USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1027 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 75 SER OG : rot 71:sc= 0.0689 USER MOD Set 1.2: A 88 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 48 ASN : amide:sc= -2.58! C(o=-3.4!,f=-12!) USER MOD Set 2.2: A 50 SER OG : rot -7:sc= 1.11 USER MOD Set 2.3: A 111 HIS : no HD1:sc= -1.92 K(o=-3.4,f=-6.1) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0716 USER MOD Single : A 17 LYS NZ :NH3+ -132:sc= -0.332 (180deg=-0.584) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 27 ASN : amide:sc= -0.162 X(o=-0.16,f=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.0396 K(o=-0.04,f=-1.1) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= -0.164 X(o=-0.16,f=-0.016) USER MOD Single : A 59 CYS SG : rot 140:sc= -2.27 USER MOD Single : A 60 GLN : amide:sc= -0.317 X(o=-0.32,f=-0.78) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -150:sc= 0 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 GLN : amide:sc= -4.15! C(o=-4.2!,f=-9.6!) USER MOD Single : A 77 ASN : amide:sc= -0.688 K(o=-0.69,f=-6.7!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -1.92 X(o=-1.9,f=-1.8!) USER MOD Single : A 95 ASN : amide:sc= -4.5! C(o=-4.5!,f=-1.8!) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.103 USER MOD Single : A 109 TYR OH : rot 165:sc= -0.084 USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=-0.00078) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 SER OG : rot 21:sc= 0.415 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 ASN : amide:sc= -1.76 K(o=-1.8,f=-3.1!) USER MOD Single : A 124 ASN : amide:sc= -0.144 K(o=-0.14,f=-1.1) USER MOD Single : A 129 SER OG : rot -108:sc= 1.12 USER MOD Single : A 131 GLN : amide:sc= 0.757 K(o=0.76,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -21.018 -24.861 8.046 1.00 0.00 N ATOM 2 CA GLY A 1 -20.673 -24.052 6.892 1.00 0.00 C ATOM 3 C GLY A 1 -19.179 -23.824 6.769 1.00 0.00 C ATOM 4 O GLY A 1 -18.567 -24.197 5.769 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.050 -24.988 8.085 1.00 0.00 H new ATOM 0 H2 GLY A 1 -20.558 -25.790 7.969 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.694 -24.386 8.913 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -21.039 -24.539 5.988 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -21.180 -23.089 6.962 1.00 0.00 H new ATOM 8 N SER A 2 -18.591 -23.207 7.789 1.00 0.00 N ATOM 9 CA SER A 2 -17.161 -22.924 7.789 1.00 0.00 C ATOM 10 C SER A 2 -16.612 -22.897 9.213 1.00 0.00 C ATOM 11 O SER A 2 -17.307 -22.505 10.150 1.00 0.00 O ATOM 12 CB SER A 2 -16.883 -21.588 7.098 1.00 0.00 C ATOM 13 OG SER A 2 -15.556 -21.155 7.339 1.00 0.00 O ATOM 0 H SER A 2 -19.083 -22.894 8.626 1.00 0.00 H new ATOM 0 HA SER A 2 -16.659 -23.720 7.239 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.046 -21.689 6.025 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.585 -20.836 7.458 1.00 0.00 H new ATOM 0 HG SER A 2 -15.403 -20.300 6.885 1.00 0.00 H new ATOM 19 N SER A 3 -15.360 -23.317 9.366 1.00 0.00 N ATOM 20 CA SER A 3 -14.718 -23.345 10.675 1.00 0.00 C ATOM 21 C SER A 3 -13.243 -22.973 10.564 1.00 0.00 C ATOM 22 O SER A 3 -12.615 -23.181 9.527 1.00 0.00 O ATOM 23 CB SER A 3 -14.861 -24.731 11.307 1.00 0.00 C ATOM 24 OG SER A 3 -14.843 -24.651 12.722 1.00 0.00 O ATOM 0 H SER A 3 -14.770 -23.642 8.600 1.00 0.00 H new ATOM 0 HA SER A 3 -15.213 -22.611 11.311 1.00 0.00 H new ATOM 0 HB2 SER A 3 -15.793 -25.190 10.977 1.00 0.00 H new ATOM 0 HB3 SER A 3 -14.051 -25.375 10.966 1.00 0.00 H new ATOM 0 HG SER A 3 -14.938 -25.549 13.102 1.00 0.00 H new ATOM 30 N GLY A 4 -12.696 -22.420 11.643 1.00 0.00 N ATOM 31 CA GLY A 4 -11.299 -22.027 11.648 1.00 0.00 C ATOM 32 C GLY A 4 -10.384 -23.133 11.159 1.00 0.00 C ATOM 33 O GLY A 4 -9.799 -23.033 10.080 1.00 0.00 O ATOM 0 H GLY A 4 -13.196 -22.237 12.513 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.170 -21.147 11.017 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.009 -21.740 12.659 1.00 0.00 H new ATOM 37 N SER A 5 -10.258 -24.190 11.955 1.00 0.00 N ATOM 38 CA SER A 5 -9.404 -25.317 11.600 1.00 0.00 C ATOM 39 C SER A 5 -9.543 -26.446 12.616 1.00 0.00 C ATOM 40 O SER A 5 -9.879 -26.213 13.777 1.00 0.00 O ATOM 41 CB SER A 5 -7.943 -24.869 11.515 1.00 0.00 C ATOM 42 OG SER A 5 -7.380 -24.720 12.806 1.00 0.00 O ATOM 0 H SER A 5 -10.737 -24.289 12.850 1.00 0.00 H new ATOM 0 HA SER A 5 -9.721 -25.688 10.625 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.368 -25.599 10.946 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.880 -23.924 10.976 1.00 0.00 H new ATOM 0 HG SER A 5 -6.446 -24.435 12.725 1.00 0.00 H new ATOM 48 N SER A 6 -9.283 -27.671 12.170 1.00 0.00 N ATOM 49 CA SER A 6 -9.383 -28.838 13.039 1.00 0.00 C ATOM 50 C SER A 6 -8.722 -28.570 14.387 1.00 0.00 C ATOM 51 O SER A 6 -9.293 -28.855 15.439 1.00 0.00 O ATOM 52 CB SER A 6 -8.734 -30.053 12.372 1.00 0.00 C ATOM 53 OG SER A 6 -7.355 -29.828 12.135 1.00 0.00 O ATOM 0 H SER A 6 -9.002 -27.881 11.212 1.00 0.00 H new ATOM 0 HA SER A 6 -10.440 -29.046 13.208 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.859 -30.930 13.007 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.238 -30.267 11.430 1.00 0.00 H new ATOM 0 HG SER A 6 -6.963 -30.619 11.710 1.00 0.00 H new ATOM 59 N GLY A 7 -7.512 -28.018 14.347 1.00 0.00 N ATOM 60 CA GLY A 7 -6.792 -27.721 15.571 1.00 0.00 C ATOM 61 C GLY A 7 -6.864 -26.253 15.944 1.00 0.00 C ATOM 62 O GLY A 7 -7.825 -25.555 15.621 1.00 0.00 O ATOM 0 H GLY A 7 -7.019 -27.772 13.489 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.202 -28.320 16.384 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.748 -28.013 15.455 1.00 0.00 H new ATOM 66 N PRO A 8 -5.828 -25.764 16.641 1.00 0.00 N ATOM 67 CA PRO A 8 -5.754 -24.366 17.074 1.00 0.00 C ATOM 68 C PRO A 8 -5.546 -23.407 15.907 1.00 0.00 C ATOM 69 O PRO A 8 -5.276 -23.816 14.777 1.00 0.00 O ATOM 70 CB PRO A 8 -4.539 -24.346 18.005 1.00 0.00 C ATOM 71 CG PRO A 8 -3.693 -25.484 17.548 1.00 0.00 C ATOM 72 CD PRO A 8 -4.648 -26.539 17.060 1.00 0.00 C ATOM 0 HA PRO A 8 -6.678 -24.038 17.550 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -4.002 -23.400 17.935 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -4.836 -24.467 19.047 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.016 -25.172 16.753 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -3.075 -25.863 18.362 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -4.227 -27.110 16.232 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -4.894 -27.253 17.846 1.00 0.00 H new ATOM 80 N PRO A 9 -5.675 -22.101 16.182 1.00 0.00 N ATOM 81 CA PRO A 9 -5.504 -21.057 15.167 1.00 0.00 C ATOM 82 C PRO A 9 -4.054 -20.920 14.715 1.00 0.00 C ATOM 83 O PRO A 9 -3.136 -20.789 15.525 1.00 0.00 O ATOM 84 CB PRO A 9 -5.964 -19.786 15.885 1.00 0.00 C ATOM 85 CG PRO A 9 -5.750 -20.069 17.331 1.00 0.00 C ATOM 86 CD PRO A 9 -5.996 -21.542 17.506 1.00 0.00 C ATOM 0 HA PRO A 9 -6.065 -21.276 14.258 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -5.388 -18.919 15.562 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -7.011 -19.570 15.675 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -4.737 -19.804 17.635 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -6.432 -19.484 17.948 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -5.362 -21.965 18.285 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -7.029 -21.746 17.789 1.00 0.00 H new ATOM 94 N PRO A 10 -3.841 -20.949 13.391 1.00 0.00 N ATOM 95 CA PRO A 10 -2.504 -20.828 12.802 1.00 0.00 C ATOM 96 C PRO A 10 -1.924 -19.427 12.964 1.00 0.00 C ATOM 97 O PRO A 10 -2.452 -18.609 13.717 1.00 0.00 O ATOM 98 CB PRO A 10 -2.738 -21.143 11.323 1.00 0.00 C ATOM 99 CG PRO A 10 -4.167 -20.797 11.084 1.00 0.00 C ATOM 100 CD PRO A 10 -4.888 -21.102 12.368 1.00 0.00 C ATOM 0 HA PRO A 10 -1.785 -21.490 13.284 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -2.077 -20.558 10.684 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -2.543 -22.193 11.106 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -4.274 -19.746 10.817 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -4.577 -21.379 10.259 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -5.718 -20.415 12.536 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -5.304 -22.110 12.366 1.00 0.00 H new ATOM 108 N ALA A 11 -0.835 -19.156 12.251 1.00 0.00 N ATOM 109 CA ALA A 11 -0.186 -17.853 12.314 1.00 0.00 C ATOM 110 C ALA A 11 -0.079 -17.225 10.928 1.00 0.00 C ATOM 111 O ALA A 11 0.824 -17.531 10.149 1.00 0.00 O ATOM 112 CB ALA A 11 1.193 -17.980 12.945 1.00 0.00 C ATOM 0 H ALA A 11 -0.384 -19.822 11.623 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.799 -17.199 12.934 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.666 -16.999 12.986 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.096 -18.378 13.955 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.806 -18.654 12.347 1.00 0.00 H new ATOM 118 N PRO A 12 -1.024 -16.327 10.610 1.00 0.00 N ATOM 119 CA PRO A 12 -1.057 -15.638 9.317 1.00 0.00 C ATOM 120 C PRO A 12 0.084 -14.639 9.162 1.00 0.00 C ATOM 121 O PRO A 12 0.946 -14.527 10.035 1.00 0.00 O ATOM 122 CB PRO A 12 -2.405 -14.912 9.337 1.00 0.00 C ATOM 123 CG PRO A 12 -2.711 -14.721 10.782 1.00 0.00 C ATOM 124 CD PRO A 12 -2.130 -15.914 11.489 1.00 0.00 C ATOM 0 HA PRO A 12 -0.942 -16.331 8.483 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -2.348 -13.957 8.815 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -3.179 -15.500 8.843 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -2.273 -13.795 11.155 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -3.786 -14.654 10.948 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -1.775 -15.656 12.487 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -2.867 -16.709 11.608 1.00 0.00 H new ATOM 132 N ILE A 13 0.084 -13.915 8.048 1.00 0.00 N ATOM 133 CA ILE A 13 1.119 -12.924 7.781 1.00 0.00 C ATOM 134 C ILE A 13 0.873 -11.645 8.573 1.00 0.00 C ATOM 135 O ILE A 13 -0.115 -10.940 8.369 1.00 0.00 O ATOM 136 CB ILE A 13 1.196 -12.580 6.282 1.00 0.00 C ATOM 137 CG1 ILE A 13 1.342 -13.856 5.450 1.00 0.00 C ATOM 138 CG2 ILE A 13 2.355 -11.631 6.015 1.00 0.00 C ATOM 139 CD1 ILE A 13 0.851 -13.709 4.027 1.00 0.00 C ATOM 0 H ILE A 13 -0.621 -13.996 7.316 1.00 0.00 H new ATOM 0 HA ILE A 13 2.066 -13.365 8.093 1.00 0.00 H new ATOM 0 HB ILE A 13 0.271 -12.083 5.991 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.391 -14.152 5.435 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.790 -14.661 5.935 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.396 -11.397 4.951 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.211 -10.712 6.583 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.289 -12.103 6.319 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.985 -14.652 3.497 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.206 -13.443 4.032 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.420 -12.926 3.525 1.00 0.00 H new ATOM 151 N PRO A 14 1.793 -11.335 9.499 1.00 0.00 N ATOM 152 CA PRO A 14 1.699 -10.138 10.339 1.00 0.00 C ATOM 153 C PRO A 14 1.923 -8.854 9.546 1.00 0.00 C ATOM 154 O PRO A 14 2.420 -8.887 8.420 1.00 0.00 O ATOM 155 CB PRO A 14 2.819 -10.335 11.363 1.00 0.00 C ATOM 156 CG PRO A 14 3.803 -11.223 10.684 1.00 0.00 C ATOM 157 CD PRO A 14 2.997 -12.130 9.795 1.00 0.00 C ATOM 0 HA PRO A 14 0.710 -10.029 10.784 1.00 0.00 H new ATOM 0 HB2 PRO A 14 3.272 -9.384 11.642 1.00 0.00 H new ATOM 0 HB3 PRO A 14 2.442 -10.790 12.279 1.00 0.00 H new ATOM 0 HG2 PRO A 14 4.518 -10.641 10.102 1.00 0.00 H new ATOM 0 HG3 PRO A 14 4.377 -11.798 11.411 1.00 0.00 H new ATOM 0 HD2 PRO A 14 3.541 -12.389 8.887 1.00 0.00 H new ATOM 0 HD3 PRO A 14 2.748 -13.066 10.295 1.00 0.00 H new ATOM 165 N ASP A 15 1.552 -7.726 10.140 1.00 0.00 N ATOM 166 CA ASP A 15 1.713 -6.430 9.490 1.00 0.00 C ATOM 167 C ASP A 15 3.181 -6.160 9.173 1.00 0.00 C ATOM 168 O ASP A 15 4.070 -6.866 9.651 1.00 0.00 O ATOM 169 CB ASP A 15 1.156 -5.317 10.378 1.00 0.00 C ATOM 170 CG ASP A 15 2.128 -4.903 11.465 1.00 0.00 C ATOM 171 OD1 ASP A 15 2.995 -4.047 11.192 1.00 0.00 O ATOM 172 OD2 ASP A 15 2.021 -5.435 12.590 1.00 0.00 O ATOM 0 H ASP A 15 1.137 -7.682 11.071 1.00 0.00 H new ATOM 0 HA ASP A 15 1.155 -6.449 8.554 1.00 0.00 H new ATOM 0 HB2 ASP A 15 0.914 -4.451 9.762 1.00 0.00 H new ATOM 0 HB3 ASP A 15 0.225 -5.653 10.835 1.00 0.00 H new ATOM 177 N LEU A 16 3.427 -5.135 8.366 1.00 0.00 N ATOM 178 CA LEU A 16 4.788 -4.771 7.984 1.00 0.00 C ATOM 179 C LEU A 16 4.905 -3.268 7.755 1.00 0.00 C ATOM 180 O LEU A 16 4.252 -2.710 6.873 1.00 0.00 O ATOM 181 CB LEU A 16 5.203 -5.525 6.720 1.00 0.00 C ATOM 182 CG LEU A 16 6.707 -5.681 6.495 1.00 0.00 C ATOM 183 CD1 LEU A 16 6.994 -6.889 5.617 1.00 0.00 C ATOM 184 CD2 LEU A 16 7.286 -4.418 5.872 1.00 0.00 C ATOM 0 H LEU A 16 2.703 -4.541 7.963 1.00 0.00 H new ATOM 0 HA LEU A 16 5.455 -5.049 8.800 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.755 -6.518 6.750 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.778 -5.010 5.858 1.00 0.00 H new ATOM 0 HG LEU A 16 7.185 -5.839 7.462 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.070 -6.983 5.468 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.614 -7.789 6.101 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.504 -6.762 4.652 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.358 -4.546 5.719 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.802 -4.230 4.913 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.113 -3.572 6.537 1.00 0.00 H new ATOM 196 N LYS A 17 5.745 -2.617 8.553 1.00 0.00 N ATOM 197 CA LYS A 17 5.952 -1.178 8.436 1.00 0.00 C ATOM 198 C LYS A 17 6.761 -0.845 7.187 1.00 0.00 C ATOM 199 O LYS A 17 7.765 -1.494 6.894 1.00 0.00 O ATOM 200 CB LYS A 17 6.668 -0.643 9.678 1.00 0.00 C ATOM 201 CG LYS A 17 6.495 0.852 9.883 1.00 0.00 C ATOM 202 CD LYS A 17 6.606 1.231 11.350 1.00 0.00 C ATOM 203 CE LYS A 17 7.967 0.860 11.920 1.00 0.00 C ATOM 204 NZ LYS A 17 9.064 1.649 11.295 1.00 0.00 N ATOM 0 H LYS A 17 6.294 -3.063 9.288 1.00 0.00 H new ATOM 0 HA LYS A 17 4.976 -0.701 8.353 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.294 -1.168 10.557 1.00 0.00 H new ATOM 0 HB3 LYS A 17 7.731 -0.870 9.600 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.251 1.388 9.310 1.00 0.00 H new ATOM 0 HG3 LYS A 17 5.523 1.163 9.499 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.443 2.303 11.463 1.00 0.00 H new ATOM 0 HD3 LYS A 17 5.823 0.727 11.917 1.00 0.00 H new ATOM 0 HE2 LYS A 17 7.967 1.027 12.997 1.00 0.00 H new ATOM 0 HE3 LYS A 17 8.149 -0.203 11.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 9.834 1.009 11.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 8.700 2.146 10.