USER MOD reduce.3.24.130724 H: found=0, std=0, add=1062, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1060 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 95 THR OG1 : rot 160:sc= -0.355 USER MOD Set 1.2: A 96 THR OG1 : rot 87:sc= 0.758 USER MOD Set 2.1: A 80 GLN : amide:sc= -0.36 K(o=-3.5,f=-0.75) USER MOD Set 2.2: A 83 GLN : amide:sc= -3.12! K(o=-3.5!,f=-0.082) USER MOD Set 3.1: A 69 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 114 THR OG1 : rot -81:sc= 0.771 USER MOD Set 4.1: A 62 TYR OH : rot 180:sc= 0.225 USER MOD Set 4.2: A 122 LYS NZ :NH3+ -134:sc= 0.306 (180deg=0.104) USER MOD Single : A 1 MET CE :methyl -156:sc= -0.161 (180deg=-0.873) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= -0.0197 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.0361 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl 164:sc= -0.0796 (180deg=-0.457) USER MOD Single : A 38 GLN : amide:sc= -0.463 X(o=-0.46,f=-0.22) USER MOD Single : A 41 GLN : amide:sc= -0.0149 K(o=-0.015,f=-0.96) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 45 MET CE :methyl -159:sc= -0.14 (180deg=-0.691) USER MOD Single : A 47 LYS NZ :NH3+ -141:sc= -0.187 (180deg=-1.54!) USER MOD Single : A 48 TYR OH : rot 100:sc= -0.122 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 78:sc= 0.0214 USER MOD Single : A 58 ASN : amide:sc= -0.189 X(o=-0.19,f=0) USER MOD Single : A 59 LYS NZ :NH3+ -165:sc= -0.0605 (180deg=-0.355) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.52 X(o=-0.52,f=-0.85) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -167:sc= -0.0418 (180deg=-0.251) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot -84:sc= 0.322 USER MOD Single : A 98 GLN : amide:sc= -1.78! K(o=-1.8!,f=0) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 100 HIS : no HD1:sc= -0.935 X(o=-0.93,f=-0.73) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 MET CE :methyl 137:sc= -0.762 (180deg=-2.16) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 164:sc= -0.0757 (180deg=-0.501) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 15.929 9.261 -22.645 1.00 0.00 N ATOM 2 CA MET A 1 15.781 8.492 -23.907 1.00 0.00 C ATOM 3 C MET A 1 16.861 7.421 -24.020 1.00 0.00 C ATOM 4 O MET A 1 18.050 7.708 -23.876 1.00 0.00 O ATOM 5 CB MET A 1 15.850 9.437 -25.111 1.00 0.00 C ATOM 6 CG MET A 1 15.625 8.746 -26.446 1.00 0.00 C ATOM 7 SD MET A 1 15.589 9.903 -27.829 1.00 0.00 S ATOM 8 CE MET A 1 14.165 10.900 -27.400 1.00 0.00 C ATOM 0 H1 MET A 1 15.184 9.984 -22.590 1.00 0.00 H new ATOM 0 H2 MET A 1 15.846 8.616 -21.834 1.00 0.00 H new ATOM 0 H3 MET A 1 16.861 9.722 -22.627 1.00 0.00 H new ATOM 0 HA MET A 1 14.809 7.999 -23.895 1.00 0.00 H new ATOM 0 HB2 MET A 1 15.104 10.222 -24.988 1.00 0.00 H new ATOM 0 HB3 MET A 1 16.825 9.924 -25.124 1.00 0.00 H new ATOM 0 HG2 MET A 1 16.416 8.014 -26.610 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.684 8.196 -26.412 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.753 11.353 -28.302 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.408 10.271 -26.932 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.466 11.684 -26.705 1.00 0.00 H new ATOM 18 N ASP A 2 16.436 6.186 -24.277 1.00 0.00 N ATOM 19 CA ASP A 2 17.359 5.060 -24.410 1.00 0.00 C ATOM 20 C ASP A 2 18.157 4.855 -23.125 1.00 0.00 C ATOM 21 O ASP A 2 19.203 5.474 -22.926 1.00 0.00 O ATOM 22 CB ASP A 2 18.311 5.279 -25.587 1.00 0.00 C ATOM 