USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1069 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 51 SER OG : rot -165:sc= 0.658 USER MOD Set 1.2: A 126 HIS : no HD1:sc= -0.259 K(o=0.4,f=-0.12) USER MOD Set 2.1: A 44 THR OG1 : rot -159:sc= 0.728 USER MOD Set 2.2: A 63 LYS NZ :NH3+ 149:sc= 0.807 (180deg=0) USER MOD Set 3.1: A 37 LYS NZ :NH3+ 171:sc= 0.9 (180deg=0) USER MOD Set 3.2: A 40 GLN : amide:sc= 0.79 K(o=1.7,f=-1.5) USER MOD Set 4.1: A 27 SER OG : rot 180:sc= 0.303 USER MOD Set 4.2: A 28 ASN : amide:sc= 0.317 X(o=0.62,f=0.77) USER MOD Set 5.1: A 9 SER OG : rot 180:sc= 1.02 USER MOD Set 5.2: A 52 LYS NZ :NH3+ -143:sc= 1.21 (180deg=0) USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A -3 SER OG : rot 180:sc= 0 USER MOD Single : A -4 GLY N :NH3+ 140:sc= 0.0237 (180deg=0) USER MOD Single : A 12 CYS SG : rot 153:sc= -0.85 USER MOD Single : A 14 LYS NZ :NH3+ 175:sc= 2.46 (180deg=2.4) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot -140:sc= -0.411 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 177:sc= 1.26 (180deg=1.18) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0.403 K(o=0.4,f=-1.5) USER MOD Single : A 76 GLN : amide:sc= -0.09 X(o=-0.09,f=-0.071) USER MOD Single : A 77 TYR OH : rot 30:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0.602 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= -1.81! C(o=-1.8!,f=-3.1!) USER MOD Single : A 100 THR OG1 : rot -43:sc= 0.115 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -0.222 K(o=-0.22,f=-1.4) USER MOD Single : A 122 SER OG : rot -119:sc= 1.21 USER MOD Single : A 124 GLN : amide:sc= 0.842 K(o=0.84,f=0) USER MOD Single : A 128 LYS NZ :NH3+ -177:sc= 1.23 (180deg=1.14) USER MOD Single : A 131 LYS NZ :NH3+ 179:sc= 1.09 (180deg=1.09) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 -19.436 24.878 11.217 1.00 0.00 N ATOM 2 CA GLY A -4 -18.569 25.793 11.992 1.00 0.00 C ATOM 3 C GLY A -4 -17.824 26.759 11.083 1.00 0.00 C ATOM 4 O GLY A -4 -17.434 26.396 9.972 1.00 0.00 O ATOM 0 H1 GLY A -4 -19.386 23.923 11.626 1.00 0.00 H new ATOM 0 H2 GLY A -4 -20.418 25.218 11.251 1.00 0.00 H new ATOM 0 H3 GLY A -4 -19.114 24.849 10.228 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -19.175 26.355 12.703 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -17.852 25.212 12.573 1.00 0.00 H new ATOM 10 N SER A -3 -17.621 27.998 11.539 1.00 0.00 N ATOM 11 CA SER A -3 -16.956 29.067 10.769 1.00 0.00 C ATOM 12 C SER A -3 -15.448 28.811 10.565 1.00 0.00 C ATOM 13 O SER A -3 -14.800 28.277 11.473 1.00 0.00 O ATOM 14 CB SER A -3 -17.146 30.419 11.470 1.00 0.00 C ATOM 15 OG SER A -3 -18.529 30.700 11.642 1.00 0.00 O ATOM 0 H SER A -3 -17.917 28.297 12.468 1.00 0.00 H new ATOM 0 HA SER A -3 -17.424 29.078 9.785 1.00 0.00 H new ATOM 0 HB2 SER A -3 -16.648 30.406 12.440 1.00 0.00 H new ATOM 0 HB3 SER A -3 -16.679 31.209 10.882 1.00 0.00 H new ATOM 0 HG SER A -3 -18.634 31.564 12.092 1.00 0.00 H new ATOM 21 N PRO A -2 -14.836 29.245 9.440 1.00 0.00 N ATOM 22 CA PRO A -2 -13.396 29.078 9.190 1.00 0.00 C ATOM 23 C PRO A -2 -12.485 29.719 10.252 1.00 0.00 C ATOM 24 O PRO A -2 -11.389 29.222 10.511 1.00 0.00 O ATOM 25 CB PRO A -2 -13.144 29.702 7.811 1.00 0.00 C ATOM 26 CG PRO A -2 -14.491 29.564 7.109 1.00 0.00 C ATOM 27 CD PRO A -2 -15.484 29.782 8.249 1.00 0.00 C ATOM 0 HA PRO A -2 -13.144 28.018 9.234 1.00 0.00 H new ATOM 0 HB2 PRO A -2 -12.838 30.745 7.892 1.00 0.00 H new ATOM 0 HB3 PRO A -2 -12.354 29.179 7.272 1.00 0.00 H new ATOM 0 HG2 PRO A -2 -14.613 30.304 6.318 1.00 0.00 H new ATOM 0 HG3 PRO A -2 -14.610 28.583 6.650 1.00 0.00 H new ATOM 0 HD2 PRO A -2 -15.714 30.840 8.371 1.00 0.00 H new ATOM 0 HD3 PRO A -2 -16.426 29.271 8.051 1.00 0.00 H new ATOM 35 N ASN A -1 -12.954 30.785 10.913 1.00 0.00 N ATOM 36 CA ASN A -1 -12.230 31.488 11.982 1.00 0.00 C ATOM 37 C ASN A -1 -11.990 30.626 13.242 1.00 0.00 C ATOM 38 O ASN A -1 -11.120 30.954 14.053 1.00 0.00 O ATOM 39 CB ASN A -1 -13.001 32.775 12.333 1.00 0.00 C ATOM 40 CG ASN A -1 -13.088 33.747 11.166 1.00 0.00 C ATOM 41 OD1 ASN A -1 -12.089 34.197 10.622 1.00 0.00 O ATOM 42 ND2 ASN A -1 -14.280 34.089 10.726 1.00 0.00 N ATOM 0 H ASN A -1 -13.868 31.193 10.716 1.00 0.00 H new ATOM 0 HA ASN A -1 -11.235 31.726 11.607 1.00 0.00 H new ATOM 0 HB2 ASN A -1 -14.008 32.513 12.657 1.00 0.00 H new ATOM 0 HB3 ASN A -1 -12.513 33.267 13.174 1.00 0.00 H new ATOM 0 HD21 ASN A -1 -14.368 34.727 9.935 1.00 0.00 H new ATOM 0 HD22 ASN A -1 -15.116 33.716 11.176 1.00 0.00 H new ATOM 49 N SER A 0 -12.719 29.514 13.403 1.00 0.00 N ATOM 50 CA SER A 0 -12.534 28.543 14.496 1.00 0.00 C ATOM 51 C SER A 0 -11.374 27.558 14.261 1.00 0.00 C ATOM 52 O SER A 0 -11.036 26.789 15.164 1.00 0.00 O ATOM 53 CB SER A 0 -13.835 27.762 14.733 1.00 0.00 C ATOM 54 OG SER A 0 -14.909 28.646 15.028 1.00 0.00 O ATOM 0 H SER A 0 -13.471 29.256 12.764 1.00 0.00 H new ATOM 0 HA SER A 0 -12.272 29.127 15.379 1.00 0.00 H new ATOM 0 HB2 SER A 0 -14.076 27.172 13.849 1.00 0.00 H new ATOM 0 HB3 SER A 0 -13.699 27.061 15.556 1.00 0.00 H new ATOM 0 HG SER A 0 -15.728 28.128 15.174 1.00 0.00 H new ATOM 60 N MET A 1 -10.758 27.566 13.070 1.00 0.00 N ATOM 61 CA MET A 1 -9.677 26.658 12.661 1.00 0.00 C ATOM 62 C MET A 1 -8.329 27.386 12.500 1.00 0.00 C ATOM 63 O MET A 1 -8.277 28.581 12.196 1.00 0.00 O ATOM 64 CB MET A 1 -10.063 25.930 11.360 1.00 0.00 C ATOM 65 CG MET A 1 -11.340 25.088 11.478 1.00 0.00 C ATOM 66 SD MET A 1 -11.262 23.741 12.693 1.00 0.00 S ATOM 67 CE MET A 1 -12.919 23.040 12.470 1.00 0.00 C ATOM 0 H MET A 1 -11.009 28.230 12.338 1.00 0.00 H new ATOM 0 HA MET A 1 -9.545 25.925 13.457 1.00 0.00 H new ATOM 0 HB2 MET A 1 -10.197 26.667 10.568 1.00 0.00 H new ATOM 0 HB3 MET A 1 -9.239 25.283 11.058 1.00 0.00 H new ATOM 0 HG2 MET A 1 -12.168 25.746 11.741 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.568 24.663 10.501 1.00 0.00 H new ATOM 0 HE1 MET A 1 -13.049 22.193 13.144 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.668 23.800 12.693 1.00 0.00 H new ATOM 0 HE3 MET A 1 -13.037 22.705 11.439 1.00 0.00 H new ATOM 77 N ALA A 2 -7.233 26.645 12.690 1.00 0.00 N ATOM 78 CA ALA A 2 -5.849 27.111 12.495 1.00 0.00 C ATOM 79 C ALA A 2 -4.897 25.955 12.115 1.00 0.00 C ATOM 80 O ALA A 2 -4.116 26.072 11.167 1.00 0.00 O ATOM 81 CB ALA A 2 -5.380 27.807 13.782 1.00 0.00 C ATOM 0 H ALA A 2 -7.282 25.672 12.994 1.00 0.00 H new ATOM 0 HA ALA A 2 -5.828 27.814 11.662 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -4.356 28.158 13.653 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -6.030 28.655 13.995 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -5.420 27.102 14.612 1.00 0.00 H new ATOM 87 N THR A 3 -5.008 24.823 12.822 1.00 0.00 N ATOM 88 CA THR A 3 -4.396 23.527 12.481 1.00 0.00 C ATOM 89 C THR A 3 -5.430 22.436 12.759 1.00 0.00 C ATOM 90 O THR A 3 -5.846 22.245 13.902 1.00 0.00 O ATOM 91 CB THR A 3 -3.107 23.269 13.286 1.00 0.00 C ATOM 92 OG1 THR A 3 -2.195 24.345 13.165 1.00 0.00 O ATOM 93 CG2 THR A 3 -2.377 22.009 12.814 1.00 0.00 C ATOM 0 H THR A 3 -5.550 24.781 13.685 1.00 0.00 H new ATOM 0 HA THR A 3 -4.109 23.529 11.430 1.00 0.00 H new ATOM 0 HB THR A 3 -3.429 23.151 14.321 1.00 0.00 H new ATOM 0 HG1 THR A 3 -1.389 24.151 13.688 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.475 21.867 13.409 1.00 0.00 H new ATOM 0 HG22 THR A 3 -3.030 21.144 12.932 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.105 22.118 11.764 1.00 0.00 H new ATOM 101 N GLU A 4 -5.906 21.770 11.706 1.00 0.00 N ATOM 102 CA GLU A 4 -7.184 21.038 11.706 1.00 0.00 C ATOM 103 C GLU A 4 -7.137 19.660 11.017 1.00 0.00 C ATOM 104 O GLU A 4 -8.178 19.084 10.687 1.00 0.00 O ATOM 105 CB GLU A 4 -8.303 21.954 11.162 1.00 0.00 C ATOM 106 CG GLU A 4 -8.221 22.320 9.668 1.00 0.00 C ATOM 107 CD GLU A 4 -7.033 23.244 9.330 1.00 0.00 C ATOM 108 OE1 GLU A 4 -7.193 24.487 9.367 1.00 0.00 O ATOM 109 OE2 GLU A 4 -5.927 22.726 9.036 1.00 0.00 O ATOM 0 H GLU A 4 -5.412 21.720 10.815 1.00 0.00 H new ATOM 0 HA GLU A 4 -7.410 20.784 12.742 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -9.261 21.467 11.343 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -8.300 22.878 11.741 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.139 21.405 9.081 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.149 22.808 9.369 1.00 0.00 H new ATOM 116 N LEU A 5 -5.937 19.101 10.824 1.00 0.00 N ATOM 117 CA LEU A 5 -5.699 17.788 10.210 1.00 0.00 C ATOM 118 C LEU A 5 -5.978 16.622 11.188 1.00 0.00 C ATOM 119 O LEU A 5 -5.116 15.801 11.502 1.00 0.00 O ATOM 120 CB LEU A 5 -4.301 17.768 9.552 1.00 0.00 C ATOM 121 CG LEU A 5 -4.277 16.997 8.219 1.00 0.00 C ATOM 122 CD1 LEU A 5 -2.860 17.004 7.647 1.00 0.00 C ATOM 123 CD2 LEU A 5 -4.749 15.541 8.309 1.00 0.00 C ATOM 0 H LEU A 5 -5.073 19.567 11.101 1.00 0.00 H new ATOM 0 HA LEU A 5 -6.420 17.625 9.409 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -3.972 18.793 9.379 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -3.587 17.316 10.241 1.00 0.00 H new ATOM 0 HG LEU A 5 -4.985 17.518 7.574 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -2.846 16.458 6.704 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -2.542 18.032 7.476 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -2.180 16.527 8.353 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -4.697 15.080 7.323 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -4.108 14.993 9.000 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -5.778 15.514 8.669 1.00 0.00 H new ATOM 135 N GLU A 6 -7.210 16.570 11.690 1.00 0.00 N ATOM 136 CA GLU A 6 -7.755 15.520 12.559 1.00 0.00 C ATOM 137 C GLU A 6 -9.004 14.915 11.887 1.00 0.00 C ATOM 138 O GLU A 6 -10.136 15.053 12.358 1.00 0.00 O ATOM 139 CB GLU A 6 -7.991 16.094 13.970 1.00 0.00 C ATOM 140 CG GLU A 6 -8.244 15.000 15.015 1.00 0.00 C ATOM 141 CD GLU A 6 -8.429 15.608 16.419 1.00 0.00 C ATOM 142 OE1 GLU A 6 -9.582 15.920 16.807 1.00 0.00 O ATOM 143 OE2 GLU A 6 -7.423 15.772 17.153 1.00 0.00 O ATOM 0 H GLU A 6 -7.896 17.299 11.492 1.00 0.00 H new ATOM 0 HA GLU A 6 -7.054 14.696 12.692 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -7.124 16.683 14.269 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -8.844 16.772 13.945 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -9.132 14.430 14.742 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -7.407 14.301 15.025 1.00 0.00 H new ATOM 150 N TYR A 7 -8.795 14.308 10.714 1.00 0.00 N ATOM 151 CA TYR A 7 -9.834 13.775 9.837 1.00 0.00 C ATOM 152 C TYR A 7 -9.303 12.549 9.097 1.00 0.00 C ATOM 153 O TYR A 7 -8.128 12.510 8.724 1.00 0.00 O ATOM 154 CB TYR A 7 -10.319 14.861 8.859 1.00 0.00 C ATOM 155 CG TYR A 7 -9.298 15.373 7.850 1.00 0.00 C ATOM 156 CD1 TYR A 7 -8.761 16.670 7.987 1.00 0.00 C ATOM 157 CD2 TYR A 7 -8.920 14.578 6.748 1.00 0.00 C ATOM 158 CE1 TYR A 7 -7.858 17.169 7.027 1.00 0.00 C ATOM 159 CE2 TYR A 7 -8.013 15.068 5.793 1.00 0.00 C ATOM 160 CZ TYR A 7 -7.479 16.367 5.926 1.00 0.00 C ATOM 161 OH TYR A 7 -6.616 16.842 4.987 1.00 0.00 O ATOM 0 H TYR A 7 -7.857 14.171 10.337 1.00 0.00 H new ATOM 0 HA TYR A 7 -10.691 13.467 10.435 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -11.174 14.468 8.309 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -10.678 15.709 9.442 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -9.043 17.283 8.830 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -9.331 13.585 6.637 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -7.455 18.165 7.132 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -7.724 14.449 4.956 1.00 0.00 H new ATOM 0 HH TYR A 7 -6.467 16.156 4.303 1.00 0.00 H new ATOM 171 N GLU A 8 -10.168 11.557 8.878 1.00 0.00 N ATOM 172 CA GLU A 8 -9.943 10.405 8.010 1.00 0.00 C ATOM 173 C GLU A 8 -11.214 9.539 7.994 1.00 0.00 C ATOM 174 O GLU A 8 -11.733 9.140 9.038 1.00 0.00 O ATOM 175 CB GLU A 8 -8.718 9.580 8.471 1.00 0.00 C ATOM 176 CG GLU A 8 -8.697 9.153 9.946 1.00 0.00 C ATOM 177 CD GLU A 8 -7.423 8.373 10.302 1.00 0.00 C ATOM 178 OE1 GLU A 8 -7.554 7.267 10.874 1.00 0.00 O ATOM 179 OE2 GLU A 8 -6.300 8.856 10.023 1.00 0.00 O ATOM 0 H GLU A 8 -11.086 11.536 9.322 1.00 0.00 H new ATOM 0 HA GLU A 8 -9.727 10.756 7.001 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.659 8.683 7.855 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -7.819 10.163 8.271 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -8.770 10.037 10.580 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.570 8.536 10.157 1.00 0.00 H new ATOM 186 N SER A 9 -11.733 9.251 6.804 1.00 0.00 N ATOM 187 CA SER A 9 -12.791 8.255 6.595 1.00 0.00 C ATOM 188 C SER A 9 -12.162 6.889 6.312 1.00 0.00 C ATOM 189 O SER A 9 -11.574 6.695 5.249 1.00 0.00 O ATOM 190 CB SER A 9 -13.689 8.666 5.423 1.00 0.00 C ATOM 191 OG SER A 9 -14.539 9.741 5.792 1.00 0.00 O ATOM 0 H SER A 9 -11.430 9.706 5.943 1.00 0.00 H new ATOM 0 HA SER A 9 -13.401 8.195 7.497 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.073 8.959 4.573 1.00 0.00 H new ATOM 0 HB3 SER A 9 -14.290 7.815 5.103 1.00 0.00 H new ATOM 0 HG SER A 9 -15.102 9.989 5.030 1.00 0.00 H new ATOM 197 N VAL A 10 -12.248 5.946 7.253 1.00 0.00 N ATOM 198 CA VAL A 10 -11.682 4.585 7.109 1.00 0.00 C ATOM 199 C VAL A 10 -12.413 3.738 6.052 1.00 0.00 C ATOM 200 O VAL A 10 -13.620 3.883 5.851 1.00 0.00 O ATOM 201 CB VAL A 10 -11.568 3.894 8.484 1.00 0.00 C ATOM 202 CG1 VAL A 10 -12.925 3.513 9.089 1.00 0.00 C ATOM 203 CG2 VAL A 10 -10.674 2.651 8.440 1.00 0.00 C ATOM 0 H VAL A 10 -12.715 6.098 8.147 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.669 4.687 6.719 1.00 0.00 H new ATOM 0 HB VAL A 10 -11.109 4.644 9.128 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -12.771 3.032 10.055 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -13.528 4.411 9.223 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -13.442 2.825 8.419 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -10.627 2.202 9.432 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -11.087 1.930 7.734 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -9.671 2.935 8.122 1.00 0.00 H new ATOM 213 N LEU A 11 -11.671 2.857 5.366 1.00 0.00 N ATOM 214 CA LEU A 11 -12.137 2.042 4.230 1.00 0.00 C ATOM 215 C LEU A 11 -11.775 0.557 4.387 1.00 0.00 C ATOM 216 O LEU A 11 -12.606 -0.309 4.114 1.00 0.00 O ATOM 217 CB LEU A 11 -11.525 2.579 2.920 1.00 0.00 C ATOM 218 CG LEU A 11 -11.962 3.993 2.496 1.00 0.00 C ATOM 219 CD1 LEU A 11 -11.216 4.381 1.222 1.00 0.00 C ATOM 220 CD2 LEU A 11 -13.462 4.083 2.202 1.00 0.00 C ATOM 0 H LEU A 11 -10.692 2.684 5.594 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.224 2.117 4.203 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -10.440 2.571 3.020 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.776 1.887 2.116 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.733 4.662 3.326 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -11.519 5.382 0.913 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -10.143 4.369 1.411 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.453 3.670 0.431 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -13.715 5.102 1.908 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.716 3.398 1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -14.025 3.813 3.096 1.00 0.00 H new ATOM 232 N CYS A 12 -10.551 0.260 4.837 1.00 0.00 N ATOM 233 CA CYS A 12 -10.072 -1.100 5.091 1.00 0.00 C ATOM 234 C CYS A 12 -9.007 -1.108 6.187 1.00 0.00 C ATOM 235 O CYS A 12 -8.076 -0.302 6.159 1.00 0.00 O ATOM 236 CB CYS A 12 -9.499 -1.684 3.796 1.00 0.00 C ATOM 237 SG CYS A 12 -9.169 -3.458 3.973 1.00 0.00 S ATOM 0 H CYS A 12 -9.852 0.975 5.039 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.909 -1.710 5.430 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -10.200 -1.521 2.978 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -8.578 -1.163 3.535 1.00 0.00 H new ATOM 0 HG CYS A 12 -9.254 -4.033 2.810 1.00 0.00 H new ATOM 243 N VAL A 13 -9.123 -2.043 7.125 1.00 0.00 N ATOM 244 CA VAL A 13 -8.122 -2.305 8.167 1.00 0.00 C ATOM 245 C VAL A 13 -7.794 -3.799 8.195 1.00 0.00 C ATOM 246 O VAL A 13 -8.698 -4.633 8.291 1.00 0.00 O ATOM 247 CB VAL A 13 -8.602 -1.791 9.540 1.00 0.00 C ATOM 248 CG1 VAL A 13 -7.618 -2.119 10.672 1.00 0.00 C ATOM 249 CG2 VAL A 13 -8.787 -0.267 9.522 1.00 0.00 C ATOM 0 H VAL A 13 -9.934 -2.658 7.188 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.208 -1.759 7.934 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.548 -2.298 9.727 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.007 -1.734 11.615 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.494 -3.199 10.745 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -6.654 -1.657 10.461 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.126 0.070 10.502 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -7.838 0.212 9.282 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.529 0.001 8.770 1.00 0.00 H new ATOM 259 N LYS A 14 -6.499 -4.131 8.125 1.00 0.00 N ATOM 260 CA LYS A 14 -5.962 -5.500 8.271 1.00 0.00 C ATOM 261 C LYS A 14 -4.855 -5.522 9.338 1.00 0.00 C ATOM 262 O LYS A 14 -3.956 -4.684 9.264 1.00 0.00 O ATOM 263 CB LYS A 14 -5.454 -6.065 6.923 1.00 0.00 C ATOM 264 CG LYS A 14 -6.491 -6.067 5.787 1.00 0.00 C ATOM 265 CD LYS A 14 -7.608 -7.100 5.985 1.00 0.00 C ATOM 266 CE LYS A 14 -8.711 -6.863 4.957 1.00 0.00 C ATOM 267 NZ LYS A 14 -9.813 -7.840 5.112 1.00 0.00 N ATOM 0 H LYS A 14 -5.770 -3.437 7.960 1.00 0.00 H new ATOM 0 HA LYS A 14 -6.774 -6.149 8.598 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -4.590 -5.482 6.605 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -5.109 -7.087 7.081 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -6.934 -5.074 5.707 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -5.984 -6.267 4.843 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -7.208 -8.108 5.879 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.014 -7.023 6.994 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.102 -5.851 5.067 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.296 -6.937 3.