000 8.391 1.00 0.00 C ATOM 862 O LEU A 57 0.089 2.999 8.936 1.00 0.00 O ATOM 863 CB LEU A 57 -1.513 5.073 7.082 1.00 0.00 C ATOM 864 CG LEU A 57 -1.207 4.255 5.826 1.00 0.00 C ATOM 865 CD1 LEU A 57 -2.481 3.646 5.262 1.00 0.00 C ATOM 866 CD2 LEU A 57 -0.519 5.121 4.780 1.00 0.00 C ATOM 0 H LEU A 57 -0.888 5.760 9.451 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.908 3.984 8.303 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.346 5.741 6.862 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.650 5.701 7.302 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.531 3.444 6.099 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.244 3.068 4.369 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.933 2.992 6.008 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.181 4.441 5.004 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.309 4.523 3.893 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.170 5.953 4.511 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.415 5.509 5.186 1.00 0.00 H new ATOM 878 N GLN A 58 -1.541 1.922 7.819 1.00 0.00 N ATOM 879 CA GLN A 58 -0.836 0.646 7.800 1.00 0.00 C ATOM 880 C GLN A 58 -1.135 -0.122 6.517 1.00 0.00 C ATOM 881 O GLN A 58 -1.955 0.305 5.703 1.00 0.00 O ATOM 882 CB GLN A 58 -1.229 -0.196 9.015 1.00 0.00 C ATOM 883 CG GLN A 58 -0.761 0.390 10.338 1.00 0.00 C ATOM 884 CD GLN A 58 0.720 0.174 10.579 1.00 0.00 C ATOM 885 OE1 GLN A 58 1.549 0.453 9.712 1.00 0.00 O ATOM 886 NE2 GLN A 58 1.061 -0.324 11.762 1.00 0.00 N ATOM 0 H GLN A 58 -2.453 1.907 7.363 1.00 0.00 H new ATOM 0 HA GLN A 58 0.234 0.850 7.839 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -2.314 -0.302 9.038 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.813 -1.197 8.903 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.976 1.458 10.354 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.328 -0.062 11.152 1.00 0.00 H new ATOM 0 HE21 GLN A 58 0.341 -0.541 12.451 1.00 0.00 H new ATOM 0 HE22 GLN A 58 2.043 -0.490 11.982 1.00 0.00 H new ATOM 895 N ILE A 59 -0.464 -1.255 6.342 1.00 0.00 N ATOM 896 CA ILE A 59 -0.659 -2.083 5.157 1.00 0.00 C ATOM 897 C ILE A 59 -0.802 -3.554 5.532 1.00 0.00 C ATOM 898 O ILE A 59 -0.012 -4.086 6.312 1.00 0.00 O ATOM 899 CB ILE A 59 0.509 -1.929 4.165 1.00 0.00 C ATOM 900 CG1 ILE A 59 0.778 -0.449 3.886 1.00 0.00 C ATOM 901 CG2 ILE A 59 0.206 -2.671 2.872 1.00 0.00 C ATOM 902 CD1 ILE A 59 1.865 -0.215 2.860 1.00 0.00 C ATOM 0 H ILE A 59 0.219 -1.621 7.005 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.578 -1.741 4.680 1.00 0.00 H new ATOM 0 HB ILE A 59 1.404 -2.364 4.610 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -0.143 0.021 3.541 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.057 0.043 4.818 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.040 -2.553 2.181 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.059 -3.730 3.086 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.699 -2.263 2.422 1.00 0.00 H new ATOM 0 HD11 ILE A 59 2.002 0.856 2.713 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.798 -0.655 3.212 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.579 -0.678 1.915 1.00 0.00 H new ATOM 914 N ARG A 60 -1.815 -4.206 4.970 1.00 0.00 N ATOM 915 CA ARG A 60 -2.062 -5.616 5.245 1.00 0.00 C ATOM 916 C ARG A 60 -1.746 -6.471 4.021 1.00 0.00 C ATOM 917 O ARG A 60 -2.255 -6.222 2.928 1.00 0.00 O ATOM 918 CB ARG A 60 -3.517 -5.828 5.666 1.00 0.00 C ATOM 919 CG ARG A 60 -3.912 -7.292 5.777 1.00 0.00 C ATOM 920 CD ARG A 60 -5.182 -7.466 6.595 1.00 0.00 C ATOM 921 NE ARG A 60 -6.383 -7.371 5.769 1.00 0.00 N ATOM 922 CZ ARG A 60 -7.601 -7.178 6.262 1.00 0.00 C ATOM 923 NH1 ARG A 60 -7.779 -7.059 7.571 1.00 0.00 N ATOM 924 NH2 ARG A 60 -8.644 -7.103 5.446 1.00 0.00 N ATOM 0 H ARG A 60 -2.477 -3.780 4.322 1.00 0.00 H new ATOM 0 HA ARG A 60 -1.407 -5.922 6.061 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.683 -5.342 6.627 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -4.170 -5.338 4.944 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.061 -7.706 4.780 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.101 -7.855 6.239 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -5.161 -8.435 7.095 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.218 -6.706 7.375 1.00 0.00 H new ATOM 0 HE ARG A 60 -6.281 -7.458 4.758 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.979 -7.116 8.202 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -8.716 -6.911 7.947 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -8.511 -7.194 4.439 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -9.579 -6.955 5.826 1.00 0.00 H new ATOM 938 N TYR A 61 -0.903 -7.480 4.213 1.00 0.00 N ATOM 939 CA TYR A 61 -0.517 -8.371 3.125 1.00 0.00 C ATOM 940 C TYR A 61 -0.438 -9.816 3.606 1.00 0.00 C ATOM 941 O TYR A 61 0.263 -10.124 4.570 1.00 0.00 O ATOM 942 CB TYR A 61 0.830 -7.941 2.540 1.00 0.00 C ATOM 943 CG TYR A 61 1.404 -8.932 1.553 1.00 0.00 C ATOM 944 CD1 TYR A 61 0.972 -8.957 0.233 1.00 0.00 C ATOM 945 CD2 TYR A 61 2.381 -9.842 1.939 1.00 0.00 C ATOM 946 CE1 TYR A 61 1.494 -9.860 -0.673 1.00 0.00 C ATOM 947 CE2 TYR A 61 2.909 -10.748 1.040 1.00 0.00 C ATOM 948 CZ TYR A 61 2.462 -10.753 -0.264 1.00 0.00 C ATOM 949 OH TYR A 61 2.985 -11.654 -1.164 1.00 0.00 O ATOM 0 H TYR A 61 -0.474 -7.701 5.112 1.00 0.00 H new ATOM 0 HA TYR A 61 -1.280 -8.308 2.349 1.00 0.00 H new ATOM 0 HB2 TYR A 61 0.711 -6.976 2.047 1.00 0.00 H new ATOM 0 HB3 TYR A 61 1.541 -7.797 3.354 1.00 0.00 H new ATOM 0 HD1 TYR A 61 0.215 -8.258 -0.091 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.734 -9.841 2.960 1.00 0.00 H new ATOM 0 HE1 TYR A 61 1.146 -9.866 -1.695 1.00 0.00 H new ATOM 0 HE2 TYR A 61 3.668 -11.448 1.357 1.00 0.00 H new ATOM 0 HH TYR A 61 3.656 -12.211 -0.717 1.00 0.00 H new ATOM 959 N SER A 62 -1.162 -10.700 2.927 1.00 0.00 N ATOM 960 CA SER A 62 -1.177 -12.113 3.285 1.00 0.00 C ATOM 961 C SER A 62 -1.755 -12.312 4.683 1.00 0.00 C ATOM 962 O SER A 62 -1.443 -13.290 5.363 1.00 0.00 O ATOM 963 CB SER A 62 0.237 -12.693 3.218 1.00 0.00 C ATOM 964 OG SER A 62 0.531 -13.168 1.916 1.00 0.00 O ATOM 0 H SER A 62 -1.746 -10.462 2.125 1.00 0.00 H new ATOM 0 HA SER A 62 -1.811 -12.637 2.570 1.00 0.00 H new ATOM 0 HB2 SER A 62 0.961 -11.929 3.502 1.00 0.00 H new ATOM 0 HB3 SER A 62 0.334 -13.507 3.936 1.00 0.00 H new ATOM 0 HG SER A 62 1.215 -12.598 1.507 1.00 0.00 H new ATOM 970 N GLY A 63 -2.600 -11.377 5.107 1.00 0.00 N ATOM 971 CA GLY A 63 -3.208 -11.467 6.421 1.00 0.00 C ATOM 972 C GLY A 63 -2.291 -10.968 7.520 1.00 0.00 C ATOM 973 O GLY A 63 -2.701 -10.847 8.675 1.00 0.00 O ATOM 0 H GLY A 63 -2.874 -10.559 4.563 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -4.131 -10.887 6.431 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.480 -12.503 6.622 1.00 0.00 H new ATOM 977 N LYS A 64 -1.045 -10.678 7.162 1.00 0.00 N ATOM 978 CA LYS A 64 -0.066 -10.189 8.125 1.00 0.00 C ATOM 979 C LYS A 64 0.336 -8.751 7.811 1.00 0.00 C ATOM 980 O LYS A 64 0.469 -8.375 6.646 1.00 0.00 O ATOM 981 CB LYS A 64 1.173 -11.087 8.125 1.00 0.00 C ATOM 982 CG LYS A 64 2.131 -10.802 6.981 1.00 0.00 C ATOM 983 CD LYS A 64 3.486 -11.450 7.214 1.00 0.00 C ATOM 984 CE LYS A 64 4.144 -11.850 5.902 1.00 0.00 C ATOM 985 NZ LYS A 64 5.306 -12.757 6.119 1.00 0.00 N ATOM 0 H LYS A 64 -0.689 -10.773 6.211 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.524 -10.212 9.114 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.702 -10.962 9.070 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.856 -12.129 8.072 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.705 -11.172 6.048 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.256 -9.725 6.870 1.00 0.00 H new ATOM 0 HD2 LYS A 64 4.134 -10.758 7.751 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.366 -12.330 7.846 1.00 0.00 H new ATOM 0 HE2 LYS A 64 3.411 -12.344 5.264 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.475 -10.956 5.