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 9.426 2.343 11.979 1.00 0.00 H new ATOM 218 N VAL A 18 6.318 0.172 6.454 1.00 0.00 N ATOM 219 CA VAL A 18 7.003 0.593 5.237 1.00 0.00 C ATOM 220 C VAL A 18 7.476 2.038 5.345 1.00 0.00 C ATOM 221 O VAL A 18 8.542 2.392 4.842 1.00 0.00 O ATOM 222 CB VAL A 18 6.091 0.454 4.004 1.00 0.00 C ATOM 223 CG1 VAL A 18 5.765 -1.009 3.743 1.00 0.00 C ATOM 224 CG2 VAL A 18 4.819 1.268 4.187 1.00 0.00 C ATOM 0 H VAL A 18 5.488 0.719 6.682 1.00 0.00 H new ATOM 0 HA VAL A 18 7.867 -0.061 5.117 1.00 0.00 H new ATOM 0 HB VAL A 18 6.622 0.844 3.135 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.120 -1.087 2.868 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.688 -1.561 3.564 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.254 -1.428 4.610 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.187 1.158 3.306 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.282 0.911 5.066 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.076 2.319 4.320 1.00 0.00 H new ATOM 234 N PHE A 19 6.677 2.869 6.006 1.00 0.00 N ATOM 235 CA PHE A 19 7.014 4.277 6.180 1.00 0.00 C ATOM 236 C PHE A 19 6.705 4.738 7.601 1.00 0.00 C ATOM 237 O PHE A 19 5.605 4.524 8.108 1.00 0.00 O ATOM 238 CB PHE A 19 6.244 5.136 5.174 1.00 0.00 C ATOM 239 CG PHE A 19 6.632 6.586 5.204 1.00 0.00 C ATOM 240 CD1 PHE A 19 7.908 6.984 4.838 1.00 0.00 C ATOM 241 CD2 PHE A 19 5.721 7.553 5.599 1.00 0.00 C ATOM 242 CE1 PHE A 19 8.268 8.318 4.864 1.00 0.00 C ATOM 243 CE2 PHE A 19 6.075 8.888 5.626 1.00 0.00 C ATOM 244 CZ PHE A 19 7.351 9.271 5.260 1.00 0.00 C ATOM 0 H PHE A 19 5.792 2.592 6.430 1.00 0.00 H new ATOM 0 HA PHE A 19 8.083 4.394 6.003 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.411 4.744 4.171 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.176 5.049 5.376 1.00 0.00 H new ATOM 0 HD1 PHE A 19 8.630 6.243 4.529 1.00 0.00 H new ATOM 0 HD2 PHE A 19 4.723 7.259 5.889 1.00 0.00 H new ATOM 0 HE1 PHE A 19 9.265 8.615 4.575 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.355 9.632 5.933 1.00 0.00 H new ATOM 0 HZ PHE A 19 7.631 10.314 5.284 1.00 0.00 H new ATOM 254 N GLU A 20 7.685 5.373 8.237 1.00 0.00 N ATOM 255 CA GLU A 20 7.518 5.863 9.600 1.00 0.00 C ATOM 256 C GLU A 20 8.092 7.270 9.747 1.00 0.00 C ATOM 257 O GLU A 20 9.308 7.454 9.780 1.00 0.00 O ATOM 258 CB GLU A 20 8.197 4.917 10.593 1.00 0.00 C ATOM 259 CG GLU A 20 8.165 5.416 12.028 1.00 0.00 C ATOM 260 CD GLU A 20 9.370 6.268 12.377 1.00 0.00 C ATOM 261 OE1 GLU A 20 10.388 5.701 12.824 1.00 0.00 O ATOM 262 OE2 GLU A 20 9.294 7.502 12.202 1.00 0.00 O ATOM 0 H GLU A 20 8.602 5.560 7.830 1.00 0.00 H new ATOM 0 HA GLU A 20 6.450 5.900 9.817 1.00 0.00 H new ATOM 0 HB2 GLU A 20 7.710 3.943 10.545 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.234 4.770 10.291 1.00 0.00 H new ATOM 0 HG2 GLU A 20 7.256 5.997 12.187 1.00 0.00 H new ATOM 0 HG3 GLU A 20 8.120 4.563 12.704 1.00 0.00 H new ATOM 269 N ARG A 21 7.207 8.257 9.833 1.00 0.00 N ATOM 270 CA ARG A 21 7.625 9.647 9.974 1.00 0.00 C ATOM 271 C ARG A 21 7.333 10.163 11.381 1.00 0.00 C ATOM 272 O ARG A 21 6.394 9.710 12.035 1.00 0.00 O ATOM 273 CB ARG A 21 6.914 10.523 8.941 1.00 0.00 C ATOM 274 CG ARG A 21 7.373 11.972 8.951 1.00 0.00 C ATOM 275 CD ARG A 21 7.206 12.619 7.585 1.00 0.00 C ATOM 276 NE ARG A 21 7.781 13.961 7.541 1.00 0.00 N ATOM 277 CZ ARG A 21 8.067 14.601 6.413 1.00 0.00 C ATOM 278 NH1 ARG A 21 7.832 14.025 5.242 1.00 0.00 N ATOM 279 NH2 ARG A 21 8.588 15.820 6.454 1.00 0.00 N ATOM 0 H ARG A 21 6.196 8.121 9.808 1.00 0.00 H new ATOM 0 HA ARG A 21 8.700 9.696 9.803 1.00 0.00 H new ATOM 0 HB2 ARG A 21 7.079 10.105 7.948 1.00 0.00 H new ATOM 0 HB3 ARG A 21 5.840 10.490 9.126 1.00 0.00 H new ATOM 0 HG2 ARG A 21 6.801 12.531 9.692 1.00 0.00 H new ATOM 0 HG3 ARG A 21 8.419 12.021 9.253 1.00 0.00 H new ATOM 0 HD2 ARG A 21 7.682 11.996 6.828 1.00 0.00 H new ATOM 0 HD3 ARG A 21 6.146 12.670 7.335 1.00 0.00 H new ATOM 0 HE ARG A 21 7.973 14.432 8.425 1.00 0.00 H new ATOM 0 HH11 ARG A 21 7.431 13.088 5.206 1.00 0.00 H new ATOM 0 HH12 ARG A 21 8.053 14.519 4.377 1.00 0.00 H new ATOM 0 HH21 ARG A 21 8.770 16.267 7.353 1.00 0.00 H new ATOM 0 HH22 ARG A 21 8.807 16.310 5.587 1.00 0.00 H new ATOM 293 N GLU A 22 8.145 11.111 11.838 1.00 0.00 N ATOM 294 CA GLU A 22 7.974 11.686 13.167 1.00 0.00 C ATOM 295 C GLU A 22 6.514 12.054 13.417 1.00 0.00 C ATOM 296 O GLU A 22 6.081 12.178 14.562 1.00 0.00 O ATOM 297 CB GLU A 22 8.858 12.924 13.329 1.00 0.00 C ATOM 298 CG GLU A 22 8.530 14.039 12.350 1.00 0.00 C ATOM 299 CD GLU A 22 9.157 15.362 12.742 1.00 0.00 C ATOM 300 OE1 GLU A 22 9.154 15.685 13.948 1.00 0.00 O ATOM 301 OE2 GLU A 22 9.650 16.075 11.843 1.00 0.00 O ATOM 0 H GLU A 22 8.927 11.497 11.308 1.00 0.00 H new ATOM 0 HA GLU A 22 8.273 10.937 13.900 1.00 0.00 H new ATOM 0 HB2 GLU A 22 8.755 13.303 14.346 1.00 0.00 H new ATOM 0 HB3 GLU A 22 9.901 12.635 13.201 1.00 0.00 H new ATOM 0 HG2 GLU A 22 8.876 13.758 11.355 1.00 0.00 H new ATOM 0 HG3 GLU A 22 7.448 14.158 12.289 1.00 0.00 H new ATOM 308 N GLY A 23 5.760 12.227 12.336 1.00 0.00 N ATOM 309 CA GLY A 23 4.358 12.580 12.458 1.00 0.00 C ATOM 310 C GLY A 23 3.449 11.598 11.746 1.00 0.00 C ATOM 311 O GLY A 23 2.482 11.102 12.326 1.00 0.00 O ATOM 0 H GLY A 23 6.095 12.129 11.378 1.00 0.00 H new ATOM 0 HA2 GLY A 23 4.087 12.622 13.513 1.00 0.00 H new ATOM 0 HA3 GLY A 23 4.201 13.578 12.049 1.00 0.00 H new ATOM 315 N VAL A 24 3.756 11.317 10.484 1.00 0.00 N ATOM 316 CA VAL A 24 2.960 10.389 9.691 1.00 0.00 C ATOM 317 C VAL A 24 3.437 8.953 9.882 1.00 0.00 C ATOM 318 O VAL A 24 4.611 8.712 10.161 1.00 0.00 O ATOM 319 CB VAL A 24 3.013 10.741 8.192 1.00 0.00 C ATOM 320 CG1 VAL A 24 2.110 9.813 7.393 1.00 0.00 C ATOM 321 CG2 VAL A 24 2.625 12.195 7.973 1.00 0.00 C ATOM 0 H VAL A 24 4.551 11.720 9.988 1.00 0.00 H new ATOM 0 HA VAL A 24 1.931 10.477 10.041 1.00 0.00 H new ATOM 0 HB VAL A 24 4.036 10.605 7.840 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.160 10.077 6.337 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.439 8.782 7.526 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.083 9.914 7.744 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.668 12.427 6.909 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.612 12.361 8.340 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.317 12.841 8.513 1.00 0.00 H new ATOM 331 N GLN A 25 2.518 8.005 9.728 1.00 0.00 N ATOM 332 CA GLN A 25 2.846 6.593 9.884 1.00 0.00 C ATOM 333 C GLN A 25 2.041 5.736 8.912 1.00 0.00 C ATOM 334 O GLN A 25 0.851 5.972 8.699 1.00 0.00 O ATOM 335 CB GLN A 25 2.579 6.141 11.321 1.00 0.00 C ATOM 336 CG GLN A 25 3.769 6.329 12.249 1.00 0.00 C ATOM 337 CD GLN A 25 3.356 6.532 13.693 1.00 0.00 C ATOM 338 OE1 GLN A 25 2.398 5.921 14.169 1.00 0.00 O ATOM 339 NE2 GLN A 25 4.078 7.392 14.401 1.00 0.00 N ATOM 0 H GLN A 25 1.542 8.189 9.496 1.00 0.00 H new ATOM 0 HA GLN A 25 3.905 6.466 9.661 1.00 0.00 H new ATOM 0 HB2 GLN A 25 1.729 6.698 11.716 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.296 5.088 11.315 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.420 5.457 12.180 1.00 0.00 H new ATOM 0 HG3 GLN A 25 4.351 7.189 11.917 1.00 0.00 H new ATOM 0 HE21 GLN A 25 4.864 7.877 13.967 1.00 0.00 H new ATOM 0 HE22 GLN A 25 3.847 7.568 15.379 1.00 0.00 H new ATOM 348 N LEU A 26 2.698 4.743 8.324 1.00 0.00 N ATOM 349 CA LEU A 26 2.044 3.851 7.373 1.00 0.00 C ATOM 350 C LEU A 26 2.342 2.391 7.701 1.00 0.00 C ATOM 351 O LEU A 26 3.481 2.032 7.996 1.00 0.00 O ATOM 352 CB LEU A 26 2.500 4.169 5.948 1.00 0.00 C ATOM 353 CG LEU A 26 1.507 3.834 4.834 1.00 0.00 C ATOM 354 CD1 LEU A 26 0.294 4.749 4.908 1.00 0.00 C ATOM 355 CD2 LEU A 26 2.176 3.942 3.472 1.00 0.00 C ATOM 0 H LEU A 26 3.683 4.535 8.489 1.00 0.00 H new ATOM 0 HA LEU A 26 0.968 4.008 7.447 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.733 5.232 5.892 1.00 0.00 H new ATOM 0 HB3 LEU A 26 3.427 3.629 5.756 1.00 0.00 H new ATOM 0 HG LEU A 26 1.171 2.806 4.970 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.402 4.496 4.108 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.199 4.622 5.872 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.613 5.785 4.798 1.00 0.00 H new ATOM 0 HD21 LEU A 26 1.454 3.700 2.692 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.541 4.958 3.326 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.012 3.245 3.421 1.00 0.00 H new ATOM 367 N ASN A 27 1.311 1.555 7.644 1.00 0.00 N ATOM 368 CA ASN A 27 1.464 0.133 7.934 1.00 0.00 C ATOM 369 C ASN A 27 1.009 -0.715 6.750 1.00 0.00 C ATOM 370 O ASN A 27 0.088 -0.342 6.022 1.00 0.00 O ATOM 371 CB ASN A 27 0.663 -0.243 9.182 1.00 0.00 C ATOM 372 CG ASN A 27 1.222 0.391 10.441 1.00 0.00 C ATOM 373 OD1 ASN A 27 1.862 -0.276 11.254 1.00 0.00 O ATOM 374 ND2 ASN A 27 0.984 1.687 10.607 1.00 0.00 N ATOM 0 H ASN A 27 0.361 1.836 7.400 1.00 0.00 H new ATOM 0 HA ASN A 27 2.521 -0.064 8.115 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.374 0.067 9.052 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.660 -1.327 9.295 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.337 2.168 11.434 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.449 2.201 9.907 1.00 0.00 H new ATOM 381 N LEU A 28 1.661 -1.857 6.563 1.00 0.00 N ATOM 382 CA LEU A 28 1.324 -2.760 5.467 1.00 0.00 C ATOM 383 C LEU A 28 0.690 -4.043 5.995 1.00 0.00 C ATOM 384 O LEU A 28 1.152 -4.616 6.981 1.00 0.00 O ATOM 385 CB LEU A 28 2.575 -3.094 4.652 1.00 0.00 C ATOM 386 CG LEU A 28 2.346 -3.432 3.179 1.00 0.00 C ATOM 387 CD1 LEU A 28 3.635 -3.273 2.388 1.00 0.00 C ATOM 388 CD2 LEU A 28 1.800 -4.845 3.035 1.00 0.00 C ATOM 0 H LEU A 28 2.426 -2.180 7.156 1.00 0.00 H new ATOM 0 HA LEU A 28 0.602 -2.257 4.823 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.257 -2.246 4.708 1.00 0.00 H new ATOM 0 HB3 LEU A 28 3.077 -3.939 5.124 1.00 0.00 H new ATOM 0 HG LEU A 28 1.609 -2.737 2.777 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.452 -3.518 1.342 1.00 0.00 H new ATOM 0 HD12 LEU A 28 3.984 -2.243 2.464 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.394 -3.944 2.791 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.643 -5.069 1.980 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.513 -5.555 3.454 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.852 -4.925 3.568 1.00 0.00 H new ATOM 400 N SER A 29 -0.371 -4.489 5.329 1.00 0.00 N ATOM 401 CA SER A 29 -1.070 -5.704 5.732 1.00 0.00 C ATOM 402 C SER A 29 -1.241 -6.650 4.547 1.00 0.00 C ATOM 403 O SER A 29 -1.653 -6.238 3.463 1.00 0.00 O ATOM 404 CB SER A 29 -2.438 -5.358 6.324 1.00 0.00 C ATOM 405 OG SER A 29 -2.303 -4.734 7.589 1.00 0.00 O ATOM 0 H SER A 29 -0.765 -4.028 4.509 1.00 0.00 H new ATOM 0 HA SER A 29 -0.469 -6.205 6.491 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.975 -4.697 5.644 1.00 0.00 H new ATOM 0 HB3 SER A 29 -3.034 -6.265 6.424 1.00 0.00 H new ATOM 0 HG SER A 29 -3.191 -4.521 7.945 1.00 0.00 H new ATOM 411 N PHE A 30 -0.921 -7.922 4.763 1.00 0.00 N ATOM 412 CA PHE A 30 -1.037 -8.928 3.714 1.00 0.00 C ATOM 413 C PHE A 30 -2.265 -9.805 3.936 1.00 0.00 C ATOM 414 O PHE A 30 -2.643 -10.087 5.073 1.00 0.00 O ATOM 415 CB PHE A 30 0.222 -9.796 3.669 1.00 0.00 C ATOM 416 CG PHE A 30 1.472 -9.024 3.357 1.00 0.00 C ATOM 417 CD1 PHE A 30 2.200 -8.420 4.369 1.00 0.00 C ATOM 418 CD2 PHE A 30 1.919 -8.903 2.051 1.00 0.00 C ATOM 419 CE1 PHE A 30 3.351 -7.709 4.084 1.00 0.00 C ATOM 420 CE2 PHE A 30 3.069 -8.193 1.760 1.00 0.00 C ATOM 421 CZ PHE A 30 3.785 -7.595 2.778 1.00 0.00 C ATOM 0 H PHE A 30 -0.579 -8.280 5.655 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.148 -8.412 2.760 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.344 -10.296 4.630 1.00 0.00 H new ATOM 0 HB3 PHE A 30 0.089 -10.576 2.919 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.865 -8.505 5.392 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.363 -9.369 1.251 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.910 -7.243 4.882 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.407 -8.106 0.738 1.00 0.00 H new ATOM 0 HZ PHE A 30 4.683 -7.039 2.553 1.00 0.00 H new ATOM 431 N ILE A 31 -2.885 -10.233 2.841 1.00 0.00 N ATOM 432 CA ILE A 31 -4.070 -11.078 2.915 1.00 0.00 C ATOM 433 C ILE A 31 -4.133 -12.041 1.734 1.00 0.00 C ATOM 434 O ILE A 31 -4.057 -11.627 0.577 1.00 0.00 O ATOM 435 CB ILE A 31 -5.360 -10.237 2.946 1.00 0.00 C ATOM 436 CG1 ILE A 31 -5.485 -9.506 4.284 1.00 0.00 C ATOM 437 CG2 ILE A 31 -6.574 -11.121 2.704 1.00 0.00 C ATOM 438 CD1 ILE A 31 -4.828 -8.143 4.292 1.00 0.00 C ATOM 0 H ILE A 31 -2.586 -10.008 1.892 1.00 0.00 H new ATOM 0 HA ILE A 31 -3.994 -11.647 3.842 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.312 -9.494 2.150 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.541 -9.393 4.530 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.040 -10.120 5.067 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -7.478 -10.512 2.729 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.486 -11.601 1.729 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -6.629 -11.884 3.480 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.956 -7.683 5.272 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.765 -8.250 4.078 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.289 -7.512 3.532 1.00 0.00 H new ATOM 450 N ARG A 32 -4.275 -13.328 2.034 1.00 0.00 N ATOM 451 CA ARG A 32 -4.349 -14.350 0.998 1.00 0.00 C ATOM 452 C ARG A 32 -5.595 -15.214 1.174 1.00 0.00 C ATOM 453 O ARG A 32 -5.674 -16.058 2.067 1.00 0.00 O ATOM 454 CB ARG A 32 -3.098 -15.230 1.028 1.00 0.00 C ATOM 455 CG ARG A 32 -1.804 -14.454 0.846 1.00 0.00 C ATOM 456 CD ARG A 32 -0.593 -15.374 0.877 1.00 0.00 C ATOM 457 NE ARG A 32 -0.585 -16.228 2.062 1.00 0.00 N ATOM 458 CZ ARG A 32 -1.185 -17.412 2.118 1.00 0.00 C ATOM 459 NH1 ARG A 32 -1.837 -17.879 1.063 1.00 0.00 N ATOM 460 NH2 ARG A 32 -1.133 -18.130 3.233 1.00 0.00 N ATOM 0 H ARG A 32 -4.341 -13.687 2.986 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.409 -13.848 0.032 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -3.062 -15.763 1.978 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.174 -15.982 0.243 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -1.831 -13.918 -0.103 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -1.714 -13.705 1.633 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -0.587 -15.996 -0.018 1.00 0.00 H new ATOM 0 HD3 ARG A 32 0.318 -14.775 0.855 1.00 0.00 H new ATOM 0 HE ARG A 32 -0.092 -15.897 2.891 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -1.879 -17.329 0.205 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -2.297 -18.788 1.109 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -0.632 -17.773 4.047 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -1.594 -19.039 3.276 1.00 0.00 H new ATOM 474 N PRO A 33 -6.593 -14.999 0.304 1.00 0.00 N ATOM 475 CA PRO A 33 -7.853 -15.747 0.343 1.00 0.00 C ATOM 476 C PRO A 33 -7.675 -17.204 -0.071 1.00 0.00 C ATOM 477 O PRO A 33 -6.825 -17.540 -0.896 1.00 0.00 O ATOM 478 CB PRO A 33 -8.735 -15.008 -0.666 1.00 0.00 C ATOM 479 CG PRO A 33 -7.777 -14.362 -1.606 1.00 0.00 C ATOM 480 CD PRO A 33 -6.567 -14.009 -0.786 1.00 0.00 C ATOM 0 HA PRO A 33 -8.273 -15.787 1.348 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.400 -15.696 -1.189 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.366 -14.268 -0.173 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.513 -15.037 -2.420 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.215 -13.472 -2.059 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.650 -14.080 -1.371 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.624 -12.990 -0.404 1.00 0.00 H new ATOM 488 N PRO A 34 -8.494 -18.090 0.514 1.00 0.00 N ATOM 489 CA PRO A 34 -8.447 -19.526 0.220 1.00 0.00 C ATOM 490 C PRO A 34 -8.943 -19.846 -1.186 1.00 0.00 C ATOM 491 O PRO A 34 -8.367 -20.682 -1.881 1.00 0.00 O ATOM 492 CB PRO A 34 -9.382 -20.133 1.269 1.00 0.00 C ATOM 493 CG PRO A 34 -10.322 -19.033 1.621 1.00 0.00 C ATOM 494 CD PRO A 34 -9.530 -17.759 1.506 1.00 0.00 C ATOM 0 HA PRO A 34 -7.430 -19.917 0.258 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -9.915 -20.997 0.872 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.828 -20.475 2.143 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.179 -19.022 0.948 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -10.711 -19.161 2.631 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.152 -16.928 1.175 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.093 -17.470 2.462 1.00 0.00 H new ATOM 502 N GLU A 35 -10.014 -19.176 -1.598 1.00 0.00 N ATOM 503 CA GLU A 35 -10.587 -19.391 -2.921 1.00 0.00 C ATOM 504 C GLU A 35 -9.570 -19.069 -4.013 1.00 0.00 C ATOM 505 O GLU A 35 -9.478 -19.774 -5.017 1.00 0.00 O ATOM 506 CB GLU A 35 -11.839 -18.531 -3.106 1.00 0.00 C ATOM 507 CG GLU A 35 -11.583 -17.041 -2.950 1.00 0.00 C ATOM 508 CD GLU A 35 -12.774 -16.198 -3.362 1.00 0.00 C ATOM 509 OE1 GLU A 35 -13.502 -16.611 -4.288 1.00 0.00 O ATOM 510 OE2 GLU A 35 -12.977 -15.124 -2.757 1.00 0.00 O ATOM 0 H GLU A 35 -10.502 -18.480 -1.035 1.00 0.00 H new ATOM 0 HA GLU A 35 -10.862 -20.442 -3.003 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.255 -18.718 -4.096 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -12.592 -18.840 -2.381 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -11.333 -16.826 -1.911 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -10.718 -16.760 -3.551 1.00 0.00 H new ATOM 517 N ASN A 36 -8.810 -17.998 -3.808 1.00 0.00 N ATOM 518 CA ASN A 36 -7.800 -17.582 -4.775 1.00 0.00 C ATOM 519 C ASN A 36 -6.425 -17.490 -4.120 1.00 0.00 C ATOM 520 O ASN A 36 -6.046 -16.463 -3.556 1.00 0.00 O ATOM 521 CB ASN A 36 -8.178 -16.231 -5.387 1.00 0.00 C ATOM 522 CG ASN A 36 -9.041 -16.378 -6.625 1.00 0.00 C ATOM 523 OD1 ASN A 36 -9.598 -17.445 -6.883 1.00 0.00 O ATOM 524 ND2 ASN A 36 -9.157 -15.304 -7.396 1.00 0.00 N ATOM 0 H ASN A 36 -8.874 -17.403 -2.982 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.757 -18.332 -5.565 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -8.710 -15.635 -4.645 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -7.270 -15.685 -5.643 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -9.726 -15.342 -8.242 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -8.677 -14.440 -7.143 1.00 0.00 H new ATOM 531 N PRO A 37 -5.659 -18.588 -4.197 1.00 0.00 N ATOM 532 CA PRO A 37 -4.314 -18.656 -3.618 1.00 0.00 C ATOM 533 C PRO A 37 -3.314 -17.787 -4.373 1.00 0.00 C ATOM 534 O PRO A 37 -2.401 -17.216 -3.777 1.00 0.00 O ATOM 535 CB PRO A 37 -3.945 -20.136 -3.753 1.00 0.00 C ATOM 536 CG PRO A 37 -4.762 -20.628 -4.897 1.00 0.00 C ATOM 537 CD PRO A 37 -6.047 -19.847 -4.854 1.00 0.00 C ATOM 0 HA PRO A 37 -4.292 -18.289 -2.592 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -2.879 -20.262 -3.944 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.172 -20.685 -2.839 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.243 -20.473 -5.843 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.952 -21.698 -4.809 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.445 -19.673 -5.854 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -6.818 -20.373 -4.291 1.00 0.00 H new ATOM 545 N ALA A 38 -3.493 -17.691 -5.686 1.00 0.00 N ATOM 546 CA ALA A 38 -2.607 -16.889 -6.521 1.00 0.00 C ATOM 547 C ALA A 38 -2.907 -15.401 -6.368 1.00 0.00 C ATOM 548 O ALA A 38 -2.218 -14.557 -6.942 1.00 0.00 O ATOM 549 CB ALA A 38 -2.733 -17.308 -7.978 1.00 0.00 C ATOM 0 H ALA A 38 -4.243 -18.159 -6.195 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.582 -17.062 -6.192 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -2.066 -16.701 -8.590 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -2.462 -18.359 -8.079 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -3.761 -17.165 -8.310 1.00 0.00 H new ATOM 555 N LEU A 39 -3.938 -15.087 -5.592 1.00 0.00 N ATOM 556 CA LEU A 39 -4.330 -13.700 -5.365 1.00 0.00 C ATOM 557 C LEU A 39 -3.782 -13.191 -4.035 1.00 0.00 C ATOM 558 O LEU A 39 -3.923 -13.846 -3.002 1.00 0.00 O ATOM 559 CB LEU A 39 -5.854 -13.570 -5.385 1.00 0.00 C ATOM 560 CG LEU A 39 -6.410 -12.161 -5.178 1.00 0.00 C ATOM 561 CD1 LEU A 39 -6.485 -11.418 -6.503 1.00 0.00 C ATOM 562 CD2 LEU A 39 -7.780 -12.219 -4.518 1.00 0.00 C ATOM 0 H LEU A 39 -4.518 -15.774 -5.109 1.00 0.00 H new ATOM 0 HA LEU A 39 -3.910 -13.093 -6.167 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.218 -13.946 -6.341 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.264 -14.218 -4.611 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.734 -11.618 -4.517 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -6.883 -10.417 -6.337 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.487 -11.345 -6.936 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.139 -11.959 -7.187 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.160 -11.207 -4.379 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.466 -12.780 -5.153 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.697 -12.712 -3.549 1.00 0.00 H new ATOM 574 N LEU A 40 -3.158 -12.019 -4.069 1.00 0.00 N ATOM 575 CA LEU A 40 -2.591 -11.420 -2.865 1.00 0.00 C ATOM 576 C LEU A 40 -3.224 -10.061 -2.583 1.00 0.00 C ATOM 577 O LEU A 40 -2.915 -9.070 -3.244 1.00 0.00 O ATOM 578 CB LEU A 40 -1.076 -11.268 -3.014 1.00 0.00 C ATOM 579 CG LEU A 40 -0.364 -10.513 -1.890 1.00 0.00 C ATOM 580 CD1 LEU A 40 -0.450 -11.292 -0.587 1.00 0.00 C ATOM 581 CD2 LEU A 40 1.088 -10.250 -2.261 1.00 0.00 C ATOM 0 H LEU A 40 -3.032 -11.465 -4.916 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.804 -12.081 -2.025 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.637 -12.263 -3.092 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.873 -10.756 -3.954 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.862 -9.554 -1.750 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.062 -10.740 0.201 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.496 -11.429 -0.314 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.023 -12.266 -0.714 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.579 -9.712 -1.450 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.598 -11.199 -2.429 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.128 -9.651 -3.171 1.00 0.00 H new ATOM 593 N LEU A 41 -4.112 -10.023 -1.595 1.00 0.00 N ATOM 594 CA LEU A 41 -4.788 -8.785 -1.222 1.00 0.00 C ATOM 595 C LEU A 41 -3.961 -7.996 -0.212 1.00 0.00 C ATOM 596 O LEU A 41 -3.740 -8.447 0.912 1.00 0.00 O ATOM 597 CB LEU A 41 -6.169 -9.091 -0.639 1.00 0.00 C ATOM 598 CG LEU A 41 -7.099 -9.926 -1.520 1.00 0.00 C ATOM 599 CD1 LEU A 41 -8.303 -10.403 -0.723 1.00 0.00 C ATOM 600 CD2 LEU A 41 -7.544 -9.126 -2.735 1.00 0.00 C ATOM 0 H LEU A 41 -4.380 -10.834 -1.038 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.905 -8.179 -2.120 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.034 -9.612 0.309 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.664 -8.146 -0.415 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.550 -10.801 -1.868 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.954 -10.996 -1.366 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -7.966 -11.014 0.114 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.854 -9.542 -0.345 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.205 -9.736 -3.350 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.075 -8.232 -2.408 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.671 -8.835 -3.319 1.00 0.00 H new ATOM 612 N ILE A 42 -3.509 -6.814 -0.620 1.00 0.00 N ATOM 613 CA ILE A 42 -2.710 -5.961 0.251 1.00 0.00 C ATOM 614 C ILE A 42 -3.496 -4.728 0.683 1.00 0.00 C ATOM 615 O ILE A 42 -4.187 -4.103 -0.122 1.00 0.00 O ATOM 616 CB ILE A 42 -1.410 -5.511 -0.442 1.00 0.00 C ATOM 617 CG1 ILE A 42 -0.430 -6.682 -0.546 1.00 0.00 C ATOM 618 CG2 ILE A 42 -0.780 -4.352 0.316 1.00 0.00 C ATOM 619 CD1 ILE A 42 0.899 -6.304 -1.162 1.00 0.00 C ATOM 0 H ILE A 42 -3.683 -6.426 -1.547 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.457 -6.554 1.130 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.651 -5.173 -1.450 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -0.257 -7.090 0.450 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.885 -7.474 -1.141 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.138 -4.045 -0.186 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.476 -3.514 0.343 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.549 -4.666 1.334 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.543 -7.182 -1.204 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.737 -5.924 -2.171 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.375 -5.533 -0.556 1.00 0.00 H new ATOM 631 N THR A 43 -3.384 -4.379 1.961 1.00 0.00 N ATOM 632 CA THR A 43 -4.082 -3.220 2.502 1.00 0.00 C ATOM 633 C THR A 43 -3.103 -2.222 3.110 1.00 0.00 C ATOM 634 O THR A 43 -2.047 -2.604 3.615 1.00 0.00 O ATOM 635 CB THR A 43 -5.109 -3.633 3.573 1.00 0.00 C ATOM 636 OG1 THR A 43 -5.895 -4.733 3.101 1.00 0.00 O ATOM 637 CG2 THR A 43 -6.021 -2.467 3.926 1.00 0.00 C ATOM 0 H THR A 43 -2.816 -4.884 2.641 1.00 0.00 H new ATOM 0 HA THR A 43 -4.605 -2.749 1.670 1.00 0.00 H new ATOM 0 HB THR A 43 -4.565 -3.934 4.469 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.544 -4.990 3.789 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.738 -2.782 4.684 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.423 -1.642 4.313 1.00 0.00 H new ATOM 0 HG23 THR A 43 -6.556 -2.141 3.034 1.00 0.00 H new ATOM 645 N ILE A 44 -3.461 -0.944 3.059 1.00 0.00 N ATOM 646 CA ILE A 44 -2.614 0.108 3.607 1.00 0.00 C ATOM 647 C ILE A 44 -3.297 0.811 4.775 1.00 0.00 C ATOM 648 O ILE A 44 -4.525 0.837 4.868 1.00 0.00 O ATOM 649 CB ILE A 44 -2.250 1.153 2.536 1.00 0.00 C ATOM 650 CG1 ILE A 44 -2.179 0.497 1.156 1.00 0.00 C ATOM 651 CG2 ILE A 44 -0.927 1.823 2.878 1.00 0.00 C ATOM 652 CD1 ILE A 44 -1.825 1.461 0.045 1.00 0.00 C ATOM 0 H ILE A 44 -4.332 -0.612 2.644 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.701 -0.373 3.959 1.00 0.00 H new ATOM 0 HB ILE A 44 -3.028 1.917 2.515 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.439 -0.303 1.181 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -3.141 0.035 0.932 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.683 2.559 2.112 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -1.010 2.319 3.845 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -0.139 1.071 2.923 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.793 0.926 -0.904 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -2.577 2.248 -0.007 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.849 1.904 0.245 1.00 0.00 H new ATOM 664 N THR A 45 -2.493 1.383 5.667 1.00 0.00 N ATOM 665 CA THR A 45 -3.019 2.088 6.829 1.00 0.00 C ATOM 666 C THR A 45 -2.165 3.304 7.167 1.00 0.00 C ATOM 667 O THR A 45 -1.067 3.173 7.706 1.00 0.00 O ATOM 668 CB THR A 45 -3.089 1.165 8.061 1.00 0.00 C ATOM 669 OG1 THR A 45 -3.760 -0.054 7.722 1.00 0.00 O ATOM 670 CG2 THR A 45 -3.818 1.849 9.208 1.00 0.00 C ATOM 0 H THR A 45 -1.475 1.371 5.606 1.00 0.00 H new ATOM 0 HA THR A 45 -4.026 2.415 6.571 1.00 0.00 H new ATOM 0 HB THR A 45 -2.071 0.942 8.380 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.799 -0.636 8.510 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.855 1.179 10.067 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.289 2.762 9.483 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.833 2.097 8.897 1.00 0.00 H new ATOM 678 N ALA A 46 -2.678 4.488 6.849 1.00 0.00 N ATOM 679 CA ALA A 46 -1.963 5.729 7.122 1.00 0.00 C ATOM 680 C ALA A 46 -2.572 6.463 8.311 1.00 0.00 C ATOM 681 O ALA A 46 -3.751 6.819 8.298 1.00 0.00 O ATOM 682 CB ALA A 46 -1.965 6.622 5.890 1.00 0.00 C ATOM 0 H ALA A 46 -3.586 4.614 6.402 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.932 5.478 7.373 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.428 7.545 6.109 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.476 6.104 5.065 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -2.993 6.857 5.613 1.00 0.00 H new ATOM 688 N THR A 47 -1.762 6.687 9.341 1.00 0.00 N ATOM 689 CA THR A 47 -2.222 7.377 10.540 1.00 0.00 C ATOM 690 C THR A 47 -1.464 8.684 10.747 1.00 0.00 C ATOM 691 O THR A 47 -0.234 8.708 10.729 1.00 0.00 O ATOM 692 CB THR A 47 -2.057 6.497 11.793 1.00 0.00 C ATOM 693 OG1 THR A 47 -0.867 5.708 11.685 1.00 0.00 O ATOM 694 CG2 THR A 47 -3.261 5.586 11.976 1.00 0.00 C ATOM 0 H THR A 47 -0.783 6.400 9.369 1.00 0.00 H new ATOM 0 HA THR A 47 -3.280 7.593 10.394 1.00 0.00 H new ATOM 0 HB THR A 47 -1.980 7.151 12.662 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.769 5.153 12.487 1.00 0.00 H new ATOM 0 HG21 THR A 47 -3.122 4.974 12.867 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.161 6.191 12.088 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.364 4.940 11.104 1.00 0.00 H new ATOM 702 N ASN A 48 -2.206 9.768 10.945 1.00 0.00 N ATOM 703 CA ASN A 48 -1.603 11.079 11.156 1.00 0.00 C ATOM 704 C ASN A 48 -1.804 11.546 12.594 1.00 0.00 C ATOM 705 O ASN A 48 -2.916 11.505 13.122 1.00 0.00 O ATOM 706 CB ASN A 48 -2.203 12.101 10.188 1.00 0.00 C ATOM 707 CG ASN A 48 -1.817 13.525 10.539 1.00 0.00 C ATOM 708 OD1 ASN A 48 -1.015 13.758 11.443 1.00 0.00 O ATOM 709 ND2 ASN A 48 -2.389 14.486 9.823 1.00 0.00 N ATOM 0 H ASN A 48 -3.226 9.765 10.964 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.533 10.993 10.967 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -1.870 11.876 9.175 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -3.289 12.010 10.195 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -2.169 15.464 10.013 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -3.048 14.247 9.083 1.00 0.00 H new ATOM 716 N PHE A 49 -0.721 11.989 13.224 1.00 0.00 N ATOM 717 CA PHE A 49 -0.778 12.463 14.602 1.00 0.00 C ATOM 718 C PHE A 49 -0.263 13.895 14.706 1.00 0.00 C ATOM 719 O PHE A 49 -0.504 14.582 15.698 1.00 0.00 O ATOM 720 CB PHE A 49 0.041 11.546 15.513 1.00 0.00 C ATOM 721 CG PHE A 49 -0.524 10.160 15.635 1.00 0.00 C ATOM 722 CD1 PHE A 49 -1.559 9.895 16.518 1.00 0.00 C ATOM 723 CD2 PHE A 49 -0.023 9.123 14.866 1.00 0.00 C ATOM 724 CE1 PHE A 49 -2.080 8.621 16.633 1.00 0.00 C ATOM 725 CE2 PHE A 49 -0.541 7.846 14.976 1.00 0.00 C ATOM 726 CZ PHE A 49 -1.572 7.595 15.860 1.00 0.00 C ATOM 0 H PHE A 49 0.207 12.030 12.802 1.00 0.00 H new ATOM 0 HA PHE A 49 -1.819 12.446 14.923 1.00 0.00 H new ATOM 0 HB2 PHE A 49 1.059 11.482 15.129 1.00 0.00 H new ATOM 0 HB3 PHE A 49 0.102 11.993 16.505 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -1.963 10.694 17.123 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.782 9.314 14.172 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.884 8.427 17.327 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -0.140 7.046 14.372 1.00 0.00 H new ATOM 0 HZ PHE A 49 -1.980 6.599 15.947 1.00 0.00 H new ATOM 736 N SER A 50 0.448 14.338 13.674 1.00 0.00 N ATOM 737 CA SER A 50 1.002 15.687 13.650 1.00 0.00 C ATOM 738 C SER A 50 -0.087 16.726 13.904 1.00 0.00 C ATOM 739 O SER A 50 -1.261 16.387 14.044 1.00 0.00 O ATOM 740 CB SER A 50 1.679 15.960 12.306 1.00 0.00 C ATOM 741 OG SER A 50 0.832 15.605 11.227 1.00 0.00 O ATOM 0 H SER A 50 0.654 13.783 12.844 1.00 0.00 H new ATOM 0 HA SER A 50 1.745 15.762 14.444 1.00 0.00 H new ATOM 0 HB2 SER A 50 1.941 17.016 12.235 1.00 0.00 H new ATOM 0 HB3 SER A 50 2.610 15.396 12.243 1.00 0.00 H new ATOM 0 HG SER A 50 0.033 15.155 11.573 1.00 0.00 H new ATOM 747 N GLU A 51 0.314 17.992 13.961 1.00 0.00 N ATOM 748 CA GLU A 51 -0.627 19.080 14.199 1.00 0.00 C ATOM 749 C GLU A 51 -1.392 19.426 12.924 1.00 0.00 C ATOM 750 O GLU A 