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.584 -7.601 4.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.462 -8.796 4.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.168 -7.811 6.089 1.00 0.00 H new ATOM 281 N PRO A 15 -4.877 -6.444 10.319 1.00 0.00 N ATOM 282 CA PRO A 15 -3.962 -6.411 11.467 1.00 0.00 C ATOM 283 C PRO A 15 -2.537 -6.906 11.180 1.00 0.00 C ATOM 284 O PRO A 15 -1.652 -6.706 12.013 1.00 0.00 O ATOM 285 CB PRO A 15 -4.616 -7.306 12.519 1.00 0.00 C ATOM 286 CG PRO A 15 -5.397 -8.319 11.686 1.00 0.00 C ATOM 287 CD PRO A 15 -5.877 -7.488 10.501 1.00 0.00 C ATOM 0 HA PRO A 15 -3.825 -5.376 11.779 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -3.873 -7.793 13.150 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -5.272 -6.738 13.179 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -4.768 -9.151 11.368 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -6.230 -8.745 12.245 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -5.970 -8.102 9.605 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -6.860 -7.059 10.697 1.00 0.00 H new ATOM 295 N ASP A 16 -2.310 -7.576 10.046 1.00 0.00 N ATOM 296 CA ASP A 16 -1.020 -8.169 9.689 1.00 0.00 C ATOM 297 C ASP A 16 -0.643 -7.857 8.235 1.00 0.00 C ATOM 298 O ASP A 16 -1.233 -8.380 7.285 1.00 0.00 O ATOM 299 CB ASP A 16 -1.062 -9.680 9.953 1.00 0.00 C ATOM 300 CG ASP A 16 0.320 -10.325 9.756 1.00 0.00 C ATOM 301 OD1 ASP A 16 0.450 -11.241 8.912 1.00 0.00 O ATOM 302 OD2 ASP A 16 1.275 -9.927 10.467 1.00 0.00 O ATOM 0 H ASP A 16 -3.031 -7.723 9.339 1.00 0.00 H new ATOM 0 HA ASP A 16 -0.243 -7.728 10.313 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.409 -9.863 10.970 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.782 -10.148 9.282 1.00 0.00 H new ATOM 307 N VAL A 17 0.354 -6.989 8.079 1.00 0.00 N ATOM 308 CA VAL A 17 0.977 -6.610 6.803 1.00 0.00 C ATOM 309 C VAL A 17 2.477 -6.366 7.006 1.00 0.00 C ATOM 310 O VAL A 17 2.903 -5.899 8.070 1.00 0.00 O ATOM 311 CB VAL A 17 0.243 -5.405 6.172 1.00 0.00 C ATOM 312 CG1 VAL A 17 0.491 -4.073 6.890 1.00 0.00 C ATOM 313 CG2 VAL A 17 0.600 -5.219 4.694 1.00 0.00 C ATOM 0 H VAL A 17 0.773 -6.505 8.873 1.00 0.00 H new ATOM 0 HA VAL A 17 0.881 -7.429 6.090 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.811 -5.660 6.279 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.059 -3.279 6.385 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.153 -4.148 7.923 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.556 -3.843 6.873 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.060 -4.361 4.295 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.672 -5.050 4.597 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.322 -6.114 4.137 1.00 0.00 H new ATOM 323 N SER A 18 3.284 -6.694 5.996 1.00 0.00 N ATOM 324 CA SER A 18 4.752 -6.712 6.091 1.00 0.00 C ATOM 325 C SER A 18 5.399 -5.893 4.979 1.00 0.00 C ATOM 326 O SER A 18 5.050 -6.076 3.814 1.00 0.00 O ATOM 327 CB SER A 18 5.269 -8.154 6.029 1.00 0.00 C ATOM 328 OG SER A 18 4.705 -8.946 7.063 1.00 0.00 O ATOM 0 H SER A 18 2.936 -6.959 5.075 1.00 0.00 H new ATOM 0 HA SER A 18 5.023 -6.264 7.047 1.00 0.00 H new ATOM 0 HB2 SER A 18 5.025 -8.589 5.060 1.00 0.00 H new ATOM 0 HB3 SER A 18 6.356 -8.158 6.116 1.00 0.00 H new ATOM 0 HG SER A 18 5.050 -9.861 6.999 1.00 0.00 H new ATOM 334 N VAL A 19 6.341 -5.011 5.332 1.00 0.00 N ATOM 335 CA VAL A 19 7.050 -4.105 4.410 1.00 0.00 C ATOM 336 C VAL A 19 8.409 -4.662 4.005 1.00 0.00 C ATOM 337 O VAL A 19 9.235 -4.998 4.855 1.00 0.00 O ATOM 338 CB VAL A 19 7.207 -2.689 5.003 1.00 0.00 C ATOM 339 CG1 VAL A 19 8.116 -1.772 4.165 1.00 0.00 C ATOM 340 CG2 VAL A 19 5.851 -1.986 5.100 1.00 0.00 C ATOM 0 H VAL A 19 6.644 -4.902 6.300 1.00 0.00 H new ATOM 0 HA VAL A 19 6.433 -4.030 3.515 1.00 0.00 H new ATOM 0 HB VAL A 19 7.657 -2.845 5.983 1.00 0.00 H new ATOM 0 HG11 VAL A 19 8.182 -0.793 4.640 1.00 0.00 H new ATOM 0 HG12 VAL A 19 9.112 -2.210 4.097 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.699 -1.663 3.164 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.987 -0.990 5.521 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.412 -1.903 4.106 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.187 -2.564 5.743 1.00 0.00 H new ATOM 350 N TYR A 20 8.679 -4.646 2.702 1.00 0.00 N ATOM 351 CA TYR A 20 9.998 -4.872 2.115 1.00 0.00 C ATOM 352 C TYR A 20 10.290 -3.744 1.119 1.00 0.00 C ATOM 353 O TYR A 20 9.542 -3.527 0.163 1.00 0.00 O ATOM 354 CB TYR A 20 10.118 -6.269 1.467 1.00 0.00 C ATOM 355 CG TYR A 20 9.025 -7.263 1.822 1.00 0.00 C ATOM 356 CD1 TYR A 20 7.853 -7.323 1.044 1.00 0.00 C ATOM 357 CD2 TYR A 20 9.162 -8.089 2.951 1.00 0.00 C ATOM 358 CE1 TYR A 20 6.804 -8.188 1.413 1.00 0.00 C ATOM 359 CE2 TYR A 20 8.115 -8.948 3.329 1.00 0.00 C ATOM 360 CZ TYR A 20 6.934 -9.001 2.562 1.00 0.00 C ATOM 361 OH TYR A 20 5.939 -9.851 2.933 1.00 0.00 O ATOM 0 H TYR A 20 7.960 -4.469 2.001 1.00 0.00 H new ATOM 0 HA TYR A 20 10.749 -4.856 2.905 1.00 0.00 H new ATOM 0 HB2 TYR A 20 10.132 -6.146 0.384 1.00 0.00 H new ATOM 0 HB3 TYR A 20 11.079 -6.698 1.751 1.00 0.00 H new ATOM 0 HD1 TYR A 20 7.758 -6.705 0.163 1.00 0.00 H new ATOM 0 HD2 TYR A 20 10.074 -8.064 3.530 1.00 0.00 H new ATOM 0 HE1 TYR A 20 5.903 -8.230 0.819 1.00 0.00 H new ATOM 0 HE2 TYR A 20 8.216 -9.568 4.208 1.00 0.00 H new ATOM 0 HH TYR A 20 6.204 -10.330 3.746 1.00 0.00 H new ATOM 371 N ARG A 21 11.375 -3.001 1.349 1.00 0.00 N ATOM 372 CA ARG A 21 11.813 -1.918 0.452 1.00 0.00 C ATOM 373 C ARG A 21 12.377 -2.509 -0.844 1.00 0.00 C ATOM 374 O ARG A 21 13.186 -3.439 -0.817 1.00 0.00 O ATOM 375 CB ARG A 21 12.793 -0.969 1.159 1.00 0.00 C ATOM 376 CG ARG A 21 12.151 -0.347 2.410 1.00 0.00 C ATOM 377 CD ARG A 21 13.058 0.708 3.047 1.00 0.00 C ATOM 378 NE ARG A 21 12.575 1.045 4.399 1.00 0.00 N ATOM 379 CZ ARG A 21 11.909 2.101 4.815 1.00 0.00 C ATOM 380 NH1 ARG A 21 11.528 2.121 6.056 1.00 0.00 N ATOM 381 NH2 ARG A 21 11.613 3.112 4.049 1.00 0.00 N ATOM 0 H ARG A 21 11.978 -3.130 2.162 1.00 0.00 H new ATOM 0 HA ARG A 21 10.952 -1.307 0.181 1.00 0.00 H new ATOM 0 HB2 ARG A 21 13.694 -1.514 1.441 1.00 0.00 H new ATOM 0 HB3 ARG A 21 13.100 -0.180 0.473 1.00 0.00 H new ATOM 0 HG2 ARG A 21 11.197 0.107 2.142 1.00 0.00 H new ATOM 0 HG3 ARG A 21 11.938 -1.130 3.137 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.081 0.334 3.101 1.00 0.00 H new ATOM 0 HD3 ARG A 21 13.078 1.604 2.426 1.00 0.00 H new ATOM 0 HE ARG A 21 12.789 0.356 5.120 1.00 0.00 H new ATOM 0 HH11 ARG A 21 11.747 1.336 6.670 1.00 0.00 H new ATOM 0 HH12 ARG A 21 11.009 2.922 6.417 1.00 0.00 H new ATOM 0 HH21 ARG A 21 11.900 3.112 3.070 1.00 0.00 H new ATOM 0 HH22 ARG A 21 11.094 3.904 4.428 1.00 0.00 H new ATOM 395 N ILE A 22 11.897 -1.996 -1.975 1.00 0.00 N ATOM 396 CA ILE A 22 12.031 -2.637 -3.295 1.00 0.00 C ATOM 397 C ILE A 22 13.276 -2.174 -4.078 1.00 0.00 C ATOM 398 O ILE A 22 13.719 -1.032 -3.904 1.00 0.00 O ATOM 399 CB ILE A 22 10.743 -2.450 -4.133 1.00 0.00 C ATOM 400 CG1 ILE A 22 10.453 -0.963 -4.441 1.00 0.00 C ATOM 401 CG2 ILE A 22 9.555 -3.140 -3.441 1.00 0.00 C ATOM 402 CD1 ILE A 22 9.158 -0.748 -5.224 1.00 0.00 C ATOM 0 H ILE A 22 11.395 -1.109 -2.008 1.00 0.00 H new ATOM 0 HA ILE A 22 12.175 -3.701 -3.104 1.00 0.00 H new ATOM 0 HB ILE A 22 10.899 -2.929 -5.100 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.399 -0.409 -3.504 1.00 0.00 H new ATOM 0 HG13 ILE A 22 11.286 -0.548 -5.009 1.00 0.00 H new ATOM 0 HG21 ILE A 22 8.655 -3.002 -4.040 1.00 0.00 H new ATOM 0 HG22 ILE A 22 9.762 -4.205 -3.338 1.00 0.00 H new ATOM 0 HG23 ILE A 22 9.405 -2.703 -2.454 1.00 0.00 H new ATOM 0 HD11 ILE A 22 9.016 0.317 -5.406 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.217 -1.274 -6.177 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.316 -1.133 -4.648 1.00 0.00 H new ATOM 414 N PRO A 23 13.819 -3.008 -4.989 1.00 0.00 N ATOM 415 CA PRO A 23 14.705 -2.540 -6.058 1.00 0.00 C ATOM 416 C PRO A 23 13.948 -1.622 -7.046 1.00 0.00 C ATOM 417 O PRO A 23 12.715 -1.692 -7.129 1.00 0.00 O ATOM 418 CB PRO A 23 15.214 -3.817 -6.739 1.00 0.00 C ATOM 419 CG PRO A 23 14.055 -4.796 -6.556 1.00 0.00 C ATOM 420 CD PRO A 23 13.506 -4.421 -5.180 1.00 0.00 C ATOM 0 HA PRO A 23 15.529 -1.937 -5.676 1.00 0.00 H new ATOM 0 HB2 PRO A 23 15.437 -3.650 -7.793 1.00 0.00 H new ATOM 0 HB3 PRO A 23 16.129 -4.184 -6.274 1.00 0.00 H new ATOM 0 HG2 PRO A 23 13.302 -4.682 -7.336 1.00 0.00 H new ATOM 0 HG3 PRO A 23 14.392 -5.832 -6.588 1.00 0.00 H new ATOM 0 HD2 PRO A 23 12.431 -4.592 -5.130 1.00 0.00 H new ATOM 0 HD3 PRO A 23 13.962 -5.030 -4.399 1.00 0.00 H new ATOM 428 N PRO A 24 14.647 -0.769 -7.822 1.00 0.00 N ATOM 429 CA PRO A 24 14.017 0.081 -8.835 1.00 0.00 C ATOM 430 C PRO A 24 13.327 -0.747 -9.934 1.00 0.00 C ATOM 431 O PRO A 24 13.776 -1.844 -10.285 1.00 0.00 O ATOM 432 CB PRO A 24 15.144 0.961 -9.391 1.00 0.00 C ATOM 433 CG PRO A 24 16.399 0.118 -9.161 1.00 0.00 C ATOM 434 CD PRO A 24 16.093 -0.597 -7.846 1.00 0.00 C ATOM 0 HA PRO A 24 13.219 0.687 -8.406 1.00 0.00 H new ATOM 0 HB2 PRO A 24 14.997 1.182 -10.448 1.00 0.00 H new ATOM 0 HB3 PRO A 24 15.201 1.917 -8.870 1.00 0.00 H new ATOM 0 HG2 PRO A 24 16.567 -0.587 -9.975 1.00 0.00 H new ATOM 0 HG3 PRO A 24 17.293 0.737 -9.086 1.00 0.00 H new ATOM 0 HD2 PRO A 24 16.603 -1.559 -7.795 1.00 0.00 H new ATOM 0 HD3 PRO A 24 16.432 -0.010 -6.992 1.00 0.00 H new ATOM 442 N ARG A 25 12.226 -0.219 -10.490 1.00 0.00 N ATOM 443 CA ARG A 25 11.408 -0.908 -11.505 1.00 0.00 C ATOM 444 C ARG A 25 12.173 -1.115 -12.817 1.00 0.00 C ATOM 445 O ARG A 25 12.970 -0.274 -13.240 1.00 0.00 O ATOM 446 CB ARG A 25 10.104 -0.123 -11.759 1.00 0.00 C ATOM 447 CG ARG A 25 8.961 -0.947 -12.389 1.00 0.00 C ATOM 448 CD ARG A 25 7.845 -0.083 -12.994 1.00 0.00 C ATOM 449 NE ARG A 25 7.205 0.822 -12.012 1.00 0.00 N ATOM 450 CZ ARG A 25 7.501 2.084 -11.762 1.00 0.00 C ATOM 451 NH1 ARG A 25 6.881 2.730 -10.822 1.00 0.00 N ATOM 452 NH2 ARG A 25 8.408 2.743 -12.434 1.00 0.00 N ATOM 0 H ARG A 25 11.874 0.707 -10.247 1.00 0.00 H new ATOM 0 HA ARG A 25 11.163 -1.896 -11.115 1.00 0.00 H new ATOM 0 HB2 ARG A 25 9.755 0.290 -10.812 1.00 0.00 H new ATOM 0 HB3 ARG A 25 10.327 0.721 -12.412 1.00 0.00 H new ATOM 0 HG2 ARG A 25 9.373 -1.591 -13.166 1.00 0.00 H new ATOM 0 HG3 ARG A 25 8.532 -1.600 -11.629 1.00 0.00 H new ATOM 0 HD2 ARG A 25 8.257 0.511 -13.810 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.085 -0.734 -13.426 1.00 0.00 H new ATOM 0 HE ARG A 25 6.444 0.422 -11.463 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.161 2.263 -10.272 1.00 0.00 H new ATOM 0 HH12 ARG A 25 7.114 3.705 -10.634 1.00 0.00 H new ATOM 0 HH21 ARG A 25 8.920 2.283 -13.187 1.00 0.00 H new ATOM 0 HH22 ARG A 25 8.604 3.718 -12.206 1.00 0.00 H new ATOM 466 N ALA A 26 11.848 -2.215 -13.488 1.00 0.00 N ATOM 467 CA ALA A 26 12.129 -2.441 -14.902 1.00 0.00 C ATOM 468 C ALA A 26 11.390 -1.446 -15.828 1.00 0.00 C ATOM 469 O ALA A 26 10.591 -0.611 -15.395 1.00 0.00 O ATOM 470 CB ALA A 26 11.690 -3.876 -15.198 1.00 0.00 C ATOM 0 H ALA A 26 11.366 -2.999 -13.049 1.00 0.00 H new ATOM 0 HA ALA A 26 13.190 -2.286 -15.098 1.00 0.00 H new ATOM 0 HB1 ALA A 26 11.877 -4.104 -16.247 1.00 0.00 H new ATOM 0 HB2 ALA A 26 12.254 -4.566 -14.570 1.00 0.00 H new ATOM 0 HB3 ALA A 26 10.626 -3.982 -14.987 1.00 0.00 H new ATOM 476 N SER A 27 11.623 -1.599 -17.131 1.00 0.00 N ATOM 477 CA SER A 27 11.006 -0.815 -18.216 1.00 0.00 C ATOM 478 C SER A 27 9.890 -1.585 -18.933 1.00 0.00 C ATOM 479 O SER A 27 8.874 -1.004 -19.321 1.00 0.00 O ATOM 480 CB SER A 27 12.096 -0.405 -19.212 1.00 0.00 C ATOM 481 OG SER A 27 12.721 -1.554 -19.775 1.00 0.00 O ATOM 0 H SER A 27 12.274 -2.302 -17.481 1.00 0.00 H new ATOM 0 HA SER A 27 10.542 0.068 -17.777 1.00 0.00 H new ATOM 0 HB2 SER A 27 11.661 0.204 -20.005 1.00 0.00 H new ATOM 0 HB3 SER A 27 12.842 0.211 -18.710 1.00 0.00 H new ATOM 0 HG SER A 27 13.413 -1.272 -20.410 1.00 0.00 H new ATOM 487 N ASN A 28 10.070 -2.903 -19.083 1.00 0.00 N ATOM 488 CA ASN A 28 9.192 -3.823 -19.814 1.00 0.00 C ATOM 489 C ASN A 28 8.889 -5.107 -19.004 1.00 0.00 C ATOM 490 O ASN A 28 8.631 -6.164 -19.586 1.00 0.00 O ATOM 491 CB ASN A 28 9.818 -4.113 -21.198 1.00 0.00 C ATOM 492 CG ASN A 28 9.829 -2.910 -22.129 1.00 0.00 C ATOM 493 OD1 ASN A 28 8.930 -2.717 -22.939 1.00 0.00 O ATOM 494 ND2 ASN A 28 10.836 -2.067 -22.067 1.00 0.00 N ATOM 0 H ASN A 28 10.874 -3.381 -18.676 1.00 0.00 H new ATOM 0 HA ASN A 28 8.220 -3.354 -19.966 1.00 0.00 H new ATOM 0 HB2 ASN A 28 10.841 -4.462 -21.058 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.267 -4.924 -21.673 1.00 0.00 H new ATOM 0 HD21 ASN A 28 10.865 -1.260 -22.690 1.00 0.00 H new ATOM 0 HD22 ASN A 28 11.589 -2.220 -21.396 1.00 0.00 H new ATOM 501 N ARG A 29 8.959 -5.042 -17.663 1.00 0.00 N ATOM 502 CA ARG A 29 8.641 -6.165 -16.751 1.00 0.00 C ATOM 503 C ARG A 29 7.666 -5.779 -15.645 1.00 0.00 C ATOM 504 O ARG A 29 6.581 -6.354 -15.584 1.00 0.00 O ATOM 505 CB ARG A 29 9.909 -6.815 -16.155 1.00 0.00 C ATOM 506 CG ARG A 29 10.898 -7.367 -17.189 1.00 0.00 C ATOM 507 CD ARG A 29 10.258 -8.556 -17.900 1.00 0.00 C ATOM 508 NE ARG A 29 11.162 -9.160 -18.897 1.00 0.00 N ATOM 509 CZ ARG A 29 11.191 -8.928 -20.199 1.00 0.00 C ATOM 510 NH1 ARG A 29 12.036 -9.566 -20.957 1.00 0.00 N ATOM 511 NH2 ARG A 29 10.400 -8.071 -20.783 1.00 0.00 N ATOM 0 H ARG A 29 9.242 -4.195 -17.170 1.00 0.00 H new ATOM 0 HA ARG A 29 8.143 -6.908 -17.374 1.00 0.00 H new ATOM 0 HB2 ARG A 29 10.423 -6.077 -15.540 1.00 0.00 H new ATOM 0 HB3 ARG A 29 9.607 -7.627 -15.493 1.00 0.00 H new ATOM 0 HG2 ARG A 29 11.160 -6.593 -17.910 1.00 0.00 H new ATOM 0 HG3 ARG A 29 11.823 -7.673 -16.700 1.00 0.00 H new ATOM 0 HD2 ARG A 29 9.976 -9.309 -17.164 1.00 0.00 H new ATOM 0 HD3 ARG A 29 9.341 -8.232 -18.392 1.00 0.00 H new ATOM 0 HE ARG A 29 11.842 -9.833 -18.542 1.00 0.00 H new ATOM 0 HH11 ARG A 29 12.677 -10.246 -20.547 1.00 0.00 H new ATOM 0 HH12 ARG A 29 12.057 -9.386 -21.961 1.00 0.00 H new ATOM 0 HH21 ARG A 29 9.722 -7.545 -20.232 1.00 0.00 H new ATOM 0 HH22 ARG A 29 10.460 -7.926 -21.791 1.00 0.00 H new ATOM 525 N GLY A 30 8.034 -4.825 -14.783 1.00 0.00 N ATOM 526 CA GLY A 30 7.317 -4.587 -13.545 1.00 0.00 C ATOM 527 C GLY A 30 7.876 -5.429 -12.401 1.00 0.00 C ATOM 528 O GLY A 30 8.823 -6.211 -12.551 1.00 0.00 O ATOM 0 H GLY A 30 8.831 -4.206 -14.930 1.00 0.00 H new ATOM 0 HA2 GLY A 30 7.380 -3.530 -13.285 1.00 0.00 H new ATOM 0 HA3 GLY A 30 6.261 -4.818 -13.685 1.00 0.00 H new ATOM 532 N TYR A 31 7.281 -5.232 -11.236 1.00 0.00 N ATOM 533 CA TYR A 31 7.585 -5.953 -10.007 1.00 0.00 C ATOM 534 C TYR A 31 6.983 -7.363 -10.041 1.00 0.00 C ATOM 535 O TYR A 31 5.896 -7.561 -10.569 1.00 0.00 O ATOM 536 CB TYR A 31 7.021 -5.174 -8.817 1.00 0.00 C ATOM 537 CG TYR A 31 7.336 -3.690 -8.773 1.00 0.00 C ATOM 538 CD1 TYR A 31 6.338 -2.801 -8.334 1.00 0.00 C ATOM 539 CD2 TYR A 31 8.603 -3.196 -9.149 1.00 0.00 C ATOM 540 CE1 TYR A 31 6.598 -1.421 -8.260 1.00 0.00 C ATOM 541 CE2 TYR A 31 8.889 -1.826 -8.988 1.00 0.00 C ATOM 542 CZ TYR A 31 7.882 -0.928 -8.572 1.00 0.00 C ATOM 543 OH TYR A 31 8.146 0.403 -8.483 1.00 0.00 O ATOM 0 H TYR A 31 6.543 -4.538 -11.114 1.00 0.00 H new ATOM 0 HA TYR A 31 8.666 -6.047 -9.909 1.00 0.00 H new ATOM 0 HB2 TYR A 31 5.938 -5.294 -8.813 1.00 0.00 H new ATOM 0 HB3 TYR A 31 7.396 -5.630 -7.901 1.00 0.00 H new ATOM 0 HD1 TYR A 31 5.367 -3.180 -8.052 1.00 0.00 H new ATOM 0 HD2 TYR A 31 9.348 -3.863 -9.557 1.00 0.00 H new ATOM 0 HE1 TYR A 31 5.815 -0.739 -7.964 1.00 0.00 H new ATOM 0 HE2 TYR A 31 9.886 -1.460 -9.184 1.00 0.00 H new ATOM 0 HH TYR A 31 9.079 0.569 -8.733 1.00 0.00 H new ATOM 553 N ARG A 32 7.651 -8.343 -9.434 1.00 0.00 N ATOM 554 CA ARG A 32 7.278 -9.777 -9.496 1.00 0.00 C ATOM 555 C ARG A 32 7.237 -10.476 -8.141 1.00 0.00 C ATOM 556 O ARG A 32 7.258 -11.700 -8.083 1.00 0.00 O ATOM 557 CB ARG A 32 8.115 -10.540 -10.550 1.00 0.00 C ATOM 558 CG ARG A 32 9.640 -10.340 -10.488 1.00 0.00 C ATOM 559 CD ARG A 32 10.071 -9.102 -11.288 1.00 0.00 C ATOM 560 NE ARG A 32 11.525 -8.886 -11.254 1.00 0.00 N ATOM 561 CZ ARG A 32 12.190 -7.938 -11.882 1.00 0.00 C ATOM 562 NH1 ARG A 32 13.483 -7.901 -11.764 1.00 0.00 N ATOM 563 NH2 ARG A 32 11.609 -7.022 -12.605 1.00 0.00 N ATOM 0 H ARG A 32 8.484 -8.171 -8.872 1.00 0.00 H new ATOM 0 HA ARG A 32 6.242 -9.798 -9.833 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.906 -11.605 -10.447 1.00 0.00 H new ATOM 0 HB3 ARG A 32 7.771 -10.242 -11.540 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.953 -10.232 -9.450 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.142 -11.224 -10.882 1.00 0.00 H new ATOM 0 HD2 ARG A 32 9.748 -9.212 -12.323 1.00 0.00 H new ATOM 0 HD3 ARG A 32 9.567 -8.222 -10.888 1.00 0.00 H new ATOM 0 HE ARG A 32 12.073 -9.534 -10.688 1.00 0.00 H new ATOM 0 HH11 ARG A 32 13.963 -8.597 -11.194 1.00 0.00 H new ATOM 0 HH12 ARG A 32 14.018 -7.176 -12.242 1.00 0.00 H new ATOM 0 HH21 ARG A 32 10.594 -7.018 -12.704 1.00 0.00 H new ATOM 0 HH22 ARG A 32 12.170 -6.309 -13.072 1.00 0.00 H new ATOM 577 N ALA A 33 7.153 -9.694 -7.065 1.00 0.00 N ATOM 578 CA ALA A 33 7.199 -10.082 -5.650 1.00 0.00 C ATOM 579 C ALA A 33 8.497 -10.794 -5.203 1.00 0.00 C ATOM 580 O ALA A 33 9.123 -10.393 -4.223 1.00 0.00 O ATOM 581 CB ALA A 33 5.926 -10.880 -5.360 1.00 0.00 C ATOM 0 H ALA A 33 7.041 -8.685 -7.167 1.00 0.00 H new ATOM 0 HA ALA A 33 7.229 -9.179 -5.040 1.00 0.00 H new ATOM 0 HB1 ALA A 33 5.920 -11.189 -4.315 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.053 -10.258 -5.559 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.896 -11.762 -5.999 1.00 0.00 H new ATOM 587 N SER A 34 8.948 -11.804 -5.949 1.00 0.00 N ATOM 588 CA SER A 34 10.136 -12.625 -5.692 1.00 0.00 C ATOM 589 C SER A 34 11.469 -11.867 -5.772 1.00 0.00 C ATOM 590 O SER A 34 12.476 -12.329 -5.231 1.00 0.00 O ATOM 591 CB SER A 34 10.143 -13.790 -6.686 1.00 0.00 C ATOM 592 OG SER A 34 10.256 -13.317 -8.021 1.00 0.00 O ATOM 0 H SER A 34 8.465 -12.089 -6.801 1.00 0.00 H new ATOM 0 HA SER A 34 10.062 -12.969 -4.660 1.00 0.00 H new ATOM 0 HB2 SER A 34 10.973 -14.460 -6.462 1.00 0.00 H new ATOM 0 HB3 SER A 34 9.227 -14.371 -6.578 1.00 0.00 H new ATOM 0 HG SER A 34 10.260 -14.078 -8.638 1.00 0.00 H new ATOM 598 N ASP A 35 11.485 -10.691 -6.410 1.00 0.00 N ATOM 599 CA ASP A 35 12.648 -9.795 -6.450 1.00 0.00 C ATOM 600 C ASP A 35 12.835 -8.991 -5.145 1.00 0.00 C ATOM 601 O ASP A 35 13.906 -8.424 -4.915 1.00 0.00 O ATOM 602 CB ASP A 35 12.542 -8.860 -7.670 1.00 0.00 C ATOM 603 CG ASP A 35 13.798 -8.944 -8.552 1.00 0.00 C ATOM 604 OD1 ASP A 35 13.743 -9.630 -9.600 1.00 0.00 O ATOM 605 OD2 ASP A 35 14.825 -8.304 -8.230 1.00 0.00 O ATOM 0 H ASP A 35 10.679 -10.329 -6.920 1.00 0.00 H new ATOM 0 HA ASP A 35 13.538 -10.417 -6.547 1.00 0.00 H new ATOM 0 HB2 ASP A 35 11.664 -9.126 -8.259 1.00 0.00 H new ATOM 0 HB3 ASP A 35 12.401 -7.833 -7.332 1.00 0.00 H new ATOM 610 N TRP A 36 11.814 -8.934 -4.280 1.00 0.00 N ATOM 611 CA TRP A 36 11.861 -8.281 -2.978 1.00 0.00 C ATOM 612 C TRP A 36 12.306 -9.277 -1.897 1.00 0.00 C ATOM 613 O TRP A 36 12.267 -10.498 -2.077 1.00 0.00 O ATOM 614 CB TRP A 36 10.485 -7.698 -2.624 1.00 0.00 C ATOM 615 CG TRP A 36 9.669 -7.003 -3.685 1.00 0.00 C ATOM 616 CD1 TRP A 36 10.104 -6.482 -4.861 1.00 0.00 C ATOM 617 CD2 TRP A 36 8.233 -6.728 -3.647 1.00 0.00 C ATOM 618 NE1 TRP A 36 9.045 -5.920 -5.549 1.00 0.00 N ATOM 619 CE2 TRP A 36 7.882 -5.998 -4.820 1.00 0.00 C ATOM 620 CE3 TRP A 36 7.191 -7.008 -2.733 1.00 0.00 C ATOM 621 CZ2 TRP A 36 6.590 -5.521 -5.050 1.00 0.00 C ATOM 622 CZ3 TRP A 36 5.883 -6.530 -2.951 1.00 0.00 C ATOM 623 CH2 TRP A 36 5.590 -5.777 -4.100 1.00 0.00 C ATOM 0 H TRP A 36 10.907 -9.356 -4.479 1.00 0.00 H new ATOM 0 HA TRP A 36 12.585 -7.468 -3.024 1.00 0.00 H new ATOM 0 HB2 TRP A 36 9.878 -8.513 -2.230 1.00 0.00 H new ATOM 0 HB3 TRP A 36 10.633 -6.988 -1.810 1.00 0.00 H new ATOM 0 HD1 TRP A 36 11.127 -6.504 -5.208 1.00 0.00 H new ATOM 0 HE1 TRP A 36 9.117 -5.502 -6.477 1.00 0.00 H new ATOM 0 HE3 TRP A 36 7.401 -7.598 -1.853 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 6.364 -4.963 -5.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 5.105 -6.743 -2.233 1.00 0.00 H new ATOM 0 HH2 TRP A 36 4.592 -5.394 -4.253 1.00 0.00 H new ATOM 634 N LYS A 37 12.683 -8.756 -0.729 1.00 0.00 N ATOM 635 CA LYS A 37 13.164 -9.559 0.410 1.00 0.00 C ATOM 636 C LYS A 37 12.020 -10.054 1.301 1.00 0.00 C ATOM 637 O LYS A 37 11.917 -9.690 2.471 1.00 0.00 O ATOM 638 CB LYS A 37 14.269 -8.819 1.174 1.00 0.00 C ATOM 639 CG LYS A 37 15.411 -8.341 0.262 1.00 0.00 C ATOM 640 CD LYS A 37 16.776 -8.436 0.954 1.00 0.00 C ATOM 641 CE LYS A 37 16.839 -7.693 2.296 1.00 0.00 C ATOM 642 NZ LYS A 37 18.048 -8.085 3.069 1.00 0.00 N ATOM 0 H LYS A 37 12.665 -7.754 -0.539 1.00 0.00 H new ATOM 0 HA LYS A 37 13.619 -10.467 0.014 1.00 0.00 H new ATOM 0 HB2 LYS A 37 13.836 -7.960 1.686 1.00 0.00 H new ATOM 0 HB3 LYS A 37 14.676 -9.477 1.942 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.423 -8.941 -0.648 1.00 0.00 H new ATOM 0 HG3 LYS A 37 15.228 -7.309 -0.038 1.00 0.00 H new ATOM 0 HD2 LYS A 37 17.018 -9.486 1.118 1.00 0.00 H new ATOM 0 HD3 LYS A 37 17.540 -8.033 0.289 1.00 0.00 H new ATOM 0 HE2 LYS A 37 16.849 -6.617 2.120 1.00 0.00 H new ATOM 0 HE3 LYS A 37 15.944 -7.912 2.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 18.148 -7.462 3.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 17.952 -9.071 3.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 18.890 -7.996 2.465 1.00 0.00 H new ATOM 656 N LEU A 38 11.161 -10.899 0.731 1.00 0.00 N ATOM 657 CA LEU A 38 9.906 -11.385 1.330 1.00 0.00 C ATOM 658 C LEU A 38 10.062 -12.080 2.696 1.00 0.00 C ATOM 659 O LEU A 38 9.140 -12.065 3.511 1.00 0.00 O ATOM 660 CB LEU A 38 9.248 -12.367 0.344 1.00 0.00 C ATOM 661 CG LEU A 38 8.887 -11.783 -1.036 1.00 0.00 C ATOM 662 CD1 LEU A 38 8.152 -12.844 -1.855 1.00 0.00 C ATOM 663 CD2 LEU A 38 8.003 -10.540 -0.934 1.00 0.00 C ATOM 0 H LEU A 38 11.322 -11.283 -0.200 1.00 0.00 H new ATOM 0 HA LEU A 38 9.295 -10.502 1.517 1.00 0.00 H new ATOM 0 HB2 LEU A 38 9.921 -13.212 0.196 1.00 0.00 H new ATOM 0 HB3 LEU A 38 8.340 -12.759 0.801 1.00 0.00 H new ATOM 0 HG LEU A 38 9.820 -11.489 -1.518 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.894 -12.435 -2.832 1.00 0.00 H new ATOM 0 HD12 LEU A 38 8.795 -13.715 -1.984 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.241 -13.140 -1.334 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.779 -10.170 -1.934 1.00 0.00 H new ATOM 0 HD22 LEU A 38 7.074 -10.795 -0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 38 8.525 -9.767 -0.370 1.00 0.00 H new ATOM 675 N ASP A 39 11.223 -12.683 2.963 1.00 0.00 N ATOM 676 CA ASP A 39 11.527 -13.364 4.233 1.00 0.00 C ATOM 677 C ASP A 39 12.072 -12.408 5.320 1.00 0.00 C ATOM 678 O ASP A 39 12.266 -12.807 6.470 1.00 0.00 O ATOM 679 CB ASP A 39 12.502 -14.513 3.925 1.00 0.00 C ATOM 680 CG ASP A 39 12.733 -15.452 5.124 1.00 0.00 C ATOM 681 OD1 ASP A 39 13.900 -15.599 5.562 1.00 0.00 O ATOM 682 OD2 ASP A 39 11.759 -16.089 5.594 1.00 0.00 O ATOM 0 H ASP A 39 11.993 -12.715 2.295 1.00 0.00 H new ATOM 0 HA ASP A 39 10.604 -13.758 4.659 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.116 -15.093 3.087 1.00 0.00 H new ATOM 0 HB3 ASP A 39 13.458 -14.095 3.610 1.00 0.00 H new ATOM 687 N GLN A 40 12.360 -11.151 4.954 1.00 0.00 N ATOM 688 CA GLN A 40 13.218 -10.222 5.707 1.00 0.00 C ATOM 689 C GLN A 40 12.594 -8.818 5.804 1.00 0.00 C ATOM 690 O GLN A 40 13.189 -7.848 5.313 1.00 0.00 O ATOM 691 CB GLN A 40 14.588 -10.133 5.007 1.00 0.00 C ATOM 692 CG GLN A 40 15.340 -11.457 4.913 1.00 0.00 C ATOM 693 CD GLN A 40 16.297 -11.463 3.726 1.00 0.00 C ATOM 694 OE1 GLN A 40 17.338 -10.813 3.721 1.00 0.00 O ATOM 695 NE2 GLN A 40 15.950 -12.133 2.646 1.00 0.00 N ATOM 0 H GLN A 40 11.990 -10.738 4.098 1.00 0.00 H new ATOM 0 HA GLN A 40 13.330 -10.603 6.722 1.00 0.00 H new ATOM 0 HB2 GLN A 40 14.442 -9.741 4.001 1.00 0.00 H new ATOM 0 HB3 GLN A 40 15.209 -9.415 5.542 1.00 0.00 H new ATOM 0 HG2 GLN A 40 15.897 -11.628 5.834 1.00 0.00 H new ATOM 0 HG3 GLN A 40 14.628 -12.277 4.814 1.00 0.00 H new ATOM 0 HE21 GLN A 40 15.087 -12.677 2.638 1.00 0.00 H new ATOM 0 HE22 GLN A 40 16.544 -12.108 1.817 1.00 0.00 H new ATOM 704 N PRO A 41 11.386 -8.663 6.376 1.00 0.00 N ATOM 705 CA PRO A 41 10.722 -7.376 6.337 1.00 0.00 C ATOM 706 C PRO A 41 11.472 -6.306 7.141 1.00 0.00 C ATOM 707 O PRO A 41 11.965 -6.555 8.244 1.00 0.00 O ATOM 708 CB PRO A 41 9.288 -7.602 6.831 1.00 0.00 C ATOM 709 CG PRO A 41 9.424 -8.855 7.700 1.00 0.00 C ATOM 710 CD PRO A 41 10.532 -9.655 7.011 1.00 0.00 C ATOM 0 HA PRO A 41 10.708 -6.982 5.321 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.918 -6.751 7.403 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.595 -7.756 6.004 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.691 -8.603 8.727 1.00 0.00 H new ATOM 0 HG3 PRO A 41 8.491 -9.417 7.742 1.00 0.00 H new ATOM 0 HD2 PRO A 41 11.092 -10.252 7.731 1.00 0.00 H new ATOM 0 HD3 PRO A 41 10.119 -10.346 6.276 1.00 0.00 H new ATOM 718 N ASP A 42 11.531 -5.094 6.589 1.00 0.00 N ATOM 719 CA ASP A 42 12.101 -3.919 7.260 1.00 0.00 C ATOM 720 C ASP A 42 11.214 -3.462 8.433 1.00 0.00 C ATOM 721 O ASP A 42 11.705 -2.908 9.420 1.00 0.00 O ATOM 722 CB ASP A 42 12.267 -2.797 6.223 1.00 0.00 C ATOM 723 CG ASP A 42 12.967 -1.561 6.808 1.00 0.00 C ATOM 724 OD1 ASP A 42 14.143 -1.672 7.230 1.00 0.00 O ATOM 725 OD2 ASP A 42 12.365 -0.462 6.782 1.00 0.00 O ATOM 0 H ASP A 42 11.181 -4.895 5.652 1.00 0.00 H new ATOM 0 HA ASP A 42 13.073 -4.176 7.680 1.00 0.00 H new ATOM 0 HB2 ASP A 42 12.842 -3.171 5.376 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.287 -2.510 5.841 1.00 0.00 H new ATOM 730 N TRP A 43 9.909 -3.737 8.333 1.00 0.00 N ATOM 731 CA TRP A 43 8.893 -3.458 9.349 1.00 0.00 C ATOM 732 C TRP A 43 7.664 -4.360 9.151 1.00 0.00 C ATOM 733 O TRP A 43 7.341 -4.735 8.021 1.00 0.00 O ATOM 734 CB TRP A 43 8.513 -1.975 9.245 1.00 0.00 C ATOM 735 CG TRP A 43 7.342 -1.528 10.058 1.00 0.00 C ATOM 736 CD1 TRP A 43 7.387 -0.971 11.289 1.00 0.00 C ATOM 737 CD2 TRP A 43 5.934 -1.549 9.678 1.00 0.00 C ATOM 738 NE1 TRP A 43 6.109 -0.620 11.683 1.00 0.00 N ATOM 739 CE2 TRP A 43 5.182 -0.914 10.706 1.00 0.00 C ATOM 740 CE3 TRP A 43 5.223 -2.032 8.558 1.00 0.00 C ATOM 741 CZ2 TRP A 43 3.801 -0.702 10.594 1.00 0.00 C ATOM 742 CZ3 TRP A 43 3.836 -1.818 8.438 1.00 0.00 C ATOM 743 CH2 TRP A 43 3.124 -1.154 9.451 1.00 0.00 C ATOM 0 H TRP A 43 9.516 -4.181 7.503 1.00 0.00 H new ATOM 0 HA TRP A 43 9.287 -3.669 10.343 1.00 0.00 H new ATOM 0 HB2 TRP A 43 9.378 -1.380 9.537 1.00 0.00 H new ATOM 0 HB3 TRP A 43 8.309 -1.748 8.199 1.00 0.00 H new ATOM 0 HD1 TRP A 43 8.283 -0.823 11.874 1.00 0.00 H new ATOM 0 HE1 TRP A 43 5.881 -0.197 12.583 1.00 0.00 H new ATOM 0 HE3 TRP A 43 5.749 -2.572 7.784 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 3.262 -0.195 11.381 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 3.315 -2.168 7.559 1.00 0.00 H new ATOM 0 HH2 TRP A 43 2.061 -0.992 9.350 1.00 0.00 H new ATOM 754 N THR A 44 6.942 -4.674 10.232 1.00 0.00 N ATOM 755 CA THR A 44 5.611 -5.304 10.174 1.00 0.00 C ATOM 756 C THR A 44 4.612 -4.606 11.093 1.00 0.00 C ATOM 757 O THR A 44 4.974 -4.058 12.139 1.00 0.00 O ATOM 758 CB THR A 44 5.636 -6.805 10.496 1.00 0.00 C ATOM 759 OG1 THR A 44 6.050 -7.068 11.821 1.00 0.00 O ATOM 760 CG2 THR A 44 6.540 -7.597 9.565 1.00 0.00 C ATOM 0 H THR A 44 7.265 -4.498 11.183 1.00 0.00 H new ATOM 0 HA THR A 44 5.289 -5.191 9.139 1.00 0.00 H new ATOM 0 HB THR A 44 4.603 -7.126 10.359 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.369 -7.992 11.887 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.515 -8.651 9.843 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.193 -7.485 8.538 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.561 -7.224 9.645 1.00 0.00 H new ATOM 768 N GLY A 45 3.336 -4.648 10.716 1.00 0.00 N ATOM 769 CA GLY A 45 2.264 -3.967 11.444 1.00 0.00 C ATOM 770 C GLY A 45 0.889 -4.143 10.808 1.00 0.00 C ATOM 771 O GLY A 45 0.570 -5.218 10.301 1.00 0.00 O ATOM 0 H GLY A 45 3.014 -5.157 9.893 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.234 -4.344 12.466 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.495 -2.903 11.503 1.00 0.00 H new ATOM 775 N ARG A 46 0.077 -3.084 10.857 1.00 0.00 N ATOM 776 CA ARG A 46 -1.313 -3.025 10.384 1.00 0.00 C ATOM 777 C ARG A 46 -1.450 -2.162 9.129 1.00 0.00 C ATOM 778 O ARG A 46 -0.788 -1.131 8.995 1.00 0.00 O ATOM 779 CB ARG A 46 -2.245 -2.473 11.482 1.00 0.00 C ATOM 780 CG ARG A 46 -2.001 -3.048 12.887 1.00 0.00 C ATOM 781 CD ARG A 46 -3.129 -2.698 13.869 1.00 0.00 C ATOM 782 NE ARG A 46 -3.316 -1.239 14.042 1.00 0.00 N ATOM 783 CZ ARG A 46 -3.728 -0.612 15.130 1.00 0.00 C ATOM 784 NH1 ARG A 46 -3.956 0.668 15.101 1.00 0.00 N ATOM 785 NH2 ARG A 46 -3.942 -1.228 16.259 1.00 0.00 N ATOM 0 H ARG A 46 0.386 -2.195 11.249 1.00 0.00 H new ATOM 0 HA ARG A 46 -1.605 -4.046 10.137 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -2.132 -1.390 11.524 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -3.278 -2.675 11.197 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -1.904 -4.132 12.821 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -1.056 -2.667 13.273 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -4.061 -3.138 13.515 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -2.912 -3.148 14.838 1.00 0.00 H new ATOM 0 HE ARG A 46 -3.104 -0.655 13.233 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -3.817 1.191 14.237 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -4.274 1.149 15.943 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -3.792 -2.235 16.327 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -4.260 -0.703 17.074 1.00 0.00 H new ATOM 799 N LEU A 47 -2.375 -2.550 8.258 1.00 0.00 N ATOM 800 CA LEU A 47 -2.920 -1.730 7.177 1.00 0.00 C ATOM 801 C LEU A 47 -4.070 -0.866 7.711 1.00 0.00 C ATOM 802 O LEU A 47 -4.928 -1.376 8.436 1.00 0.00 O ATOM 803 CB LEU A 47 -3.441 -2.676 6.080 1.00 0.00 C ATOM 804 CG LEU A 47 -4.116 -1.977 4.885 1.00 0.00 C ATOM 805 CD1 LEU A 47 -3.101 -1.242 4.011 1.00 0.00 C ATOM 806 CD2 LEU A 47 -4.855 -3.013 4.048 1.00 0.00 C ATOM 0 H LEU A 47 -2.784 -3.484 8.285 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.151 -1.071 6.774 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.607 -3.272 5.709 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.154 -3.368 6.527 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.815 -1.238 5.276 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.617 -0.762 3.179 