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 6.185 -12.263 5.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 5.345 -13.038 7.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 5.201 -13.604 5.525 1.00 0.00 H new ATOM 999 N ILE A 65 0.529 -7.954 8.856 1.00 0.00 N ATOM 1000 CA ILE A 65 0.918 -6.559 8.690 1.00 0.00 C ATOM 1001 C ILE A 65 2.403 -6.437 8.365 1.00 0.00 C ATOM 1002 O ILE A 65 3.226 -7.197 8.877 1.00 0.00 O ATOM 1003 CB ILE A 65 0.613 -5.735 9.955 1.00 0.00 C ATOM 1004 CG1 ILE A 65 -0.800 -6.038 10.459 1.00 0.00 C ATOM 1005 CG2 ILE A 65 0.773 -4.249 9.671 1.00 0.00 C ATOM 1006 CD1 ILE A 65 -1.885 -5.341 9.668 1.00 0.00 C ATOM 0 H ILE A 65 0.422 -8.250 9.826 1.00 0.00 H new ATOM 0 HA ILE A 65 0.332 -6.165 7.859 1.00 0.00 H new ATOM 0 HB ILE A 65 1.324 -6.014 10.733 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -0.968 -7.114 10.421 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -0.876 -5.741 11.505 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.554 -3.680 10.575 1.00 0.00 H new ATOM 0 HG22 ILE A 65 1.796 -4.047 9.354 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.083 -3.953 8.880 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.860 -5.601 10.080 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.742 -4.262 9.727 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.836 -5.657 8.626 1.00 0.00 H new ATOM 1018 N LEU A 66 2.739 -5.476 7.511 1.00 0.00 N ATOM 1019 CA LEU A 66 4.126 -5.253 7.118 1.00 0.00 C ATOM 1020 C LEU A 66 4.608 -3.881 7.579 1.00 0.00 C ATOM 1021 O LEU A 66 3.870 -2.898 7.517 1.00 0.00 O ATOM 1022 CB LEU A 66 4.272 -5.374 5.600 1.00 0.00 C ATOM 1023 CG LEU A 66 3.306 -6.336 4.907 1.00 0.00 C ATOM 1024 CD1 LEU A 66 3.472 -6.264 3.397 1.00 0.00 C ATOM 1025 CD2 LEU A 66 3.525 -7.759 5.402 1.00 0.00 C ATOM 0 H LEU A 66 2.070 -4.839 7.078 1.00 0.00 H new ATOM 0 HA LEU A 66 4.741 -6.014 7.598 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.143 -4.384 5.163 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.291 -5.691 5.377 1.00 0.00 H new ATOM 0 HG LEU A 66 2.287 -6.038 5.154 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.777 -6.955 2.921 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.265 -5.249 3.056 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.493 -6.536 3.130 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.829 -8.430 4.899 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.548 -8.067 5.184 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.355 -7.800 6.478 1.00 0.00 H new ATOM 1037 N LYS A 67 5.853 -3.822 8.040 1.00 0.00 N ATOM 1038 CA LYS A 67 6.438 -2.571 8.508 1.00 0.00 C ATOM 1039 C LYS A 67 7.403 -2.001 7.474 1.00 0.00 C ATOM 1040 O LYS A 67 7.675 -2.629 6.452 1.00 0.00 O ATOM 1041 CB LYS A 67 7.166 -2.791 9.836 1.00 0.00 C ATOM 1042 CG LYS A 67 8.500 -3.502 9.688 1.00 0.00 C ATOM 1043 CD LYS A 67 9.010 -4.014 11.024 1.00 0.00 C ATOM 1044 CE LYS A 67 10.289 -4.822 10.860 1.00 0.00 C ATOM 1045 NZ LYS A 67 11.130 -4.785 12.088 1.00 0.00 N ATOM 0 H LYS A 67 6.477 -4.627 8.099 1.00 0.00 H new ATOM 0 HA LYS A 67 5.631 -1.854 8.658 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.330 -1.826 10.315 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.526 -3.372 10.500 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.394 -4.336 8.994 1.00 0.00 H new ATOM 0 HG3 LYS A 67 9.231 -2.819 9.256 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.193 -3.172 11.692 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.245 -4.633 11.494 1.00 0.00 H new ATOM 0 HE2 LYS A 67 10.038 -5.856 10.623 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.860 -4.432 10.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 11.992 -5.347 11.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 11.392 -3.801 12.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 10.595 -5.181 12.887 1.00 0.00 H new ATOM 1059 N ASN A 68 7.920 -0.808 7.749 1.00 0.00 N ATOM 1060 CA ASN A 68 8.857 -0.153 6.843 1.00 0.00 C ATOM 1061 C ASN A 68 10.151 -0.952 6.729 1.00 0.00 C ATOM 1062 O ASN A 68 10.508 -1.425 5.650 1.00 0.00 O ATOM 1063 CB ASN A 68 9.161 1.266 7.327 1.00 0.00 C ATOM 1064 CG ASN A 68 9.475 1.315 8.810 1.00 0.00 C ATOM 1065 OD1 ASN A 68 8.825 0.650 9.616 1.00 0.00 O ATOM 1066 ND2 ASN A 68 10.477 2.107 9.176 1.00 0.00 N ATOM 0 H ASN A 68 7.706 -0.275 8.592 1.00 0.00 H new ATOM 0 HA ASN A 68 8.394 -0.101 5.857 1.00 0.00 H new ATOM 0 HB2 ASN A 68 10.006 1.665 6.766 1.00 0.00 H new ATOM 0 HB3 ASN A 68 8.306 1.909 7.118 1.00 0.00 H new ATOM 0 HD21 ASN A 68 10.735 2.182 10.160 1.00 0.00 H new ATOM 0 HD22 ASN A 68 10.989 2.640 8.473 1.00 0.00 H new ATOM 1073 N ASN A 69 10.850 -1.099 7.849 1.00 0.00 N ATOM 1074 CA ASN A 69 12.106 -1.841 7.876 1.00 0.00 C ATOM 1075 C ASN A 69 12.011 -3.100 7.019 1.00 0.00 C ATOM 1076 O ASN A 69 13.012 -3.573 6.481 1.00 0.00 O ATOM 1077 CB ASN A 69 12.472 -2.214 9.313 1.00 0.00 C ATOM 1078 CG ASN A 69 13.144 -1.074 10.054 1.00 0.00 C ATOM 1079 OD1 ASN A 69 12.477 -0.224 10.644 1.00 0.00 O ATOM 1080 ND2 ASN A 69 14.471 -1.052 10.025 1.00 0.00 N ATOM 0 H ASN A 69 10.568 -0.714 8.751 1.00 0.00 H new ATOM 0 HA ASN A 69 12.887 -1.201 7.465 1.00 0.00 H new ATOM 0 HB2 ASN A 69 11.571 -2.511 9.849 1.00 0.00 H new ATOM 0 HB3 ASN A 69 13.136 -3.078 9.303 1.00 0.00 H new ATOM 0 HD21 ASN A 69 14.979 -0.309 10.505 1.00 0.00 H new ATOM 0 HD22 ASN A 69 14.982 -1.778 9.523 1.00 0.00 H new ATOM 1087 N GLU A 70 10.801 -3.638 6.899 1.00 0.00 N ATOM 1088 CA GLU A 70 10.577 -4.842 6.108 1.00 0.00 C ATOM 1089 C GLU A 70 10.525 -4.514 4.619 1.00 0.00 C ATOM 1090 O GLU A 70 9.989 -3.480 4.217 1.00 0.00 O ATOM 1091 CB GLU A 70 9.276 -5.525 6.536 1.00 0.00 C ATOM 1092 CG GLU A 70 9.441 -6.457 7.726 1.00 0.00 C ATOM 1093 CD GLU A 70 8.117 -6.823 8.367 1.00 0.00 C ATOM 1094 OE1 GLU A 70 7.066 -6.402 7.840 1.00 0.00 O ATOM 1095 OE2 GLU A 70 8.132 -7.530 9.396 1.00 0.00 O ATOM 0 H GLU A 70 9.962 -3.259 7.339 1.00 0.00 H new ATOM 0 HA GLU A 70 11.411 -5.521 6.284 1.00 0.00 H new ATOM 0 HB2 GLU A 70 8.539 -4.761 6.783 1.00 0.00 H new ATOM 0 HB3 GLU A 70 8.879 -6.091 5.694 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.948 -7.366 7.403 1.00 0.00 H new ATOM 0 HG3 GLU A 70 10.081 -5.982 8.469 1.00 0.00 H new ATOM 1102 N THR A 71 11.086 -5.401 3.803 1.00 0.00 N ATOM 1103 CA THR A 71 11.106 -5.206 2.359 1.00 0.00 C ATOM 1104 C THR A 71 10.279 -6.271 1.649 1.00 0.00 C ATOM 1105 O THR A 71 10.031 -7.346 2.195 1.00 0.00 O ATOM 1106 CB THR A 71 12.544 -5.237 1.807 1.00 0.00 C ATOM 1107 OG1 THR A 71 13.448 -4.672 2.763 1.00 0.00 O ATOM 1108 CG2 THR A 71 12.639 -4.470 0.497 1.00 0.00 C ATOM 0 H THR A 71 11.533 -6.262 4.118 1.00 0.00 H new ATOM 0 HA THR A 71 10.672 -4.225 2.167 1.00 0.00 H new ATOM 0 HB THR A 71 12.815 -6.276 1.621 