51 -2.598 19.665 12.957 1.00 0.00 O ATOM 751 CB GLU A 51 0.110 20.318 14.716 1.00 0.00 C ATOM 752 CG GLU A 51 0.633 20.166 16.134 1.00 0.00 C ATOM 753 CD GLU A 51 -0.472 20.212 17.172 1.00 0.00 C ATOM 754 OE1 GLU A 51 -1.057 21.298 17.366 1.00 0.00 O ATOM 755 OE2 GLU A 51 -0.751 19.164 17.789 1.00 0.00 O ATOM 0 H GLU A 51 1.283 18.289 13.846 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.341 18.750 14.953 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.945 20.537 14.051 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -0.563 21.175 14.676 1.00 0.00 H new ATOM 0 HG2 GLU A 51 1.168 19.220 16.220 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.352 20.959 16.339 1.00 0.00 H new ATOM 762 N GLY A 52 -0.680 19.451 11.802 1.00 0.00 N ATOM 763 CA GLY A 52 -1.307 19.769 10.532 1.00 0.00 C ATOM 764 C GLY A 52 -1.959 18.561 9.889 1.00 0.00 C ATOM 765 O GLY A 52 -1.318 17.527 9.703 1.00 0.00 O ATOM 0 H GLY A 52 0.320 19.257 11.749 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.057 20.545 10.685 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.559 20.179 9.853 1.00 0.00 H new ATOM 769 N ASP A 53 -3.237 18.692 9.550 1.00 0.00 N ATOM 770 CA ASP A 53 -3.976 17.602 8.924 1.00 0.00 C ATOM 771 C ASP A 53 -3.541 17.411 7.474 1.00 0.00 C ATOM 772 O ASP A 53 -3.063 18.345 6.831 1.00 0.00 O ATOM 773 CB ASP A 53 -5.480 17.876 8.986 1.00 0.00 C ATOM 774 CG ASP A 53 -5.891 18.561 10.274 1.00 0.00 C ATOM 775 OD1 ASP A 53 -5.606 19.768 10.422 1.00 0.00 O ATOM 776 OD2 ASP A 53 -6.498 17.891 11.135 1.00 0.00 O ATOM 0 H ASP A 53 -3.782 19.541 9.698 1.00 0.00 H new ATOM 0 HA ASP A 53 -3.758 16.686 9.473 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.768 18.499 8.139 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -6.022 16.935 8.889 1.00 0.00 H new ATOM 781 N VAL A 54 -3.708 16.194 6.967 1.00 0.00 N ATOM 782 CA VAL A 54 -3.333 15.880 5.593 1.00 0.00 C ATOM 783 C VAL A 54 -4.564 15.741 4.705 1.00 0.00 C ATOM 784 O VAL A 54 -5.522 15.051 5.055 1.00 0.00 O ATOM 785 CB VAL A 54 -2.510 14.580 5.519 1.00 0.00 C ATOM 786 CG1 VAL A 54 -2.177 14.240 4.075 1.00 0.00 C ATOM 787 CG2 VAL A 54 -1.244 14.703 6.353 1.00 0.00 C ATOM 0 H VAL A 54 -4.101 15.409 7.487 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.722 16.709 5.234 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.109 13.767 5.929 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.595 13.319 4.043 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.100 14.106 3.511 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.597 15.051 3.635 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.675 13.776 6.289 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.638 15.527 5.976 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.510 14.895 7.392 1.00 0.00 H new ATOM 797 N THR A 55 -4.532 16.401 3.551 1.00 0.00 N ATOM 798 CA THR A 55 -5.645 16.352 2.612 1.00 0.00 C ATOM 799 C THR A 55 -5.160 16.047 1.199 1.00 0.00 C ATOM 800 O THR A 55 -3.979 16.210 0.889 1.00 0.00 O ATOM 801 CB THR A 55 -6.428 17.679 2.598 1.00 0.00 C ATOM 802 OG1 THR A 55 -5.550 18.762 2.271 1.00 0.00 O ATOM 803 CG2 THR A 55 -7.079 17.937 3.949 1.00 0.00 C ATOM 0 H THR A 55 -3.747 16.976 3.245 1.00 0.00 H new ATOM 0 HA THR A 55 -6.305 15.552 2.947 1.00 0.00 H new ATOM 0 HB THR A 55 -7.211 17.606 1.843 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.055 19.602 2.262 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.626 18.879 3.915 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.768 17.125 4.182 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.310 17.992 4.719 1.00 0.00 H new ATOM 811 N HIS A 56 -6.077 15.605 0.346 1.00 0.00 N ATOM 812 CA HIS A 56 -5.742 15.279 -1.036 1.00 0.00 C ATOM 813 C HIS A 56 -4.647 14.218 -1.093 1.00 0.00 C ATOM 814 O HIS A 56 -3.805 14.228 -1.992 1.00 0.00 O ATOM 815 CB HIS A 56 -5.293 16.534 -1.784 1.00 0.00 C ATOM 816 CG HIS A 56 -6.427 17.331 -2.353 1.00 0.00 C ATOM 817 ND1 HIS A 56 -6.447 18.709 -2.363 1.00 0.00 N ATOM 818 CD2 HIS A 56 -7.583 16.934 -2.934 1.00 0.00 C ATOM 819 CE1 HIS A 56 -7.567 19.127 -2.925 1.00 0.00 C ATOM 820 NE2 HIS A 56 -8.274 18.069 -3.280 1.00 0.00 N ATOM 0 H HIS A 56 -7.058 15.464 0.587 1.00 0.00 H new ATOM 0 HA HIS A 56 -6.635 14.880 -1.517 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.720 17.166 -1.105 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -4.622 16.244 -2.593 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -7.902 15.915 -3.095 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.855 20.158 -3.070 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -9.186 18.092 -3.737 1.00 0.00 H new ATOM 828 N PHE A 57 -4.662 13.305 -0.128 1.00 0.00 N ATOM 829 CA PHE A 57 -3.669 12.239 -0.067 1.00 0.00 C ATOM 830 C PHE A 57 -3.722 11.375 -1.323 1.00 0.00 C ATOM 831 O PHE A 57 -4.798 11.102 -1.857 1.00 0.00 O ATOM 832 CB PHE A 57 -3.896 11.372 1.173 1.00 0.00 C ATOM 833 CG PHE A 57 -3.202 10.041 1.109 1.00 0.00 C ATOM 834 CD1 PHE A 57 -1.843 9.966 0.851 1.00 0.00 C ATOM 835 CD2 PHE A 57 -3.909 8.866 1.305 1.00 0.00 C ATOM 836 CE1 PHE A 57 -1.201 8.743 0.792 1.00 0.00 C ATOM 837 CE2 PHE A 57 -3.273 7.641 1.247 1.00 0.00 C ATOM 838 CZ PHE A 57 -1.918 7.579 0.989 1.00 0.00 C ATOM 0 H PHE A 57 -5.352 13.282 0.623 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.682 12.698 -0.004 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -3.548 11.912 2.053 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -4.966 11.209 1.302 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -1.279 10.873 0.694 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -4.969 8.908 1.505 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -0.141 8.698 0.592 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -3.835 6.732 1.403 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.420 6.622 0.941 1.00 0.00 H new ATOM 848 N ILE A 58 -2.554 10.947 -1.790 1.00 0.00 N ATOM 849 CA ILE A 58 -2.467 10.113 -2.982 1.00 0.00 C ATOM 850 C ILE A 58 -1.613 8.876 -2.726 1.00 0.00 C ATOM 851 O ILE A 58 -0.500 8.973 -2.208 1.00 0.00 O ATOM 852 CB ILE A 58 -1.878 10.893 -4.172 1.00 0.00 C ATOM 853 CG1 ILE A 58 -2.753 12.104 -4.500 1.00 0.00 C ATOM 854 CG2 ILE A 58 -1.744 9.985 -5.386 1.00 0.00 C ATOM 855 CD1 ILE A 58 -4.172 11.740 -4.877 1.00 0.00 C ATOM 0 H ILE A 58 -1.655 11.164 -1.361 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.483 9.805 -3.227 1.00 0.00 H new ATOM 0 HB ILE A 58 -0.885 11.250 -3.898 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.774 12.771 -3.638 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -2.299 12.659 -5.321 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.326 10.551 -6.219 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.084 9.152 -5.146 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.726 9.602 -5.664 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.734 12.648 -5.096 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -4.161 11.098 -5.758 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -4.644 11.212 -4.049 1.00 0.00 H new ATOM 867 N CYS A 59 -2.141 7.714 -3.095 1.00 0.00 N ATOM 868 CA CYS A 59 -1.427 6.456 -2.907 1.00 0.00 C ATOM 869 C CYS A 59 -1.298 5.701 -4.226 1.00 0.00 C ATOM 870 O CYS A 59 -2.255 5.087 -4.696 1.00 0.00 O ATOM 871 CB CYS A 59 -2.147 5.586 -1.876 1.00 0.00 C ATOM 872 SG CYS A 59 -1.146 4.227 -1.228 1.00 0.00 S ATOM 0 H CYS A 59 -3.060 7.617 -3.526 1.00 0.00 H new ATOM 0 HA CYS A 59 -0.426 6.686 -2.542 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -2.467 6.215 -1.046 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -3.049 5.175 -2.330 1.00 0.00 H new ATOM 0 HG CYS A 59 -1.360 4.101 0.048 1.00 0.00 H new ATOM 878 N GLN A 60 -0.109 5.753 -4.817 1.00 0.00 N ATOM 879 CA GLN A 60 0.144 5.076 -6.084 1.00 0.00 C ATOM 880 C GLN A 60 1.062 3.875 -5.885 1.00 0.00 C ATOM 881 O GLN A 60 1.767 3.779 -4.881 1.00 0.00 O ATOM 882 CB GLN A 60 0.766 6.047 -7.090 1.00 0.00 C ATOM 883 CG GLN A 60 -0.118 7.242 -7.408 1.00 0.00 C ATOM 884 CD GLN A 60 0.416 8.072 -8.559 1.00 0.00 C ATOM 885 OE1 GLN A 60 0.975 7.539 -9.517 1.00 0.00 O ATOM 886 NE2 GLN A 60 0.245 9.386 -8.470 1.00 0.00 N ATOM 0 H GLN A 60 0.694 6.256 -4.440 1.00 0.00 H new ATOM 0 HA GLN A 60 -0.810 4.721 -6.474 1.00 0.00 H new ATOM 0 HB2 GLN A 60 1.718 6.404 -6.697 1.00 0.00 H new ATOM 0 HB3 GLN A 60 0.984 5.510 -8.014 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -1.121 6.893 -7.652 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -0.206 7.870 -6.522 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -0.224 9.785 -7.657 1.00 0.00 H new ATOM 0 HE22 GLN A 60 0.583 9.996 -9.214 1.00 0.00 H new ATOM 895 N ALA A 61 1.047 2.959 -6.849 1.00 0.00 N ATOM 896 CA ALA A 61 1.879 1.764 -6.780 1.00 0.00 C ATOM 897 C ALA A 61 2.188 1.230 -8.174 1.00 0.00 C ATOM 898 O ALA A 61 1.571 1.638 -9.157 1.00 0.00 O ATOM 899 CB ALA A 61 1.196 0.694 -5.942 1.00 0.00 C ATOM 0 H ALA A 61 0.468 3.022 -7.686 1.00 0.00 H new ATOM 0 HA ALA A 61 2.822 2.034 -6.306 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.828 -0.193 -5.899 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.032 1.072 -4.933 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.238 0.435 -6.393 1.00 0.00 H new ATOM 905 N ALA A 62 3.149 0.315 -8.252 1.00 0.00 N ATOM 906 CA ALA A 62 3.540 -0.276 -9.526 1.00 0.00 C ATOM 907 C ALA A 62 4.069 -1.693 -9.335 1.00 0.00 C ATOM 908 O ALA A 62 4.765 -1.980 -8.361 1.00 0.00 O ATOM 909 CB ALA A 62 4.584 0.592 -10.212 1.00 0.00 C ATOM 0 H ALA A 62 3.671 -0.033 -7.448 1.00 0.00 H new ATOM 0 HA ALA A 62 2.655 -0.330 -10.160 1.00 0.00 H new ATOM 0 HB1 ALA A 62 4.867 0.139 -11.162 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.171 1.584 -10.392 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.464 0.676 -9.574 1.00 0.00 H new ATOM 915 N VAL A 63 3.734 -2.576 -10.270 1.00 0.00 N ATOM 916 CA VAL A 63 4.176 -3.964 -10.204 1.00 0.00 C ATOM 917 C VAL A 63 4.678 -4.446 -11.561 1.00 0.00 C ATOM 918 O VAL A 63 4.223 -3.998 -12.614 1.00 0.00 O ATOM 919 CB VAL A 63 3.042 -4.892 -9.730 1.00 0.00 C ATOM 920 CG1 VAL A 63 2.490 -4.420 -8.393 1.00 0.00 C ATOM 921 CG2 VAL A 63 1.940 -4.965 -10.776 1.00 0.00 C ATOM 0 H VAL A 63 3.158 -2.355 -11.082 1.00 0.00 H new ATOM 0 HA VAL A 63 4.992 -4.002 -9.483 1.00 0.00 H new ATOM 0 HB VAL A 63 3.449 -5.894 -9.595 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.690 -5.088 -8.074 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.286 -4.426 -7.648 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.098 -3.408 -8.498 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.147 -5.625 -10.424 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.533 -3.968 -10.946 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.349 -5.354 -11.709 1.00 0.00 H new ATOM 931 N PRO A 64 5.638 -5.382 -11.538 1.00 0.00 N ATOM 932 CA PRO A 64 6.223 -5.946 -12.758 1.00 0.00 C ATOM 933 C PRO A 64 5.240 -6.833 -13.515 1.00 0.00 C ATOM 934 O PRO A 64 4.390 -7.490 -12.914 1.00 0.00 O ATOM 935 CB PRO A 64 7.400 -6.775 -12.237 1.00 0.00 C ATOM 936 CG PRO A 64 7.026 -7.125 -10.838 1.00 0.00 C ATOM 937 CD PRO A 64 6.227 -5.961 -10.319 1.00 0.00 C ATOM 0 HA PRO A 64 6.512 -5.171 -13.468 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.553 -7.669 -12.841 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.329 -6.206 -12.268 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.441 -8.044 -10.809 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.913 -7.293 -10.227 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.459 -6.282 -9.615 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.858 -5.242 -9.796 1.00 0.00 H new ATOM 945 N LYS A 65 5.362 -6.848 -14.838 1.00 0.00 N ATOM 946 CA LYS A 65 4.486 -7.656 -15.678 1.00 0.00 C ATOM 947 C LYS A 65 4.153 -8.981 -15.001 1.00 0.00 C ATOM 948 O LYS A 65 3.014 -9.444 -15.048 1.00 0.00 O ATOM 949 CB LYS A 65 5.145 -7.915 -17.035 1.00 0.00 C ATOM 950 CG LYS A 65 5.405 -6.652 -17.837 1.00 0.00 C ATOM 951 CD LYS A 65 4.110 -6.025 -18.327 1.00 0.00 C ATOM 952 CE LYS A 65 4.374 -4.799 -19.187 1.00 0.00 C ATOM 953 NZ LYS A 65 3.115 -4.231 -19.744 1.00 0.00 N ATOM 0 H LYS A 65 6.059 -6.309 -15.352 1.00 0.00 H new ATOM 0 HA LYS A 65 3.559 -7.104 -15.830 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.089 -8.436 -16.877 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.508 -8.580 -17.618 1.00 0.00 H new ATOM 0 HG2 LYS A 65 5.947 -5.934 -17.221 1.00 0.00 H new ATOM 0 HG3 LYS A 65 6.042 -6.886 -18.690 1.00 0.00 H new ATOM 0 HD2 LYS A 65 3.544 -6.758 -18.901 1.00 0.00 H new ATOM 0 HD3 LYS A 65 3.494 -5.745 -17.472 1.00 0.00 H new ATOM 0 HE2 LYS A 65 4.883 -4.041 -18.592 1.00 0.00 H new ATOM 0 HE3 LYS A 65 5.045 -5.066 -20.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 3.337 -3.397 -20.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.642 -4.946 -20.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 2.485 -3.953 -18.965 1.00 0.00 H new ATOM 967 N SER A 66 5.155 -9.587 -14.371 1.00 0.00 N ATOM 968 CA SER A 66 4.968 -10.860 -13.686 1.00 0.00 C ATOM 969 C SER A 66 3.701 -10.840 -12.837 1.00 0.00 C ATOM 970 O SER A 66 2.887 -11.763 -12.893 1.00 0.00 O ATOM 971 CB SER A 66 6.180 -11.173 -12.806 1.00 0.00 C ATOM 972 OG SER A 66 7.269 -11.638 -13.585 1.00 0.00 O ATOM 0 H SER A 66 6.104 -9.217 -14.321 1.00 0.00 H new ATOM 0 HA SER A 66 4.866 -11.639 -14.442 1.00 0.00 H new ATOM 0 HB2 SER A 66 6.476 -10.279 -12.258 1.00 0.00 H new ATOM 0 HB3 SER A 66 5.911 -11.926 -12.065 1.00 0.00 H new ATOM 0 HG SER A 66 7.815 -12.252 -13.051 1.00 0.00 H new ATOM 978 N LEU A 67 3.540 -9.781 -12.050 1.00 0.00 N ATOM 979 CA LEU A 67 2.372 -9.639 -11.188 1.00 0.00 C ATOM 980 C LEU A 67 1.424 -8.572 -11.727 1.00 0.00 C ATOM 981 O LEU A 67 1.812 -7.745 -12.552 1.00 0.00 O ATOM 982 CB LEU A 67 2.805 -9.281 -9.765 1.00 0.00 C ATOM 983 CG LEU A 67 4.011 -10.044 -9.218 1.00 0.00 C ATOM 984 CD1 LEU A 67 4.484 -9.430 -7.910 1.00 0.00 C ATOM 985 CD2 LEU A 67 3.670 -11.515 -9.026 1.00 0.00 C ATOM 0 H LEU A 67 4.204 -9.009 -11.991 1.00 0.00 H new ATOM 0 HA LEU A 67 1.844 -10.593 -11.172 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.030 -8.215 -9.733 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.960 -9.449 -9.097 1.00 0.00 H new ATOM 0 HG LEU A 67 4.821 -9.971 -9.943 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.343 -9.987 -7.536 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.770 -8.392 -8.078 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.679 -9.471 -7.177 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.541 -12.042 -8.636 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.844 -11.608 -8.321 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.381 -11.949 -9.983 1.00 0.00 H new ATOM 997 N GLN A 68 0.183 -8.598 -11.254 1.00 0.00 N ATOM 998 CA GLN A 68 -0.820 -7.632 -11.688 1.00 0.00 C ATOM 999 C GLN A 68 -1.156 -6.655 -10.567 1.00 0.00 C ATOM 1000 O GLN A 68 -0.926 -6.940 -9.391 1.00 0.00 O ATOM 1001 CB GLN A 68 -2.087 -8.353 -12.150 1.00 0.00 C ATOM 1002 CG GLN A 68 -2.897 -7.568 -13.169 1.00 0.00 C ATOM 1003 CD GLN A 68 -4.281 -8.147 -13.386 1.00 0.00 C ATOM 1004 OE1 GLN A 68 -5.215 -7.850 -12.640 1.00 0.00 O ATOM 1005 NE2 GLN A 68 -4.421 -8.979 -14.411 1.00 0.00 N ATOM 0 H GLN A 68 -0.153 -9.277 -10.571 1.00 0.00 H new ATOM 0 HA GLN A 68 -0.407 -7.068 -12.524 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -1.811 -9.315 -12.581 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.713 -8.561 -11.283 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -2.988 -6.534 -12.836 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -2.361 -7.551 -14.118 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -3.620 -9.197 -15.004 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -5.329 -9.400 -14.606 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.700 -5.501 -10.937 1.00 0.00 N ATOM 1015 CA LEU A 69 -2.068 -4.480 -9.962 1.00 0.00 C ATOM 1016 C LEU A 69 -3.412 -3.851 -10.312 1.00 0.00 C ATOM 1017 O LEU A 69 -3.689 -3.565 -11.477 1.00 0.00 O ATOM 1018 CB LEU A 69 -0.988 -3.399 -9.894 1.00 0.00 C ATOM 1019 CG LEU A 69 -1.091 -2.420 -8.724 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -0.970 -3.157 -7.399 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -0.023 -1.341 -8.836 1.00 0.00 C ATOM 0 H LEU A 69 -1.896 -5.249 -11.906 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.156 -4.959 -8.987 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.015 -3.888 -9.848 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.014 -2.829 -10.822 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.069 -1.940 -8.761 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.046 -2.444 -6.578 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.771 -3.892 -7.317 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.006 -3.664 -7.351 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.111 -0.653 -7.995 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.964 -1.803 -8.825 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.156 -0.793 -9.769 1.00 0.00 H new ATOM 1033 N GLN A 70 -4.243 -3.638 -9.297 1.00 0.00 N ATOM 1034 CA GLN A 70 -5.558 -3.042 -9.499 1.00 0.00 C ATOM 1035 C GLN A 70 -5.888 -2.060 -8.379 1.00 0.00 C ATOM 1036 O GLN A 70 -6.044 -2.451 -7.222 1.00 0.00 O ATOM 1037 CB GLN A 70 -6.630 -4.131 -9.570 1.00 0.00 C ATOM 1038 CG GLN A 70 -8.037 -3.588 -9.760 1.00 0.00 C ATOM 1039 CD GLN A 70 -8.360 -3.303 -11.214 1.00 0.00 C ATOM 1040 OE1 GLN A 70 -8.966 -4.126 -11.900 1.00 0.00 O ATOM 1041 NE2 GLN A 70 -7.958 -2.131 -11.691 1.00 0.00 N ATOM 0 H GLN A 70 -4.029 -3.869 -8.327 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.541 -2.497 -10.443 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.396 -4.806 -10.393 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -6.598 -4.721 -8.654 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.756 -4.306 -9.366 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -8.151 -2.672 -9.180 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -7.458 -1.479 -11.087 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -8.149 -1.883 -12.662 1.00 0.00 H new ATOM 1050 N LEU A 71 -5.992 -0.783 -8.731 1.00 0.00 N ATOM 1051 CA LEU A 71 -6.303 0.256 -7.756 1.00 0.00 C ATOM 1052 C LEU A 71 -7.794 0.272 -7.434 1.00 0.00 C ATOM 1053 O LEU A 71 -8.612 0.671 -8.262 1.00 0.00 O ATOM 1054 CB LEU A 71 -5.869 1.625 -8.284 1.00 0.00 C ATOM 1055 CG LEU A 71 -5.711 2.729 -7.237 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -4.682 3.752 -7.692 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -7.049 3.400 -6.965 1.00 0.00 C ATOM 0 H LEU A 71 -5.865 -0.443 -9.684 1.00 0.00 H new ATOM 0 HA LEU A 71 -5.755 0.036 -6.840 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.919 1.507 -8.805 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.599 1.955 -9.024 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.358 2.277 -6.310 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.583 4.530 -6.935 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.720 3.261 -7.836 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.005 4.200 -8.632 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.918 4.183 -6.218 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.430 3.839 -7.887 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.759 2.660 -6.595 1.00 0.00 H new ATOM 1069 N GLN A 72 -8.138 -0.161 -6.225 1.00 0.00 N ATOM 1070 CA GLN A 72 -9.530 -0.195 -5.794 1.00 0.00 C ATOM 1071 C GLN A 72 -9.931 1.126 -5.144 1.00 0.00 C ATOM 1072 O GLN A 72 -9.119 1.777 -4.487 1.00 0.00 O ATOM 1073 CB GLN A 72 -9.755 -1.348 -4.815 1.00 0.00 C ATOM 1074 CG GLN A 72 -11.215 -1.742 -4.664 1.00 0.00 C ATOM 1075 CD GLN A 72 -11.918 -0.971 -3.564 1.00 0.00 C ATOM 1076 OE1 GLN A 72 -12.527 0.070 -3.812 1.00 0.00 O ATOM 1077 NE2 GLN A 72 -11.836 -1.478 -2.340 1.00 0.00 N ATOM 0 H GLN A 72 -7.472 -0.493 -5.527 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.153 -0.349 -6.675 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -9.186 -2.215 -5.151 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -9.360 -1.067 -3.839 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.732 -1.573 -5.608 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -11.279 -2.809 -4.452 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -11.321 -2.344 -2.180 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -12.288 -1.002 -1.559 1.00 0.00 H new ATOM 1086 N ALA A 73 -11.187 1.515 -5.333 1.00 0.00 N ATOM 1087 CA ALA A 73 -11.696 2.757 -4.763 1.00 0.00 C ATOM 1088 C ALA A 73 -11.344 2.867 -3.283 1.00 0.00 C ATOM 1089 O ALA A 73 -11.773 2.061 -2.457 1.00 0.00 O ATOM 1090 CB ALA A 73 -13.202 2.849 -4.958 1.00 0.00 C ATOM 0 H ALA A 73 -11.871 0.989 -5.876 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.222 3.588 -5.285 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.568 3.781 -4.528 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.433 2.825 -6.023 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.685 2.006 -4.463 1.00 0.00 H new ATOM 1096 N PRO A 74 -10.544 3.887 -2.939 1.00 0.00 N ATOM 1097 CA PRO A 74 -10.117 4.126 -1.557 1.00 0.00 C ATOM 1098 C PRO A 74 -11.264 4.596 -0.669 1.00 0.00 C ATOM 1099 O PRO A 74 -12.414 4.656 -1.104 1.00 0.00 O ATOM 1100 CB PRO A 74 -9.063 5.227 -1.697 1.00 0.00 C ATOM 1101 CG PRO A 74 -9.418 5.933 -2.960 1.00 0.00 C ATOM 1102 CD PRO A 74 -9.996 4.886 -3.871 1.00 0.00 C ATOM 0 HA PRO A 74 -9.744 3.218 -1.083 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -9.084 5.906 -0.845 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -8.058 4.809 -1.746 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -10.139 6.729 -2.773 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -8.539 6.398 -3.408 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -10.770 5.299 -4.518 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -9.235 4.454 -4.521 1.00 0.00 H new ATOM 1110 N SER A 75 -10.943 4.930 0.577 1.00 0.00 N ATOM 1111 CA SER A 75 -11.948 5.392 1.527 1.00 0.00 C ATOM 1112 C SER A 75 -12.127 6.905 1.436 1.00 0.00 C ATOM 1113 O SER A 75 -13.229 7.422 1.610 1.00 0.00 O ATOM 1114 CB SER A 75 -11.551 5.000 2.952 1.00 0.00 C ATOM 1115 OG SER A 75 -11.209 3.627 3.026 1.00 0.00 O ATOM 0 H SER A 75 -9.995 4.889 0.952 1.00 0.00 H new ATOM 0 HA SER A 75 -12.896 4.915 1.276 1.00 0.00 H new ATOM 0 HB2 SER A 75 -10.706 5.607 3.277 1.00 0.00 H new ATOM 0 HB3 SER A 75 -12.375 5.210 3.633 1.00 0.00 H new ATOM 0 HG SER A 75 -10.356 3.477 2.567 1.00 0.00 H new ATOM 1121 N GLY A 76 -11.033 7.609 1.160 1.00 0.00 N ATOM 1122 CA GLY A 76 -11.089 9.055 1.050 1.00 0.00 C ATOM 1123 C GLY A 76 -9.726 9.671 0.809 1.00 0.00 C ATOM 1124 O GLY A 76 -8.714 8.971 0.795 1.00 0.00 O ATOM 0 H GLY A 76 -10.109 7.203 1.011 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -11.757 9.329 0.234 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.515 9.470 1.964 1.00 0.00 H new ATOM 1128 N ASN A 77 -9.698 10.986 0.618 1.00 0.00 N ATOM 1129 CA ASN A 77 -8.448 11.697 0.374 1.00 0.00 C ATOM 1130 C ASN A 77 -8.162 12.694 1.493 1.00 0.00 C ATOM 1131 O ASN A 77 -7.493 13.706 1.282 1.00 0.00 O ATOM 1132 CB ASN A 77 -8.505 12.425 -0.971 1.00 0.00 C ATOM 1133 CG ASN A 77 -8.768 11.481 -2.128 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -9.034 10.295 -1.929 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -8.695 12.004 -3.346 1.00 0.00 N ATOM 0 H ASN A 77 -10.527 11.581 0.627 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.641 10.965 0.349 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.288 13.182 -0.938 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -7.563 12.947 -1.139 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -8.862 11.418 -4.164 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -8.472 12.992 -3.464 1.00 0.00 H new ATOM 1142 N THR A 78 -8.675 12.402 2.684 1.00 0.00 N ATOM 1143 CA THR A 78 -8.476 13.272 3.836 1.00 0.00 C ATOM 1144 C THR A 78 -8.127 12.465 5.081 1.00 0.00 C ATOM 1145 O THR A 78 -8.675 11.386 5.308 1.00 0.00 O ATOM 1146 CB THR A 78 -9.729 14.120 4.123 1.00 0.00 C ATOM 1147 OG1 THR A 78 -10.101 14.856 2.952 1.00 0.00 O ATOM 1148 CG2 THR A 78 -9.480 15.082 5.275 1.00 0.00 C ATOM 0 H THR A 78 -9.232 11.569 2.876 1.00 0.00 H new ATOM 0 HA THR A 78 -7.646 13.935 3.591 1.00 0.00 H new ATOM 0 HB THR A 78 -10.540 13.447 4.402 1.00 0.00 H new ATOM 0 HG1 THR A 78 -10.899 15.392 3.142 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.379 15.670 5.459 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.226 14.517 6.172 1.00 0.00 H new ATOM 0 HG23 THR A 78 -8.656 15.749 5.021 1.00 0.00 H new ATOM 1156 N VAL A 79 -7.211 12.994 5.887 1.00 0.00 N ATOM 1157 CA VAL A 79 -6.790 12.323 7.111 1.00 0.00 C ATOM 1158 C VAL A 79 -6.741 13.297 8.283 1.00 0.00 C ATOM 1159 O VAL A 79 -6.081 14.335 8.232 1.00 0.00 O ATOM 1160 CB VAL A 79 -5.406 11.667 6.944 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -4.966 11.012 8.244 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -5.430 10.655 5.809 1.00 0.00 C ATOM 0 H VAL A 79 -6.746 13.885 5.714 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.528 11.548 7.317 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.683 12.443 6.693 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -3.986 10.554 8.107 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -4.908 11.765 9.030 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.688 10.247 8.528 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.444 10.201 5.705 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.165 9.880 6.028 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.698 11.157 4.879 1.00 0.00 H new ATOM 1172 N PRO A 80 -7.457 12.957 9.365 1.00 0.00 N ATOM 1173 CA PRO A 80 -7.510 13.788 10.572 1.00 0.00 C ATOM 1174 C PRO A 80 -6.187 13.797 11.329 1.00 0.00 C ATOM 1175 O PRO A 80 -5.572 12.751 11.536 1.00 0.00 O ATOM 1176 CB PRO A 80 -8.602 13.122 11.413 1.00 0.00 C ATOM 1177 CG PRO A 80 -8.620 11.704 10.956 1.00 0.00 C ATOM 1178 CD PRO A 80 -8.268 11.735 9.495 1.00 0.00 C ATOM 0 HA PRO A 80 -7.710 14.834 10.338 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -8.380 13.192 12.478 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.569 13.601 11.257 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.904 11.104 11.517 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.602 11.256 11.111 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -7.709 10.848 9.198 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -9.159 11.775 8.868 1.00 0.00 H new ATOM 1186 N ALA A 81 -5.754 14.984 11.739 1.00 0.00 N ATOM 1187 CA ALA A 81 -4.504 15.129 12.476 1.00 0.00 C ATOM 1188 C ALA A 81 -4.686 14.760 13.944 1.00 0.00 C ATOM 1189 O ALA A 81 -3.792 14.973 14.763 1.00 0.00 O ATOM 1190 CB ALA A 81 -3.977 16.551 12.348 1.00 0.00 C ATOM 0 H ALA A 81 -6.250 15.860 11.574 1.00 0.00 H new ATOM 0 HA ALA A 81 -3.775 14.443 12.044 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -3.044 16.644 12.903 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.799 16.780 11.297 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.711 17.249 12.752 1.00 0.00 H new ATOM 1196 N ARG A 82 -5.849 14.207 14.270 1.00 0.00 N ATOM 1197 CA ARG A 82 -6.149 13.810 15.641 1.00 0.00 C ATOM 1198 C ARG A 82 -6.343 12.300 15.740 1.00 0.00 C ATOM 1199 O ARG A 82 -7.293 11.826 16.362 1.00 0.00 O ATOM 1200 CB ARG A 82 -7.403 14.531 16.140 1.00 0.00 C ATOM 1201 CG ARG A 82 -7.320 16.044 16.030 1.00 0.00 C ATOM 1202 CD ARG A 82 -6.420 16.633 17.104 1.00 0.00 C ATOM 1203 NE ARG A 82 -7.158 16.951 18.324 1.00 0.00 N ATOM 1204 CZ ARG A 82 -6.596 17.026 19.525 1.00 0.00 C ATOM 1205 NH1 ARG A 82 -5.296 16.808 19.667 1.00 0.00 N ATOM 1206 NH2 ARG A 82 -7.335 17.320 20.587 1.00 0.00 N ATOM 0 H ARG A 82 -6.599 14.023 13.604 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.303 14.091 16.268 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -8.264 14.181 15.571 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -7.578 14.260 17.181 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.940 16.318 15.046 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -8.319 16.471 16.117 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.623 15.927 17.336 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -5.944 17.536 16.723 1.00 0.00 H new ATOM 0 HE ARG A 82 -8.160 17.125 18.249 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -4.725 16.582 18.853 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -4.867 16.866 20.591 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -8.335 17.489 20.481 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -6.903 17.377 21.509 1.00 0.00 H new ATOM 1220 N GLY A 83 -5.436 11.550 15.122 1.00 0.00 N ATOM 1221 CA GLY A 83 -5.526 10.102 15.152 1.00 0.00 C ATOM 1222 C GLY A 83 -6.934 9.603 14.891 1.00 0.00 C ATOM 1223 O GLY A 83 -7.371 8.618 15.485 1.00 0.00 O ATOM 0 H GLY A 83 -4.641 11.919 14.601 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -4.851 9.684 14.405 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.190 9.740 16.124 1.00 0.00 H new ATOM 1227 N GLY A 84 -7.647 10.286 14.001 1.00 0.00 N ATOM 1228 CA GLY A 84 -9.007 9.893 13.681 1.00 0.00 C ATOM 1229 C GLY A 84 -9.080 8.509 13.066 1.00 0.00 C ATOM 1230 O GLY A 84 -8.914 7.504 13.759 1.00 0.00 O ATOM 0 H GLY A 84 -7.307 11.104 13.496 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.612 9.917 14.587 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.439 10.618 12.990 1.00 0.00 H new ATOM 1234 N LEU A 85 -9.331 8.455 11.762 1.00 0.00 N ATOM 1235 CA LEU A 85 -9.428 7.184 11.054 1.00 0.00 C ATOM 1236 C LEU A 85 -8.506 7.166 9.838 1.00 0.00 C ATOM 1237 O LEU A 85 -8.605 8.003 8.941 1.00 0.00 O ATOM 1238 CB LEU A 85 -10.872 6.929 10.617 1.00 0.00 C ATOM 1239 CG LEU A 85 -11.926 6.982 11.723 1.00 0.00 C ATOM 1240 CD1 LEU A 85 -12.387 8.412 11.954 1.00 0.00 C ATOM 1241 CD2 LEU A 85 -13.108 6.088 11.376 1.00 0.00 C ATOM 0 H LEU A 85 -9.471 9.277 11.174 1.00 0.00 H new ATOM 0 HA LEU A 85 -9.116 6.392 11.735 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.135 7.663 9.856 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -10.920 5.948 10.144 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.476 6.614 12.645 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -13.137 8.429 12.745 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.536 9.026 12.248 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.819 8.808 11.035 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.849 6.138 12.174 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.558 6.425 10.442 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -12.765 5.059 11.263 1.00 0.00 H new ATOM 1253 N PRO A 86 -7.589 6.188 9.805 1.00 0.00 N ATOM 1254 CA PRO A 86 -6.634 6.036 8.704 1.00 0.00 C ATOM 1255 C PRO A 86 -7.306 5.583 7.412 1.00 0.00 C ATOM 1256 O PRO A 86 -8.391 5.002 7.437 1.00 0.00 O ATOM 1257 CB PRO A 86 -5.674 4.958 