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.589 -0.485 4.606 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.372 -1.953 3.624 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -5.334 -2.522 3.201 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.148 -3.758 3.683 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.613 -3.502 4.660 1.00 0.00 H new ATOM 818 N ARG A 48 -4.147 0.395 7.278 1.00 0.00 N ATOM 819 CA ARG A 48 -5.299 1.287 7.474 1.00 0.00 C ATOM 820 C ARG A 48 -5.500 2.188 6.253 1.00 0.00 C ATOM 821 O ARG A 48 -4.933 3.275 6.148 1.00 0.00 O ATOM 822 CB ARG A 48 -5.096 2.067 8.786 1.00 0.00 C ATOM 823 CG ARG A 48 -6.271 3.000 9.112 1.00 0.00 C ATOM 824 CD ARG A 48 -6.095 3.594 10.511 1.00 0.00 C ATOM 825 NE ARG A 48 -7.202 4.496 10.865 1.00 0.00 N ATOM 826 CZ ARG A 48 -8.355 4.199 11.425 1.00 0.00 C ATOM 827 NH1 ARG A 48 -9.171 5.171 11.692 1.00 0.00 N ATOM 828 NH2 ARG A 48 -8.712 2.981 11.726 1.00 0.00 N ATOM 0 H ARG A 48 -3.386 0.840 6.765 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.221 0.713 7.567 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.960 1.361 9.606 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.180 2.654 8.716 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -6.327 3.799 8.373 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -7.210 2.449 9.057 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -6.034 2.789 11.243 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.152 4.139 10.558 1.00 0.00 H new ATOM 0 HE ARG A 48 -7.056 5.482 10.648 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -8.911 6.131 11.468 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -10.073 4.975 12.126 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -8.084 2.202 11.528 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -9.619 2.808 12.160 1.00 0.00 H new ATOM 842 N ILE A 49 -6.334 1.734 5.322 1.00 0.00 N ATOM 843 CA ILE A 49 -6.781 2.545 4.185 1.00 0.00 C ATOM 844 C ILE A 49 -7.846 3.522 4.680 1.00 0.00 C ATOM 845 O ILE A 49 -8.841 3.124 5.291 1.00 0.00 O ATOM 846 CB ILE A 49 -7.298 1.698 3.004 1.00 0.00 C ATOM 847 CG1 ILE A 49 -6.307 0.567 2.656 1.00 0.00 C ATOM 848 CG2 ILE A 49 -7.538 2.612 1.786 1.00 0.00 C ATOM 849 CD1 ILE A 49 -6.749 -0.273 1.459 1.00 0.00 C ATOM 0 H ILE A 49 -6.722 0.791 5.331 1.00 0.00 H new ATOM 0 HA ILE A 49 -5.923 3.090 3.791 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.239 1.229 3.290 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -5.329 1.001 2.446 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.188 -0.082 3.523 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.903 2.016 0.950 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -8.278 3.371 2.041 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.603 3.096 1.505 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -6.009 -1.050 1.267 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -7.713 -0.735 1.674 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.841 0.366 0.580 1.00 0.00 H new ATOM 861 N THR A 50 -7.621 4.800 4.404 1.00 0.00 N ATOM 862 CA THR A 50 -8.460 5.941 4.784 1.00 0.00 C ATOM 863 C THR A 50 -8.568 6.928 3.616 1.00 0.00 C ATOM 864 O THR A 50 -7.789 6.844 2.673 1.00 0.00 O ATOM 865 CB THR A 50 -7.882 6.645 6.027 1.00 0.00 C ATOM 866 OG1 THR A 50 -6.480 6.744 6.001 1.00 0.00 O ATOM 867 CG2 THR A 50 -8.263 5.961 7.337 1.00 0.00 C ATOM 0 H THR A 50 -6.798 5.091 3.876 1.00 0.00 H new ATOM 0 HA THR A 50 -9.457 5.574 5.028 1.00 0.00 H new ATOM 0 HB THR A 50 -8.326 7.640 5.987 1.00 0.00 H new ATOM 0 HG1 THR A 50 -6.123 6.575 6.898 1.00 0.00 H new ATOM 0 HG21 THR A 50 -7.825 6.506 8.173 1.00 0.00 H new ATOM 0 HG22 THR A 50 -9.348 5.950 7.440 1.00 0.00 H new ATOM 0 HG23 THR A 50 -7.889 4.937 7.335 1.00 0.00 H new ATOM 875 N SER A 51 -9.511 7.871 3.659 1.00 0.00 N ATOM 876 CA SER A 51 -9.669 8.941 2.659 1.00 0.00 C ATOM 877 C SER A 51 -10.214 10.224 3.264 1.00 0.00 C ATOM 878 O SER A 51 -10.870 10.202 4.307 1.00 0.00 O ATOM 879 CB SER A 51 -10.635 8.513 1.549 1.00 0.00 C ATOM 880 OG SER A 51 -10.095 7.490 0.744 1.00 0.00 O ATOM 0 H SER A 51 -10.205 7.917 4.405 1.00 0.00 H new ATOM 0 HA SER A 51 -8.671 9.124 2.260 1.00 0.00 H new ATOM 0 HB2 SER A 51 -11.569 8.169 1.994 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.877 9.375 0.927 1.00 0.00 H new ATOM 0 HG SER A 51 -10.618 7.413 -0.081 1.00 0.00 H new ATOM 886 N LYS A 52 -10.016 11.348 2.571 1.00 0.00 N ATOM 887 CA LYS A 52 -10.874 12.525 2.711 1.00 0.00 C ATOM 888 C LYS A 52 -10.980 13.328 1.408 1.00 0.00 C ATOM 889 O LYS A 52 -9.975 13.733 0.823 1.00 0.00 O ATOM 890 CB LYS A 52 -10.376 13.365 3.889 1.00 0.00 C ATOM 891 CG LYS A 52 -11.411 14.371 4.404 1.00 0.00 C ATOM 892 CD LYS A 52 -12.756 13.797 4.881 1.00 0.00 C ATOM 893 CE LYS A 52 -12.584 12.837 6.065 1.00 0.00 C ATOM 894 NZ LYS A 52 -13.894 12.368 6.584 1.00 0.00 N ATOM 0 H LYS A 52 -9.258 11.467 1.899 1.00 0.00 H new ATOM 0 HA LYS A 52 -11.893 12.201 2.923 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -10.091 12.700 4.704 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -9.477 13.903 3.587 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -10.965 14.925 5.230 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -11.611 15.090 3.610 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -13.417 14.614 5.170 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -13.239 13.273 4.057 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -11.987 11.979 5.755 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -12.034 13.337 6.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -13.848 12.286 7.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -14.635 13.050 6.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -14.118 11.439 6.173 1.00 0.00 H new ATOM 908 N GLY A 53 -12.213 13.549 0.955 1.00 0.00 N ATOM 909 CA GLY A 53 -12.546 14.252 -0.279 1.00 0.00 C ATOM 910 C GLY A 53 -12.231 13.372 -1.482 1.00 0.00 C ATOM 911 O GLY A 53 -12.684 12.229 -1.568 1.00 0.00 O ATOM 0 H GLY A 53 -13.040 13.229 1.460 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -13.603 14.520 -0.281 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -11.981 15.182 -0.341 1.00 0.00 H new ATOM 915 N LYS A 54 -11.410 13.903 -2.383 1.00 0.00 N ATOM 916 CA LYS A 54 -10.908 13.229 -3.589 1.00 0.00 C ATOM 917 C LYS A 54 -9.484 12.678 -3.429 1.00 0.00 C ATOM 918 O LYS A 54 -8.821 12.368 -4.419 1.00 0.00 O ATOM 919 CB LYS A 54 -11.062 14.203 -4.760 1.00 0.00 C ATOM 920 CG LYS A 54 -12.538 14.413 -5.139 1.00 0.00 C ATOM 921 CD LYS A 54 -12.730 15.303 -6.373 1.00 0.00 C ATOM 922 CE LYS A 54 -12.242 16.739 -6.138 1.00 0.00 C ATOM 923 NZ LYS A 54 -12.490 17.602 -7.323 1.00 0.00 N ATOM 0 H LYS A 54 -11.058 14.856 -2.294 1.00 0.00 H new ATOM 0 HA LYS A 54 -11.499 12.334 -3.783 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -10.615 15.161 -4.497 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -10.516 13.823 -5.623 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -12.999 13.443 -5.325 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -13.062 14.859 -4.294 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -12.191 14.872 -7.216 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -13.785 15.320 -6.645 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -12.749 17.159 -5.269 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -11.176 16.729 -5.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -12.148 18.565 -7.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -11.986 17.215 -8.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -13.510 17.631 -7.524 1.00 0.00 H new ATOM 937 N THR A 55 -9.026 12.534 -2.187 1.00 0.00 N ATOM 938 CA THR A 55 -7.702 12.005 -1.843 1.00 0.00 C ATOM 939 C THR A 55 -7.840 10.817 -0.894 1.00 0.00 C ATOM 940 O THR A 55 -8.467 10.926 0.162 1.00 0.00 O ATOM 941 CB THR A 55 -6.812 13.095 -1.222 1.00 0.00 C ATOM 942 OG1 THR A 55 -6.841 14.272 -2.010 1.00 0.00 O ATOM 943 CG2 THR A 55 -5.355 12.646 -1.163 1.00 0.00 C ATOM 0 H THR A 55 -9.578 12.788 -1.368 1.00 0.00 H new ATOM 0 HA THR A 55 -7.221 11.667 -2.761 1.00 0.00 H new ATOM 0 HB THR A 55 -7.199 13.282 -0.220 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.271 14.955 -1.599 1.00 0.00 H new ATOM 0 HG21 THR A 55 -4.749 13.436 -0.720 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.276 11.744 -0.556 1.00 0.00 H new ATOM 0 HG23 THR A 55 -4.998 12.437 -2.171 1.00 0.00 H new ATOM 951 N ALA A 56 -7.243 9.685 -1.266 1.00 0.00 N ATOM 952 CA ALA A 56 -7.103 8.506 -0.418 1.00 0.00 C ATOM 953 C ALA A 56 -5.711 8.448 0.227 1.00 0.00 C ATOM 954 O ALA A 56 -4.766 9.081 -0.239 1.00 0.00 O ATOM 955 CB ALA A 56 -7.446 7.243 -1.215 1.00 0.00 C ATOM 0 H ALA A 56 -6.833 9.561 -2.192 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.813 8.571 0.406 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -7.339 6.368 -0.574 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -8.473 7.307 -1.573 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.770 7.155 -2.066 1.00 0.00 H new ATOM 961 N TYR A 57 -5.596 7.683 1.306 1.00 0.00 N ATOM 962 CA TYR A 57 -4.444 7.591 2.193 1.00 0.00 C ATOM 963 C TYR A 57 -4.263 6.127 2.632 1.00 0.00 C ATOM 964 O TYR A 57 -4.987 5.626 3.498 1.00 0.00 O ATOM 965 CB TYR A 57 -4.672 8.517 3.409 1.00 0.00 C ATOM 966 CG TYR A 57 -4.967 9.978 3.094 1.00 0.00 C ATOM 967 CD1 TYR A 57 -6.237 10.537 3.370 1.00 0.00 C ATOM 968 CD2 TYR A 57 -3.959 10.786 2.533 1.00 0.00 C ATOM 969 CE1 TYR A 57 -6.502 11.887 3.066 1.00 0.00 C ATOM 970 CE2 TYR A 57 -4.221 12.135 2.225 1.00 0.00 C ATOM 971 CZ TYR A 57 -5.494 12.688 2.485 1.00 0.00 C ATOM 972 OH TYR A 57 -5.736 13.991 2.178 1.00 0.00 O ATOM 0 H TYR A 57 -6.355 7.070 1.604 1.00 0.00 H new ATOM 0 HA TYR A 57 -3.536 7.910 1.681 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.501 8.118 3.993 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -3.786 8.475 4.043 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -7.007 9.926 3.816 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -2.982 10.370 2.338 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -7.474 12.308 3.277 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -3.446 12.748 1.789 1.00 0.00 H new ATOM 0 HH TYR A 57 -4.931 14.390 1.787 1.00 0.00 H new ATOM 982 N ILE A 58 -3.295 5.413 2.054 1.00 0.00 N ATOM 983 CA ILE A 58 -2.888 4.091 2.557 1.00 0.00 C ATOM 984 C ILE A 58 -1.936 4.333 3.728 1.00 0.00 C ATOM 985 O ILE A 58 -0.742 4.553 3.522 1.00 0.00 O ATOM 986 CB ILE A 58 -2.291 3.187 1.446 1.00 0.00 C ATOM 987 CG1 ILE A 58 -3.311 2.798 0.347 1.00 0.00 C ATOM 988 CG2 ILE A 58 -1.760 1.876 2.061 1.00 0.00 C ATOM 989 CD1 ILE A 58 -3.511 3.844 -0.756 1.00 0.00 C ATOM 0 H ILE A 58 -2.774 5.726 1.234 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.755 3.529 2.903 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.497 3.776 0.986 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.987 1.865 -0.114 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.274 2.603 0.820 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.343 1.248 1.274 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.984 2.105 2.792 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.577 1.348 2.552 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.243 3.478 -1.476 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.870 4.774 -0.315 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.563 4.025 -1.262 1.00 0.00 H new ATOM 1001 N LYS A 59 -2.472 4.345 4.954 1.00 0.00 N ATOM 1002 CA LYS A 59 -1.681 4.472 6.187 1.00 0.00 C ATOM 1003 C LYS A 59 -1.262 3.098 6.723 1.00 0.00 C ATOM 1004 O LYS A 59 -2.029 2.137 6.678 1.00 0.00 O ATOM 1005 CB LYS A 59 -2.431 5.309 7.240 1.00 0.00 C ATOM 1006 CG LYS A 59 -2.993 6.619 6.657 1.00 0.00 C ATOM 1007 CD LYS A 59 -3.350 7.640 7.743 1.00 0.00 C ATOM 1008 CE LYS A 59 -4.098 8.827 7.125 1.00 0.00 C ATOM 1009 NZ LYS A 59 -4.504 9.812 8.159 1.00 0.00 N ATOM 0 H LYS A 59 -3.475 4.266 5.121 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.763 5.009 5.949 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.248 4.719 7.654 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.756 5.541 8.064 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -2.259 7.056 5.980 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.881 6.398 6.065 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.968 7.169 8.507 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -2.443 7.989 8.237 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -3.462 9.315 6.386 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.981 8.467 6.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -4.962 10.626 7.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -5.171 9.366 8.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -3.664 10.135 8.680 1.00 0.00 H new ATOM 1023 N LEU A 60 -0.042 3.016 7.242 1.00 0.00 N ATOM 1024 CA LEU A 60 0.542 1.857 7.925 1.00 0.00 C ATOM 1025 C LEU A 60 0.770 2.184 9.409 1.00 0.00 C ATOM 1026 O LEU A 60 1.326 3.234 9.734 1.00 0.00 O ATOM 1027 CB LEU A 60 1.857 1.467 7.221 1.00 0.00 C ATOM 1028 CG LEU A 60 1.729 0.354 6.168 1.00 0.00 C ATOM 1029 CD1 LEU A 60 0.711 0.640 5.062 1.00 0.00 C ATOM 1030 CD2 LEU A 60 3.086 0.151 5.497 1.00 0.00 C ATOM 0 H LEU A 60 0.608 3.801 7.197 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.140 1.008 7.876 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.271 2.354 6.741 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.575 1.149 7.977 1.00 0.00 H new ATOM 0 HG LEU A 60 1.382 -0.527 6.708 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.687 -0.197 4.364 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.277 0.774 5.503 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.997 1.547 4.530 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.007 -0.637 4.748 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.397 1.079 5.017 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.824 -0.134 6.247 1.00 0.00 H new ATOM 1042 N GLU A 61 0.369 1.288 10.312 1.00 0.00 N ATOM 1043 CA GLU A 61 0.377 1.521 11.768 1.00 0.00 C ATOM 1044 C GLU A 61 1.021 0.375 12.554 1.00 0.00 C ATOM 1045 O GLU A 61 0.907 -0.791 12.180 1.00 0.00 O ATOM 1046 CB GLU A 61 -1.047 1.714 12.304 1.00 0.00 C ATOM 1047 CG GLU A 61 -1.797 2.914 11.716 1.00 0.00 C ATOM 1048 CD GLU A 61 -3.137 3.116 12.447 1.00 0.00 C ATOM 1049 OE1 GLU A 61 -3.507 4.280 12.728 1.00 0.00 O ATOM 1050 OE2 GLU A 61 -3.825 2.108 12.749 1.00 0.00 O ATOM 0 H GLU A 61 0.023 0.364 10.054 1.00 0.00 H new ATOM 0 HA GLU A 61 0.971 2.424 11.912 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -1.622 0.810 12.103 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -1.000 1.828 13.387 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -1.187 3.813 11.806 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -1.975 2.755 10.653 1.00 0.00 H new ATOM 1057 N ASP A 62 1.669 0.676 13.678 1.00 0.00 N ATOM 1058 CA ASP A 62 2.244 -0.328 14.567 1.00 0.00 C ATOM 1059 C ASP A 62 1.142 -1.141 15.262 1.00 0.00 C ATOM 1060 O ASP A 62 0.182 -0.593 15.810 1.00 0.00 O ATOM 1061 CB ASP A 62 3.124 0.376 15.597 1.00 0.00 C ATOM 1062 CG ASP A 62 3.986 -0.628 16.363 1.00 0.00 C ATOM 1063 OD1 ASP A 62 5.185 -0.786 16.037 1.00 0.00 O ATOM 1064 OD2 ASP A 62 3.429 -1.275 17.276 1.00 0.00 O ATOM 0 H ASP A 62 1.810 1.634 13.999 1.00 0.00 H new ATOM 0 HA ASP A 62 2.846 -1.025 13.984 1.00 0.00 H new ATOM 0 HB2 ASP A 62 3.764 1.103 15.097 1.00 0.00 H new ATOM 0 HB3 ASP A 62 2.498 0.931 16.296 1.00 0.00 H new ATOM 1069 N LYS A 63 1.305 -2.463 15.276 1.00 0.00 N ATOM 1070 CA LYS A 63 0.335 -3.423 15.824 1.00 0.00 C ATOM 1071 C LYS A 63 0.311 -3.544 17.349 1.00 0.00 C ATOM 1072 O LYS A 63 -0.548 -4.243 17.888 1.00 0.00 O ATOM 1073 CB LYS A 63 0.514 -4.787 15.124 1.00 0.00 C ATOM 1074 CG LYS A 63 1.975 -5.266 15.171 1.00 0.00 C ATOM 1075 CD LYS A 63 2.167 -6.645 14.535 1.00 0.00 C ATOM 1076 CE LYS A 63 3.643 -6.805 14.148 1.00 0.00 C ATOM 1077 NZ LYS A 63 3.904 -8.095 13.459 1.00 0.00 N ATOM 0 H LYS A 63 2.138 -2.913 14.897 1.00 0.00 H new ATOM 0 HA LYS A 63 -0.653 -3.020 15.602 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -0.127 -5.528 15.602 1.00 0.00 H new ATOM 0 HB3 LYS A 63 0.191 -4.708 14.086 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.607 -4.542 14.656 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.309 -5.299 16.208 1.00 0.00 H new ATOM 0 HD2 LYS A 63 1.872 -7.428 15.234 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.532 -6.747 13.655 1.00 0.00 H new ATOM 0 HE2 LYS A 63 3.938 -5.981 13.498 1.00 0.00 H new ATOM 0 HE3 LYS A 63 4.261 -6.741 15.