1.00 0.00 H new ATOM 0 HG1 THR A 71 14.360 -4.697 2.405 1.00 0.00 H new ATOM 0 HG21 THR A 71 13.664 -4.506 0.128 1.00 0.00 H new ATOM 0 HG22 THR A 71 11.972 -4.921 -0.238 1.00 0.00 H new ATOM 0 HG23 THR A 71 12.349 -3.432 0.661 1.00 0.00 H new ATOM 1116 N LEU A 72 9.853 -5.966 0.428 1.00 0.00 N ATOM 1117 CA LEU A 72 9.053 -6.898 -0.359 1.00 0.00 C ATOM 1118 C LEU A 72 9.796 -8.214 -0.566 1.00 0.00 C ATOM 1119 O LEU A 72 9.227 -9.293 -0.403 1.00 0.00 O ATOM 1120 CB LEU A 72 8.699 -6.281 -1.713 1.00 0.00 C ATOM 1121 CG LEU A 72 7.631 -5.187 -1.693 1.00 0.00 C ATOM 1122 CD1 LEU A 72 6.283 -5.763 -1.289 1.00 0.00 C ATOM 1123 CD2 LEU A 72 8.036 -4.063 -0.750 1.00 0.00 C ATOM 0 H LEU A 72 10.048 -5.080 -0.039 1.00 0.00 H new ATOM 0 HA LEU A 72 8.135 -7.103 0.191 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.608 -5.866 -2.149 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.362 -7.078 -2.376 1.00 0.00 H new ATOM 0 HG LEU A 72 7.541 -4.777 -2.699 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.536 -4.969 -1.280 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.987 -6.532 -2.003 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.358 -6.201 -0.294 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.264 -3.293 -0.749 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.155 -4.459 0.258 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.979 -3.630 -1.084 1.00 0.00 H new ATOM 1135 N VAL A 73 11.073 -8.116 -0.924 1.00 0.00 N ATOM 1136 CA VAL A 73 11.896 -9.298 -1.150 1.00 0.00 C ATOM 1137 C VAL A 73 12.107 -10.076 0.144 1.00 0.00 C ATOM 1138 O VAL A 73 12.396 -11.272 0.120 1.00 0.00 O ATOM 1139 CB VAL A 73 13.268 -8.923 -1.740 1.00 0.00 C ATOM 1140 CG1 VAL A 73 13.123 -8.485 -3.190 1.00 0.00 C ATOM 1141 CG2 VAL A 73 13.925 -7.832 -0.908 1.00 0.00 C ATOM 0 H VAL A 73 11.559 -7.230 -1.064 1.00 0.00 H new ATOM 0 HA VAL A 73 11.361 -9.924 -1.864 1.00 0.00 H new ATOM 0 HB VAL A 73 13.909 -9.804 -1.714 1.00 0.00 H new ATOM 0 HG11 VAL A 73 14.102 -8.224 -3.591 1.00 0.00 H new ATOM 0 HG12 VAL A 73 12.697 -9.300 -3.775 1.00 0.00 H new ATOM 0 HG13 VAL A 73 12.466 -7.617 -3.244 1.00 0.00 H new ATOM 0 HG21 VAL A 73 14.894 -7.579 -1.339 1.00 0.00 H new ATOM 0 HG22 VAL A 73 13.289 -6.947 -0.901 1.00 0.00 H new ATOM 0 HG23 VAL A 73 14.064 -8.187 0.113 1.00 0.00 H new ATOM 1151 N GLN A 74 11.961 -9.389 1.272 1.00 0.00 N ATOM 1152 CA GLN A 74 12.137 -10.016 2.577 1.00 0.00 C ATOM 1153 C GLN A 74 10.911 -10.841 2.953 1.00 0.00 C ATOM 1154 O GLN A 74 10.988 -11.737 3.795 1.00 0.00 O ATOM 1155 CB GLN A 74 12.398 -8.953 3.646 1.00 0.00 C ATOM 1156 CG GLN A 74 13.871 -8.621 3.826 1.00 0.00 C ATOM 1157 CD GLN A 74 14.708 -9.841 4.158 1.00 0.00 C ATOM 1158 OE1 GLN A 74 14.219 -10.799 4.756 1.00 0.00 O ATOM 1159 NE2 GLN A 74 15.978 -9.811 3.769 1.00 0.00 N ATOM 0 H GLN A 74 11.721 -8.398 1.309 1.00 0.00 H new ATOM 0 HA GLN A 74 12.998 -10.682 2.519 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.859 -8.043 3.382 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.993 -9.299 4.597 1.00 0.00 H new ATOM 0 HG2 GLN A 74 14.250 -8.162 2.913 1.00 0.00 H new ATOM 0 HG3 GLN A 74 13.979 -7.884 4.622 1.00 0.00 H new ATOM 0 HE21 GLN A 74 16.341 -8.995 3.276 1.00 0.00 H new ATOM 0 HE22 GLN A 74 16.590 -10.604 3.964 1.00 0.00 H new ATOM 1168 N HIS A 75 9.781 -10.534 2.325 1.00 0.00 N ATOM 1169 CA HIS A 75 8.538 -11.248 2.594 1.00 0.00 C ATOM 1170 C HIS A 75 8.310 -12.349 1.563 1.00 0.00 C ATOM 1171 O HIS A 75 7.470 -13.228 1.754 1.00 0.00 O ATOM 1172 CB HIS A 75 7.356 -10.278 2.591 1.00 0.00 C ATOM 1173 CG HIS A 75 7.202 -9.519 3.873 1.00 0.00 C ATOM 1174 ND1 HIS A 75 6.693 -10.081 5.024 1.00 0.00 N ATOM 1175 CD2 HIS A 75 7.494 -8.234 4.181 1.00 0.00 C ATOM 1176 CE1 HIS A 75 6.677 -9.175 5.985 1.00 0.00 C ATOM 1177 NE2 HIS A 75 7.159 -8.045 5.500 1.00 0.00 N ATOM 0 H HIS A 75 9.700 -9.795 1.626 1.00 0.00 H new ATOM 0 HA HIS A 75 8.618 -11.708 3.579 1.00 0.00 H new ATOM 0 HB2 HIS A 75 7.480 -9.570 1.772 1.00 0.00 H new ATOM 0 HB3 HIS A 75 6.440 -10.835 2.396 1.00 0.00 H new ATOM 0 HD2 HIS A 75 7.912 -7.495 3.514 1.00 0.00 H new ATOM 0 HE1 HIS A 75 6.329 -9.332 6.995 1.00 0.00 H new ATOM 0 HE2 HIS A 75 7.265 -7.174 6.020 1.00 0.00 H new ATOM 1186 N GLY A 76 9.063 -12.294 0.468 1.00 0.00 N ATOM 1187 CA GLY A 76 8.927 -13.291 -0.577 1.00 0.00 C ATOM 1188 C GLY A 76 8.277 -12.734 -1.828 1.00 0.00 C ATOM 1189 O GLY A 76 7.254 -13.245 -2.285 1.00 0.00 O ATOM 0 H GLY A 76 9.765 -11.576 0.287 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.911 -13.687 -0.828 1.00 0.00 H new ATOM 0 HA3 GLY A 76 8.334 -14.126 -0.204 1.00 0.00 H new ATOM 1193 N VAL A 77 8.871 -11.683 -2.384 1.00 0.00 N ATOM 1194 CA VAL A 77 8.343 -11.056 -3.590 1.00 0.00 C ATOM 1195 C VAL A 77 9.432 -10.888 -4.644 1.00 0.00 C ATOM 1196 O VAL A 77 10.529 -10.414 -4.349 1.00 0.00 O ATOM 1197 CB VAL A 77 7.726 -9.679 -3.282 1.00 0.00 C ATOM 1198 CG1 VAL A 77 7.231 -9.017 -4.559 1.00 0.00 C ATOM 1199 CG2 VAL A 77 6.597 -9.815 -2.271 1.00 0.00 C ATOM 0 H VAL A 77 9.718 -11.248 -2.019 1.00 0.00 H new ATOM 0 HA VAL A 77 7.566 -11.716 -3.976 1.00 0.00 H new ATOM 0 HB VAL A 77 8.498 -9.044 -2.848 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.798 -8.045 -4.321 1.00 0.00 H new ATOM 0 HG12 VAL A 77 8.066 -8.884 -5.247 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.473 -9.647 -5.025 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.173 -8.832 -2.065 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.823 -10.467 -2.676 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.986 -10.243 -1.347 1.00 0.00 H new ATOM 1209 N LYS A 78 9.122 -11.280 -5.875 1.00 0.00 N ATOM 1210 CA LYS A 78 10.072 -11.172 -6.975 1.00 0.00 C ATOM 1211 C LYS A 78 9.689 -10.035 -7.916 1.00 0.00 C ATOM 1212 O LYS A 78 8.549 -9.570 -7.934 1.00 0.00 O ATOM 1213 CB LYS A 78 10.137 -12.490 -7.751 1.00 0.00 C ATOM 1214 CG LYS A 78 11.144 -13.478 -7.188 1.00 0.00 C ATOM 1215 CD LYS A 78 12.572 -13.015 -7.424 1.00 0.00 C ATOM 1216 CE LYS A 78 13.570 -13.881 -6.671 1.00 0.00 C ATOM 1217 NZ LYS A 78 14.911 -13.873 -7.320 1.00 0.00 N ATOM 0 H LYS A 78 8.219 -11.676 -6.136 1.00 0.00 H new ATOM 0 HA LYS A 78 11.054 -10.956 -6.554 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.149 -12.951 -7.751 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.390 -12.278 -8.790 1.00 0.00 H new ATOM 0 HG2 LYS A 78 10.973 -13.603 -6.119 1.00 0.00 H new ATOM 0 HG3 LYS A 78 10.996 -14.454 -7.651 1.00 0.00 H new ATOM 0 HD2 LYS A 78 12.794 -13.046 -8.491 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.676 -11.978 -7.106 1.00 0.00 H new ATOM 0 HE2 LYS A 78 13.661 -13.523 -5.645 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.197 -14.904 -6.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 15.563 -14.475 -6.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 14.829 -14.238 -8.