9.213 1.00 0.00 C ATOM 1258 CG PRO A 86 -6.471 4.175 10.199 1.00 0.00 C ATOM 1259 CD PRO A 86 -7.414 5.155 10.840 1.00 0.00 C ATOM 0 HA PRO A 86 -6.146 6.978 8.455 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.321 4.326 8.398 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.793 5.400 9.678 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -7.019 3.371 9.708 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -5.824 3.712 10.944 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.362 4.686 11.104 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -6.998 5.572 11.757 1.00 0.00 H new ATOM 1267 N ILE A 87 -6.654 5.852 6.286 1.00 0.00 N ATOM 1268 CA ILE A 87 -7.189 5.470 4.985 1.00 0.00 C ATOM 1269 C ILE A 87 -6.704 4.083 4.576 1.00 0.00 C ATOM 1270 O ILE A 87 -5.516 3.774 4.676 1.00 0.00 O ATOM 1271 CB ILE A 87 -6.792 6.482 3.894 1.00 0.00 C ATOM 1272 CG1 ILE A 87 -7.258 7.888 4.278 1.00 0.00 C ATOM 1273 CG2 ILE A 87 -7.380 6.072 2.552 1.00 0.00 C ATOM 1274 CD1 ILE A 87 -6.764 8.966 3.339 1.00 0.00 C ATOM 0 H ILE A 87 -5.755 6.333 6.248 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.275 5.459 5.082 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.706 6.491 3.806 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.348 7.908 4.299 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.915 8.112 5.288 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.091 6.797 1.791 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.004 5.087 2.276 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.467 6.038 2.626 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -7.133 9.936 3.672 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.674 8.974 3.335 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.129 8.766 2.331 1.00 0.00 H new ATOM 1286 N THR A 88 -7.632 3.250 4.114 1.00 0.00 N ATOM 1287 CA THR A 88 -7.299 1.896 3.689 1.00 0.00 C ATOM 1288 C THR A 88 -7.698 1.662 2.236 1.00 0.00 C ATOM 1289 O THR A 88 -8.798 2.024 1.820 1.00 0.00 O ATOM 1290 CB THR A 88 -7.992 0.844 4.575 1.00 0.00 C ATOM 1291 OG1 THR A 88 -9.412 0.920 4.408 1.00 0.00 O ATOM 1292 CG2 THR A 88 -7.636 1.051 6.040 1.00 0.00 C ATOM 0 H THR A 88 -8.619 3.489 4.025 1.00 0.00 H new ATOM 0 HA THR A 88 -6.219 1.790 3.788 1.00 0.00 H new ATOM 0 HB THR A 88 -7.644 -0.142 4.269 1.00 0.00 H new ATOM 0 HG1 THR A 88 -9.844 0.247 4.974 1.00 0.00 H new ATOM 0 HG21 THR A 88 -8.137 0.296 6.646 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.557 0.962 6.168 1.00 0.00 H new ATOM 0 HG23 THR A 88 -7.958 2.043 6.356 1.00 0.00 H new ATOM 1300 N GLN A 89 -6.797 1.055 1.471 1.00 0.00 N ATOM 1301 CA GLN A 89 -7.056 0.773 0.064 1.00 0.00 C ATOM 1302 C GLN A 89 -6.847 -0.706 -0.242 1.00 0.00 C ATOM 1303 O GLN A 89 -6.117 -1.401 0.466 1.00 0.00 O ATOM 1304 CB GLN A 89 -6.146 1.623 -0.824 1.00 0.00 C ATOM 1305 CG GLN A 89 -6.363 1.396 -2.311 1.00 0.00 C ATOM 1306 CD GLN A 89 -6.051 2.626 -3.141 1.00 0.00 C ATOM 1307 OE1 GLN A 89 -4.891 2.905 -3.446 1.00 0.00 O ATOM 1308 NE2 GLN A 89 -7.087 3.368 -3.512 1.00 0.00 N ATOM 0 H GLN A 89 -5.882 0.749 1.801 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.095 1.025 -0.146 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -6.312 2.676 -0.598 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -5.107 1.405 -0.579 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -5.736 0.569 -2.644 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -7.398 1.100 -2.482 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -8.032 3.099 -3.237 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -6.939 4.207 -4.073 1.00 0.00 H new ATOM 1317 N LEU A 90 -7.493 -1.183 -1.301 1.00 0.00 N ATOM 1318 CA LEU A 90 -7.378 -2.581 -1.701 1.00 0.00 C ATOM 1319 C LEU A 90 -6.617 -2.710 -3.016 1.00 0.00 C ATOM 1320 O LEU A 90 -6.775 -1.890 -3.920 1.00 0.00 O ATOM 1321 CB LEU A 90 -8.767 -3.208 -1.839 1.00 0.00 C ATOM 1322 CG LEU A 90 -8.834 -4.528 -2.607 1.00 0.00 C ATOM 1323 CD1 LEU A 90 -7.988 -5.589 -1.921 1.00 0.00 C ATOM 1324 CD2 LEU A 90 -10.276 -4.996 -2.739 1.00 0.00 C ATOM 0 H LEU A 90 -8.101 -0.622 -1.898 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.822 -3.110 -0.927 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.171 -3.371 -0.840 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.421 -2.489 -2.334 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.433 -4.364 -3.607 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.048 -6.521 -2.482 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.951 -5.257 -1.880 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.358 -5.751 -0.908 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -10.304 -5.937 -3.288 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -10.703 -5.142 -1.747 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.855 -4.245 -3.276 1.00 0.00 H new ATOM 1336 N PHE A 91 -5.792 -3.747 -3.117 1.00 0.00 N ATOM 1337 CA PHE A 91 -5.007 -3.985 -4.323 1.00 0.00 C ATOM 1338 C PHE A 91 -4.999 -5.468 -4.683 1.00 0.00 C ATOM 1339 O PHE A 91 -4.500 -6.299 -3.924 1.00 0.00 O ATOM 1340 CB PHE A 91 -3.573 -3.488 -4.129 1.00 0.00 C ATOM 1341 CG PHE A 91 -3.489 -2.052 -3.699 1.00 0.00 C ATOM 1342 CD1 PHE A 91 -3.726 -1.694 -2.382 1.00 0.00 C ATOM 1343 CD2 PHE A 91 -3.173 -1.059 -4.613 1.00 0.00 C ATOM 1344 CE1 PHE A 91 -3.650 -0.372 -1.984 1.00 0.00 C ATOM 1345 CE2 PHE A 91 -3.095 0.264 -4.221 1.00 0.00 C ATOM 1346 CZ PHE A 91 -3.333 0.608 -2.905 1.00 0.00 C ATOM 0 H PHE A 91 -5.650 -4.436 -2.378 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.468 -3.433 -5.142 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.079 -4.111 -3.384 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -3.025 -3.612 -5.063 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -3.973 -2.456 -1.658 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -2.986 -1.322 -5.644 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.838 -0.106 -0.954 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -2.848 1.028 -4.943 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.271 1.641 -2.596 1.00 0.00 H new ATOM 1356 N ARG A 92 -5.556 -5.791 -5.845 1.00 0.00 N ATOM 1357 CA ARG A 92 -5.615 -7.173 -6.306 1.00 0.00 C ATOM 1358 C ARG A 92 -4.385 -7.522 -7.138 1.00 0.00 C ATOM 1359 O ARG A 92 -4.193 -6.991 -8.232 1.00 0.00 O ATOM 1360 CB ARG A 92 -6.884 -7.405 -7.130 1.00 0.00 C ATOM 1361 CG ARG A 92 -8.077 -7.846 -6.299 1.00 0.00 C ATOM 1362 CD ARG A 92 -9.021 -8.726 -7.103 1.00 0.00 C ATOM 1363 NE ARG A 92 -9.774 -9.644 -6.252 1.00 0.00 N ATOM 1364 CZ ARG A 92 -10.566 -10.600 -6.723 1.00 0.00 C ATOM 1365 NH1 ARG A 92 -10.709 -10.763 -8.031 1.00 0.00 N ATOM 1366 NH2 ARG A 92 -11.218 -11.396 -5.885 1.00 0.00 N ATOM 0 H ARG A 92 -5.973 -5.115 -6.485 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.635 -7.821 -5.430 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.139 -6.485 -7.656 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.681 -8.161 -7.889 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.729 -8.391 -5.421 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.614 -6.969 -5.938 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.715 -8.098 -7.661 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -8.449 -9.297 -7.835 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.687 -9.545 -5.241 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -10.210 -10.153 -8.679 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -11.318 -11.498 -8.390 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -11.111 -11.274 -4.878 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -11.826 -12.130 -6.248 1.00 0.00 H new ATOM 1380 N ILE A 93 -3.556 -8.417 -6.612 1.00 0.00 N ATOM 1381 CA ILE A 93 -2.345 -8.837 -7.307 1.00 0.00 C ATOM 1382 C ILE A 93 -2.400 -10.319 -7.662 1.00 0.00 C ATOM 1383 O ILE A 93 -3.048 -11.110 -6.974 1.00 0.00 O ATOM 1384 CB ILE A 93 -1.088 -8.570 -6.458 1.00 0.00 C ATOM 1385 CG1 ILE A 93 -0.940 -7.073 -6.183 1.00 0.00 C ATOM 1386 CG2 ILE A 93 0.149 -9.111 -7.159 1.00 0.00 C ATOM 1387 CD1 ILE A 93 -0.216 -6.764 -4.891 1.00 0.00 C ATOM 0 H ILE A 93 -3.700 -8.865 -5.707 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.287 -8.249 -8.223 1.00 0.00 H new ATOM 0 HB ILE A 93 -1.196 -9.086 -5.504 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.402 -6.611 -7.011 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.930 -6.618 -6.153 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.029 -8.915 -6.547 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.042 -10.186 -7.307 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.263 -8.621 -8.126 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -0.148 -5.684 -4.761 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.765 -7.196 -4.054 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.787 -7.189 -4.925 1.00 0.00 H new ATOM 1399 N LEU A 94 -1.716 -10.690 -8.738 1.00 0.00 N ATOM 1400 CA LEU A 94 -1.685 -12.078 -9.184 1.00 0.00 C ATOM 1401 C LEU A 94 -0.255 -12.608 -9.216 1.00 0.00 C ATOM 1402 O LEU A 94 0.626 -12.008 -9.829 1.00 0.00 O ATOM 1403 CB LEU A 94 -2.318 -12.203 -10.571 1.00 0.00 C ATOM 1404 CG LEU A 94 -3.821 -12.485 -10.600 1.00 0.00 C ATOM 1405 CD1 LEU A 94 -4.102 -13.926 -10.204 1.00 0.00 C ATOM 1406 CD2 LEU A 94 -4.561 -11.523 -9.681 1.00 0.00 C ATOM 0 H LEU A 94 -1.175 -10.049 -9.318 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.258 -12.674 -8.474 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.131 -11.279 -11.118 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.808 -13.001 -11.110 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.180 -12.334 -11.618 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.176 -14.108 -10.230 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.603 -14.599 -10.901 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.728 -14.106 -9.196 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.629 -11.738 -9.714 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.198 -11.643 -8.660 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.387 -10.499 -10.010 1.00 0.00 H new ATOM 1418 N ASN A 95 -0.034 -13.738 -8.552 1.00 0.00 N ATOM 1419 CA ASN A 95 1.289 -14.351 -8.506 1.00 0.00 C ATOM 1420 C ASN A 95 1.228 -15.811 -8.943 1.00 0.00 C ATOM 1421 O ASN A 95 1.820 -16.695 -8.323 1.00 0.00 O ATOM 1422 CB ASN A 95 1.870 -14.253 -7.094 1.00 0.00 C ATOM 1423 CG ASN A 95 3.179 -15.006 -6.953 1.00 0.00 C ATOM 1424 OD1 ASN A 95 3.234 -16.065 -6.327 1.00 0.00 O ATOM 1425 ND2 ASN A 95 4.240 -14.462 -7.537 1.00 0.00 N ATOM 0 H ASN A 95 -0.753 -14.248 -8.039 1.00 0.00 H new ATOM 0 HA ASN A 95 1.937 -13.811 -9.197 1.00 0.00 H new ATOM 0 HB2 ASN A 95 2.028 -13.205 -6.841 1.00 0.00 H new ATOM 0 HB3 ASN A 95 1.148 -14.648 -6.379 1.00 0.00 H new ATOM 0 HD21 ASN A 95 5.148 -14.923 -7.477 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.147 -13.583 -8.046 1.00 0.00 H new ATOM 1432 N PRO A 96 0.496 -16.072 -10.036 1.00 0.00 N ATOM 1433 CA PRO A 96 0.341 -17.424 -10.581 1.00 0.00 C ATOM 1434 C PRO A 96 1.631 -17.951 -11.200 1.00 0.00 C ATOM 1435 O PRO A 96 1.792 -19.155 -11.389 1.00 0.00 O ATOM 1436 CB PRO A 96 -0.736 -17.252 -11.654 1.00 0.00 C ATOM 1437 CG PRO A 96 -0.643 -15.821 -12.059 1.00 0.00 C ATOM 1438 CD PRO A 96 -0.237 -15.067 -10.824 1.00 0.00 C ATOM 0 HA PRO A 96 0.081 -18.148 -9.809 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -0.560 -17.915 -12.501 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -1.725 -17.489 -11.263 1.00 0.00 H new ATOM 0 HG2 PRO A 96 0.089 -15.688 -12.856 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.598 -15.460 -12.440 1.00 0.00 H new ATOM 0 HD2 PRO A 96 0.391 -14.209 -11.065 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.103 -14.686 -10.283 1.00 0.00 H new ATOM 1446 N ASN A 97 2.547 -17.040 -11.512 1.00 0.00 N ATOM 1447 CA ASN A 97 3.823 -17.414 -12.110 1.00 0.00 C ATOM 1448 C ASN A 97 4.825 -17.832 -11.038 1.00 0.00 C ATOM 1449 O ASN A 97 6.005 -18.037 -11.321 1.00 0.00 O ATOM 1450 CB ASN A 97 4.389 -16.249 -12.925 1.00 0.00 C ATOM 1451 CG ASN A 97 3.818 -16.194 -14.329 1.00 0.00 C ATOM 1452 OD1 ASN A 97 4.372 -16.777 -15.260 1.00 0.00 O ATOM 1453 ND2 ASN A 97 2.702 -15.490 -14.487 1.00 0.00 N ATOM 0 H ASN A 97 2.429 -16.038 -11.361 1.00 0.00 H new ATOM 0 HA ASN A 97 3.650 -18.263 -12.772 1.00 0.00 H new ATOM 0 HB2 ASN A 97 4.174 -15.312 -12.411 1.00 0.00 H new ATOM 0 HB3 ASN A 97 5.474 -16.341 -12.980 1.00 0.00 H new ATOM 0 HD21 ASN A 97 2.271 -15.417 -15.409 1.00 0.00 H new ATOM 0 HD22 ASN A 97 2.276 -15.022 -13.687 1.00 0.00 H new ATOM 1460 N LYS A 98 4.345 -17.958 -9.806 1.00 0.00 N ATOM 1461 CA LYS A 98 5.196 -18.354 -8.690 1.00 0.00 C ATOM 1462 C LYS A 98 6.485 -17.538 -8.672 1.00 0.00 C ATOM 1463 O LYS A 98 7.541 -18.037 -8.285 1.00 0.00 O ATOM 1464 CB LYS A 98 5.526 -19.846 -8.777 1.00 0.00 C ATOM 1465 CG LYS A 98 4.309 -20.746 -8.653 1.00 0.00 C ATOM 1466 CD LYS A 98 4.697 -22.154 -8.235 1.00 0.00 C ATOM 1467 CE LYS A 98 5.031 -23.021 -9.440 1.00 0.00 C ATOM 1468 NZ LYS A 98 5.698 -24.291 -9.041 1.00 0.00 N ATOM 0 H LYS A 98 3.371 -17.792 -9.555 1.00 0.00 H new ATOM 0 HA LYS A 98 4.652 -18.162 -7.765 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.020 -20.046 -9.728 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.236 -20.099 -7.990 1.00 0.00 H new ATOM 0 HG2 LYS A 98 3.618 -20.326 -7.922 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.782 -20.781 -9.607 1.00 0.00 H new ATOM 0 HD2 LYS A 98 5.557 -22.112 -7.566 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.879 -22.607 -7.675 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.117 -23.248 -9.989 1.00 0.00 H new ATOM 0 HE3 LYS A 98 5.681 -22.467 -10.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.909 -24.854 -9.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 6.583 -24.076 -8.