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 4.685 -7.975 12.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 4.162 -8.818 14.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.048 -8.396 12.951 1.00 0.00 H new ATOM 1091 N VAL A 64 1.212 -2.850 18.043 1.00 0.00 N ATOM 1092 CA VAL A 64 1.318 -2.827 19.506 1.00 0.00 C ATOM 1093 C VAL A 64 1.155 -1.409 20.059 1.00 0.00 C ATOM 1094 O VAL A 64 0.430 -1.221 21.039 1.00 0.00 O ATOM 1095 CB VAL A 64 2.659 -3.458 19.930 1.00 0.00 C ATOM 1096 CG1 VAL A 64 2.965 -3.294 21.425 1.00 0.00 C ATOM 1097 CG2 VAL A 64 2.683 -4.960 19.615 1.00 0.00 C ATOM 0 H VAL A 64 1.914 -2.267 17.588 1.00 0.00 H new ATOM 0 HA VAL A 64 0.505 -3.416 19.930 1.00 0.00 H new ATOM 0 HB VAL A 64 3.417 -2.923 19.358 1.00 0.00 H new ATOM 0 HG11 VAL A 64 3.923 -3.761 21.654 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.010 -2.234 21.673 1.00 0.00 H new ATOM 0 HG13 VAL A 64 2.180 -3.771 22.012 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.640 -5.381 19.924 1.00 0.00 H new ATOM 0 HG22 VAL A 64 1.877 -5.458 20.154 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.550 -5.109 18.544 1.00 0.00 H new ATOM 1107 N SER A 65 1.767 -0.405 19.423 1.00 0.00 N ATOM 1108 CA SER A 65 1.712 0.992 19.886 1.00 0.00 C ATOM 1109 C SER A 65 0.585 1.804 19.237 1.00 0.00 C ATOM 1110 O SER A 65 0.183 2.839 19.771 1.00 0.00 O ATOM 1111 CB SER A 65 3.058 1.684 19.641 1.00 0.00 C ATOM 1112 OG SER A 65 4.088 1.060 20.394 1.00 0.00 O ATOM 0 H SER A 65 2.315 -0.534 18.573 1.00 0.00 H new ATOM 0 HA SER A 65 1.498 0.953 20.954 1.00 0.00 H new ATOM 0 HB2 SER A 65 3.303 1.647 18.580 1.00 0.00 H new ATOM 0 HB3 SER A 65 2.987 2.736 19.915 1.00 0.00 H new ATOM 0 HG SER A 65 4.939 1.514 20.223 1.00 0.00 H new ATOM 1118 N GLY A 66 0.076 1.356 18.084 1.00 0.00 N ATOM 1119 CA GLY A 66 -0.959 2.050 17.304 1.00 0.00 C ATOM 1120 C GLY A 66 -0.451 3.303 16.575 1.00 0.00 C ATOM 1121 O GLY A 66 -1.248 4.108 16.093 1.00 0.00 O ATOM 0 H GLY A 66 0.378 0.481 17.656 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.373 1.358 16.571 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.773 2.334 17.970 1.00 0.00 H new ATOM 1125 N GLU A 67 0.870 3.493 16.525 1.00 0.00 N ATOM 1126 CA GLU A 67 1.535 4.683 15.988 1.00 0.00 C ATOM 1127 C GLU A 67 1.775 4.582 14.473 1.00 0.00 C ATOM 1128 O GLU A 67 1.920 3.485 13.933 1.00 0.00 O ATOM 1129 CB GLU A 67 2.819 4.951 16.790 1.00 0.00 C ATOM 1130 CG GLU A 67 3.975 3.979 16.514 1.00 0.00 C ATOM 1131 CD GLU A 67 5.212 4.350 17.356 1.00 0.00 C ATOM 1132 OE1 GLU A 67 5.359 3.831 18.489 1.00 0.00 O ATOM 1133 OE2 GLU A 67 6.047 5.164 16.892 1.00 0.00 O ATOM 0 H GLU A 67 1.530 2.796 16.870 1.00 0.00 H new ATOM 0 HA GLU A 67 0.877 5.544 16.107 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.158 5.964 16.575 1.00 0.00 H new ATOM 0 HB3 GLU A 67 2.579 4.914 17.853 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.663 2.960 16.746 1.00 0.00 H new ATOM 0 HG3 GLU A 67 4.230 4.001 15.455 1.00 0.00 H new ATOM 1140 N LEU A 68 1.832 5.718 13.775 1.00 0.00 N ATOM 1141 CA LEU A 68 2.022 5.758 12.321 1.00 0.00 C ATOM 1142 C LEU A 68 3.463 5.369 11.931 1.00 0.00 C ATOM 1143 O LEU A 68 4.426 5.977 12.404 1.00 0.00 O ATOM 1144 CB LEU A 68 1.648 7.162 11.802 1.00 0.00 C ATOM 1145 CG LEU A 68 1.593 7.265 10.265 1.00 0.00 C ATOM 1146 CD1 LEU A 68 0.339 6.600 9.698 1.00 0.00 C ATOM 1147 CD2 LEU A 68 1.573 8.730 9.829 1.00 0.00 C ATOM 0 H LEU A 68 1.748 6.640 14.203 1.00 0.00 H new ATOM 0 HA LEU A 68 1.367 5.023 11.853 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.677 7.443 12.210 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.373 7.883 12.179 1.00 0.00 H new ATOM 0 HG LEU A 68 2.480 6.757 9.886 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.337 6.694 8.612 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.332 5.545 9.971 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.547 7.087 10.106 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.534 8.785 8.741 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.696 9.223 10.249 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.475 9.228 10.186 1.00 0.00 H new ATOM 1159 N PHE A 69 3.606 4.399 11.024 1.00 0.00 N ATOM 1160 CA PHE A 69 4.878 4.046 10.382 1.00 0.00 C ATOM 1161 C PHE A 69 5.120 4.902 9.129 1.00 0.00 C ATOM 1162 O PHE A 69 6.138 5.588 9.024 1.00 0.00 O ATOM 1163 CB PHE A 69 4.885 2.545 10.052 1.00 0.00 C ATOM 1164 CG PHE A 69 6.008 2.105 9.124 1.00 0.00 C ATOM 1165 CD1 PHE A 69 7.334 2.048 9.595 1.00 0.00 C ATOM 1166 CD2 PHE A 69 5.734 1.778 7.780 1.00 0.00 C ATOM 1167 CE1 PHE A 69 8.375 1.653 8.734 1.00 0.00 C ATOM 1168 CE2 PHE A 69 6.777 1.399 6.917 1.00 0.00 C ATOM 1169 CZ PHE A 69 8.097 1.327 7.395 1.00 0.00 C ATOM 0 H PHE A 69 2.825 3.824 10.708 1.00 0.00 H new ATOM 0 HA PHE A 69 5.697 4.254 11.071 1.00 0.00 H new ATOM 0 HB2 PHE A 69 4.959 1.982 10.983 1.00 0.00 H new ATOM 0 HB3 PHE A 69 3.931 2.282 9.596 1.00 0.00 H new ATOM 0 HD1 PHE A 69 7.553 2.308 10.620 1.00 0.00 H new ATOM 0 HD2 PHE A 69 4.719 1.819 7.412 1.00 0.00 H new ATOM 0 HE1 PHE A 69 9.389 1.600 9.102 1.00 0.00 H new ATOM 0 HE2 PHE A 69 6.564 1.163 5.885 1.00 0.00 H new ATOM 0 HZ PHE A 69 8.896 1.022 6.735 1.00 0.00 H new ATOM 1179 N ALA A 70 4.165 4.874 8.195 1.00 0.00 N ATOM 1180 CA ALA A 70 4.202 5.593 6.924 1.00 0.00 C ATOM 1181 C ALA A 70 2.777 5.804 6.379 1.00 0.00 C ATOM 1182 O ALA A 70 1.841 5.120 6.799 1.00 0.00 O ATOM 1183 CB ALA A 70 5.050 4.779 5.936 1.00 0.00 C ATOM 0 H ALA A 70 3.312 4.327 8.311 1.00 0.00 H new ATOM 0 HA ALA A 70 4.645 6.579 7.066 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.091 5.298 4.978 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.060 4.665 6.331 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.602 3.795 5.796 1.00 0.00 H new ATOM 1189 N GLN A 71 2.605 6.717 5.421 1.00 0.00 N ATOM 1190 CA GLN A 71 1.336 6.897 4.705 1.00 0.00 C ATOM 1191 C GLN A 71 1.537 7.306 3.244 1.00 0.00 C ATOM 1192 O GLN A 71 2.430 8.094 2.941 1.00 0.00 O ATOM 1193 CB GLN A 71 0.415 7.868 5.466 1.00 0.00 C ATOM 1194 CG GLN A 71 0.957 9.291 5.693 1.00 0.00 C ATOM 1195 CD GLN A 71 0.684 10.242 4.530 1.00 0.00 C ATOM 1196 OE1 GLN A 71 -0.425 10.356 4.027 1.00 0.00 O ATOM 1197 NE2 GLN A 71 1.669 10.981 4.071 1.00 0.00 N ATOM 0 H GLN A 71 3.341 7.354 5.118 1.00 0.00 H new ATOM 0 HA GLN A 71 0.839 5.928 4.671 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.526 7.944 4.921 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.186 7.431 6.438 1.00 0.00 H new ATOM 0 HG2 GLN A 71 0.510 9.701 6.599 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.032 9.238 5.864 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.601 10.899 4.478 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.502 11.636 3.307 1.00 0.00 H new ATOM 1206 N ALA A 72 0.708 6.776 2.343 1.00 0.00 N ATOM 1207 CA ALA A 72 0.747 7.033 0.904 1.00 0.00 C ATOM 1208 C ALA A 72 -0.536 7.742 0.418 1.00 0.00 C ATOM 1209 O ALA A 72 -1.578 7.088 0.289 1.00 0.00 O ATOM 1210 CB ALA A 72 0.999 5.702 0.185 1.00 0.00 C ATOM 0 H ALA A 72 -0.037 6.131 2.607 1.00 0.00 H new ATOM 0 HA ALA A 72 1.561 7.719 0.669 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.032 5.870 -0.891 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.950 5.284 0.516 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.195 5.004 0.419 1.00 0.00 H new ATOM 1216 N PRO A 73 -0.478 9.061 0.140 1.00 0.00 N ATOM 1217 CA PRO A 73 -1.541 9.802 -0.535 1.00 0.00 C ATOM 1218 C PRO A 73 -1.763 9.329 -1.978 1.00 0.00 C ATOM 1219 O PRO A 73 -0.805 9.051 -2.700 1.00 0.00 O ATOM 1220 CB PRO A 73 -1.123 11.278 -0.515 1.00 0.00 C ATOM 1221 CG PRO A 73 -0.100 11.354 0.613 1.00 0.00 C ATOM 1222 CD PRO A 73 0.565 9.981 0.562 1.00 0.00 C ATOM 0 HA PRO A 73 -2.488 9.640 -0.020 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -0.691 11.584 -1.468 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.975 11.932 -0.327 1.00 0.00 H new ATOM 0 HG2 PRO A 73 0.619 12.157 0.453 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -0.574 11.538 1.577 1.00 0.00 H new ATOM 0 HD2 PRO A 73 1.400 9.975 -0.138 1.00 0.00 H new ATOM 0 HD3 PRO A 73 0.964 9.702 1.537 1.00 0.00 H new ATOM 1230 N VAL A 74 -3.021 9.298 -2.421 1.00 0.00 N ATOM 1231 CA VAL A 74 -3.454 8.892 -3.770 1.00 0.00 C ATOM 1232 C VAL A 74 -4.546 9.852 -4.247 1.00 0.00 C ATOM 1233 O VAL A 74 -5.494 10.103 -3.508 1.00 0.00 O ATOM 1234 CB VAL A 74 -4.018 7.450 -3.769 1.00 0.00 C ATOM 1235 CG1 VAL A 74 -4.179 6.901 -5.189 1.00 0.00 C ATOM 1236 CG2 VAL A 74 -3.183 6.441 -2.975 1.00 0.00 C ATOM 0 H VAL A 74 -3.805 9.566 -1.827 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.591 8.923 -4.435 1.00 0.00 H new ATOM 0 HB VAL A 74 -4.985 7.554 -3.276 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.577 5.887 -5.144 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -4.865 7.536 -5.749 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.209 6.888 -5.686 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.652 5.458 -3.029 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.179 6.388 -3.397 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.123 6.758 -1.934 1.00 0.00 H new ATOM 1246 N GLU A 75 -4.454 10.372 -5.475 1.00 0.00 N ATOM 1247 CA GLU A 75 -5.481 11.283 -6.038 1.00 0.00 C ATOM 1248 C GLU A 75 -6.413 10.599 -7.058 1.00 0.00 C ATOM 1249 O GLU A 75 -7.490 11.107 -7.370 1.00 0.00 O ATOM 1250 CB GLU A 75 -4.800 12.514 -6.656 1.00 0.00 C ATOM 1251 CG GLU A 75 -4.088 13.381 -5.607 1.00 0.00 C ATOM 1252 CD GLU A 75 -3.479 14.638 -6.259 1.00 0.00 C ATOM 1253 OE1 GLU A 75 -2.318 14.579 -6.733 1.00 0.00 O ATOM 1254 OE2 GLU A 75 -4.154 15.696 -6.303 1.00 0.00 O ATOM 0 H GLU A 75 -3.678 10.182 -6.109 1.00 0.00 H new ATOM 0 HA GLU A 75 -6.122 11.593 -5.212 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -4.078 12.188 -7.404 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -5.546 13.116 -7.174 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -4.795 13.674 -4.831 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.303 12.801 -5.121 1.00 0.00 H new ATOM 1261 N GLN A 76 -5.992 9.449 -7.592 1.00 0.00 N ATOM 1262 CA GLN A 76 -6.750 8.560 -8.479 1.00 0.00 C ATOM 1263 C GLN A 76 -6.112 7.159 -8.481 1.00 0.00 C ATOM 1264 O GLN A 76 -4.893 7.033 -8.344 1.00 0.00 O ATOM 1265 CB GLN A 76 -6.867 9.125 -9.917 1.00 0.00 C ATOM 1266 CG GLN A 76 -5.784 10.103 -10.420 1.00 0.00 C ATOM 1267 CD GLN A 76 -4.358 9.552 -10.397 1.00 0.00 C ATOM 1268 OE1 GLN A 76 -3.966 8.723 -11.204 1.00 0.00 O ATOM 1269 NE2 GLN A 76 -3.512 10.020 -9.500 1.00 0.00 N ATOM 0 H GLN A 76 -5.055 9.091 -7.405 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.767 8.488 -8.093 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -6.892 8.279 -10.603 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -7.830 9.629 -9.997 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -6.027 10.398 -11.441 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -5.819 11.006 -9.810 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.823 10.713 -8.819 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -2.547 9.689 -9.488 1.00 0.00 H new ATOM 1278 N TYR A 77 -6.926 6.111 -8.630 1.00 0.00 N ATOM 1279 CA TYR A 77 -6.490 4.711 -8.606 1.00 0.00 C ATOM 1280 C TYR A 77 -7.120 3.900 -9.762 1.00 0.00 C ATOM 1281 O TYR A 77 -8.354 3.862 -9.858 1.00 0.00 O ATOM 1282 CB TYR A 77 -6.834 4.100 -7.240 1.00 0.00 C ATOM 1283 CG TYR A 77 -6.367 2.667 -7.086 1.00 0.00 C ATOM 1284 CD1 TYR A 77 -5.000 2.358 -7.208 1.00 0.00 C ATOM 1285 CD2 TYR A 77 -7.301 1.639 -6.862 1.00 0.00 C ATOM 1286 CE1 TYR A 77 -4.572 1.019 -7.163 1.00 0.00 C ATOM 1287 CE2 TYR A 77 -6.872 0.301 -6.773 1.00 0.00 C ATOM 1288 CZ TYR A 77 -5.506 -0.015 -6.934 1.00 0.00 C ATOM 1289 OH TYR A 77 -5.098 -1.311 -6.870 1.00 0.00 O ATOM 0 H TYR A 77 -7.931 6.214 -8.774 1.00 0.00 H new ATOM 0 HA TYR A 77 -5.410 4.674 -8.752 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.383 4.707 -6.455 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -7.913 4.140 -7.094 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.278 3.151 -7.336 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -8.349 1.877 -6.758 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -3.528 0.781 -7.304 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -7.589 -0.484 -6.581 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.180 -1.349 -6.529 1.00 0.00 H new ATOM 1299 N PRO A 78 -6.330 3.223 -10.625 1.00 0.00 N ATOM 1300 CA PRO A 78 -4.861 3.211 -10.680 1.00 0.00 C ATOM 1301 C PRO A 78 -4.218 4.593 -10.901 1.00 0.00 C ATOM 1302 O PRO A 78 -4.786 5.458 -11.571 1.00 0.00 O ATOM 1303 CB PRO A 78 -4.491 2.244 -11.811 1.00 0.00 C ATOM 1304 CG PRO A 78 -5.699 1.314 -11.885 1.00 0.00 C ATOM 1305 CD PRO A 78 -6.853 2.266 -11.591 1.00 0.00 C ATOM 0 HA PRO A 78 -4.470 2.896 -9.712 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -4.329 2.769 -12.752 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -3.575 1.697 -11.589 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -5.795 0.848 -12.866 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -5.639 0.508 -11.153 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -7.189 2.768 -12.498 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -7.711 1.729 -11.187 1.00 0.00 H new ATOM 1313 N GLY A 79 -3.026 4.780 -10.328 1.00 0.00 N ATOM 1314 CA GLY A 79 -2.223 6.010 -10.378 1.00 0.00 C ATOM 1315 C GLY A 79 -0.753 5.753 -10.017 1.00 0.00 C ATOM 1316 O GLY A 79 -0.289 4.613 -10.080 1.00 0.00 O ATOM 0 H GLY A 79 -2.570 4.043 -9.790 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -2.281 6.440 -11.378 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -2.642 6.745 -9.690 1.00 0.00 H new ATOM 1320 N ILE A 80 -0.007 6.793 -9.626 1.00 0.00 N ATOM 1321 CA ILE A 80 1.433 6.666 -9.308 1.00 0.00 C ATOM 1322 C ILE A 80 1.695 6.015 -7.940 1.00 0.00 C ATOM 1323 O ILE A 80 2.607 5.202 -7.803 1.00 0.00 O ATOM 1324 CB ILE A 80 2.171 8.021 -9.451 1.00 0.00 C ATOM 1325 CG1 ILE A 80 3.681 7.826 -9.169 1.00 0.00 C ATOM 1326 CG2 ILE A 80 1.577 9.122 -8.549 1.00 0.00 C ATOM 1327 CD1 ILE A 80 4.579 9.012 -9.527 1.00 0.00 C ATOM 0 H ILE A 80 -0.373 7.739 -9.520 1.00 0.00 H new ATOM 0 HA ILE A 80 1.848 5.983 -10.049 1.00 0.00 H new ATOM 0 HB ILE A 80 2.035 8.363 -10.477 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.809 7.603 -8.110 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.026 6.952 -9.722 1.00 0.00 H new ATOM 0 HG21 ILE A 80 2.134 10.048 -8.691 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.531 9.283 -8.812 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.646 8.814 -7.506 1.00 0.00 H new ATOM 0 HD11 ILE A 80 5.615 8.769 -9.289 1.00 0.00 H new ATOM 0 HD12 ILE A 80 4.492 9.226 -10.592 1.00 0.00 H new ATOM 0 HD13 ILE A 80 4.271 9.887 -8.955 1.00 0.00 H new ATOM 1339 N ALA A 81 0.904 6.350 -6.921 1.00 0.00 N ATOM 1340 CA ALA A 81 1.202 6.036 -5.522 1.00 0.00 C ATOM 1341 C ALA A 81 0.785 4.626 -5.086 1.00 0.00 C ATOM 1342 O ALA A 81 0.883 4.315 -3.901 1.00 0.00 O ATOM 1343 CB ALA A 81 0.604 7.143 -4.651 1.00 0.00 C ATOM 0 H ALA A 81 0.026 6.854 -7.045 1.00 0.00 H new ATOM 0 HA ALA A 81 2.284 6.013 -5.395 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.812 6.933 -3.602 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.047 8.101 -4.924 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -0.474 7.185 -4.806 1.00 0.00 H new ATOM 1349 N VAL A 82 0.341 3.780 -6.021 1.00 0.00 N ATOM 1350 CA VAL A 82 -0.112 2.403 -5.782 1.00 0.00 C ATOM 1351 C VAL A 82 0.148 1.543 -7.026 1.00 0.00 C ATOM 1352 O VAL A 82 -0.239 1.916 -8.135 1.00 0.00 O ATOM 1353 CB VAL A 82 -1.615 2.355 -5.439 1.00 0.00 C ATOM 1354 CG1 VAL A 82 -2.016 0.955 -4.951 1.00 0.00 C ATOM 1355 CG2 VAL A 82 -2.072 3.359 -4.375 1.00 0.00 C ATOM 0 H VAL A 82 0.285 4.045 -7.004 1.00 0.00 H new ATOM 0 HA VAL A 82 0.449 2.012 -4.933 1.00 0.00 H new ATOM 0 HB VAL A 82 -2.107 2.622 -6.374 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -3.080 0.943 -4.714 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.810 0.224 -5.733 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.443 0.703 -4.059 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.143 3.246 -4.205 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.535 3.173 -3.445 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.864 4.373 -4.718 1.00 0.00 H new ATOM 1365 N GLU A 83 0.774 0.382 -6.847 1.00 0.00 N ATOM 1366 CA GLU A 83 1.149 -0.572 -7.904 1.00 0.00 C ATOM 1367 C GLU A 83 0.967 -2.036 -7.467 1.00 0.00 C ATOM 1368 O GLU A 83 0.979 -2.362 -6.281 1.00 0.00 O ATOM 1369 CB GLU A 83 2.613 -0.342 -8.333 1.00 0.00 C ATOM 1370 CG GLU A 83 2.746 0.716 -9.430 1.00 0.00 C ATOM 1371 CD GLU A 83 4.214 0.856 -9.874 1.00 0.00 C ATOM 1372 OE1 GLU A 83 5.002 1.541 -9.182 1.00 0.00 O ATOM 1373 OE2 GLU A 83 4.602 0.302 -10.929 1.00 0.00 O ATOM 0 H GLU A 83 1.049 0.060 -5.919 1.00 0.00 H new ATOM 0 HA GLU A 83 0.480 -0.392 -8.745 1.00 0.00 H new ATOM 0 HB2 GLU A 83 3.198 -0.036 -7.466 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.036 -1.282 -8.687 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.127 0.442 -10.284 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.378 1.675 -9.064 1.00 0.00 H new ATOM 1380 N THR A 84 0.837 -2.931 -8.447 1.00 0.00 N ATOM 1381 CA THR A 84 0.727 -4.393 -8.297 1.00 0.00 C ATOM 1382 C THR A 84 2.007 -5.095 -8.765 1.00 0.00 C ATOM 1383 O THR A 84 2.805 -4.540 -9.527 1.00 0.00 O ATOM 1384 CB THR A 84 -0.466 -4.921 -9.116 1.00 0.00 C ATOM 1385 OG1 THR A 84 -0.344 -4.550 -10.476 1.00 0.00 O ATOM 1386 CG2 THR A 84 -1.793 -4.354 -8.616 1.00 0.00 C ATOM 0 H THR A 84 0.803 -2.644 -9.425 1.00 0.00 H new ATOM 0 HA THR A 84 0.575 -4.609 -7.239 1.00 0.00 H new ATOM 0 HB THR A 84 -0.457 -6.005 -9.003 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.110 -4.896 -10.980 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.609 -4.751 -9.220 1.00 0.00 H new ATOM 0 HG22 THR A 84 -1.941 -4.639 -7.574 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.778 -3.267 -8.696 1.00 0.00 H new ATOM 1394 N VAL A 85 2.198 -6.340 -8.329 1.00 0.00 N ATOM 1395 CA VAL A 85 3.184 -7.271 -8.900 1.00 0.00 C ATOM 1396 C VAL A 85 2.570 -8.076 -10.062 1.00 0.00 C ATOM 1397 O VAL A 85 1.350 -8.096 -10.244 1.00 0.00 O ATOM 1398 CB VAL A 85 3.735 -8.217 -7.823 1.00 0.00 C ATOM 1399 CG1 VAL A 85 4.357 -7.429 -6.668 1.00 0.00 C ATOM 1400 CG2 VAL A 85 2.654 -9.143 -7.276 1.00 0.00 C ATOM 0 H VAL A 85 1.666 -6.741 -7.557 1.00 0.00 H new ATOM 0 HA VAL A 85 4.013 -6.681 -9.292 1.00 0.00 H new ATOM 0 HB VAL A 85 4.503 -8.825 -8.302 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.740 -8.122 -5.919 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.175 -6.815 -7.045 1.00 0.00 H new ATOM 0 HG13 VAL A 85 3.600 -6.788 -6.216 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.084 -9.796 -6.517 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.856 -8.548 -6.833 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.248 -9.748 -8.087 1.00 0.00 H new ATOM 1410 N THR A 86 3.398 -8.799 -10.816 1.00 0.00 N ATOM 1411 CA THR A 86 2.983 -9.648 -11.948 1.00 0.00 C ATOM 1412 C THR A 86 2.752 -11.110 -11.563 1.00 0.00 C ATOM 1413 O THR A 86 1.936 -11.791 -12.186 1.00 0.00 O ATOM 1414 CB THR A 86 4.039 -9.604 -13.063 1.00 0.00 C ATOM 1415 OG1 THR A 86 5.268 -10.119 -12.597 1.00 0.00 O ATOM 1416 CG2 THR A 86 4.296 -8.178 -13.537 1.00 0.00 C ATOM 0 H THR A 86 4.405 -8.815 -10.657 1.00 0.00 H new ATOM 0 HA THR A 86 2.032 -9.239 -12.289 1.00 0.00 H new ATOM 0 HB THR A 86 3.650 -10.203 -13.886 1.00 0.00 H new ATOM 0 HG1 THR A 86 5.931 -10.086 -13.318 1.00 0.00 H new ATOM 0 HG21 THR A 86 5.048 -8.187 -14.326 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.371 -7.751 -13.923 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.653 -7.576 -12.702 1.00 0.00 H new ATOM 1424 N ASP A 87 3.466 -11.605 -10.546 1.00 0.00 N ATOM 1425 CA ASP A 87 3.565 -13.041 -10.256 1.00 0.00 C ATOM 1426 C ASP A 87 2.517 -13.532 -9.247 1.00 0.00 C ATOM 1427 O ASP A 87 1.935 -14.603 -9.438 1.00 0.00 O ATOM 1428 CB ASP A 87 4.979 -13.358 -9.760 1.00 0.00 C ATOM 1429 CG ASP A 87 5.209 -14.873 -9.630 1.00 0.00 C ATOM 1430 OD1 ASP A 87 5.416 -15.544 -10.669 1.00 0.00 O ATOM 1431 OD2 ASP A 87 5.185 -15.397 -8.491 1.00 0.00 O ATOM 0 H ASP A 87 3.993 -11.020 -9.898 1.00 0.00 H new ATOM 0 HA ASP A 87 3.360 -13.575 -11.184 1.00 0.00 H new ATOM 0 HB2 ASP A 87 5.710 -12.937 -10.450 1.00 0.00 H new ATOM 0 HB3 ASP A 87 5.141 -12.881 -8.794 1.00 0.00 H new ATOM 1436 N SER A 88 2.258 -12.750 -8.189 1.00 0.00 N ATOM 1437 CA SER A 88 1.304 -13.135 -7.129 1.00 0.00 C ATOM 1438 C SER A 88 0.474 -11.965 -6.592 1.00 0.00 C ATOM 1439 O SER A 88 0.983 -11.082 -5.908 1.00 0.00 O ATOM 1440 CB SER A 88 2.044 -13.849 -5.995 1.00 0.00 C ATOM 1441 OG SER A 88 1.104 -14.362 -5.065 1.00 0.00 O ATOM 0 H SER A 88 2.697 -11.841 -8.041 1.00 0.00 H new ATOM 0 HA SER A 88 0.586 -13.817 -7.586 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.653 -14.659 -6.397 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.723 -13.157 -5.497 1.00 0.00 H new ATOM 0 HG SER A 88 1.578 -14.820 -4.340 1.00 0.00 H new ATOM 1447 N SER A 89 -0.836 -11.972 -6.844 1.00 0.00 N ATOM 1448 CA SER A 89 -1.790 -10.894 -6.517 1.00 0.00 C ATOM 1449 C SER A 89 -2.147 -10.741 -5.019 1.00 0.00 C ATOM 1450 O SER A 89 -3.234 -10.279 -4.669 1.00 0.00 O ATOM 1451 CB SER A 89 -3.017 -11.018 -7.432 1.00 0.00 C ATOM 1452 OG SER A 89 -3.490 -12.357 -7.465 1.00 0.00 O ATOM 0 H SER A 89 -1.288 -12.763 -7.303 1.00 0.00 H new ATOM 0 HA SER A 89 -1.282 -9.951 -6.717 1.00 0.00 H new ATOM 0 HB2 SER A 89 -3.808 -10.357 -7.078 1.00 0.00 H new ATOM 0 HB3 SER A 89 -2.758 -10.694 -8.440 1.00 0.00 H new ATOM 0 HG SER A 89 -4.273 -12.413 -8.052 1.00 0.00 H new ATOM 1458 N ARG A 90 -1.206 -11.082 -4.124 1.00 0.00 N ATOM 1459 CA ARG A 90 -1.205 -10.775 -2.678 1.00 0.00 C ATOM 1460 C ARG A 90 -0.049 -9.849 -2.246 1.00 0.00 C ATOM 1461 O ARG A 90 0.330 -9.833 -1.074 1.00 0.00 O ATOM 1462 CB ARG A 90 -1.394 -12.042 -1.819 1.00 0.00 C ATOM 1463 CG ARG A 90 -0.477 -13.205 -2.208 1.00 0.00 C ATOM 1464 CD ARG A 90 -0.547 -14.371 -1.215 1.00 0.00 C ATOM 1465 NE ARG A 90 0.225 -14.096 0.015 1.00 0.00 N ATOM 1466 CZ ARG A 90 1.246 -14.780 0.503 1.00 0.00 C ATOM 1467 NH1 ARG A 90 1.810 -14.376 1.600 1.00 0.00 N ATOM 1468 NH2 ARG A 90 1.718 -15.857 -0.060 1.00 0.00 N ATOM 0 H ARG A 90 -0.378 -11.609 -4.402 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.089 -10.169 -2.479 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.218 -11.789 -0.774 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.431 -12.369 -1.897 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -0.751 -13.562 -3.201 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.551 -12.847 -2.270 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -1.588 -14.564 -0.955 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.164 -15.275 -1.689 1.00 0.00 H new ATOM 0 HE ARG A 90 -0.065 -13.279 0.553 1.00 0.00 H new ATOM 0 HH11 ARG A 90 1.465 -13.541 2.074 1.00 0.00 H new ATOM 0 HH12 ARG A 90 2.599 -14.893 1.989 1.00 0.00 H new ATOM 0 HH21 ARG A 90 1.297 -16.210 -0.919 1.00 0.00 H new ATOM 0 HH22 ARG A 90 2.509 -16.347 0.359 1.00 0.00 H new ATOM 1482 N TYR A 91 0.502 -9.067 -3.181 1.00 0.00 N ATOM 1483 CA TYR A 91 1.617 -8.142 -2.972 1.00 0.00 C ATOM 1484 C TYR A 91 1.392 -6.835 -3.756 1.00 0.00 C ATOM 1485 O TYR A 91 0.963 -6.868 -4.914 1.00 0.00 O ATOM 1486 CB TYR A 91 2.921 -8.823 -3.416 1.00 0.00 C ATOM 1487 CG TYR A 91 3.315 -10.050 -2.615 1.00 0.00 C ATOM 1488 CD1 TYR A 91 4.040 -9.908 -1.417 1.00 0.00 C ATOM 1489 CD2 TYR A 91 2.955 -11.337 -3.064 1.00 0.00 C ATOM 1490 CE1 TYR A 91 4.379 -11.043 -0.655 1.00 0.00 C ATOM 1491 CE2 TYR A 91 3.306 -12.475 -2.314 1.00 0.00 C ATOM 1492 CZ TYR A 91 4.016 -12.331 -1.104 1.00 0.00 C ATOM 1493 OH TYR A 91 4.348 -13.435 -0.379 1.00 0.00 O ATOM 0 H TYR A 91 0.167 -9.063 -4.145 1.00 0.00 H new ATOM 0 HA TYR A 91 1.684 -7.887 -1.914 1.00 0.00 H new ATOM 0 HB2 TYR A 91 2.824 -9.108 -4.464 1.00 0.00 H new ATOM 0 HB3 TYR A 91 3.730 -8.095 -3.357 1.00 0.00 H new ATOM 0 HD1 TYR A 91 4.337 -8.926 -1.081 1.00 0.00 H new ATOM 0 HD2 TYR A 91 2.407 -11.450 -3.988 1.00 0.00 H new ATOM 0 HE1 TYR A 91 4.917 -10.928 0.274 1.00 0.00 H new ATOM 0 HE2 TYR A 91 3.032 -13.459 -2.665 1.00 0.00 H new ATOM 0 HH TYR A 91 4.018 -14.237 -0.835 1.00 0.00 H new ATOM 1503 N PHE A 92 1.704 -5.688 -3.144 1.00 0.00 N ATOM 1504 CA PHE A 92 1.554 -4.351 -3.736 1.00 0.00 C ATOM 1505 C PHE A 92 2.764 -3.465 -3.437 1.00 0.00 C ATOM 1506 O PHE A 92 3.527 -3.733 -2.515 1.00 0.00 O ATOM 1507 CB PHE A 92 0.292 -3.661 -3.197 1.00 0.00 C ATOM 1508 CG PHE A 92 -0.992 -4.408 -3.466 1.00 0.00 C ATOM 1509 CD1 PHE A 92 -1.637 -4.295 -4.710 1.00 0.00 C ATOM 1510 CD2 PHE A 92 -1.536 -5.229 -2.465 1.00 0.00 C ATOM 1511 CE1 PHE A 92 -2.817 -5.021 -4.954 1.00 0.00 C ATOM 1512 CE2 PHE A 92 -2.727 -5.929 -2.699 1.00 0.00 C ATOM 1513 CZ PHE A 92 -3.361 -5.840 -3.950 1.00 0.00 C ATOM 0 H PHE A 92 2.079 -5.661 -2.196 1.00 0.00 H new ATOM 0 HA PHE A 92 1.473 -4.486 -4.815 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.399 -3.524 -2.121 1.00 0.00 H new ATOM 0 HB3 PHE A 92 0.219 -2.667 -3.639 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.228 -3.653 -5.476 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -1.035 -5.321 -1.513 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.306 -4.949 -5.914 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.158 -6.537 -1.918 1.00 0.00 H new ATOM 0 HZ PHE A 92 -4.265 -6.400 -4.139 1.00 0.00 H new ATOM 1523 N VAL A 93 2.905 -2.374 -4.181 1.00 0.00 N ATOM 1524 CA VAL A 93 3.810 -1.259 -3.873 1.00 0.00 C ATOM 1525 C VAL A 93 2.990 0.004 -3.659 1.00 0.00 C ATOM 1526 O VAL A 93 1.987 0.200 -4.343 1.00 0.00 O ATOM 1527 CB VAL A 93 4.867 -1.091 -4.979 1.00 0.00 C ATOM 1528 CG1 VAL A 93 5.632 0.236 -4.937 1.00 0.00 C ATOM 1529 CG2 VAL A 93 5.873 -2.233 -4.871 1.00 0.00 C ATOM 0 H VAL A 93 2.379 -2.231 -5.043 1.00 0.00 H new ATOM 0 HA VAL A 93 4.357 -1.469 -2.954 1.00 0.00 H new ATOM 0 HB VAL A 93 4.322 -1.101 -5.923 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.354 0.265 -5.753 1.00 0.00 H new ATOM 0 HG12 VAL A 93 4.931 1.064 -5.043 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.156 0.324 -3.985 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.629 -2.127 -5.649 1.00 0.00 H new ATOM 0 HG22 VAL A 93 6.353 -2.204 -3.893 1.00 0.00 H new ATOM 0 HG23 VAL A 93 5.357 -3.185 -4.994 1.00 0.00 H new ATOM 1539 N ILE A 94 3.411 0.878 -2.743 1.00 0.00 N ATOM 1540 CA ILE A 94 2.829 2.213 -2.585 1.00 0.00 C ATOM 1541 C ILE A 94 3.912 3.284 -2.436 1.00 0.00 C ATOM 1542 O ILE A 94 4.983 3.021 -1.882 1.00 0.00 O ATOM 1543 CB ILE A 94 1.777 2.297 -1.456 1.00 0.00 C ATOM 1544 CG1 ILE A 94 2.293 1.998 -0.028 1.00 0.00 C ATOM 1545 CG2 ILE A 94 0.517 1.476 -1.771 1.00 0.00 C ATOM 1546 CD1 ILE A 94 2.474 0.519 0.354 1.00 0.00 C ATOM 0 H ILE A 94 4.167 0.680 -2.088 1.00 0.00 H new ATOM 0 HA ILE A 94 2.285 2.414 -3.508 1.00 0.00 H new ATOM 0 HB ILE A 94 1.514 3.355 -1.439 1.00 0.00 H new ATOM 0 HG12 ILE A 94 3.252 2.500 0.098 1.00 0.00 H new ATOM 0 HG13 ILE A 94 1.601 2.449 0.683 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -0.192 1.567 -0.948 1.00 0.00 H new ATOM 0 HG22 ILE A 94 0.059 1.849 -2.687 1.00 0.00 H new ATOM 0 HG23 ILE A 94 0.789 0.428 -1.902 1.00 0.00 H new ATOM 0 HD11 ILE A 94 2.840 0.450 1.378 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.517 0.003 0.275 1.00 0.00 H new ATOM 0 HD13 ILE A 94 3.194 0.055 -0.320 1.00 0.00 H new ATOM 1558 N ARG A 95 3.629 4.503 -2.912 1.00 0.00 N ATOM 1559 CA ARG A 95 4.508 5.672 -2.724 1.00 0.00 C ATOM 1560 C ARG A 95 4.116 6.416 -1.450 1.00 0.00 C ATOM 1561 O ARG A 95 3.181 7.216 -1.465 1.00 0.00 O ATOM 1562 CB ARG A 95 4.512 6.592 -3.960 1.00 0.00 C ATOM 1563 CG ARG A 95 5.738 7.522 -3.947 1.00 0.00 C ATOM 1564 CD ARG A 95 5.618 8.678 -4.951 1.00 0.00 C ATOM 1565 NE ARG A 95 4.649 9.699 -4.496 1.00 0.00 N ATOM 1566 CZ ARG A 95 4.166 10.715 -5.187 1.00 0.00 C ATOM 1567 NH1 ARG A 95 3.288 11.515 -4.655 1.00 0.00 N ATOM 1568 NH2 ARG A 95 4.545 10.961 -6.407 1.00 0.00 N ATOM 0 H ARG A 95 2.782 4.711 -3.441 1.00 0.00 H new ATOM 0 HA ARG A 95 5.533 5.320 -2.609 1.00 0.00 H new ATOM 0 HB2 ARG A 95 4.518 5.989 -4.868 1.00 0.00 H new ATOM 0 HB3 ARG A 95 3.599 7.187 -3.979 1.00 0.00 H new ATOM 0 HG2 ARG A 95 5.869 7.929 -2.945 1.00 0.00 H new ATOM 0 HG3 ARG A 95 6.632 6.941 -4.174 1.00 0.00 H new ATOM 0 HD2 ARG A 95 6.595 9.141 -5.092 1.00 0.00 H new ATOM 0 HD3 ARG A 95 5.307 8.288 -5.920 1.00 0.00 H new ATOM 0 HE ARG A 95 4.315 9.607 -3.537 1.00 0.00 H new ATOM 0 HH11 ARG A 95 2.969 11.359 -3.699 1.00 0.00 H new ATOM 0 HH12 ARG A 95 2.919 12.298 -5.194 1.00 0.00 H new ATOM 0 HH21 ARG A 95 5.235 10.360 -6.858 1.00 0.00 H new ATOM 0 HH22 ARG A 95 4.152 11.755 -6.913 1.00 0.00 H new ATOM 1582 N ILE A 96 4.836 6.175 -0.358 1.00 0.00 N ATOM 1583 CA ILE A 96 4.632 6.866 0.927 1.00 0.00 C ATOM 1584 C ILE A 96 5.280 8.259 0.930 1.00 0.00 C ATOM 1585 O ILE A 96 6.245 8.500 0.200 1.00 0.00 O ATOM 1586 CB ILE A 96 5.013 5.988 2.144 1.00 0.00 C ATOM 1587 CG1 ILE A 96 6.514 5.633 2.268 1.00 0.00 C ATOM 1588 CG2 ILE A 96 4.186 4.691 2.159 1.00 0.00 C ATOM 1589 CD1 ILE A 96 7.329 6.653 3.070 1.00 0.00 C ATOM 0 H ILE A 96 5.589 5.487 -0.333 1.00 0.00 H new ATOM 0 HA ILE A 96 3.561 7.038 1.039 1.00 0.00 H new ATOM 0 HB ILE A 96 4.782 6.614 3.006 1.00 0.00 H new ATOM 0 HG12 ILE A 96 6.608 4.655 2.740 1.00 0.00 H new ATOM 0 HG13 ILE A 96 6.941 5.547 1.269 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.469 4.089 3.022 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.126 4.936 2.220 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.376 4.128 1.245 1.00 0.00 H new ATOM 0 HD11 ILE A 96 8.370 6.334 3.112 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.267 7.628 2.587 1.00 0.00 H new ATOM 0 HD13 ILE A 96 6.930 6.723 4.082 1.00 0.00 H new ATOM 1601 N GLN A 97 4.720 9.205 1.687 1.00 0.00 N ATOM 1602 CA GLN A 97 5.226 10.575 1.869 1.00 0.00 C ATOM 1603 C GLN A 97 5.386 10.905 3.362 1.00 0.00 C ATOM 1604 O GLN A 97 4.561 10.518 4.192 1.00 0.00 O ATOM 1605 CB GLN A 97 4.307 11.631 1.208 1.00 0.00 C ATOM 1606 CG GLN A 97 4.535 11.913 -0.290 1.00 0.00 C ATOM 1607 CD GLN A 97 3.791 10.981 -1.240 1.00 0.00 C ATOM 1608 OE1 GLN A 97 2.778 11.315 -1.834 1.00 0.00 O ATOM 1609 NE2 GLN A 97 4.271 9.782 -1.467 1.00 0.00 N ATOM 0 H GLN A 97 3.864 9.034 2.215 1.00 0.00 H new ATOM 0 HA GLN A 97 6.198 10.615 1.378 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.273 11.311 1.340 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.422 12.569 1.751 1.00 0.00 H new ATOM 0 HG2 GLN A 97 4.234 12.939 -0.501 1.00 0.00 H new ATOM 0 HG3 GLN A 97 5.603 11.844 -0.499 1.00 0.00 H new ATOM 0 HE21 GLN A 97 5.116 9.472 -0.987 1.00 0.00 H new ATOM 0 HE22 GLN A 97 3.800 9.160 -2.123 1.00 0.00 H new ATOM 1618 N ASP A 98 6.408 11.701 3.689 1.00 0.00 N ATOM 1619 CA ASP A 98 6.675 12.206 5.051 1.00 0.00 C ATOM 1620 C ASP A 98 5.933 13.530 5.367 1.00 0.00 C ATOM 1621 O ASP A 98 6.083 14.099 6.449 1.00 0.00 O ATOM 1622 CB ASP A 98 8.197 12.340 5.217 1.00 0.00 C ATOM 1623 CG ASP A 98 8.680 12.509 6.668 1.00 0.00 C ATOM 1624 OD1 ASP A 98 8.198 11.783 7.570 1.00 0.00 O ATOM 1625 OD2 ASP A 98 9.608 13.327 6.887 1.00 0.00 O ATOM 0 H ASP A 98 7.091 12.023 3.004 1.00 0.00 H new ATOM 0 HA ASP A 98 6.282 11.494 5.776 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.673 11.456 4.792 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.537 13.196 4.635 1.00 0.00 H new ATOM 1630 N GLY A 99 5.141 14.041 4.413 1.00 0.00 N ATOM 1631 CA GLY A 99 4.339 15.270 4.543 1.00 0.00 C ATOM 1632 C GLY A 99 5.109 16.575 4.282 1.00 0.00 C ATOM 1633 O GLY A 99 4.614 17.657 4.602 1.00 0.00 O ATOM 0 H GLY A 99 5.037 13.598 3.500 1.00 0.00 H new ATOM 0 HA2 GLY A 99 3.501 15.215 3.849 1.00 0.00 H new ATOM 0 HA3 GLY A 99 3.919 15.308 5.548 1.00 0.00 H new ATOM 1637 N THR A 100 