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 15.278 -12.900 -7.346 1.00 0.00 H new ATOM 1231 N PRO A 79 10.661 -9.576 -8.718 1.00 0.00 N ATOM 1232 CA PRO A 79 10.447 -8.489 -9.678 1.00 0.00 C ATOM 1233 C PRO A 79 9.552 -8.908 -10.839 1.00 0.00 C ATOM 1234 O PRO A 79 9.525 -10.077 -11.223 1.00 0.00 O ATOM 1235 CB PRO A 79 11.860 -8.175 -10.178 1.00 0.00 C ATOM 1236 CG PRO A 79 12.622 -9.440 -9.980 1.00 0.00 C ATOM 1237 CD PRO A 79 12.042 -10.084 -8.750 1.00 0.00 C ATOM 0 HA PRO A 79 9.941 -7.637 -9.223 1.00 0.00 H new ATOM 0 HB2 PRO A 79 11.852 -7.878 -11.227 1.00 0.00 H new ATOM 0 HB3 PRO A 79 12.305 -7.353 -9.617 1.00 0.00 H new ATOM 0 HG2 PRO A 79 12.524 -10.094 -10.846 1.00 0.00 H new ATOM 0 HG3 PRO A 79 13.685 -9.239 -9.851 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.069 -11.172 -8.815 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.594 -9.805 -7.852 1.00 0.00 H new ATOM 1245 N GLN A 80 8.822 -7.946 -11.394 1.00 0.00 N ATOM 1246 CA GLN A 80 7.925 -8.217 -12.512 1.00 0.00 C ATOM 1247 C GLN A 80 6.841 -9.212 -12.111 1.00 0.00 C ATOM 1248 O GLN A 80 6.501 -10.114 -12.877 1.00 0.00 O ATOM 1249 CB GLN A 80 8.714 -8.756 -13.706 1.00 0.00 C ATOM 1250 CG GLN A 80 9.816 -7.822 -14.180 1.00 0.00 C ATOM 1251 CD GLN A 80 10.132 -7.992 -15.653 1.00 0.00 C ATOM 1252 OE1 GLN A 80 10.213 -9.112 -16.157 1.00 0.00 O ATOM 1253 NE2 GLN A 80 10.312 -6.877 -16.352 1.00 0.00 N ATOM 0 H GLN A 80 8.834 -6.973 -11.088 1.00 0.00 H new ATOM 0 HA GLN A 80 7.445 -7.281 -12.796 1.00 0.00 H new ATOM 0 HB2 GLN A 80 9.154 -9.716 -13.436 1.00 0.00 H new ATOM 0 HB3 GLN A 80 8.026 -8.941 -14.531 1.00 0.00 H new ATOM 0 HG2 GLN A 80 9.518 -6.790 -13.993 1.00 0.00 H new ATOM 0 HG3 GLN A 80 10.718 -8.004 -13.595 1.00 0.00 H new ATOM 0 HE21 GLN A 80 10.235 -5.969 -15.893 1.00 0.00 H new ATOM 0 HE22 GLN A 80 10.527 -6.928 -17.348 1.00 0.00 H new ATOM 1262 N GLU A 81 6.304 -9.042 -10.907 1.00 0.00 N ATOM 1263 CA GLU A 81 5.260 -9.927 -10.406 1.00 0.00 C ATOM 1264 C GLU A 81 4.022 -9.133 -9.999 1.00 0.00 C ATOM 1265 O GLU A 81 4.095 -7.926 -9.767 1.00 0.00 O ATOM 1266 CB GLU A 81 5.775 -10.736 -9.213 1.00 0.00 C ATOM 1267 CG GLU A 81 5.547 -10.056 -7.873 1.00 0.00 C ATOM 1268 CD GLU A 81 5.907 -10.946 -6.699 1.00 0.00 C ATOM 1269 OE1 GLU A 81 6.644 -11.933 -6.906 1.00 0.00 O ATOM 1270 OE2 GLU A 81 5.450 -10.656 -5.574 1.00 0.00 O ATOM 0 H GLU A 81 6.575 -8.300 -10.261 1.00 0.00 H new ATOM 0 HA GLU A 81 4.984 -10.611 -11.208 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.284 -11.709 -9.205 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.842 -10.918 -9.342 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.140 -9.143 -7.827 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.501 -9.761 -7.793 1.00 0.00 H new ATOM 1277 N ILE A 82 2.887 -9.819 -9.915 1.00 0.00 N ATOM 1278 CA ILE A 82 1.634 -9.178 -9.537 1.00 0.00 C ATOM 1279 C ILE A 82 1.193 -9.613 -8.143 1.00 0.00 C ATOM 1280 O ILE A 82 1.168 -10.804 -7.832 1.00 0.00 O ATOM 1281 CB ILE A 82 0.511 -9.499 -10.541 1.00 0.00 C ATOM 1282 CG1 ILE A 82 0.891 -9.003 -11.938 1.00 0.00 C ATOM 1283 CG2 ILE A 82 -0.799 -8.872 -10.089 1.00 0.00 C ATOM 1284 CD1 ILE A 82 -0.024 -9.514 -13.030 1.00 0.00 C ATOM 0 H ILE A 82 2.810 -10.818 -10.104 1.00 0.00 H new ATOM 0 HA ILE A 82 1.816 -8.103 -9.540 1.00 0.00 H new ATOM 0 HB ILE A 82 0.378 -10.580 -10.582 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.877 -7.913 -11.944 1.00 0.00 H new ATOM 0 HG13 ILE A 82 1.913 -9.310 -12.158 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.583 -9.108 -10.809 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.073 -9.268 -9.111 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.681 -7.790 -10.023 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.305 -9.123 -13.993 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.008 -10.603 -13.051 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -1.044 -9.185 -12.834 1.00 0.00 H new ATOM 1296 N VAL A 83 0.844 -8.640 -7.308 1.00 0.00 N ATOM 1297 CA VAL A 83 0.401 -8.922 -5.948 1.00 0.00 C ATOM 1298 C VAL A 83 -0.837 -8.105 -5.593 1.00 0.00 C ATOM 1299 O VAL A 83 -1.319 -7.310 -6.398 1.00 0.00 O ATOM 1300 CB VAL A 83 1.511 -8.623 -4.922 1.00 0.00 C ATOM 1301 CG1 VAL A 83 2.823 -9.258 -5.356 1.00 0.00 C ATOM 1302 CG2 VAL A 83 1.672 -7.122 -4.734 1.00 0.00 C ATOM 0 H VAL A 83 0.859 -7.649 -7.550 1.00 0.00 H new ATOM 0 HA VAL A 83 0.157 -9.984 -5.909 1.00 0.00 H new ATOM 0 HB VAL A 83 1.224 -9.057 -3.964 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.596 -9.036 -4.620 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.696 -10.338 -5.435 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.119 -8.856 -6.325 1.00 0.00 H new ATOM 0 HG21 VAL A 83 2.460 -6.929 -4.006 1.00 0.00 H new ATOM 0 HG22 VAL A 83 1.937 -6.662 -5.686 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.734 -6.698 -4.375 1.00 0.00 H new ATOM 1312 N GLN A 84 -1.345 -8.308 -4.381 1.00 0.00 N ATOM 1313 CA GLN A 84 -2.527 -7.590 -3.920 1.00 0.00 C ATOM 1314 C GLN A 84 -2.388 -7.199 -2.452 1.00 0.00 C ATOM 1315 O GLN A 84 -2.214 -8.055 -1.585 1.00 0.00 O ATOM 1316 CB GLN A 84 -3.779 -8.448 -4.115 1.00 0.00 C ATOM 1317 CG GLN A 84 -5.073 -7.718 -3.792 1.00 0.00 C ATOM 1318 CD GLN A 84 -6.296 -8.434 -4.329 1.00 0.00 C ATOM 1319 OE1 GLN A 84 -6.189 -9.492 -4.948 1.00 0.00 O ATOM 1320 NE2 GLN A 84 -7.470 -7.859 -4.093 1.00 0.00 N ATOM 0 H GLN A 84 -0.957 -8.963 -3.702 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.623 -6.680 -4.512 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -3.815 -8.794 -5.148 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -3.704 -9.334 -3.484 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -5.165 -7.610 -2.711 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -5.033 -6.712 -4.210 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -7.513 -6.981 -3.575 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -8.328 -8.295 -4.429 1.00 0.00 H new ATOM 1329 N VAL A 85 -2.466 -5.900 -2.181 1.00 0.00 N ATOM 1330 CA VAL A 85 -2.350 -5.395 -0.818 1.00 0.00 C ATOM 1331 C VAL A 85 -3.498 -4.451 -0.482 1.00 0.00 C ATOM 1332 O VAL A 85 -4.053 -3.796 -1.363 1.00 0.00 O ATOM 1333 CB VAL A 85 -1.014 -4.658 -0.605 1.00 0.00 C ATOM 1334 CG1 VAL A 85 0.158 -5.605 -0.813 1.00 0.00 C ATOM 1335 CG2 VAL A 85 -0.913 -3.459 -1.536 1.00 0.00 C ATOM 0 H VAL A 85 -2.609 -5.178 -2.887 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.389 -6.260 -0.155 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.979 -4.296 0.422 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.093 -5.066 -0.658 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.091 -6.428 -0.102 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.131 -6.000 -1.828 1.00 0.00 H new ATOM 0 HG21 VAL A 85 0.037 -2.950 -1.372 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -0.970 -3.796 -2.571 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.733 -2.771 -1.333 1.00 0.00 H new ATOM 1345 N GLU A 86 -3.849 -4.386 0.799 1.00 0.00 N ATOM 1346 CA GLU A 86 -4.932 -3.522 1.251 1.00 0.00 C ATOM 1347 C GLU A 86 -4.400 -2.407 2.147 1.00 0.00 C ATOM 1348 O GLU A 86 -3.456 -2.608 2.911 1.00 0.00 O ATOM 1349 CB GLU A 86 -5.986 -4.337 2.003 1.00 0.00 C ATOM 1350 CG GLU A 86 -6.930 -5.101 1.090 1.00 0.00 C ATOM 1351 CD GLU A 86 -7.766 -6.122 1.838 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -8.725 -5.713 2.526 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -7.462 -7.328 1.735 1.00 0.00 O ATOM 0 H GLU A 86 -3.399 -4.922 1.541 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.393 -3.070 0.372 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.484 -5.043 2.665 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.569 -3.667 2.635 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -7.590 -4.396 0.585 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -6.352 -5.607 0.317 1.00 0.00 H new ATOM 1360 N ILE A 87 -5.014 -1.233 2.048 1.00 0.00 N ATOM 1361 CA ILE A 87 -4.603 -0.087 2.849 1.00 0.00 C ATOM 1362 C ILE A 87 -5.758 0.432 3.700 1.00 0.00 C ATOM 1363 O ILE A 87 -6.909 0.443 3.263 1.00 0.00 O ATOM 1364 CB ILE A 87 -4.077 1.060 1.965 1.00 0.00 C ATOM 1365 CG1 ILE A 87 -2.684 0.722 1.431 1.00 0.00 C ATOM 1366 CG2 ILE A 87 -4.049 2.363 2.749 1.00 0.00 C ATOM 1367 CD1 ILE A 87 -2.161 1.728 0.429 1.00 0.00 C ATOM 0 H ILE A 87 -5.798 -1.051 1.421 1.00 0.00 H new ATOM 0 HA ILE A 87 -3.799 -0.431 3.500 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.750 1.185 1.117 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -1.988 0.659 2.268 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -2.711 -0.263 0.965 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.675 3.164 2.111 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -5.057 2.607 3.085 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.395 2.253 3.614 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -1.169 1.425 0.093 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.835 1.774 -0.426 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -2.101 2.710 0.897 1.00 0.00 H new ATOM 1379 N PHE A 88 -5.442 0.861 4.917 1.00 0.00 N ATOM 1380 CA PHE A 88 -6.454 1.382 5.830 1.00 0.00 C ATOM 1381 C PHE A 88 -5.804 2.100 7.009 1.00 0.00 C ATOM 1382 O PHE A 88 -4.630 1.884 7.311 1.00 0.00 O ATOM 1383 CB PHE A 88 -7.346 0.247 6.338 1.00 0.00 C ATOM 1384 CG PHE A 88 -6.647 -0.688 7.283 1.00 0.00 C ATOM 1385 CD1 PHE A 88 -6.311 -0.277 8.563 1.00 0.00 C ATOM 1386 CD2 PHE A 88 -6.325 -1.977 6.892 1.00 0.00 C ATOM 1387 CE1 PHE A 88 -5.667 -1.135 9.434 1.00 0.00 C ATOM 1388 CE2 PHE A 88 -5.682 -2.840 7.759 1.00 0.00 C ATOM 1389 CZ PHE A 88 -5.353 -2.419 9.032 1.00 0.00 C ATOM 0 H PHE A 88 -4.494 0.858 5.294 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.067 2.099 5.283 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.215 0.675 6.839 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -7.718 -0.322 5.486 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.555 0.725 8.883 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.580 -2.312 5.897 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -5.409 -0.802 10.429 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.437 -3.843 7.441 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.851 -3.092 9.712 1.00 0.00 H new ATOM 1399 N SER A 89 -6.576 2.955 7.672 1.00 0.00 N ATOM 1400 CA SER A 89 -6.075 3.709 8.816 1.00 0.00 C ATOM 1401 C SER A 89 -6.681 3.190 10.116 1.00 0.00 C ATOM 1402 O SER A 89 -7.869 2.870 10.177 1.00 0.00 O ATOM 1403 CB SER A 89 -6.391 5.197 8.651 1.00 0.00 C ATOM 1404 OG SER A 89 -5.622 5.984 9.544 1.00 0.00 O ATOM 0 H SER A 89 -7.551 3.143 7.437 1.00 0.00 H new ATOM 0 HA SER A 89 -4.994 3.577 8.861 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.188 5.503 7.625 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.452 5.369 8.831 1.00 0.00 H new ATOM 0 HG SER A 89 -5.959 6.904 9.543 1.00 0.00 H new ATOM 1410 N THR A 90 -5.856 3.108 11.155 1.00 0.00 N ATOM 1411 CA THR A 90 -6.309 2.627 12.454 1.00 0.00 C ATOM 1412 C THR A 90 -7.244 3.632 13.117 1.00 0.00 C ATOM 1413 O THR A 90 -8.203 3.252 13.788 1.00 0.00 O ATOM 1414 CB THR A 90 -5.121 2.351 13.396 1.00 0.00 C ATOM 1415 OG1 THR A 90 -4.408 3.565 13.655 1.00 0.00 O ATOM 1416 CG2 THR A 90 -4.178 1.322 12.789 1.00 0.00 C ATOM 0 H THR A 90 -4.870 3.369 11.122 1.00 0.00 H new ATOM 0 HA THR A 90 -6.847 1.696 12.276 1.00 0.00 H new ATOM 0 HB THR A 90 -5.513 1.954 14.333 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.967 3.867 12.833 1.00 0.00 H new ATOM 0 HG21 THR A 90 -3.347 1.143 13.471 1.00 0.00 H new ATOM 0 HG22 THR A 90 -4.717 0.389 12.621 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.794 1.696 11.840 1.00 0.00 H new ATOM 1424 N ASN A 91 -6.960 4.916 12.924 1.00 0.00 N ATOM 1425 CA ASN A 91 -7.777 5.975 13.503 1.00 0.00 C ATOM 1426 C ASN A 91 -8.497 6.764 12.414 1.00 0.00 C ATOM 1427 O ASN A 91 -8.070 7.847 12.011 1.00 0.00 O ATOM 1428 CB ASN A 91 -6.910 6.917 14.341 1.00 0.00 C ATOM 1429 CG ASN A 91 -6.810 6.475 15.789 1.00 0.00 C ATOM 1430 OD1 ASN A 91 -6.261 5.415 16.090 1.00 0.00 O ATOM 1431 ND2 ASN A 91 -7.341 7.289 16.693 1.00 0.00 N ATOM 0 H ASN A 91 -6.170 5.248 12.371 1.00 0.00 H new ATOM 0 HA ASN A 91 -8.525 5.511 14.146 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.910 6.967 13.909 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -7.326 7.924 14.299 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -7.304 7.046 17.683 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -7.786 8.158 16.398 1.00 0.00 H new ATOM 1438 N PRO A 92 -9.617 6.212 11.925 1.00 0.00 N ATOM 1439 CA PRO A 92 -10.421 6.847 10.877 1.00 0.00 C ATOM 1440 C PRO A 92 -11.139 8.097 11.374 1.00 0.00 C ATOM 1441 O PRO A 92 -11.543 8.949 10.582 1.00 0.00 O ATOM 1442 CB PRO A 92 -11.435 5.763 10.501 1.00 0.00 C ATOM 1443 CG PRO A 92 -11.546 4.910 11.718 1.00 0.00 C ATOM 1444 CD PRO A 92 -10.185 4.924 12.359 1.00 0.00 C ATOM 0 HA PRO A 92 -9.807 7.184 10.042 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.398 6.198 10.233 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -11.096 5.185 9.642 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.302 5.299 12.400 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -11.844 3.895 11.457 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.252 4.860 13.445 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.576 4.084 12.027 1.00 0.00 H new ATOM 1452 N ASP A 93 -11.292 8.202 12.690 1.00 0.00 N ATOM 1453 CA ASP A 93 -11.960 9.349 13.293 1.00 0.00 C ATOM 1454 C ASP A 93 -11.036 10.563 13.318 1.00 0.00 C ATOM 1455 O ASP A 93 -11.486 11.702 13.186 1.00 0.00 O ATOM 1456 CB ASP A 93 -12.418 9.012 14.712 1.00 0.00 C ATOM 1457 CG ASP A 93 -13.655 9.788 15.121 1.00 0.00 C ATOM 1458 OD1 ASP A 93 -14.769 9.370 14.742 1.00 0.00 O ATOM 1459 OD2 ASP A 93 -13.509 10.814 15.818 1.00 0.00 O ATOM 0 H ASP A 93 -10.962 7.506 13.359 1.00 0.00 H new ATOM 0 HA ASP A 93 -12.833 9.591 12.686 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -12.624 7.944 14.780 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -11.610 9.226 15.412 1.00 0.00 H new ATOM 1464 N LEU A 94 -9.743 10.313 13.490 1.00 0.00 N ATOM 1465 CA LEU A 94 -8.755 11.385 13.534 1.00 0.00 C ATOM 1466 C LEU A 94 -8.132 11.609 12.160 1.00 0.00 C ATOM 1467 O LEU A 94 -7.977 12.746 11.715 1.00 0.00 O ATOM 1468 CB LEU A 94 -7.664 11.058 14.555 1.00 0.00 C ATOM 1469 CG LEU A 94 -7.997 11.364 16.016 1.00 0.00 C ATOM 1470 CD1 LEU A 94 -7.014 10.668 16.944 1.00 0.00 C ATOM 1471 CD2 LEU A 94 -7.994 12.866 16.260 1.00 0.00 C ATOM 0 H LEU A 94 -9.354 9.377 13.601 1.00 0.00 H new ATOM 0 HA LEU A 94 -9.263 12.301 13.835 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.423 9.998 14.473 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.764 11.611 14.285 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.996 10.984 16.229 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.266 10.897 17.979 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.066 9.591 16.788 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.003 11.017 16.731 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.233 13.065 17.305 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.008 