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 5.068 -24.832 -8.415 1.00 0.00 H new ATOM 1482 N ALA A 99 6.389 -16.281 -9.091 1.00 0.00 N ATOM 1483 CA ALA A 99 7.547 -15.395 -9.120 1.00 0.00 C ATOM 1484 C ALA A 99 7.421 -14.293 -8.073 1.00 0.00 C ATOM 1485 O ALA A 99 6.667 -13.334 -8.235 1.00 0.00 O ATOM 1486 CB ALA A 99 7.716 -14.792 -10.506 1.00 0.00 C ATOM 0 H ALA A 99 5.522 -15.853 -9.415 1.00 0.00 H new ATOM 0 HA ALA A 99 8.432 -15.986 -8.883 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.584 -14.133 -10.513 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.860 -15.590 -11.235 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.825 -14.221 -10.765 1.00 0.00 H new ATOM 1492 N PRO A 100 8.176 -14.433 -6.973 1.00 0.00 N ATOM 1493 CA PRO A 100 8.166 -13.458 -5.878 1.00 0.00 C ATOM 1494 C PRO A 100 8.813 -12.135 -6.273 1.00 0.00 C ATOM 1495 O PRO A 100 9.982 -11.890 -5.973 1.00 0.00 O ATOM 1496 CB PRO A 100 8.983 -14.147 -4.782 1.00 0.00 C ATOM 1497 CG PRO A 100 9.876 -15.091 -5.513 1.00 0.00 C ATOM 1498 CD PRO A 100 9.097 -15.552 -6.713 1.00 0.00 C ATOM 0 HA PRO A 100 7.152 -13.198 -5.573 1.00 0.00 H new ATOM 0 HB2 PRO A 100 9.559 -13.424 -4.204 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.338 -14.675 -4.080 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.801 -14.599 -5.814 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.154 -15.934 -4.881 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.748 -15.743 -7.566 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.558 -16.477 -6.511 1.00 0.00 H new ATOM 1506 N LEU A 101 8.046 -11.285 -6.947 1.00 0.00 N ATOM 1507 CA LEU A 101 8.545 -9.986 -7.383 1.00 0.00 C ATOM 1508 C LEU A 101 8.412 -8.950 -6.271 1.00 0.00 C ATOM 1509 O LEU A 101 7.990 -9.269 -5.160 1.00 0.00 O ATOM 1510 CB LEU A 101 7.786 -9.517 -8.626 1.00 0.00 C ATOM 1511 CG LEU A 101 8.374 -9.941 -9.972 1.00 0.00 C ATOM 1512 CD1 LEU A 101 9.798 -9.425 -10.118 1.00 0.00 C ATOM 1513 CD2 LEU A 101 8.336 -11.455 -10.118 1.00 0.00 C ATOM 0 H LEU A 101 7.077 -11.472 -7.203 1.00 0.00 H new ATOM 0 HA LEU A 101 9.601 -10.094 -7.629 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.764 -9.890 -8.565 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.730 -8.429 -8.604 1.00 0.00 H new ATOM 0 HG LEU A 101 7.767 -9.505 -10.766 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.201 -9.736 -11.082 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.798 -8.337 -10.059 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.416 -9.832 -9.318 1.00 0.00 H new ATOM 0 HD21 LEU A 101 8.759 -11.738 -11.082 1.00 0.00 H new ATOM 0 HD22 LEU A 101 8.918 -11.912 -9.318 1.00 0.00 H new ATOM 0 HD23 LEU A 101 7.304 -11.800 -10.059 1.00 0.00 H new ATOM 1525 N ARG A 102 8.773 -7.709 -6.580 1.00 0.00 N ATOM 1526 CA ARG A 102 8.693 -6.626 -5.607 1.00 0.00 C ATOM 1527 C ARG A 102 7.546 -5.677 -5.942 1.00 0.00 C ATOM 1528 O ARG A 102 6.989 -5.723 -7.040 1.00 0.00 O ATOM 1529 CB ARG A 102 10.012 -5.853 -5.562 1.00 0.00 C ATOM 1530 CG ARG A 102 10.034 -4.746 -4.521 1.00 0.00 C ATOM 1531 CD ARG A 102 11.410 -4.107 -4.417 1.00 0.00 C ATOM 1532 NE ARG A 102 11.610 -3.070 -5.426 1.00 0.00 N ATOM 1533 CZ ARG A 102 12.802 -2.579 -5.750 1.00 0.00 C ATOM 1534 NH1 ARG A 102 13.893 -3.029 -5.146 1.00 0.00 N ATOM 1535 NH2 ARG A 102 12.902 -1.637 -6.678 1.00 0.00 N ATOM 0 H ARG A 102 9.124 -7.429 -7.496 1.00 0.00 H new ATOM 0 HA ARG A 102 8.504 -7.065 -4.628 1.00 0.00 H new ATOM 0 HB2 ARG A 102 10.825 -6.550 -5.356 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.204 -5.421 -6.544 1.00 0.00 H new ATOM 0 HG2 ARG A 102 9.297 -3.986 -4.781 1.00 0.00 H new ATOM 0 HG3 ARG A 102 9.745 -5.151 -3.551 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.535 -3.675 -3.424 1.00 0.00 H new ATOM 0 HD3 ARG A 102 12.176 -4.875 -4.530 1.00 0.00 H new ATOM 0 HE ARG A 102 10.790 -2.702 -5.908 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.818 -3.753 -4.431 1.00 0.00 H new ATOM 0 HH12 ARG A 102 14.807 -2.651 -5.396 1.00 0.00 H new ATOM 0 HH21 ARG A 102 12.064 -1.289 -7.144 1.00 0.00 H new ATOM 0 HH22 ARG A 102 13.817 -1.261 -6.926 1.00 0.00 H new ATOM 1549 N LEU A 103 7.197 -4.819 -4.990 1.00 0.00 N ATOM 1550 CA LEU A 103 6.116 -3.858 -5.184 1.00 0.00 C ATOM 1551 C LEU A 103 6.602 -2.434 -4.934 1.00 0.00 C ATOM 1552 O LEU A 103 7.350 -2.179 -3.990 1.00 0.00 O ATOM 1553 CB LEU A 103 4.947 -4.182 -4.253 1.00 0.00 C ATOM 1554 CG LEU A 103 3.950 -3.049 -4.009 1.00 0.00 C ATOM 1555 CD1 LEU A 103 3.026 -2.883 -5.205 1.00 0.00 C ATOM 1556 CD2 LEU A 103 3.146 -3.310 -2.743 1.00 0.00 C ATOM 0 H LEU A 103 7.647 -4.769 -4.076 1.00 0.00 H new ATOM 0 HA LEU A 103 5.779 -3.930 -6.218 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.405 -5.033 -4.665 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.351 -4.497 -3.291 1.00 0.00 H new ATOM 0 HG LEU A 103 4.508 -2.122 -3.877 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.324 -2.072 -5.012 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.616 -2.649 -6.091 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.475 -3.809 -5.370 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.441 -2.494 -2.585 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.599 -4.247 -2.846 1.00 0.00 H new ATOM 0 HD23 LEU A 103 3.822 -3.377 -1.890 1.00 0.00 H new ATOM 1568 N LYS A 104 6.169 -1.509 -5.784 1.00 0.00 N ATOM 1569 CA LYS A 104 6.555 -0.109 -5.654 1.00 0.00 C ATOM 1570 C LYS A 104 5.440 0.705 -5.006 1.00 0.00 C ATOM 1571 O LYS A 104 4.282 0.631 -5.421 1.00 0.00 O ATOM 1572 CB LYS A 104 6.898 0.476 -7.026 1.00 0.00 C ATOM 1573 CG LYS A 104 7.244 1.954 -6.987 1.00 0.00 C ATOM 1574 CD LYS A 104 7.631 2.473 -8.362 1.00 0.00 C ATOM 1575 CE LYS A 104 8.459 3.745 -8.266 1.00 0.00 C ATOM 1576 NZ LYS A 104 8.896 4.225 -9.606 1.00 0.00 N ATOM 0 H LYS A 104 5.550 -1.704 -6.571 1.00 0.00 H new ATOM 0 HA LYS A 104 7.436 -0.059 -5.014 1.00 0.00 H new ATOM 0 HB2 LYS A 104 7.739 -0.075 -7.446 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.052 0.327 -7.697 1.00 0.00 H new ATOM 0 HG2 LYS A 104 6.391 2.518 -6.611 1.00 0.00 H new ATOM 0 HG3 LYS A 104 8.066 2.118 -6.291 1.00 0.00 H new ATOM 0 HD2 LYS A 104 8.197 1.709 -8.894 1.00 0.00 H new ATOM 0 HD3 LYS A 104 6.731 2.667 -8.945 1.00 0.00 H new ATOM 0 HE2 LYS A 104 7.874 4.523 -7.775 1.00 0.00 H new ATOM 0 HE3 LYS A 104 9.334 3.562 -7.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 9.458 5.094 -9.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 9.475 3.493 -10.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 8.061 4.424 -10.193 1.00 0.00 H new ATOM 1590 N LEU A 105 5.795 1.483 -3.990 1.00 0.00 N ATOM 1591 CA LEU A 105 4.824 2.313 -3.286 1.00 0.00 C ATOM 1592 C LEU A 105 5.208 3.787 -3.367 1.00 0.00 C ATOM 1593 O LEU A 105 6.312 4.173 -2.984 1.00 0.00 O ATOM 1594 CB LEU A 105 4.720 1.881 -1.822 1.00 0.00 C ATOM 1595 CG LEU A 105 3.796 0.697 -1.536 1.00 0.00 C ATOM 1596 CD1 LEU A 105 3.907 0.273 -0.079 1.00 0.00 C ATOM 1597 CD2 LEU A 105 2.356 1.047 -1.883 1.00 0.00 C ATOM 0 H LEU A 105 6.748 1.557 -3.635 1.00 0.00 H new ATOM 0 HA LEU A 105 3.855 2.182 -3.767 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.719 1.631 -1.466 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.377 2.734 -1.236 1.00 0.00 H new ATOM 0 HG LEU A 105 4.106 -0.140 -2.162 1.00 0.00 H new ATOM 0 HD11 LEU A 105 3.242 -0.571 0.106 1.00 0.00 H new ATOM 0 HD12 LEU A 105 4.934 -0.020 0.137 1.00 0.00 H new ATOM 0 HD13 LEU A 105 3.624 1.106 0.565 1.00 0.00 H new ATOM 0 HD21 LEU A 105 1.713 0.192 -1.673 1.00 0.00 H new ATOM 0 HD22 LEU A 105 2.034 1.899 -1.284 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.288 1.301 -2.941 1.00 0.00 H new ATOM 1609 N ARG A 106 4.287 4.606 -3.866 1.00 0.00 N ATOM 1610 CA ARG A 106 4.529 6.038 -3.996 1.00 0.00 C ATOM 1611 C ARG A 106 3.503 6.837 -3.197 1.00 0.00 C ATOM 1612 O ARG A 106 2.299 6.598 -3.297 1.00 0.00 O ATOM 1613 CB ARG A 106 4.481 6.453 -5.468 1.00 0.00 C ATOM 1614 CG ARG A 106 4.543 7.957 -5.678 1.00 0.00 C ATOM 1615 CD ARG A 106 4.991 8.304 -7.089 1.00 0.00 C ATOM 1616 NE ARG A 106 4.427 9.572 -7.547 1.00 0.00 N ATOM 1617 CZ ARG A 106 4.699 10.114 -8.728 1.00 0.00 C ATOM 1618 NH1 ARG A 106 5.523 9.502 -9.568 1.00 0.00 N ATOM 1619 NH2 ARG A 106 4.147 11.270 -9.073 1.00 0.00 N ATOM 0 H ARG A 106 3.367 4.302 -4.186 1.00 0.00 H new ATOM 0 HA ARG A 106 5.521 6.252 -3.598 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.313 5.986 -5.996 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.564 6.069 -5.915 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.562 8.393 -5.489 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.232 8.398 -4.957 1.00 0.00 H new ATOM 0 HD2 ARG A 106 6.079 8.359 -7.120 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.692 7.507 -7.770 1.00 0.00 H new ATOM 0 HE ARG A 106 3.789 10.068 -6.925 1.00 0.00 H new ATOM 0 HH11 ARG A 106 5.949 8.613 -9.307 1.00 0.00 H new ATOM 0 HH12 ARG A 106 5.730 9.921 -10.475 1.00 0.00 H new ATOM 0 HH21 ARG A 106 3.512 11.744 -8.430 1.00 0.00 H new ATOM 0 HH22 ARG A 106 4.357 11.685 -9.981 1.00 0.00 H new ATOM 1633 N LEU A 107 3.988 7.787 -2.405 1.00 0.00 N ATOM 1634 CA LEU A 107 3.114 8.622 -1.588 1.00 0.00 C ATOM 1635 C LEU A 107 3.291 10.097 -1.934 1.00 0.00 C ATOM 1636 O LEU A 107 4.412 10.604 -1.988 1.00 0.00 O ATOM 1637 CB LEU A 107 3.402 8.396 -0.103 1.00 0.00 C ATOM 1638 CG LEU A 107 3.126 6.989 0.428 1.00 0.00 C ATOM 1639 CD1 LEU A 107 3.728 6.815 1.814 1.00 0.00 C ATOM 1640 CD2 LEU A 107 1.630 6.714 0.455 1.00 0.00 C ATOM 0 H LEU A 107 4.981 7.998 -2.311 1.00 0.00 H new ATOM 0 HA LEU A 107 2.082 8.340 -1.798 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.449 8.634 0.084 1.00 0.00 H new ATOM 0 HB3 LEU A 107 2.806 9.104 0.474 1.00 0.00 H new ATOM 0 HG LEU A 107 3.595 6.269 -0.242 1.00 0.00 H new ATOM 0 HD11 LEU A 107 3.522 5.808 2.176 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.806 6.969 1.765 1.00 0.00 H new ATOM 0 HD13 LEU A 107 3.288 7.543 2.496 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.452 5.708 0.836 1.00 0.00 H new ATOM 0 HD22 LEU A 107 1.138 7.440 1.103 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.227 6.797 -0.554 1.00 0.00 H new ATOM 1652 N THR A 108 2.176 10.783 -2.167 1.00 0.00 N ATOM 1653 CA THR A 108 2.208 12.200 -2.506 1.00 0.00 C ATOM 1654 C THR A 108 1.022 12.938 -1.895 1.00 0.00 C ATOM 1655 O THR A 108 -0.132 12.652 -2.215 1.00 0.00 O ATOM 1656 CB THR A 108 2.199 12.413 -4.032 1.00 0.00 C ATOM 1657 OG1 THR A 108 1.453 11.369 -4.668 1.00 0.00 O ATOM 1658 CG2 THR A 108 3.617 12.438 -4.583 1.00 0.00 C ATOM 0 H THR A 108 1.240 10.380 -2.127 1.00 0.00 H new ATOM 0 HA THR A 108 3.134 12.602 -2.096 1.00 0.00 H new ATOM 0 HB THR A 108 1.728 13.374 -4.240 1.00 0.00 H new ATOM 0 HG1 THR A 108 1.451 11.513 -5.637 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.585 12.589 -5.662 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.174 13.252 -4.118 1.00 0.00 H new ATOM 0 HG23 THR A 108 4.109 11.490 -4.364 1.00 0.00 H new ATOM 1666 N TYR A 109 1.314 13.889 -1.015 1.00 0.00 N ATOM 1667 CA TYR A 109 0.271 14.668 -0.357 1.00 0.00 C ATOM 1668 C TYR A 109 0.809 16.018 0.106 1.00 0.00 C ATOM 1669 O TYR A 109 1.964 16.359 -0.148 1.00 0.00 O ATOM 1670 CB TYR A 109 -0.296 13.896 0.836 1.00 0.00 C ATOM 1671 CG TYR A 109 0.752 13.490 1.847 1.00 0.00 C ATOM 1672 CD1 TYR A 109 1.416 12.274 1.739 1.00 0.00 C ATOM 1673 CD2 TYR A 109 1.077 14.322 2.912 1.00 0.00 C ATOM 1674 CE1 TYR A 109 2.374 11.899 2.662 1.00 0.00 C ATOM 1675 CE2 TYR A 109 2.034 13.955 3.838 1.00 0.00 C ATOM 1676 CZ TYR A 109 2.679 12.743 3.709 1.00 0.00 C ATOM 1677 OH TYR A 109 3.632 12.374 4.630 1.00 0.00 O ATOM 0 H TYR A 109 2.264 14.139 -0.741 1.00 0.00 H new ATOM 0 HA TYR A 109 -0.526 14.843 -1.080 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -1.048 14.510 1.331 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -0.803 13.003 0.472 1.00 0.00 H new ATOM 0 HD1 TYR A 109 1.179 11.611 0.920 1.00 0.00 H new ATOM 0 HD2 TYR A 109 0.573 15.271 3.017 1.00 0.00 H new ATOM 0 HE1 TYR A 109 2.881 10.950 2.564 1.00 0.00 H new ATOM 0 HE2 TYR A 109 2.276 14.614 4.659 1.00 0.00 H new ATOM 0 HH TYR A 109 3.902 13.157 5.153 1.00 0.00 H new ATOM 1687 N ASP A 110 -0.037 16.782 0.789 1.00 0.00 N ATOM 1688 CA ASP A 110 0.353 18.095 1.290 1.00 0.00 C ATOM 1689 C ASP A 110 0.376 18.109 2.815 1.00 0.00 C ATOM 1690 O ASP A 110 -0.552 17.627 3.465 1.00 0.00 O ATOM 1691 CB ASP A 110 -0.607 19.167 0.772 1.00 0.00 C ATOM 1692 CG ASP A 110 -0.668 20.378 1.683 1.00 0.00 C ATOM 1693 OD1 ASP A 110 0.214 21.255 1.564 1.00 0.00 O ATOM 1694 OD2 ASP A 110 -1.597 20.449 2.513 1.00 0.00 O ATOM 0 H ASP A 110 -0.997 16.515 1.008 1.00 0.00 H new ATOM 0 HA ASP A 110 1.358 18.312 0.927 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -0.294 19.480 -0.224 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -1.605 18.740 0.673 1.00 0.00 H new ATOM 1699 N HIS A 111 1.443 18.664 3.381 1.00 0.00 N ATOM 1700 CA HIS A 111 1.588 18.740 4.830 1.00 0.00 C ATOM 1701 C HIS A 111 2.200 20.074 5.246 1.00 0.00 C ATOM 1702 O HIS A 111 3.079 20.604 4.565 1.00 0.00 O ATOM 1703 CB HIS A 111 2.454 17.587 5.339 1.00 0.00 C ATOM 1704 CG HIS A 111 2.226 17.259 6.783 1.00 0.00 C ATOM 1705 ND1 HIS A 111 3.147 16.584 7.555 1.00 0.00 N ATOM 1706 CD2 HIS A 111 1.174 17.518 7.595 1.00 0.00 C ATOM 1707 CE1 HIS A 111 2.672 16.441 8.779 1.00 0.00 C ATOM 1708 NE2 HIS A 111 1.476 17.000 8.830 1.00 0.00 N ATOM 0 H HIS A 111 2.220 19.068 2.858 1.00 0.00 H new ATOM 0 HA HIS A 111 0.595 18.662 5.274 1.00 0.00 H new ATOM 0 HB2 HIS A 111 2.254 16.700 4.737 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.504 17.841 5.194 1.00 0.00 H new ATOM 0 HD2 HIS A 111 0.266 18.036 7.322 1.00 0.00 H new ATOM 0 HE1 HIS A 111 3.176 15.950 9.599 1.00 0.00 H new ATOM 0 HE2 HIS A 111 0.875 17.040 9.653 1.00 0.00 H new ATOM 1716 N PHE A 112 1.731 20.612 6.367 1.00 0.00 N ATOM 1717 CA PHE A 112 2.231 21.885 6.872 1.00 0.00 C ATOM 1718 C PHE A 112 2.549 22.838 5.724 1.00 0.00 C ATOM 1719 O PHE A 112 3.578 23.515 5.730 1.00 0.00 O ATOM 1720 CB PHE A 112 3.481 21.663 7.726 1.00 0.00 C ATOM 1721 CG PHE A 112 3.211 20.916 9.001 1.00 0.00 C ATOM 1722 CD1 PHE A 112 2.469 21.498 10.016 1.00 0.00 C ATOM 1723 CD2 PHE A 112 3.698 19.632 9.184 1.00 0.00 C ATOM 1724 CE1 PHE A 112 2.220 20.813 11.191 1.00 0.00 C ATOM 1725 CE2 PHE A 112 3.451 18.942 10.356 1.00 0.00 C ATOM 1726 CZ PHE A 112 2.710 19.533 11.360 1.00 0.00 C ATOM 0 H PHE A 112 1.005 20.186 6.943 1.00 0.00 H new ATOM 0 HA PHE A 112 1.453 22.334 7.489 1.00 0.00 H new ATOM 0 HB2 PHE A 112 4.218 21.113 7.141 1.00 0.00 H new ATOM 0 HB3 PHE A 112 3.923 22.630 7.967 1.00 0.00 H new ATOM 0 HD1 PHE A 112 2.081 22.498 9.888 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.278 19.165 8.402 1.00 0.00 H new ATOM 0 HE1 PHE A 112 1.643 21.279 11.976 1.00 0.00 H new ATOM 0 HE2 PHE A 112 3.837 17.942 10.486 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.514 18.995 12.276 1.00 0.00 H new ATOM 1736 N HIS A 113 1.658 22.886 4.738 1.00 0.00 N ATOM 1737 CA HIS A 113 1.843 23.757 3.583 1.00 0.00 C ATOM 1738 C HIS A 113 3.166 23.458 2.883 1.00 0.00 C ATOM 1739 O HIS A 113 3.938 24.368 2.583 1.00 0.00 O ATOM 1740 CB HIS A 113 1.799 25.224 4.010 1.00 0.00 C ATOM 1741 CG HIS A 113 0.516 25.615 4.677 1.00 0.00 C ATOM 1742 ND1 HIS A 113 -0.720 25.446 4.089 1.00 0.00 N ATOM 1743 CD2 HIS A 113 0.281 26.168 5.890 1.00 0.00 C ATOM 1744 CE1 HIS A 113 -1.659 25.880 4.910 1.00 0.00 C ATOM 1745 NE2 HIS A 113 -1.078 26.323 6.011 1.00 0.00 N ATOM 0 H HIS A 113 0.802 22.332 4.716 1.00 0.00 H new ATOM 0 HA HIS A 113 1.030 23.566 2.882 1.00 0.00 H new ATOM 0 HB2 HIS A 113 2.627 25.421 4.690 1.00 0.00 H new ATOM 0 HB3 HIS A 113 1.950 25.854 3.133 1.00 0.00 H new ATOM 0 HD2 HIS A 113 1.024 26.437 6.626 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -2.721 25.874 4.715 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -1.560 26.716 6.819 1.00 0.00 H new ATOM 1753 N GLN A 114 3.420 22.179 2.629 1.00 0.00 N ATOM 1754 CA GLN A 114 4.650 21.761 1.967 1.00 0.00 C ATOM 1755 C GLN A 114 4.415 20.519 1.113 1.00 0.00 C ATOM 1756 O GLN A 114 3.619 19.651 1.471 1.00 0.00 O ATOM 1757 CB GLN A 114 5.742 21.485 3.001 1.00 0.00 C ATOM 1758 CG GLN A 114 6.754 20.442 2.554 1.00 0.00 C ATOM 1759 CD GLN A 114 7.950 20.353 3.481 1.00 0.00 C ATOM 1760 OE1 GLN A 114 8.929 21.082 3.321 1.00 0.00 O ATOM 1761 NE2 GLN A 114 7.876 19.458 4.459 1.00 0.00 N ATOM 0 H GLN A 114 2.791 21.414 2.872 1.00 0.00 H new ATOM 0 HA GLN A 114 4.974 22.571 1.314 1.00 0.00 H new ATOM 0 HB2 GLN A 114 6.265 22.415 3.222 1.00 0.00 H new ATOM 0 HB3 GLN A 114 5.276 21.153 3.929 1.00 0.00 H new ATOM 0 HG2 GLN A 114 6.267 19.468 2.501 1.00 0.00 H new ATOM 0 HG3 GLN A 114 7.097 20.682 1.547 1.00 0.00 H new ATOM 0 HE21 GLN A 114 7.045 18.874 4.554 1.00 0.00 H new ATOM 0 HE22 GLN A 114 8.650 19.354 5.115 1.00 0.00 H new ATOM 1770 N SER A 115 5.112 20.443 -0.016 1.00 0.00 N ATOM 1771 CA SER A 115 4.975 19.308 -0.922 1.00 0.00 C ATOM 1772 C SER A 115 5.767 18.108 -0.413 1.00 0.00 C ATOM 1773 O SER A 115 6.982 18.184 -0.228 1.00 0.00 O ATOM 1774 CB SER