6.321 16.479 3.722 1.00 0.00 N ATOM 1638 CA THR A 100 7.273 17.598 3.540 1.00 0.00 C ATOM 1639 C THR A 100 7.984 17.581 2.166 1.00 0.00 C ATOM 1640 O THR A 100 9.024 18.212 1.964 1.00 0.00 O ATOM 1641 CB THR A 100 8.229 17.629 4.752 1.00 0.00 C ATOM 1642 OG1 THR A 100 8.911 18.862 4.854 1.00 0.00 O ATOM 1643 CG2 THR A 100 9.247 16.487 4.751 1.00 0.00 C ATOM 0 H THR A 100 6.685 15.594 3.369 1.00 0.00 H new ATOM 0 HA THR A 100 6.724 18.539 3.515 1.00 0.00 H new ATOM 0 HB THR A 100 7.584 17.500 5.621 1.00 0.00 H new ATOM 0 HG1 THR A 100 9.218 19.140 3.966 1.00 0.00 H new ATOM 0 HG21 THR A 100 9.887 16.569 5.630 1.00 0.00 H new ATOM 0 HG22 THR A 100 8.722 15.532 4.772 1.00 0.00 H new ATOM 0 HG23 THR A 100 9.858 16.545 3.850 1.00 0.00 H new ATOM 1651 N GLY A 101 7.437 16.839 1.190 1.00 0.00 N ATOM 1652 CA GLY A 101 7.998 16.687 -0.165 1.00 0.00 C ATOM 1653 C GLY A 101 8.999 15.530 -0.329 1.00 0.00 C ATOM 1654 O GLY A 101 9.467 15.273 -1.440 1.00 0.00 O ATOM 0 H GLY A 101 6.572 16.315 1.323 1.00 0.00 H new ATOM 0 HA2 GLY A 101 7.177 16.540 -0.867 1.00 0.00 H new ATOM 0 HA3 GLY A 101 8.493 17.618 -0.444 1.00 0.00 H new ATOM 1658 N ARG A 102 9.291 14.794 0.753 1.00 0.00 N ATOM 1659 CA ARG A 102 9.974 13.496 0.741 1.00 0.00 C ATOM 1660 C ARG A 102 8.988 12.425 0.314 1.00 0.00 C ATOM 1661 O ARG A 102 7.854 12.397 0.800 1.00 0.00 O ATOM 1662 CB ARG A 102 10.485 13.125 2.142 1.00 0.00 C ATOM 1663 CG ARG A 102 11.526 14.097 2.692 1.00 0.00 C ATOM 1664 CD ARG A 102 11.791 13.810 4.176 1.00 0.00 C ATOM 1665 NE ARG A 102 12.764 14.756 4.749 1.00 0.00 N ATOM 1666 CZ ARG A 102 12.823 15.183 6.000 1.00 0.00 C ATOM 1667 NH1 ARG A 102 13.776 15.995 6.361 1.00 0.00 N ATOM 1668 NH2 ARG A 102 11.967 14.836 6.920 1.00 0.00 N ATOM 0 H ARG A 102 9.048 15.100 1.695 1.00 0.00 H new ATOM 0 HA ARG A 102 10.817 13.563 0.054 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.640 13.085 2.829 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.916 12.125 2.109 1.00 0.00 H new ATOM 0 HG2 ARG A 102 12.453 14.006 2.126 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.177 15.122 2.570 1.00 0.00 H new ATOM 0 HD2 ARG A 102 10.855 13.870 4.731 1.00 0.00 H new ATOM 0 HD3 ARG A 102 12.164 12.792 4.289 1.00 0.00 H new ATOM 0 HE ARG A 102 13.470 15.122 4.111 1.00 0.00 H new ATOM 0 HH11 ARG A 102 14.472 16.299 5.680 1.00 0.00 H new ATOM 0 HH12 ARG A 102 13.826 16.327 7.324 1.00 0.00 H new ATOM 0 HH21 ARG A 102 11.201 14.203 6.691 1.00 0.00 H new ATOM 0 HH22 ARG A 102 12.063 15.198 7.869 1.00 0.00 H new ATOM 1682 N SER A 103 9.452 11.505 -0.515 1.00 0.00 N ATOM 1683 CA SER A 103 8.721 10.277 -0.836 1.00 0.00 C ATOM 1684 C SER A 103 9.612 9.044 -1.035 1.00 0.00 C ATOM 1685 O SER A 103 10.804 9.160 -1.335 1.00 0.00 O ATOM 1686 CB SER A 103 7.810 10.488 -2.054 1.00 0.00 C ATOM 1687 OG SER A 103 8.547 10.660 -3.251 1.00 0.00 O ATOM 0 H SER A 103 10.351 11.584 -0.990 1.00 0.00 H new ATOM 0 HA SER A 103 8.113 10.062 0.043 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.144 9.632 -2.160 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.181 11.363 -1.888 1.00 0.00 H new ATOM 0 HG SER A 103 7.929 10.789 -4.000 1.00 0.00 H new ATOM 1693 N ALA A 104 9.020 7.858 -0.870 1.00 0.00 N ATOM 1694 CA ALA A 104 9.646 6.562 -1.140 1.00 0.00 C ATOM 1695 C ALA A 104 8.620 5.543 -1.659 1.00 0.00 C ATOM 1696 O ALA A 104 7.477 5.519 -1.203 1.00 0.00 O ATOM 1697 CB ALA A 104 10.325 6.056 0.141 1.00 0.00 C ATOM 0 H ALA A 104 8.061 7.771 -0.534 1.00 0.00 H new ATOM 0 HA ALA A 104 10.396 6.686 -1.921 1.00 0.00 H new ATOM 0 HB1 ALA A 104 10.793 5.091 -0.052 1.00 0.00 H new ATOM 0 HB2 ALA A 104 11.084 6.771 0.457 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.580 5.946 0.929 1.00 0.00 H new ATOM 1703 N PHE A 105 9.032 4.671 -2.579 1.00 0.00 N ATOM 1704 CA PHE A 105 8.249 3.504 -2.996 1.00 0.00 C ATOM 1705 C PHE A 105 8.602 2.302 -2.107 1.00 0.00 C ATOM 1706 O PHE A 105 9.759 1.877 -2.062 1.00 0.00 O ATOM 1707 CB PHE A 105 8.481 3.207 -4.483 1.00 0.00 C ATOM 1708 CG PHE A 105 7.803 4.170 -5.444 1.00 0.00 C ATOM 1709 CD1 PHE A 105 8.462 5.335 -5.889 1.00 0.00 C ATOM 1710 CD2 PHE A 105 6.513 3.880 -5.929 1.00 0.00 C ATOM 1711 CE1 PHE A 105 7.838 6.190 -6.817 1.00 0.00 C ATOM 1712 CE2 PHE A 105 5.896 4.726 -6.865 1.00 0.00 C ATOM 1713 CZ PHE A 105 6.559 5.882 -7.310 1.00 0.00 C ATOM 0 H PHE A 105 9.927 4.754 -3.061 1.00 0.00 H new ATOM 0 HA PHE A 105 7.186 3.713 -2.873 1.00 0.00 H new ATOM 0 HB2 PHE A 105 9.553 3.218 -4.677 1.00 0.00 H new ATOM 0 HB3 PHE A 105 8.129 2.197 -4.696 1.00 0.00 H new ATOM 0 HD1 PHE A 105 9.448 5.572 -5.517 1.00 0.00 H new ATOM 0 HD2 PHE A 105 5.994 3.000 -5.578 1.00 0.00 H new ATOM 0 HE1 PHE A 105 8.343 7.084 -7.151 1.00 0.00 H new ATOM 0 HE2 PHE A 105 4.912 4.488 -7.242 1.00 0.00 H new ATOM 0 HZ PHE A 105 6.086 6.533 -8.030 1.00 0.00 H new ATOM 1723 N ILE A 106 7.607 1.754 -1.405 1.00 0.00 N ATOM 1724 CA ILE A 106 7.748 0.583 -0.519 1.00 0.00 C ATOM 1725 C ILE A 106 6.842 -0.564 -0.975 1.00 0.00 C ATOM 1726 O ILE A 106 5.728 -0.321 -1.439 1.00 0.00 O ATOM 1727 CB ILE A 106 7.526 0.943 0.972 1.00 0.00 C ATOM 1728 CG1 ILE A 106 6.057 1.271 1.325 1.00 0.00 C ATOM 1729 CG2 ILE A 106 8.461 2.099 1.366 1.00 0.00 C ATOM 1730 CD1 ILE A 106 5.802 1.473 2.825 1.00 0.00 C ATOM 0 H ILE A 106 6.654 2.118 -1.434 1.00 0.00 H new ATOM 0 HA ILE A 106 8.779 0.239 -0.598 1.00 0.00 H new ATOM 0 HB ILE A 106 7.768 0.053 1.553 1.00 0.00 H new ATOM 0 HG12 ILE A 106 5.760 2.174 0.792 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.419 0.464 0.965 1.00 0.00 H new ATOM 0 HG21 ILE A 106 8.305 2.352 2.415 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.497 1.796 1.216 1.00 0.00 H new ATOM 0 HG23 ILE A 106 8.244 2.969 0.747 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.748 1.699 2.988 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.065 0.563 3.365 1.00 0.00 H new ATOM 0 HD13 ILE A 106 6.411 2.300 3.189 1.00 0.00 H new ATOM 1742 N GLY A 107 7.305 -1.806 -0.835 1.00 0.00 N ATOM 1743 CA GLY A 107 6.524 -3.011 -1.119 1.00 0.00 C ATOM 1744 C GLY A 107 5.857 -3.549 0.142 1.00 0.00 C ATOM 1745 O GLY A 107 6.455 -3.508 1.217 1.00 0.00 O ATOM 0 H GLY A 107 8.252 -2.007 -0.515 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.764 -2.786 -1.867 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.174 -3.776 -1.544 1.00 0.00 H new ATOM 1749 N ILE A 108 4.634 -4.062 0.014 1.00 0.00 N ATOM 1750 CA ILE A 108 3.878 -4.735 1.074 1.00 0.00 C ATOM 1751 C ILE A 108 3.333 -6.091 0.621 1.00 0.00 C ATOM 1752 O ILE A 108 2.903 -6.252 -0.523 1.00 0.00 O ATOM 1753 CB ILE A 108 2.752 -3.858 1.671 1.00 0.00 C ATOM 1754 CG1 ILE A 108 1.746 -3.323 0.625 1.00 0.00 C ATOM 1755 CG2 ILE A 108 3.368 -2.727 2.505 1.00 0.00 C ATOM 1756 CD1 ILE A 108 0.518 -2.638 1.248 1.00 0.00 C ATOM 0 H ILE A 108 4.120 -4.019 -0.866 1.00 0.00 H new ATOM 0 HA ILE A 108 4.596 -4.912 1.875 1.00 0.00 H new ATOM 0 HB ILE A 108 2.155 -4.501 2.317 1.00 0.00 H new ATOM 0 HG12 ILE A 108 2.255 -2.614 -0.028 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.412 -4.150 -0.002 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.573 -2.110 2.925 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.962 -3.153 3.313 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.007 -2.113 1.870 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.144 -2.288 0.456 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.015 -3.350 1.878 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.842 -1.790 1.852 1.00 0.00 H new ATOM 1768 N GLY A 109 3.330 -7.064 1.534 1.00 0.00 N ATOM 1769 CA GLY A 109 2.759 -8.399 1.332 1.00 0.00 C ATOM 1770 C GLY A 109 1.643 -8.740 2.319 1.00 0.00 C ATOM 1771 O GLY A 109 1.692 -8.358 3.492 1.00 0.00 O ATOM 0 H GLY A 109 3.736 -6.942 2.462 1.00 0.00 H new ATOM 0 HA2 GLY A 109 2.369 -8.469 0.317 1.00 0.00 H new ATOM 0 HA3 GLY A 109 3.552 -9.142 1.421 1.00 0.00 H new ATOM 1775 N PHE A 110 0.643 -9.473 1.825 1.00 0.00 N ATOM 1776 CA PHE A 110 -0.557 -9.898 2.552 1.00 0.00 C ATOM 1777 C PHE A 110 -0.508 -11.396 2.876 1.00 0.00 C ATOM 1778 O PHE A 110 0.177 -12.172 2.207 1.00 0.00 O ATOM 1779 CB PHE A 110 -1.808 -9.556 1.723 1.00 0.00 C ATOM 1780 CG PHE A 110 -2.166 -8.081 1.702 1.00 0.00 C ATOM 1781 CD1 PHE A 110 -3.349 -7.640 2.328 1.00 0.00 C ATOM 1782 CD2 PHE A 110 -1.322 -7.144 1.073 1.00 0.00 C ATOM 1783 CE1 PHE A 110 -3.682 -6.275 2.326 1.00 0.00 C ATOM 1784 CE2 PHE A 110 -1.633 -5.777 1.115 1.00 0.00 C ATOM 1785 CZ PHE A 110 -2.817 -5.343 1.727 1.00 0.00 C ATOM 0 H PHE A 110 0.648 -9.803 0.860 1.00 0.00 H new ATOM 0 HA PHE A 110 -0.601 -9.363 3.500 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -1.653 -9.894 0.698 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -2.655 -10.117 2.119 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -4.001 -8.353 2.810 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -0.434 -7.479 0.558 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -4.602 -5.942 2.784 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -0.959 -5.057 0.675 1.00 0.00 H new ATOM 0 HZ PHE A 110 -3.065 -4.292 1.738 1.00 0.00 H new ATOM 1795 N THR A 111 -1.279 -11.824 3.877 1.00 0.00 N ATOM 1796 CA THR A 111 -1.356 -13.233 4.302 1.00 0.00 C ATOM 1797 C THR A 111 -2.113 -14.116 3.300 1.00 0.00 C ATOM 1798 O THR A 111 -1.839 -15.312 3.190 1.00 0.00 O ATOM 1799 CB THR A 111 -1.967 -13.318 5.715 1.00 0.00 C ATOM 1800 OG1 THR A 111 -1.817 -14.611 6.266 1.00 0.00 O ATOM 1801 CG2 THR A 111 -3.457 -12.963 5.781 1.00 0.00 C ATOM 0 H THR A 111 -1.874 -11.202 4.423 1.00 0.00 H new ATOM 0 HA THR A 111 -0.341 -13.628 4.332 1.00 0.00 H new ATOM 0 HB THR A 111 -1.412 -12.575 6.287 1.00 0.00 H new ATOM 0 HG1 THR A 111 -2.213 -14.633 7.162 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.806 -13.048 6.810 1.00 0.00 H new ATOM 0 HG22 THR A 111 -3.603 -11.941 5.432 1.00 0.00 H new ATOM 0 HG23 THR A 111 -4.022 -13.647 5.148 1.00 0.00 H new ATOM 1809 N ASP A 112 -3.036 -13.529 2.528 1.00 0.00 N ATOM 1810 CA ASP A 112 -3.887 -14.238 1.570 1.00 0.00 C ATOM 1811 C ASP A 112 -4.416 -13.299 0.471 1.00 0.00 C ATOM 1812 O ASP A 112 -4.619 -12.101 0.696 1.00 0.00 O ATOM 1813 CB ASP A 112 -5.058 -14.902 2.319 1.00 0.00 C ATOM 1814 CG ASP A 112 -5.847 -15.852 1.407 1.00 0.00 C ATOM 1815 OD1 ASP A 112 -5.398 -17.003 1.199 1.00 0.00 O ATOM 1816 OD2 ASP A 112 -6.892 -15.431 0.861 1.00 0.00 O ATOM 0 H ASP A 112 -3.214 -12.525 2.554 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.285 -15.002 1.079 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -4.675 -15.455 3.177 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -5.725 -14.132 2.708 1.00 0.00 H new ATOM 1821 N ARG A 113 -4.682 -13.852 -0.720 1.00 0.00 N ATOM 1822 CA ARG A 113 -5.234 -13.117 -1.869 1.00 0.00 C ATOM 1823 C ARG A 113 -6.616 -12.515 -1.593 1.00 0.00 C ATOM 1824 O ARG A 113 -6.896 -11.425 -2.085 1.00 0.00 O ATOM 1825 CB ARG A 113 -5.248 -14.058 -3.082 1.00 0.00 C ATOM 1826 CG ARG A 113 -5.649 -13.327 -4.373 1.00 0.00 C ATOM 1827 CD ARG A 113 -5.606 -14.240 -5.600 1.00 0.00 C ATOM 1828 NE ARG A 113 -4.232 -14.675 -5.921 1.00 0.00 N ATOM 1829 CZ ARG A 113 -3.679 -15.858 -5.720 1.00 0.00 C ATOM 1830 NH1 ARG A 113 -2.435 -16.064 -6.043 1.00 0.00 N ATOM 1831 NH2 ARG A 113 -4.332 -16.855 -5.193 1.00 0.00 N ATOM 0 H ARG A 113 -4.517 -14.839 -0.917 1.00 0.00 H new ATOM 0 HA ARG A 113 -4.595 -12.258 -2.073 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -4.260 -14.501 -3.208 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -5.944 -14.877 -2.898 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -6.655 -12.922 -4.260 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -4.981 -12.481 -4.530 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -6.231 -15.115 -5.422 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -6.029 -13.715 -6.457 1.00 0.00 H new ATOM 0 HE ARG A 113 -3.633 -13.972 -6.353 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -1.883 -15.311 -6.453 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -2.012 -16.979 -5.886 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -5.307 -16.738 -4.919 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -3.868 -17.753 -5.055 1.00 0.00 H new ATOM 1845 N GLY A 114 -7.454 -13.150 -0.775 1.00 0.00 N ATOM 1846 CA GLY A 114 -8.764 -12.615 -0.386 1.00 0.00 C ATOM 1847 C GLY A 114 -8.677 -11.313 0.421 1.00 0.00 C ATOM 1848 O GLY A 114 -9.528 -10.436 0.275 1.00 0.00 O ATOM 0 H GLY A 114 -7.244 -14.057 -0.359 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.357 -12.438 -1.284 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.293 -13.364 0.203 1.00 0.00 H new ATOM 1852 N ASP A 115 -7.616 -11.138 1.217 1.00 0.00 N ATOM 1853 CA ASP A 115 -7.358 -9.905 1.972 1.00 0.00 C ATOM 1854 C ASP A 115 -6.604 -8.856 1.140 1.00 0.00 C ATOM 1855 O ASP A 115 -6.854 -7.661 1.299 1.00 0.00 O ATOM 1856 CB ASP A 115 -6.628 -10.233 3.280 1.00 0.00 C ATOM 1857 CG ASP A 115 -7.568 -10.926 4.280 1.00 0.00 C ATOM 1858 OD1 ASP A 115 -7.305 -12.089 4.664 1.00 0.00 O ATOM 1859 OD2 ASP A 115 -8.570 -10.290 4.690 1.00 0.00 O ATOM 0 H ASP A 115 -6.905 -11.855 1.357 1.00 0.00 H new ATOM 0 HA ASP A 115 -8.319 -9.454 2.218 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -5.774 -10.878 3.072 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -6.235 -9.317 3.720 1.00 0.00 H new ATOM 1864 N ALA A 116 -5.756 -9.279 0.196 1.00 0.00 N ATOM 1865 CA ALA A 116 -5.179 -8.388 -0.809 1.00 0.00 C ATOM 1866 C ALA A 116 -6.230 -7.818 -1.782 1.00 0.00 C ATOM 1867 O ALA A 116 -6.185 -6.637 -2.128 1.00 0.00 O ATOM 1868 CB ALA A 116 -4.121 -9.184 -1.556 1.00 0.00 C ATOM 0 H ALA A 116 -5.452 -10.249 0.110 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.746 -7.519 -0.314 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.663 -8.554 -2.319 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -3.356 -9.520 -0.856 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -4.584 -10.049 -2.030 1.00 0.00 H new ATOM 1874 N PHE A 117 -7.230 -8.612 -2.169 1.00 0.00 N ATOM 1875 CA PHE A 117 -8.384 -8.117 -2.926 1.00 0.00 C ATOM 1876 C PHE A 117 -9.155 -7.058 -2.121 1.00 0.00 C ATOM 1877 O PHE A 117 -9.575 -6.048 -2.679 1.00 0.00 O ATOM 1878 CB PHE A 117 -9.284 -9.286 -3.361 1.00 0.00 C ATOM 1879 CG PHE A 117 -8.918 -9.923 -4.697 1.00 0.00 C ATOM 1880 CD1 PHE A 117 -9.940 -10.230 -5.620 1.00 0.00 C ATOM 1881 CD2 PHE A 117 -7.578 -10.205 -5.040 1.00 0.00 C ATOM 1882 CE1 PHE A 117 -9.626 -10.808 -6.864 1.00 0.00 C ATOM 1883 CE2 PHE A 117 -7.266 -10.779 -6.285 1.00 0.00 C ATOM 1884 CZ PHE A 117 -8.290 -11.083 -7.198 1.00 0.00 C ATOM 0 H PHE A 117 -7.264 -9.611 -1.968 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.026 -7.628 -3.832 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.253 -10.055 -2.589 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -10.313 -8.931 -3.415 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.970 -10.020 -5.370 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -6.787 -9.978 -4.341 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -10.415 -11.041 -7.564 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -6.237 -10.987 -6.540 1.00 0.00 H new ATOM 0 HZ PHE A 117 -8.050 -11.527 -8.153 1.00 0.00 H new ATOM 1894 N ASP A 118 -9.257 -7.214 -0.798 1.00 0.00 N ATOM 1895 CA ASP A 118 -9.891 -6.228 0.087 1.00 0.00 C ATOM 1896 C ASP A 118 -9.063 -4.931 0.262 1.00 0.00 C ATOM 1897 O ASP A 118 -9.597 -3.919 0.714 1.00 0.00 O ATOM 1898 CB ASP A 118 -10.218 -6.904 1.434 1.00 0.00 C ATOM 1899 CG ASP A 118 -11.451 -6.331 2.158 1.00 0.00 C ATOM 1900 OD1 ASP A 118 -11.577 -6.606 3.376 1.00 0.00 O ATOM 1901 OD2 ASP A 118 -12.332 -5.703 1.526 1.00 0.00 O ATOM 0 H ASP A 118 -8.900 -8.033 -0.306 1.00 0.00 H new ATOM 0 HA ASP A 118 -10.816 -5.894 -0.384 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -10.377 -7.969 1.262 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -9.353 -6.813 2.091 1.00 0.00 H new ATOM 1906 N PHE A 119 -7.787 -4.913 -0.146 1.00 0.00 N ATOM 1907 CA PHE A 119 -6.984 -3.692 -0.322 1.00 0.00 C ATOM 1908 C PHE A 119 -7.335 -2.968 -1.635 1.00 0.00 C ATOM 1909 O PHE A 119 -7.636 -1.774 -1.620 1.00 0.00 O ATOM 1910 CB PHE A 119 -5.488 -4.035 -0.201 1.00 0.00 