13.270 16.030 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.739 13.340 15.621 1.00 0.00 H new ATOM 1483 N TYR A 95 -7.779 10.516 11.492 1.00 0.00 N ATOM 1484 CA TYR A 95 -7.172 10.592 10.169 1.00 0.00 C ATOM 1485 C TYR A 95 -7.848 9.624 9.203 1.00 0.00 C ATOM 1486 O TYR A 95 -7.359 8.525 8.941 1.00 0.00 O ATOM 1487 CB TYR A 95 -5.676 10.286 10.252 1.00 0.00 C ATOM 1488 CG TYR A 95 -4.964 11.035 11.355 1.00 0.00 C ATOM 1489 CD1 TYR A 95 -4.913 10.526 12.647 1.00 0.00 C ATOM 1490 CD2 TYR A 95 -4.343 12.253 11.106 1.00 0.00 C ATOM 1491 CE1 TYR A 95 -4.264 11.208 13.658 1.00 0.00 C ATOM 1492 CE2 TYR A 95 -3.691 12.941 12.111 1.00 0.00 C ATOM 1493 CZ TYR A 95 -3.655 12.415 13.385 1.00 0.00 C ATOM 1494 OH TYR A 95 -3.007 13.097 14.390 1.00 0.00 O ATOM 0 H TYR A 95 -7.903 9.567 11.845 1.00 0.00 H new ATOM 0 HA TYR A 95 -7.308 11.606 9.793 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.541 9.215 10.406 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -5.210 10.532 9.298 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.389 9.581 12.864 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.371 12.669 10.110 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -4.234 10.798 14.657 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -3.212 13.886 11.900 1.00 0.00 H new ATOM 0 HH TYR A 95 -2.631 13.928 14.032 1.00 0.00 H new ATOM 1504 N PRO A 96 -9.002 10.041 8.660 1.00 0.00 N ATOM 1505 CA PRO A 96 -9.771 9.227 7.714 1.00 0.00 C ATOM 1506 C PRO A 96 -9.072 9.090 6.365 1.00 0.00 C ATOM 1507 O PRO A 96 -8.222 9.907 6.009 1.00 0.00 O ATOM 1508 CB PRO A 96 -11.081 10.004 7.560 1.00 0.00 C ATOM 1509 CG PRO A 96 -10.725 11.414 7.885 1.00 0.00 C ATOM 1510 CD PRO A 96 -9.644 11.338 8.927 1.00 0.00 C ATOM 0 HA PRO A 96 -9.904 8.206 8.070 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -11.475 9.918 6.547 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -11.848 9.624 8.234 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -10.376 11.943 6.998 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -11.591 11.959 8.260 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -8.937 12.163 8.834 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -10.055 11.383 9.936 1.00 0.00 H new ATOM 1518 N VAL A 97 -9.435 8.052 5.618 1.00 0.00 N ATOM 1519 CA VAL A 97 -8.844 7.809 4.308 1.00 0.00 C ATOM 1520 C VAL A 97 -9.751 8.317 3.193 1.00 0.00 C ATOM 1521 O VAL A 97 -10.976 8.261 3.301 1.00 0.00 O ATOM 1522 CB VAL A 97 -8.566 6.310 4.086 1.00 0.00 C ATOM 1523 CG1 VAL A 97 -8.045 6.066 2.678 1.00 0.00 C ATOM 1524 CG2 VAL A 97 -7.583 5.792 5.125 1.00 0.00 C ATOM 0 H VAL A 97 -10.136 7.366 5.898 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.900 8.353 4.281 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.502 5.763 4.200 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.854 5.002 2.540 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.787 6.399 1.953 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.119 6.622 2.531 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.398 4.732 4.954 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.645 6.342 5.045 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.001 5.931 6.122 1.00 0.00 H new ATOM 1534 N ARG A 98 -9.141 8.813 2.121 1.00 0.00 N ATOM 1535 CA ARG A 98 -9.894 9.331 0.985 1.00 0.00 C ATOM 1536 C ARG A 98 -9.450 8.663 -0.313 1.00 0.00 C ATOM 1537 O ARG A 98 -8.383 8.051 -0.374 1.00 0.00 O ATOM 1538 CB ARG A 98 -9.716 10.847 0.878 1.00 0.00 C ATOM 1539 CG ARG A 98 -10.497 11.628 1.922 1.00 0.00 C ATOM 1540 CD ARG A 98 -10.707 13.072 1.495 1.00 0.00 C ATOM 1541 NE ARG A 98 -11.546 13.806 2.440 1.00 0.00 N ATOM 1542 CZ ARG A 98 -12.032 15.019 2.202 1.00 0.00 C ATOM 1543 NH1 ARG A 98 -11.764 15.632 1.058 1.00 0.00 N ATOM 1544 NH2 ARG A 98 -12.787 15.621 3.112 1.00 0.00 N ATOM 0 H ARG A 98 -8.128 8.867 2.016 1.00 0.00 H new ATOM 0 HA ARG A 98 -10.948 9.105 1.146 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -8.657 11.087 0.974 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -10.028 11.172 -0.115 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -11.464 11.152 2.086 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -9.963 11.602 2.872 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -9.740 13.568 1.407 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -11.168 13.095 0.508 1.00 0.00 H new ATOM 0 HE ARG A 98 -11.771 13.363 3.331 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -11.183 15.172 0.357 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -12.139 16.563 0.879 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -12.994 15.152 3.994 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -13.160 16.553 2.930 1.00 0.00 H new ATOM 1558 N ARG A 99 -10.276 8.783 -1.347 1.00 0.00 N ATOM 1559 CA ARG A 99 -9.969 8.189 -2.642 1.00 0.00 C ATOM 1560 C ARG A 99 -8.920 9.013 -3.383 1.00 0.00 C ATOM 1561 O ARG A 99 -8.743 10.200 -3.111 1.00 0.00 O ATOM 1562 CB ARG A 99 -11.238 8.079 -3.490 1.00 0.00 C ATOM 1563 CG ARG A 99 -11.749 9.418 -3.998 1.00 0.00 C ATOM 1564 CD ARG A 99 -12.614 10.114 -2.959 1.00 0.00 C ATOM 1565 NE ARG A 99 -13.630 10.965 -3.573 1.00 0.00 N ATOM 1566 CZ ARG A 99 -13.367 12.149 -4.115 1.00 0.00 C ATOM 1567 NH1 ARG A 99 -12.127 12.620 -4.119 1.00 0.00 N ATOM 1568 NH2 ARG A 99 -14.345 12.865 -4.655 1.00 0.00 N ATOM 0 H ARG A 99 -11.163 9.286 -1.313 1.00 0.00 H new ATOM 0 HA ARG A 99 -9.567 7.191 -2.470 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -11.040 7.428 -4.342 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -12.020 7.602 -2.899 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -10.904 10.057 -4.257 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -12.325 9.266 -4.911 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -13.099 9.366 -2.331 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -11.982 10.717 -2.307 1.00 0.00 H new ATOM 0 HE ARG A 99 -14.594 10.632 -3.586 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -11.372 12.073 -3.705 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -11.928 13.529 -4.536 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -15.300 12.506 -4.654 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -14.142 13.774 -5.071 1.00 0.00 H new ATOM 1582 N ILE A 100 -8.226 8.373 -4.319 1.00 0.00 N ATOM 1583 CA ILE A 100 -7.195 9.046 -5.099 1.00 0.00 C ATOM 1584 C ILE A 100 -7.313 8.703 -6.580 1.00 0.00 C ATOM 1585 O ILE A 100 -7.294 7.531 -6.959 1.00 0.00 O ATOM 1586 CB ILE A 100 -5.784 8.673 -4.608 1.00 0.00 C ATOM 1587 CG1 ILE A 100 -5.568 9.175 -3.179 1.00 0.00 C ATOM 1588 CG2 ILE A 100 -4.729 9.246 -5.542 1.00 0.00 C ATOM 1589 CD1 ILE A 100 -4.179 8.901 -2.645 1.00 0.00 C ATOM 0 H ILE A 100 -8.359 7.390 -4.555 1.00 0.00 H new ATOM 0 HA ILE A 100 -7.347 10.117 -4.964 1.00 0.00 H new ATOM 0 HB ILE A 100 -5.690 7.587 -4.609 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.755 10.248 -3.148 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -6.300 8.704 -2.523 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -3.737 8.974 -5.181 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -4.874 8.844 -6.545 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.819 10.332 -5.570 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -4.098 9.284 -1.628 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.995 