A 115 5.451 19.690 -2.325 1.00 0.00 C ATOM 1775 OG SER A 115 6.843 19.954 -2.338 1.00 0.00 O ATOM 0 H SER A 115 5.776 21.153 -0.325 1.00 0.00 H new ATOM 0 HA SER A 115 3.921 19.033 -0.965 1.00 0.00 H new ATOM 0 HB2 SER A 115 5.224 18.883 -3.021 1.00 0.00 H new ATOM 0 HB3 SER A 115 4.908 20.570 -2.670 1.00 0.00 H new ATOM 0 HG SER A 115 7.265 19.524 -1.565 1.00 0.00 H new ATOM 1781 N VAL A 116 5.070 16.999 -0.189 1.00 0.00 N ATOM 1782 CA VAL A 116 5.706 15.781 0.298 1.00 0.00 C ATOM 1783 C VAL A 116 5.641 14.672 -0.746 1.00 0.00 C ATOM 1784 O VAL A 116 4.562 14.179 -1.075 1.00 0.00 O ATOM 1785 CB VAL A 116 5.048 15.285 1.599 1.00 0.00 C ATOM 1786 CG1 VAL A 116 5.666 13.967 2.042 1.00 0.00 C ATOM 1787 CG2 VAL A 116 5.173 16.335 2.692 1.00 0.00 C ATOM 0 H VAL A 116 4.064 16.919 -0.337 1.00 0.00 H new ATOM 0 HA VAL A 116 6.749 16.027 0.498 1.00 0.00 H new ATOM 0 HB VAL A 116 3.988 15.116 1.408 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.188 13.632 2.963 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.520 13.217 1.264 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.733 14.106 2.217 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.703 15.968 3.604 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.227 16.538 2.883 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.679 17.253 2.373 1.00 0.00 H new ATOM 1797 N GLN A 117 6.802 14.285 -1.264 1.00 0.00 N ATOM 1798 CA GLN A 117 6.876 13.233 -2.271 1.00 0.00 C ATOM 1799 C GLN A 117 7.888 12.165 -1.870 1.00 0.00 C ATOM 1800 O GLN A 117 9.097 12.371 -1.977 1.00 0.00 O ATOM 1801 CB GLN A 117 7.254 13.826 -3.630 1.00 0.00 C ATOM 1802 CG GLN A 117 7.309 12.797 -4.748 1.00 0.00 C ATOM 1803 CD GLN A 117 8.078 13.291 -5.958 1.00 0.00 C ATOM 1804 OE1 GLN A 117 7.552 14.044 -6.778 1.00 0.00 O ATOM 1805 NE2 GLN A 117 9.331 12.867 -6.076 1.00 0.00 N ATOM 0 H GLN A 117 7.704 14.684 -1.003 1.00 0.00 H new ATOM 0 HA GLN A 117 5.894 12.766 -2.346 1.00 0.00 H new ATOM 0 HB2 GLN A 117 6.532 14.599 -3.894 1.00 0.00 H new ATOM 0 HB3 GLN A 117 8.226 14.313 -3.547 1.00 0.00 H new ATOM 0 HG2 GLN A 117 7.774 11.885 -4.374 1.00 0.00 H new ATOM 0 HG3 GLN A 117 6.294 12.538 -5.048 1.00 0.00 H new ATOM 0 HE21 GLN A 117 9.727 12.243 -5.373 1.00 0.00 H new ATOM 0 HE22 GLN A 117 9.898 13.165 -6.870 1.00 0.00 H new ATOM 1814 N GLU A 118 7.386 11.025 -1.408 1.00 0.00 N ATOM 1815 CA GLU A 118 8.247 9.925 -0.989 1.00 0.00 C ATOM 1816 C GLU A 118 7.965 8.670 -1.811 1.00 0.00 C ATOM 1817 O GLU A 118 6.827 8.206 -1.883 1.00 0.00 O ATOM 1818 CB GLU A 118 8.048 9.629 0.499 1.00 0.00 C ATOM 1819 CG GLU A 118 8.650 10.682 1.414 1.00 0.00 C ATOM 1820 CD GLU A 118 10.149 10.823 1.235 1.00 0.00 C ATOM 1821 OE1 GLU A 118 10.871 9.830 1.462 1.00 0.00 O ATOM 1822 OE2 GLU A 118 10.600 11.928 0.866 1.00 0.00 O ATOM 0 H GLU A 118 6.388 10.839 -1.314 1.00 0.00 H new ATOM 0 HA GLU A 118 9.282 10.224 -1.157 1.00 0.00 H new ATOM 0 HB2 GLU A 118 6.981 9.548 0.705 1.00 0.00 H new ATOM 0 HB3 GLU A 118 8.492 8.661 0.731 1.00 0.00 H new ATOM 0 HG2 GLU A 118 8.173 11.643 1.219 1.00 0.00 H new ATOM 0 HG3 GLU A 118 8.435 10.423 2.451 1.00 0.00 H new ATOM 1829 N ILE A 119 9.010 8.127 -2.428 1.00 0.00 N ATOM 1830 CA ILE A 119 8.875 6.927 -3.243 1.00 0.00 C ATOM 1831 C ILE A 119 9.816 5.828 -2.763 1.00 0.00 C ATOM 1832 O ILE A 119 11.034 5.925 -2.921 1.00 0.00 O ATOM 1833 CB ILE A 119 9.161 7.220 -4.728 1.00 0.00 C ATOM 1834 CG1 ILE A 119 8.206 8.295 -5.251 1.00 0.00 C ATOM 1835 CG2 ILE A 119 9.036 5.947 -5.553 1.00 0.00 C ATOM 1836 CD1 ILE A 119 8.739 9.043 -6.453 1.00 0.00 C ATOM 0 H ILE A 119 9.958 8.499 -2.379 1.00 0.00 H new ATOM 0 HA ILE A 119 7.844 6.590 -3.140 1.00 0.00 H new ATOM 0 HB ILE A 119 10.182 7.591 -4.820 1.00 0.00 H new ATOM 0 HG12 ILE A 119 7.257 7.829 -5.515 1.00 0.00 H new ATOM 0 HG13 ILE A 119 8.000 9.007 -4.452 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.241 6.170 -6.600 1.00 0.00 H new ATOM 0 HG22 ILE A 119 9.752 5.208 -5.193 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.026 5.550 -5.458 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.010 9.789 -6.770 1.00 0.00 H new ATOM 0 HD12 ILE A 119 9.673 9.538 -6.189 1.00 0.00 H new ATOM 0 HD13 ILE A 119 8.918 8.342 -7.268 1.00 0.00 H new ATOM 1848 N PHE A 120 9.245 4.781 -2.178 1.00 0.00 N ATOM 1849 CA PHE A 120 10.033 3.661 -1.675 1.00 0.00 C ATOM 1850 C PHE A 120 9.398 2.330 -2.067 1.00 0.00 C ATOM 1851 O PHE A 120 8.189 2.246 -2.280 1.00 0.00 O ATOM 1852 CB PHE A 120 10.167 3.747 -0.153 1.00 0.00 C ATOM 1853 CG PHE A 120 8.851 3.884 0.558 1.00 0.00 C ATOM 1854 CD1 PHE A 120 8.044 2.778 0.769 1.00 0.00 C ATOM 1855 CD2 PHE A 120 8.420 5.120 1.014 1.00 0.00 C ATOM 1856 CE1 PHE A 120 6.832 2.901 1.423 1.00 0.00 C ATOM 1857 CE2 PHE A 120 7.210 5.249 1.669 1.00 0.00 C ATOM 1858 CZ PHE A 120 6.415 4.138 1.873 1.00 0.00 C ATOM 0 H PHE A 120 8.239 4.684 -2.040 1.00 0.00 H new ATOM 0 HA PHE A 120 11.025 3.716 -2.124 1.00 0.00 H new ATOM 0 HB2 PHE A 120 10.676 2.854 0.210 1.00 0.00 H new ATOM 0 HB3 PHE A 120 10.798 4.599 0.101 1.00 0.00 H new ATOM 0 HD1 PHE A 120 8.365 1.808 0.419 1.00 0.00 H new ATOM 0 HD2 PHE A 120 9.037 5.992 0.856 1.00 0.00 H new ATOM 0 HE1 PHE A 120 6.212 2.031 1.582 1.00 0.00 H new ATOM 0 HE2 PHE A 120 6.886 6.217 2.021 1.00 0.00 H new ATOM 0 HZ PHE A 120 5.469 4.237 2.384 1.00 0.00 H new ATOM 1868 N GLU A 121 10.224 1.292 -2.160 1.00 0.00 N ATOM 1869 CA GLU A 121 9.744 -0.035 -2.527 1.00 0.00 C ATOM 1870 C GLU A 121 9.983 -1.032 -1.397 1.00 0.00 C ATOM 1871 O GLU A 121 11.107 -1.189 -0.920 1.00 0.00 O ATOM 1872 CB GLU A 121 10.437 -0.517 -3.803 1.00 0.00 C ATOM 1873 CG GLU A 121 10.441 0.513 -4.920 1.00 0.00 C ATOM 1874 CD GLU A 121 11.279 1.732 -4.586 1.00 0.00 C ATOM 1875 OE1 GLU A 121 12.484 1.566 -4.304 1.00 0.00 O ATOM 1876 OE2 GLU A 121 10.729 2.853 -4.608 1.00 0.00 O ATOM 0 H GLU A 121 11.228 1.345 -1.986 1.00 0.00 H new ATOM 0 HA GLU A 121 8.671 0.032 -2.708 1.00 0.00 H new ATOM 0 HB2 GLU A 121 11.466 -0.789 -3.567 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.941 -1.421 -4.156 1.00 0.00 H new ATOM 0 HG2 GLU A 121 10.822 0.053 -5.832 1.00 0.00 H new ATOM 0 HG3 GLU A 121 9.417 0.826 -5.125 1.00 0.00 H new ATOM 1883 N VAL A 122 8.916 -1.703 -0.973 1.00 0.00 N ATOM 1884 CA VAL A 122 9.009 -2.686 0.100 1.00 0.00 C ATOM 1885 C VAL A 122 10.037 -3.763 -0.228 1.00 0.00 C ATOM 1886 O VAL A 122 9.789 -4.641 -1.054 1.00 0.00 O ATOM 1887 CB VAL A 122 7.648 -3.355 0.367 1.00 0.00 C ATOM 1888 CG1 VAL A 122 7.737 -4.288 1.565 1.00 0.00 C ATOM 1889 CG2 VAL A 122 6.570 -2.303 0.580 1.00 0.00 C ATOM 0 H VAL A 122 7.978 -1.584 -1.356 1.00 0.00 H new ATOM 0 HA VAL A 122 9.324 -2.149 0.995 1.00 0.00 H new ATOM 0 HB VAL A 122 7.377 -3.949 -0.506 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.766 -4.751 1.738 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.479 -5.062 1.369 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.030 -3.720 2.448 1.00 0.00 H new ATOM 0 HG21 VAL A 122 5.615 -2.794 0.767 1.00 0.00 H new ATOM 0 HG22 VAL A 122 6.833 -1.681 1.436 1.00 0.00 H new ATOM 0 HG23 VAL A 122 6.489 -1.679 -0.310 1.00 0.00 H new ATOM 1899 N ASN A 123 11.192 -3.690 0.426 1.00 0.00 N ATOM 1900 CA ASN A 123 12.259 -4.659 0.203 1.00 0.00 C ATOM 1901 C ASN A 123 12.256 -5.730 1.290 1.00 0.00 C ATOM 1902 O ASN A 123 13.094 -6.630 1.291 1.00 0.00 O ATOM 1903 CB ASN A 123 13.617 -3.955 0.169 1.00 0.00 C ATOM 1904 CG ASN A 123 13.546 -2.594 -0.497 1.00 0.00 C ATOM 1905 OD1 ASN A 123 13.235 -1.591 0.146 1.00 0.00 O ATOM 1906 ND2 ASN A 123 13.835 -2.555 -1.793 1.00 0.00 N ATOM 0 H ASN A 123 11.413 -2.970 1.114 1.00 0.00 H new ATOM 0 HA ASN A 123 12.083 -5.141 -0.759 1.00 0.00 H new ATOM 0 HB2 ASN A 123 13.989 -3.839 1.187 1.00 0.00 H new ATOM 0 HB3 ASN A 123 14.334 -4.580 -0.363 1.00 0.00 H new ATOM 0 HD21 ASN A 123 13.804 -1.668 -2.296 1.00 0.00 H new ATOM 0 HD22 ASN A 123 14.088 -3.412 -2.285 1.00 0.00 H new ATOM 1913 N ASN A 124 11.306 -5.625 2.214 1.00 0.00 N ATOM 1914 CA ASN A 124 11.193 -6.585 3.306 1.00 0.00 C ATOM 1915 C ASN A 124 9.888 -7.369 3.209 1.00 0.00 C ATOM 1916 O ASN A 124 9.237 -7.640 4.219 1.00 0.00 O ATOM 1917 CB ASN A 124 11.269 -5.865 4.654 1.00 0.00 C ATOM 1918 CG ASN A 124 12.168 -4.645 4.608 1.00 0.00 C ATOM 1919 OD1 ASN A 124 13.220 -4.659 3.969 1.00 0.00 O ATOM 1920 ND2 ASN A 124 11.757 -3.581 5.289 1.00 0.00 N ATOM 0 H ASN A 124 10.604 -4.885 2.228 1.00 0.00 H new ATOM 0 HA ASN A 124 12.024 -7.286 3.228 1.00 0.00 H new ATOM 0 HB2 ASN A 124 10.267 -5.563 4.959 1.00 0.00 H new ATOM 0 HB3 ASN A 124 11.638 -6.556 5.412 1.00 0.00 H new ATOM 0 HD21 ASN A 124 12.321 -2.731 5.296 1.00 0.00 H new ATOM 0 HD22 ASN A 124 10.878 -3.614 5.805 1.00 0.00 H new ATOM 1927 N LEU A 125 9.511 -7.731 1.988 1.00 0.00 N ATOM 1928 CA LEU A 125 8.284 -8.485 1.757 1.00 0.00 C ATOM 1929 C LEU A 125 8.397 -9.896 2.327 1.00 0.00 C ATOM 1930 O LEU A 125 9.448 -10.534 2.266 1.00 0.00 O ATOM 1931 CB LEU A 125 7.976 -8.550 0.260 1.00 0.00 C ATOM 1932 CG LEU A 125 7.521 -7.243 -0.389 1.00 0.00 C ATOM 1933 CD1 LEU A 125 7.780 -7.272 -1.887 1.00 0.00 C ATOM 1934 CD2 LEU A 125 6.048 -6.990 -0.105 1.00 0.00 C ATOM 0 H LEU A 125 10.038 -7.514 1.142 1.00 0.00 H new ATOM 0 HA LEU A 125 7.469 -7.971 2.267 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.869 -8.899 -0.259 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.201 -9.300 0.101 1.00 0.00 H new ATOM 0 HG LEU A 125 8.099 -6.426 0.043 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.450 -6.333 -2.332 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.846 -7.404 -2.069 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.230 -8.099 -2.335 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.742 -6.055 -0.575 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.454 -7.810 -0.508 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.891 -6.923 0.972 1.00 0.00 H new ATOM 1946 N PRO A 126 7.289 -10.397 2.892 1.00 0.00 N ATOM 1947 CA PRO A 126 7.237 -11.738 3.481 1.00 0.00 C ATOM 1948 C PRO A 126 7.314 -12.837 2.426 1.00 0.00 C ATOM 1949 O PRO A 126 6.778 -12.696 1.327 1.00 0.00 O ATOM 1950 CB PRO A 126 5.877 -11.765 4.183 1.00 0.00 C ATOM 1951 CG PRO A 126 5.050 -10.769 3.446 1.00 0.00 C ATOM 1952 CD PRO A 126 6.000 -9.692 2.999 1.00 0.00 C ATOM 0 HA PRO A 126 8.079 -11.924 4.147 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.430 -12.758 4.142 1.00 0.00 H new ATOM 0 HB3 PRO A 126 5.970 -11.500 5.236 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.553 -11.230 2.592 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.269 -10.359 4.087 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.698 -9.260 2.045 1.00 0.00 H new ATOM 0 HD3 PRO A 126 6.048 -8.874 3.718 1.00 0.00 H new ATOM 1960 N VAL A 127 7.984 -13.933 2.768 1.00 0.00 N ATOM 1961 CA VAL A 127 8.129 -15.058 1.852 1.00 0.00 C ATOM 1962 C VAL A 127 6.806 -15.792 1.668 1.00 0.00 C ATOM 1963 O VAL A 127 6.435 -16.152 0.551 1.00 0.00 O ATOM 1964 CB VAL A 127 9.192 -16.055 2.351 1.00 0.00 C ATOM 1965 CG1 VAL A 127 10.575 -15.423 2.314 1.00 0.00 C ATOM 1966 CG2 VAL A 127 8.853 -16.536 3.753 1.00 0.00 C ATOM 0 H VAL A 127 8.435 -14.066 3.673 1.00 0.00 H new ATOM 0 HA VAL A 127 8.448 -14.647 0.894 1.00 0.00 H new ATOM 0 HB VAL A 127 9.196 -16.919 1.687 1.00 0.00 H new ATOM 0 HG11 VAL A 127 11.313 -16.142 2.670 1.00 0.00 H new ATOM 0 HG12 VAL A 127 10.815 -15.133 1.291 1.00 0.00 H new ATOM 0 HG13 VAL A 127 10.589 -14.541 2.954 1.00 0.00 H new ATOM 0 HG21 VAL A 127 9.614 -17.240 4.090 1.00 0.00 H new ATOM 0 HG22 VAL A 127 8.820 -15.684 4.432 1.00 0.00 H new ATOM 0 HG23 VAL A 127 7.881 -17.030 3.743 1.00 0.00 H new ATOM 1976 N GLU A 128 6.098 -16.010 2.772 1.00 0.00 N ATOM 1977 CA GLU A 128 4.815 -16.702 2.732 1.00 0.00 C ATOM 1978 C GLU A 128 4.017 -16.297 1.496 1.00 0.00 C ATOM 1979 O GLU A 128 3.322 -17.117 0.897 1.00 0.00 O ATOM 1980 CB GLU A 128 4.008 -16.401 3.996 1.00 0.00 C ATOM 1981 CG GLU A 128 4.676 -16.880 5.274 1.00 0.00 C ATOM 1982 CD GLU A 128 5.052 -18.348 5.221 1.00 0.00 C ATOM 1983 OE1 GLU A 128 6.047 -18.681 4.543 1.00 0.00 O ATOM 1984 OE2 GLU A 128 4.351 -19.163 5.856 1.00 0.00 O ATOM 0 H GLU A 128 6.391 -15.718 3.704 1.00 0.00 H new ATOM 0 HA GLU A 128 5.010 -17.773 2.682 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.843 -15.326 4.064 1.00 0.00 H new ATOM 0 HB3 GLU A 128 3.028 -16.870 3.911 1.00 0.00 H new ATOM 0 HG2 GLU A 128 5.571 -16.286 5.456 1.00 0.00 H new ATOM 0 HG3 GLU A 128 4.005 -16.711 6.116 1.00 0.00 H new ATOM 1991 N SER A 129 4.122 -15.026 1.122 1.00 0.00 N ATOM 1992 CA SER A 129 3.407 -14.510 -0.039 1.00 0.00 C ATOM 1993 C SER A 129 3.552 -15.452 -1.230 1.00 0.00 C ATOM 1994 O SER A 129 2.574 -15.775 -1.903 1.00 0.00 O ATOM 1995 CB SER A 129 3.926 -13.119 -0.408 1.00 0.00 C ATOM 1996 OG SER A 129 5.269 -13.179 -0.857 1.00 0.00 O ATOM 0 H SER A 129 4.695 -14.335 1.606 1.00 0.00 H new ATOM 0 HA SER A 129 2.350 -14.439 0.219 1.00 0.00 H new ATOM 0 HB2 SER A 129 3.298 -12.688 -1.187 1.00 0.00 H new ATOM 0 HB3 SER A 129 3.858 -12.460 0.458 1.00 0.00 H new ATOM 0 HG SER A 129 5.859 -12.796 -0.175 1.00 0.00 H new ATOM 2002 N TRP A 130 4.781 -15.888 -1.484 1.00 0.00 N ATOM 2003 CA TRP A 130 5.056 -16.793 -2.594 1.00 0.00 C ATOM 2004 C TRP A 130 5.183 -18.231 -2.105 1.00 0.00 C ATOM 2005 O TRP A 130 4.599 -19.146 -2.686 1.00 0.00 O ATOM 2006 CB TRP A 130 6.337 -16.372 -3.317 1.00 0.00 C ATOM 2007 CG TRP A 130 7.560 -16.454 -2.454 1.00 0.00 C ATOM 2008 CD1 TRP A 130 8.138 -15.434 -1.753 1.00 0.00 C ATOM 2009 CD2 TRP A 130 8.355 -17.618 -2.202 1.00 0.00 C ATOM 2010 NE1 TRP A 130 9.245 -15.894 -1.081 1.00 0.00 N ATOM 2011 CE2 TRP A 130 9.399 -17.230 -1.339 1.00 0.00 C ATOM 2012 CE3 TRP A 130 8.285 -18.949 -2.619 1.00 0.00 C ATOM 2013 CZ2 TRP A 130 10.364 -18.127 -0.889 1.00 0.00 C ATOM 2014 CZ3 TRP A 130 9.244 -19.839 -2.172 1.00 0.00 C ATOM 2015 CH2 TRP A 130 10.271 -19.425 -1.314 1.00 0.00 C ATOM 0 H TRP A 130 5.602 -15.630 -0.937 1.00 0.00 H new ATOM 0 HA TRP A 130 4.219 -16.738 -3.291 1.00 0.00 H new ATOM 0 HB2 TRP A 130 6.476 -17.005 -4.193 1.00 0.00 H new ATOM 0 HB3 TRP A 130 6.223 -15.350 -3.677 1.00 0.00 H new ATOM 0 HD1 TRP A 130 7.778 -14.416 -1.730 1.00 0.00 H new ATOM 0 HE1 TRP A 130 9.853 -15.331 -0.486 1.00 0.00 H new ATOM 0 HE3 TRP A 130 7.496 -19.277 -3.279 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 11.157 -17.810 -0.228 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 9.201 -20.870 -2.490 1.00 0.00 H new ATOM 0 HH2 TRP A 130 11.004 -20.144 -0.981 1.00 0.00 H new ATOM 2026 N GLN A 131 5.947 -18.423 -1.035 1.00 0.00 N ATOM 2027 CA GLN A 131 6.149 -19.752 -0.469 1.00 0.00 C ATOM 2028 C GLN A 131 4.815 -20.451 -0.231 1.00 0.00 C ATOM 2029 O GLN A 131 4.718 -21.362 0.591 1.00 0.00 O ATOM 2030 CB GLN A 131 6.930 -19.657 0.843 1.00 0.00 C ATOM 2031 CG GLN A 131 7.651 -20.942 1.216 1.00 0.00 C ATOM 2032 CD GLN A 131 8.802 -20.709 2.175 1.00 0.00 C ATOM 2033 OE1 GLN A 131 8.609 -20.642 3.389 1.00 0.00 O ATOM 2034 NE2 GLN A 131 10.008 -20.584 1.634 1.00 0.00 N ATOM 0 H GLN A 131 6.436 -17.676 -0.542 1.00 0.00 H new ATOM 0 HA GLN A 131 6.724 -20.340 -1.184 1.00 0.00 H new ATOM 0 HB2 GLN A 131 7.659 -18.851 0.765 1.00 0.00 H new ATOM 0 HB3 GLN A 131 6.244 -19.389 1.646 1.00 0.00 H new ATOM 0 HG2 GLN A 131 6.941 -21.634 1.668 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.028 -21.418 0.311 1.00 0.00 H new ATOM 0 HE21 GLN A 131 10.122 -20.646 0.622 1.00 0.00 H new ATOM 0 HE22 GLN A 131 10.820 -20.426 2.230 1.00 0.00 H new TER 2043 GLN A 131