C ATOM 1911 CG PHE A 119 -4.527 -2.955 -0.660 1.00 0.00 C ATOM 1912 CD1 PHE A 119 -4.187 -2.833 -2.023 1.00 0.00 C ATOM 1913 CD2 PHE A 119 -3.958 -2.073 0.272 1.00 0.00 C ATOM 1914 CE1 PHE A 119 -3.323 -1.809 -2.449 1.00 0.00 C ATOM 1915 CE2 PHE A 119 -3.099 -1.050 -0.152 1.00 0.00 C ATOM 1916 CZ PHE A 119 -2.781 -0.911 -1.513 1.00 0.00 C ATOM 0 H PHE A 119 -7.272 -5.765 -0.368 1.00 0.00 H new ATOM 0 HA PHE A 119 -7.225 -2.985 0.472 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -5.271 -4.270 0.841 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -5.293 -4.939 -0.779 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -4.592 -3.529 -2.743 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -4.184 -2.183 1.322 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -3.076 -1.712 -3.496 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -2.680 -0.366 0.571 1.00 0.00 H new ATOM 0 HZ PHE A 119 -2.124 -0.118 -1.839 1.00 0.00 H new ATOM 1926 N ASN A 120 -7.348 -3.673 -2.775 1.00 0.00 N ATOM 1927 CA ASN A 120 -7.554 -3.025 -4.081 1.00 0.00 C ATOM 1928 C ASN A 120 -9.025 -2.711 -4.408 1.00 0.00 C ATOM 1929 O ASN A 120 -9.296 -1.769 -5.155 1.00 0.00 O ATOM 1930 CB ASN A 120 -6.827 -3.787 -5.206 1.00 0.00 C ATOM 1931 CG ASN A 120 -7.331 -5.186 -5.516 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -6.674 -6.178 -5.250 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -8.479 -5.328 -6.141 1.00 0.00 N ATOM 0 H ASN A 120 -7.220 -4.684 -2.821 1.00 0.00 H new ATOM 0 HA ASN A 120 -7.091 -2.041 -4.006 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -6.891 -3.192 -6.117 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -5.771 -3.856 -4.944 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -8.809 -6.259 -6.397 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -9.040 -4.507 -6.370 1.00 0.00 H new ATOM 1940 N VAL A 121 -9.988 -3.461 -3.865 1.00 0.00 N ATOM 1941 CA VAL A 121 -11.428 -3.213 -4.073 1.00 0.00 C ATOM 1942 C VAL A 121 -11.920 -2.050 -3.205 1.00 0.00 C ATOM 1943 O VAL A 121 -12.634 -1.179 -3.699 1.00 0.00 O ATOM 1944 CB VAL A 121 -12.248 -4.497 -3.819 1.00 0.00 C ATOM 1945 CG1 VAL A 121 -13.763 -4.256 -3.826 1.00 0.00 C ATOM 1946 CG2 VAL A 121 -11.955 -5.553 -4.893 1.00 0.00 C ATOM 0 H VAL A 121 -9.795 -4.263 -3.265 1.00 0.00 H new ATOM 0 HA VAL A 121 -11.576 -2.926 -5.114 1.00 0.00 H new ATOM 0 HB VAL A 121 -11.945 -4.839 -2.829 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -14.282 -5.197 -3.642 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -14.021 -3.540 -3.045 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -14.064 -3.859 -4.796 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.544 -6.448 -4.693 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -12.218 -5.157 -5.874 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -10.895 -5.805 -4.876 1.00 0.00 H new ATOM 1956 N SER A 122 -11.508 -1.981 -1.937 1.00 0.00 N ATOM 1957 CA SER A 122 -11.928 -0.904 -1.024 1.00 0.00 C ATOM 1958 C SER A 122 -11.404 0.474 -1.453 1.00 0.00 C ATOM 1959 O SER A 122 -12.114 1.474 -1.317 1.00 0.00 O ATOM 1960 CB SER A 122 -11.488 -1.222 0.405 1.00 0.00 C ATOM 1961 OG SER A 122 -10.081 -1.281 0.486 1.00 0.00 O ATOM 0 H SER A 122 -10.879 -2.662 -1.512 1.00 0.00 H new ATOM 0 HA SER A 122 -13.016 -0.854 -1.066 1.00 0.00 H new ATOM 0 HB2 SER A 122 -11.866 -0.460 1.086 1.00 0.00 H new ATOM 0 HB3 SER A 122 -11.917 -2.173 0.721 1.00 0.00 H new ATOM 0 HG SER A 122 -9.807 -2.175 0.779 1.00 0.00 H new ATOM 1967 N LEU A 123 -10.202 0.530 -2.041 1.00 0.00 N ATOM 1968 CA LEU A 123 -9.592 1.737 -2.574 1.00 0.00 C ATOM 1969 C LEU A 123 -10.280 2.193 -3.875 1.00 0.00 C ATOM 1970 O LEU A 123 -10.649 3.361 -3.992 1.00 0.00 O ATOM 1971 CB LEU A 123 -8.094 1.429 -2.741 1.00 0.00 C ATOM 1972 CG LEU A 123 -7.241 2.635 -3.137 1.00 0.00 C ATOM 1973 CD1 LEU A 123 -7.167 3.703 -2.044 1.00 0.00 C ATOM 1974 CD2 LEU A 123 -5.827 2.175 -3.466 1.00 0.00 C ATOM 0 H LEU A 123 -9.615 -0.296 -2.159 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.716 2.583 -1.898 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -7.713 1.022 -1.805 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.977 0.653 -3.497 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.722 3.085 -4.006 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -6.548 4.532 -2.387 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -8.170 4.067 -1.823 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -6.730 3.272 -1.143 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -5.221 3.036 -3.748 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -5.389 1.693 -2.592 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -5.858 1.466 -4.294 1.00 0.00 H new ATOM 1986 N GLN A 124 -10.526 1.288 -4.834 1.00 0.00 N ATOM 1987 CA GLN A 124 -11.166 1.653 -6.111 1.00 0.00 C ATOM 1988 C GLN A 124 -12.650 2.032 -5.960 1.00 0.00 C ATOM 1989 O GLN A 124 -13.145 2.892 -6.687 1.00 0.00 O ATOM 1990 CB GLN A 124 -10.937 0.556 -7.168 1.00 0.00 C ATOM 1991 CG GLN A 124 -11.904 -0.633 -7.106 1.00 0.00 C ATOM 1992 CD GLN A 124 -11.478 -1.753 -8.050 1.00 0.00 C ATOM 1993 OE1 GLN A 124 -12.094 -2.018 -9.074 1.00 0.00 O ATOM 1994 NE2 GLN A 124 -10.397 -2.440 -7.750 1.00 0.00 N ATOM 0 H GLN A 124 -10.292 0.299 -4.752 1.00 0.00 H new ATOM 0 HA GLN A 124 -10.680 2.562 -6.465 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -11.008 1.008 -8.157 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -9.919 0.180 -7.062 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -11.949 -1.014 -6.086 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -12.909 -0.300 -7.366 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -9.877 -2.227 -6.899 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -10.079 -3.186 -8.369 1.00 0.00 H new ATOM 2003 N ASP A 125 -13.347 1.458 -4.974 1.00 0.00 N ATOM 2004 CA ASP A 125 -14.749 1.762 -4.670 1.00 0.00 C ATOM 2005 C ASP A 125 -14.905 3.074 -3.876 1.00 0.00 C ATOM 2006 O ASP A 125 -16.024 3.545 -3.663 1.00 0.00 O ATOM 2007 CB ASP A 125 -15.383 0.560 -3.953 1.00 0.00 C ATOM 2008 CG ASP A 125 -16.905 0.704 -3.771 1.00 0.00 C ATOM 2009 OD1 ASP A 125 -17.404 0.515 -2.635 1.00 0.00 O ATOM 2010 OD2 ASP A 125 -17.613 0.976 -4.770 1.00 0.00 O ATOM 0 H ASP A 125 -12.945 0.756 -4.353 1.00 0.00 H new ATOM 0 HA ASP A 125 -15.283 1.929 -5.605 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -15.175 -0.347 -4.521 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -14.915 0.438 -2.976 1.00 0.00 H new ATOM 2015 N HIS A 126 -13.795 3.718 -3.494 1.00 0.00 N ATOM 2016 CA HIS A 126 -13.798 5.123 -3.080 1.00 0.00 C ATOM 2017 C HIS A 126 -13.580 6.098 -4.249 1.00 0.00 C ATOM 2018 O HIS A 126 -14.012 7.246 -4.166 1.00 0.00 O ATOM 2019 CB HIS A 126 -12.794 5.341 -1.941 1.00 0.00 C ATOM 2020 CG HIS A 126 -12.912 6.722 -1.343 1.00 0.00 C ATOM 2021 ND1 HIS A 126 -12.040 7.787 -1.580 1.00 0.00 N ATOM 2022 CD2 HIS A 126 -13.957 7.165 -0.585 1.00 0.00 C ATOM 2023 CE1 HIS A 126 -12.595 8.854 -0.983 1.00 0.00 C ATOM 2024 NE2 HIS A 126 -13.737 8.508 -0.363 1.00 0.00 N ATOM 0 H HIS A 126 -12.874 3.280 -3.464 1.00 0.00 H new ATOM 0 HA HIS A 126 -14.796 5.352 -2.705 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -12.958 4.594 -1.164 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -11.781 5.193 -2.316 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -14.792 6.579 -0.229 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -12.182 9.852 -0.999 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -14.337 9.131 0.178 1.00 0.00 H new ATOM 2032 N PHE A 127 -12.988 5.649 -5.363 1.00 0.00 N ATOM 2033 CA PHE A 127 -12.670 6.493 -6.524 1.00 0.00 C ATOM 2034 C PHE A 127 -13.660 6.423 -7.695 1.00 0.00 C ATOM 2035 O PHE A 127 -13.594 7.295 -8.562 1.00 0.00 O ATOM 2036 CB PHE A 127 -11.238 6.193 -6.997 1.00 0.00 C ATOM 2037 CG PHE A 127 -10.162 6.836 -6.145 1.00 0.00 C ATOM 2038 CD1 PHE A 127 -10.081 8.240 -6.070 1.00 0.00 C ATOM 2039 CD2 PHE A 127 -9.229 6.047 -5.449 1.00 0.00 C ATOM 2040 CE1 PHE A 127 -9.061 8.849 -5.322 1.00 0.00 C ATOM 2041 CE2 PHE A 127 -8.205 6.656 -4.703 1.00 0.00 C ATOM 2042 CZ PHE A 127 -8.121 8.058 -4.643 1.00 0.00 C ATOM 0 H PHE A 127 -12.712 4.675 -5.486 1.00 0.00 H new ATOM 0 HA PHE A 127 -12.758 7.520 -6.170 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -11.086 5.114 -7.003 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -11.126 6.536 -8.026 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -10.805 8.850 -6.589 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -9.299 4.970 -5.488 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -9.000 9.926 -5.269 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -7.484 6.048 -4.177 1.00 0.00 H new ATOM 0 HZ PHE A 127 -7.332 8.527 -4.074 1.00 0.00 H new ATOM 2052 N LYS A 128 -14.586 5.452 -7.755 1.00 0.00 N ATOM 2053 CA LYS A 128 -15.462 5.236 -8.934 1.00 0.00 C ATOM 2054 C LYS A 128 -16.262 6.461 -9.410 1.00 0.00 C ATOM 2055 O LYS A 128 -16.529 6.594 -10.602 1.00 0.00 O ATOM 2056 CB LYS A 128 -16.366 3.998 -8.767 1.00 0.00 C ATOM 2057 CG LYS A 128 -17.630 4.175 -7.910 1.00 0.00 C ATOM 2058 CD LYS A 128 -17.320 4.300 -6.418 1.00 0.00 C ATOM 2059 CE LYS A 128 -18.583 4.381 -5.559 1.00 0.00 C ATOM 2060 NZ LYS A 128 -19.293 3.078 -5.482 1.00 0.00 N ATOM 0 H LYS A 128 -14.753 4.793 -6.994 1.00 0.00 H new ATOM 0 HA LYS A 128 -14.757 5.046 -9.744 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -16.672 3.664 -9.759 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -15.769 3.197 -8.331 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -18.167 5.064 -8.241 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -18.293 3.325 -8.069 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -16.724 3.444 -6.102 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.713 5.190 -6.250 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -18.317 4.708 -4.554 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -19.254 5.135 -5.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -20.169 3.192 -4.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -19.526 2.752 -6.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -18.682 2.376 -5.018 1.00 0.00 H new ATOM 2074 N TRP A 129 -16.602 7.380 -8.504 1.00 0.00 N ATOM 2075 CA TRP A 129 -17.293 8.642 -8.816 1.00 0.00 C ATOM 2076 C TRP A 129 -16.340 9.756 -9.293 1.00 0.00 C ATOM 2077 O TRP A 129 -16.753 10.641 -10.043 1.00 0.00 O ATOM 2078 CB TRP A 129 -18.087 9.094 -7.581 1.00 0.00 C ATOM 2079 CG TRP A 129 -17.245 9.474 -6.400 1.00 0.00 C ATOM 2080 CD1 TRP A 129 -16.650 8.604 -5.555 1.00 0.00 C ATOM 2081 CD2 TRP A 129 -16.851 10.806 -5.939 1.00 0.00 C ATOM 2082 NE1 TRP A 129 -15.862 9.292 -4.661 1.00 0.00 N ATOM 2083 CE2 TRP A 129 -15.984 10.655 -4.813 1.00 0.00 C ATOM 2084 CE3 TRP A 129 -17.128 12.126 -6.360 1.00 0.00 C ATOM 2085 CZ2 TRP A 129 -15.430 11.751 -4.135 1.00 0.00 C ATOM 2086 CZ3 TRP A 129 -16.587 13.235 -5.679 1.00 0.00 C ATOM 2087 CH2 TRP A 129 -15.748 13.050 -4.564 1.00 0.00 C ATOM 0 H TRP A 129 -16.402 7.269 -7.510 1.00 0.00 H new ATOM 0 HA TRP A 129 -17.968 8.453 -9.651 1.00 0.00 H new ATOM 0 HB2 TRP A 129 -18.708 9.946 -7.857 1.00 0.00 H new ATOM 0 HB3 TRP A 129 -18.762 8.291 -7.286 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -16.774 7.531 -5.578 1.00 0.00 H new ATOM 0 HE1 TRP A 129 -15.260 8.846 -3.969 1.00 0.00 H new ATOM 0 HE3 TRP A 129 -17.764 12.288 -7.217 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 -14.768 11.598 -3.295 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 -16.818 14.235 -6.015 1.00 0.00 H new ATOM 0 HH2 TRP A 129 -15.349 13.906 -4.039 1.00 0.00 H new ATOM 2098 N VAL A 130 -15.056 9.696 -8.912 1.00 0.00 N ATOM 2099 CA VAL A 130 -14.000 10.644 -9.321 1.00 0.00 C ATOM 2100 C VAL A 130 -13.548 10.361 -10.757 1.00 0.00 C ATOM 2101 O VAL A 130 -13.433 11.286 -11.563 1.00 0.00 O ATOM 2102 CB VAL A 130 -12.793 10.600 -8.354 1.00 0.00 C ATOM 2103 CG1 VAL A 130 -11.789 11.720 -8.655 1.00 0.00 C ATOM 2104 CG2 VAL A 130 -13.221 10.752 -6.890 1.00 0.00 C ATOM 0 H VAL A 130 -14.709 8.965 -8.291 1.00 0.00 H new ATOM 0 HA VAL A 130 -14.423 11.648 -9.279 1.00 0.00 H new ATOM 0 HB VAL A 130 -12.332 9.624 -8.506 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.955 11.658 -7.956 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -11.418 11.612 -9.674 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -12.280 12.687 -8.549 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -12.341 10.715 -6.248 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -13.728 11.708 -6.756 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -13.899 9.941 -6.623 1.00 0.00 H new ATOM 2114 N LYS A 131 -13.364 9.076 -11.104 1.00 0.00 N ATOM 2115 CA LYS A 131 -13.046 8.601 -12.471 1.00 0.00 C ATOM 2116 C LYS A 131 -14.266 8.220 -13.329 1.00 0.00 C ATOM 2117 O LYS A 131 -14.116 7.700 -14.434 1.00 0.00 O ATOM 2118 CB LYS A 131 -11.948 7.523 -12.425 1.00 0.00 C ATOM 2119 CG LYS A 131 -12.415 6.236 -11.736 1.00 0.00 C ATOM 2120 CD LYS A 131 -11.295 5.195 -11.698 1.00 0.00 C ATOM 2121 CE LYS A 131 -11.789 4.005 -10.877 1.00 0.00 C ATOM 2122 NZ LYS A 131 -10.822 2.882 -10.922 1.00 0.00 N ATOM 0 H LYS A 131 -13.433 8.315 -10.428 1.00 0.00 H new ATOM 0 HA LYS A 131 -12.644 9.458 -13.011 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -11.628 7.292 -13.441 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -11.078 7.917 -11.899 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -12.741 6.461 -10.721 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -13.277 5.829 -12.265 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -11.033 4.879 -12.708 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -10.395 5.619 -11.253 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -11.944 4.313 -9.843 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -12.754 3.672 -11.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -11.177 2.095 -10.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -10.706 2.563 -11.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -9.904 3.199 -10.551 1.00 0.00 H new ATOM 2136 N GLN A 132 -15.452 8.522 -12.808 1.00 0.00 N ATOM 2137 CA GLN A 132 -16.791 8.351 -13.389 1.00 0.00 C ATOM 2138 C GLN A 132 -17.024 7.014 -14.124 1.00 0.00 C ATOM 2139 O GLN A 132 -16.972 6.919 -15.354 1.00 0.00 O ATOM 2140 CB GLN A 132 -17.164 9.557 -14.259 1.00 0.00 C ATOM 2141 CG GLN A 132 -17.175 10.886 -13.481 1.00 0.00 C ATOM 2142 CD GLN A 132 -17.602 12.091 -14.322 1.00 0.00 C ATOM 2143 OE1 GLN A 132 -17.898 12.015 -15.510 1.00 0.00 O ATOM 2144 NE2 GLN A 132 -17.650 13.269 -13.733 1.00 0.00 N ATOM 0 H GLN A 132 -15.511 8.934 -11.877 1.00 0.00 H new ATOM 0 HA GLN A 132 -17.470 8.303 -12.538 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -16.457 9.633 -15.085 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -18.149 9.391 -14.696 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -17.849 10.792 -12.629 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -16.178 11.070 -13.080 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -17.408 13.356 -12.746 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -17.929 14.094 -14.264 1.00 0.00 H new ATOM 2153 N GLU A 133 -17.346 5.988 -13.338 1.00 0.00 N ATOM 2154 CA GLU A 133 -17.767 4.637 -13.768 1.00 0.00 C ATOM 2155 C GLU A 133 -19.134 4.225 -13.188 1.00 0.00 C ATOM 2156 O GLU A 133 -20.001 3.787 -13.978 1.00 0.00 O ATOM 2157 CB GLU A 133 -16.688 3.591 -13.425 1.00 0.00 C ATOM 2158 CG GLU A 133 -15.385 3.783 -14.219 1.00 0.00 C ATOM 2159 CD GLU A 133 -14.449 2.563 -14.062 1.00 0.00 C ATOM 2160 OE1 GLU A 133 -13.611 2.543 -13.127 1.00 0.00 O ATOM 2161 OE2 GLU A 133 -14.535 1.613 -14.882 1.00 0.00 O ATOM 2162 OXT GLU A 133 -19.344 4.349 -11.959 1.00 0.00 O ATOM 0 H GLU A 133 -17.322 6.073 -12.322 1.00 0.00 H new ATOM 0 HA GLU A 133 -17.886 4.677 -14.851 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -16.467 3.642 -12.359 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -17.082 2.594 -13.621 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -15.617 3.933 -15.273 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -14.875 4.682 -13.874 1.00 0.00 H new TER 2169 GLU A 133