7.827 -2.644 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -3.442 9.395 -3.278 1.00 0.00 H new ATOM 1601 N ASP A 101 -7.434 9.731 -7.412 1.00 0.00 N ATOM 1602 CA ASP A 101 -7.553 9.538 -8.853 1.00 0.00 C ATOM 1603 C ASP A 101 -6.324 8.825 -9.409 1.00 0.00 C ATOM 1604 O ASP A 101 -5.197 9.099 -9.000 1.00 0.00 O ATOM 1605 CB ASP A 101 -7.738 10.884 -9.555 1.00 0.00 C ATOM 1606 CG ASP A 101 -8.274 10.733 -10.965 1.00 0.00 C ATOM 1607 OD1 ASP A 101 -9.511 10.693 -11.129 1.00 0.00 O ATOM 1608 OD2 ASP A 101 -7.455 10.655 -11.905 1.00 0.00 O ATOM 0 H ASP A 101 -7.452 10.706 -7.114 1.00 0.00 H new ATOM 0 HA ASP A 101 -8.428 8.915 -9.041 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -8.422 11.503 -8.974 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -6.783 11.408 -9.587 1.00 0.00 H new ATOM 1613 N GLY A 102 -6.551 7.907 -10.344 1.00 0.00 N ATOM 1614 CA GLY A 102 -5.453 7.168 -10.939 1.00 0.00 C ATOM 1615 C GLY A 102 -4.478 8.068 -11.671 1.00 0.00 C ATOM 1616 O GLY A 102 -4.652 9.287 -11.706 1.00 0.00 O ATOM 0 H GLY A 102 -7.475 7.662 -10.700 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -4.923 6.621 -10.160 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -5.851 6.428 -11.633 1.00 0.00 H new ATOM 1620 N LEU A 103 -3.447 7.468 -12.257 1.00 0.00 N ATOM 1621 CA LEU A 103 -2.438 8.224 -12.991 1.00 0.00 C ATOM 1622 C LEU A 103 -2.165 7.589 -14.350 1.00 0.00 C ATOM 1623 O LEU A 103 -2.437 8.185 -15.393 1.00 0.00 O ATOM 1624 CB LEU A 103 -1.142 8.302 -12.182 1.00 0.00 C ATOM 1625 CG LEU A 103 0.071 8.879 -12.912 1.00 0.00 C ATOM 1626 CD1 LEU A 103 0.017 10.399 -12.918 1.00 0.00 C ATOM 1627 CD2 LEU A 103 1.361 8.392 -12.269 1.00 0.00 C ATOM 0 H LEU A 103 -3.288 6.461 -12.238 1.00 0.00 H new ATOM 0 HA LEU A 103 -2.820 9.232 -13.151 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.327 8.906 -11.294 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.891 7.299 -11.838 1.00 0.00 H new ATOM 0 HG LEU A 103 0.049 8.531 -13.945 1.00 0.00 H new ATOM 0 HD11 LEU A 103 0.888 10.792 -13.442 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.890 10.729 -13.424 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.014 10.767 -11.892 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.214 8.812 -12.801 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.391 8.710 -11.227 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.403 7.304 -12.317 1.00 0.00 H new ATOM 1639 N THR A 104 -1.626 6.374 -14.333 1.00 0.00 N ATOM 1640 CA THR A 104 -1.316 5.657 -15.564 1.00 0.00 C ATOM 1641 C THR A 104 -2.589 5.234 -16.288 1.00 0.00 C ATOM 1642 O THR A 104 -2.695 5.371 -17.507 1.00 0.00 O ATOM 1643 CB THR A 104 -0.458 4.409 -15.286 1.00 0.00 C ATOM 1644 OG1 THR A 104 0.390 4.639 -14.155 1.00 0.00 O ATOM 1645 CG2 THR A 104 0.390 4.055 -16.498 1.00 0.00 C ATOM 0 H THR A 104 -1.395 5.865 -13.480 1.00 0.00 H new ATOM 0 HA THR A 104 -0.752 6.343 -16.196 1.00 0.00 H new ATOM 0 HB THR A 104 -1.127 3.575 -15.074 1.00 0.00 H new ATOM 0 HG1 THR A 104 0.931 3.840 -13.984 1.00 0.00 H new ATOM 0 HG21 THR A 104 0.988 3.170 -16.278 1.00 0.00 H new ATOM 0 HG22 THR A 104 -0.259 3.852 -17.350 1.00 0.00 H new ATOM 0 HG23 THR A 104 1.050 4.889 -16.736 1.00 0.00 H new ATOM 1653 N ASP A 105 -3.552 4.720 -15.531 1.00 0.00 N ATOM 1654 CA ASP A 105 -4.819 4.278 -16.101 1.00 0.00 C ATOM 1655 C ASP A 105 -4.646 2.965 -16.858 1.00 0.00 C ATOM 1656 O ASP A 105 -4.995 2.863 -18.034 1.00 0.00 O ATOM 1657 CB ASP A 105 -5.383 5.349 -17.036 1.00 0.00 C ATOM 1658 CG ASP A 105 -5.044 6.754 -16.579 1.00 0.00 C ATOM 1659 OD1 ASP A 105 -5.365 7.095 -15.421 1.00 0.00 O ATOM 1660 OD2 ASP A 105 -4.456 7.512 -17.378 1.00 0.00 O ATOM 0 H ASP A 105 -3.479 4.599 -14.521 1.00 0.00 H new ATOM 0 HA ASP A 105 -5.520 4.115 -15.282 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.991 5.193 -18.041 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -6.466 5.241 -17.096 1.00 0.00 H new ATOM 1665 N VAL A 106 -4.103 1.962 -16.175 1.00 0.00 N ATOM 1666 CA VAL A 106 -3.884 0.654 -16.782 1.00 0.00 C ATOM 1667 C VAL A 106 -3.902 -0.450 -15.731 1.00 0.00 C ATOM 1668 O VAL A 106 -3.626 -0.207 -14.557 1.00 0.00 O ATOM 1669 CB VAL A 106 -2.543 0.605 -17.539 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -2.700 1.175 -18.941 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -1.468 1.356 -16.768 1.00 0.00 C ATOM 0 H VAL A 106 -3.807 2.030 -15.201 1.00 0.00 H new ATOM 0 HA VAL A 106 -4.698 0.492 -17.488 1.00 0.00 H new ATOM 0 HB VAL A 106 -2.234 -0.437 -17.628 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -1.743 1.132 -19.460 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -3.438 0.591 -19.491 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -3.032 2.211 -18.877 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -0.528 1.311 -17.317 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -1.768 2.397 -16.646 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -1.337 0.899 -15.787 1.00 0.00 H new ATOM 1681 N SER A 107 -4.228 -1.664 -16.162 1.00 0.00 N ATOM 1682 CA SER A 107 -4.286 -2.806 -15.258 1.00 0.00 C ATOM 1683 C SER A 107 -4.112 -4.115 -16.023 1.00 0.00 C ATOM 1684 O SER A 107 -4.221 -4.148 -17.248 1.00 0.00 O ATOM 1685 CB SER A 107 -5.615 -2.818 -14.501 1.00 0.00 C ATOM 1686 OG SER A 107 -5.474 -3.429 -13.230 1.00 0.00 O ATOM 0 H SER A 107 -4.456 -1.882 -17.132 1.00 0.00 H new ATOM 0 HA SER A 107 -3.469 -2.712 -14.542 1.00 0.00 H new ATOM 0 HB2 SER A 107 -5.976 -1.797 -14.379 1.00 0.00 H new ATOM 0 HB3 SER A 107 -6.364 -3.354 -15.084 1.00 0.00 H new ATOM 0 HG SER A 107 -6.337 -3.422 -12.766 1.00 0.00 H new ATOM 1692 N GLN A 108 -3.841 -5.190 -15.290 1.00 0.00 N ATOM 1693 CA GLN A 108 -3.651 -6.501 -15.900 1.00 0.00 C ATOM 1694 C GLN A 108 -4.021 -7.613 -14.924 1.00 0.00 C ATOM 1695 O GLN A 108 -4.239 -7.365 -13.738 1.00 0.00 O ATOM 1696 CB GLN A 108 -2.201 -6.669 -16.357 1.00 0.00 C ATOM 1697 CG GLN A 108 -1.204 -6.723 -15.210 1.00 0.00 C ATOM 1698 CD GLN A 108 0.174 -7.173 -15.656 1.00 0.00 C ATOM 1699 OE1 GLN A 108 0.309 -8.089 -16.467 1.00 0.00 O ATOM 1700 NE2 GLN A 108 1.207 -6.528 -15.126 1.00 0.00 N ATOM 0 H GLN A 108 -3.748 -5.179 -14.274 1.00 0.00 H new ATOM 0 HA GLN A 108 -4.308 -6.569 -16.767 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -2.117 -7.584 -16.944 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -1.939 -5.842 -17.017 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -1.129 -5.737 -14.752 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -1.574 -7.404 -14.443 1.00 0.00 H new ATOM 0 HE21 GLN A 108 1.049 -5.774 -14.457 1.00 0.00 H new ATOM 0 HE22 GLN A 108 2.158 -6.786 -15.388 1.00 0.00 H new ATOM 1709 N ILE A 109 -4.091 -8.839 -15.432 1.00 0.00 N ATOM 1710 CA ILE A 109 -4.434 -9.990 -14.605 1.00 0.00 C ATOM 1711 C ILE A 109 -4.065 -11.296 -15.300 1.00 0.00 C ATOM 1712 O ILE A 109 -4.129 -11.398 -16.525 1.00 0.00 O ATOM 1713 CB ILE A 109 -5.936 -10.009 -14.263 1.00 0.00 C ATOM 1714 CG1 ILE A 109 -6.253 -11.178 -13.328 1.00 0.00 C ATOM 1715 CG2 ILE A 109 -6.767 -10.100 -15.534 1.00 0.00 C ATOM 1716 CD1 ILE A 109 -7.621 -11.087 -12.690 1.00 0.00 C ATOM 0 H ILE A 109 -3.915 -9.061 -16.412 1.00 0.00 H new ATOM 0 HA ILE A 109 -3.861 -9.898 -13.682 1.00 0.00 H new ATOM 0 HB ILE A 109 -6.190 -9.080 -13.752 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -6.184 -12.110 -13.889 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -5.497 -11.221 -12.544 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -7.826 -10.113 -15.276 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -6.558 -9.238 -16.168 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -6.513 -11.015 -16.070 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -7.778 -11.948 -12.040 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -7.688 -10.172 -12.102 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -8.385 -11.075 -13.467 1.00 0.00 H new ATOM 1728 N ILE A 110 -3.681 -12.292 -14.509 1.00 0.00 N ATOM 1729 CA ILE A 110 -3.305 -13.593 -15.048 1.00 0.00 C ATOM 1730 C ILE A 110 -3.471 -14.690 -14.002 1.00 0.00 C ATOM 1731 O ILE A 110 -3.321 -14.450 -12.804 1.00 0.00 O ATOM 1732 CB ILE A 110 -1.849 -13.595 -15.551 1.00 0.00 C ATOM 1733 CG1 ILE A 110 -1.551 -14.888 -16.312 1.00 0.00 C ATOM 1734 CG2 ILE A 110 -0.886 -13.426 -14.385 1.00 0.00 C ATOM 1735 CD1 ILE A 110 -2.157 -14.927 -17.697 1.00 0.00 C ATOM 0 H ILE A 110 -3.622 -12.223 -13.493 1.00 0.00 H new ATOM 0 HA ILE A 110 -3.971 -13.791 -15.888 1.00 0.00 H new ATOM 0 HB ILE A 110 -1.714 -12.755 -16.233 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -0.471 -15.012 -16.393 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -1.926 -15.734 -15.736 1.00 0.00 H new ATOM 0 HG21 ILE A 110 0.139 -13.429 -14.756 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -1.087 -12.480 -13.882 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -1.020 -14.247 -13.681 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -1.905 -15.872 -18.178 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -3.241 -14.835 -17.623 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -1.763 -14.102 -18.290 1.00 0.00 H new ATOM 1747 N THR A 111 -3.780 -15.898 -14.464 1.00 0.00 N ATOM 1748 CA THR A 111 -3.966 -17.034 -13.569 1.00 0.00 C ATOM 1749 C THR A 111 -3.544 -18.336 -14.239 1.00 0.00 C ATOM 1750 O THR A 111 -3.420 -18.406 -15.462 1.00 0.00 O ATOM 1751 CB THR A 111 -5.432 -17.156 -13.114 1.00 0.00 C ATOM 1752 OG1 THR A 111 -5.553 -18.180 -12.121 1.00 0.00 O ATOM 1753 CG2 THR A 111 -6.340 -17.475 -14.292 1.00 0.00 C ATOM 0 H THR A 111 -3.907 -16.115 -15.453 1.00 0.00 H new ATOM 0 HA THR A 111 -3.336 -16.856 -12.697 1.00 0.00 H new ATOM 0 HB THR A 111 -5.738 -16.200 -12.689 1.00 0.00 H new ATOM 0 HG1 THR A 111 -6.488 -18.250 -11.836 1.00 0.00 H new ATOM 0 HG21 THR A 111 -7.370 -17.556 -13.946 1.00 0.00 H new ATOM 0 HG22 THR A 111 -6.268 -16.679 -15.033 1.00 0.00 H new ATOM 0 HG23 THR A 111 -6.033 -18.419 -14.743 1.00 0.00 H new ATOM 1761 N VAL A 112 -3.325 -19.368 -13.430 1.00 0.00 N ATOM 1762 CA VAL A 112 -2.918 -20.670 -13.945 1.00 0.00 C ATOM 1763 C VAL A 112 -3.668 -21.797 -13.244 1.00 0.00 C ATOM 1764 O VAL A 112 -4.077 -21.661 -12.091 1.00 0.00 O ATOM 1765 CB VAL A 112 -1.404 -20.893 -13.775 1.00 0.00 C ATOM 1766 CG1 VAL A 112 -1.037 -20.970 -12.301 1.00 0.00 C ATOM 1767 CG2 VAL A 112 -0.965 -22.151 -14.509 1.00 0.00 C ATOM 0 H VAL A 112 -3.423 -19.327 -12.415 1.00 0.00 H new ATOM 0 HA VAL A 112 -3.162 -20.680 -15.007 1.00 0.00 H new ATOM 0 HB VAL A 112 -0.878 -20.044 -14.211 1.00 0.00 H new ATOM 0 HG11 VAL A 112 0.037 -21.128 -12.201 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -1.314 -20.038 -11.808 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -1.570 -21.799 -11.836 1.00 0.00 H new ATOM 0 HG21 VAL A 112 0.108 -22.293 -14.378 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -1.497 -23.012 -14.105 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -1.191 -22.050 -15.571 1.00 0.00 H new ATOM 1777 N SER A 113 -3.845 -22.911 -13.949 1.00 0.00 N ATOM 1778 CA SER A 113 -4.549 -24.061 -13.395 1.00 0.00 C ATOM 1779 C SER A 113 -4.461 -25.258 -14.338 1.00 0.00 C ATOM 1780 O SER A 113 -4.411 -25.099 -15.557 1.00 0.00 O ATOM 1781 CB SER A 113 -6.015 -23.711 -13.134 1.00 0.00 C ATOM 1782 OG SER A 113 -6.660 -23.291 -14.324 1.00 0.00 O ATOM 0 H SER A 113 -3.511 -23.041 -14.904 1.00 0.00 H new ATOM 0 HA SER A 113 -4.072 -24.327 -12.452 1.00 0.00 H new ATOM 0 HB2 SER A 113 -6.532 -24.579 -12.724 1.00 0.00 H new ATOM 0 HB3 SER A 113 -6.076 -22.921 -12.386 1.00 0.00 H new ATOM 0 HG SER A 113 -7.596 -23.075 -14.130 1.00 0.00 H new ATOM 1788 N GLY A 114 -4.441 -26.456 -13.763 1.00 0.00 N ATOM 1789 CA GLY A 114 -4.358 -27.663 -14.566 1.00 0.00 C ATOM 1790 C GLY A 114 -4.469 -28.923 -13.731 1.00 0.00 C ATOM 1791 O GLY A 114 -4.059 -28.963 -12.571 1.00 0.00 O ATOM 0 H GLY A 114 -4.481 -26.613 -12.756 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -5.152 -27.654 -15.313 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -3.412 -27.671 -15.107 1.00 0.00 H new ATOM 1795 N PRO A 115 -5.037 -29.983 -14.325 1.00 0.00 N ATOM 1796 CA PRO A 115 -5.215 -31.270 -13.646 1.00 0.00 C ATOM 1797 C PRO A 115 -3.891 -31.988 -13.409 1.00 0.00 C ATOM 1798 O PRO A 115 -2.820 -31.438 -13.666 1.00 0.00 O ATOM 1799 CB PRO A 115 -6.088 -32.066 -14.619 1.00 0.00 C ATOM 1800 CG PRO A 115 -5.812 -31.466 -15.954 1.00 0.00 C ATOM 1801 CD PRO A 115 -5.548 -30.007 -15.706 1.00 0.00 C ATOM 0 HA PRO A 115 -5.655 -31.151 -12.656 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -5.835 -33.126 -14.602 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -7.144 -31.986 -14.360 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -4.953 -31.943 -16.426 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -6.660 -31.600 -16.625 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -4.820 -29.605 -16.411 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -6.455 -29.411 -15.809 1.00 0.00 H new ATOM 1809 N SER A 116 -3.971 -33.221 -12.919 1.00 0.00 N ATOM 1810 CA SER A 116 -2.778 -34.014 -12.644 1.00 0.00 C ATOM 1811 C SER A 116 -3.118 -35.499 -12.572 1.00 0.00 C ATOM 1812 O SER A 116 -4.269 -35.874 -12.348 1.00 0.00 O ATOM 1813 CB SER A 116 -2.131 -33.563 -11.333 1.00 0.00 C ATOM 1814 OG SER A 116 -2.873 -34.019 -10.215 1.00 0.00 O ATOM 0 H SER A 116 -4.849 -33.693 -12.704 1.00 0.00 H new ATOM 0 HA SER A 116 -2.073 -33.860 -13.461 1.00 0.00 H new ATOM 0 HB2 SER A 116 -1.111 -33.944 -11.277 1.00 0.00 H new ATOM 0 HB3 SER A 116 -2.066 -32.475 -11.311 1.00 0.00 H new ATOM 0 HG SER A 116 -2.438 -33.719 -9.389 1.00 0.00 H new ATOM 1820 N SER A 117 -2.107 -36.341 -12.763 1.00 0.00 N ATOM 1821 CA SER A 117 -2.298 -37.786 -12.724 1.00 0.00 C ATOM 1822 C SER A 117 -2.108 -38.321 -11.308 1.00 0.00 C ATOM 1823 O SER A 117 -3.029 -38.884 -10.717 1.00 0.00 O ATOM 1824 CB SER A 117 -1.320 -38.477 -13.677 1.00 0.00 C ATOM 1825 OG SER A 117 -1.626 -38.176 -15.028 1.00 0.00 O ATOM 0 H SER A 117 -1.148 -36.047 -12.946 1.00 0.00 H new ATOM 0 HA SER A 117 -3.318 -38.001 -13.042 1.00 0.00 H new ATOM 0 HB2 SER A 117 -0.302 -38.159 -13.452 1.00 0.00 H new ATOM 0 HB3 SER A 117 -1.358 -39.555 -13.524 1.00 0.00 H new ATOM 0 HG SER A 117 -0.986 -38.628 -15.617 1.00 0.00 H new ATOM 1831 N GLY A 118 -0.906 -38.140 -10.770 1.00 0.00 N ATOM 1832 CA GLY A 118 -0.617 -38.610 -9.427 1.00 0.00 C ATOM 1833 C GLY A 118 -1.415 -37.873 -8.370 1.00 0.00 C ATOM 1834 O GLY A 118 -2.191 -36.971 -8.686 1.00 0.00 O ATOM 0 H GLY A 118 -0.128 -37.677 -11.239 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -0.834 -39.676 -9.364 1.00 0.00 H new ATOM 0 HA3 GLY A 118 0.447 -38.489 -9.224 1.00 0.00 H new TER 1838 GLY A 118