23 CG ASP A 2 19.168 4.061 -25.873 1.00 0.00 C ATOM 24 OD1 ASP A 2 20.163 3.850 -25.148 1.00 0.00 O ATOM 25 OD2 ASP A 2 18.845 3.318 -26.824 1.00 0.00 O ATOM 0 H ASP A 2 15.454 5.938 -24.398 1.00 0.00 H new ATOM 0 HA ASP A 2 16.768 4.164 -24.598 1.00 0.00 H new ATOM 0 HB2 ASP A 2 17.733 5.530 -26.476 1.00 0.00 H new ATOM 0 HB3 ASP A 2 18.956 6.132 -25.375 1.00 0.00 H new ATOM 30 N ALA A 3 17.651 3.985 -22.253 1.00 0.00 N ATOM 31 CA ALA A 3 18.311 3.691 -20.984 1.00 0.00 C ATOM 32 C ALA A 3 18.479 4.951 -20.141 1.00 0.00 C ATOM 33 O ALA A 3 17.987 6.022 -20.500 1.00 0.00 O ATOM 34 CB ALA A 3 19.662 3.032 -21.228 1.00 0.00 C ATOM 0 H ALA A 3 16.783 3.470 -22.403 1.00 0.00 H new ATOM 0 HA ALA A 3 17.677 2.999 -20.430 1.00 0.00 H new ATOM 0 HB1 ALA A 3 20.141 2.819 -20.272 1.00 0.00 H new ATOM 0 HB2 ALA A 3 19.519 2.101 -21.777 1.00 0.00 H new ATOM 0 HB3 ALA A 3 20.294 3.703 -21.809 1.00 0.00 H new ATOM 40 N LEU A 4 19.172 4.814 -19.015 1.00 0.00 N ATOM 41 CA LEU A 4 19.410 5.939 -18.118 1.00 0.00 C ATOM 42 C LEU A 4 20.669 5.708 -17.287 1.00 0.00 C ATOM 43 O LEU A 4 21.714 6.309 -17.543 1.00 0.00 O ATOM 44 CB LEU A 4 18.205 6.149 -17.194 1.00 0.00 C ATOM 45 CG LEU A 4 18.314 7.343 -16.243 1.00 0.00 C ATOM 46 CD1 LEU A 4 18.247 8.652 -17.014 1.00 0.00 C ATOM 47 CD2 LEU A 4 17.217 7.285 -15.190 1.00 0.00 C ATOM 0 H LEU A 4 19.579 3.933 -18.702 1.00 0.00 H new ATOM 0 HA LEU A 4 19.552 6.834 -18.724 1.00 0.00 H new ATOM 0 HB2 LEU A 4 17.314 6.275 -17.809 1.00 0.00 H new ATOM 0 HB3 LEU A 4 18.059 5.245 -16.602 1.00 0.00 H new ATOM 0 HG LEU A 4 19.279 7.294 -15.739 1.00 0.00 H new ATOM 0 HD11 LEU A 4 18.326 9.488 -16.319 1.00 0.00 H new ATOM 0 HD12 LEU A 4 19.068 8.695 -17.729 1.00 0.00 H new ATOM 0 HD13 LEU A 4 17.298 8.712 -17.547 1.00 0.00 H new ATOM 0 HD21 LEU A 4 17.309 8.141 -14.522 1.00 0.00 H new ATOM 0 HD22 LEU A 4 16.243 7.308 -15.678 1.00 0.00 H new ATOM 0 HD23 LEU A 4 17.313 6.364 -14.615 1.00 0.00 H new ATOM 59 N GLU A 5 20.562 4.830 -16.294 1.00 0.00 N ATOM 60 CA GLU A 5 21.690 4.515 -15.425 1.00 0.00 C ATOM 61 C GLU A 5 22.003 3.022 -15.467 1.00 0.00 C ATOM 62 O GLU A 5 21.148 2.210 -15.822 1.00 0.00 O ATOM 63 CB GLU A 5 21.391 4.945 -13.988 1.00 0.00 C ATOM 64 CG GLU A 5 21.194 6.444 -13.829 1.00 0.00 C ATOM 65 CD GLU A 5 20.834 6.837 -12.409 1.00 0.00 C ATOM 66 OE1 GLU A 5 19.627 6.875 -12.091 1.00 0.00 O ATOM 67 OE2 GLU A 5 21.760 7.107 -11.615 1.00 0.00 O ATOM 0 H GLU A 5 19.705 4.324 -16.071 1.00 0.00 H new ATOM 0 HA GLU A 5 22.560 5.063 -15.785 1.00 0.00 H new ATOM 0 HB2 GLU A 5 20.494 4.431 -13.643 1.00 0.00 H new ATOM 0 HB3 GLU A 5 22.210 4.624 -13.344 1.00 0.00 H new ATOM 0 HG2 GLU A 5 22.107 6.960 -14.125 1.00 0.00 H new ATOM 0 HG3 GLU A 5 20.407 6.777 -14.505 1.00 0.00 H new ATOM 74 N GLY A 6 23.232 2.669 -15.105 1.00 0.00 N ATOM 75 CA GLY A 6 23.634 1.275 -15.107 1.00 0.00 C ATOM 76 C GLY A 6 23.898 0.747 -16.503 1.00 0.00 C ATOM 77 O GLY A 6 23.105 0.969 -17.419 1.00 0.00 O ATOM 0 H GLY A 6 23.957 3.324 -14.810 1.00 0.00 H new ATOM 0 HA2 GLY A 6 24.534 1.159 -14.503 1.00 0.00 H new ATOM 0 HA3 GLY A 6 22.855 0.675 -14.637 1.00 0.00 H new ATOM 81 N GLU A 7 25.014 0.043 -16.664 1.00 0.00 N ATOM 82 CA GLU A 7 25.383 -0.522 -17.957 1.00 0.00 C ATOM 83 C GLU A 7 25.044 -2.008 -18.018 1.00 0.00 C ATOM 84 O GLU A 7 25.216 -2.650 -19.053 1.00 0.00 O ATOM 85 CB GLU A 7 26.876 -0.319 -18.218 1.00 0.00 C ATOM 86 CG GLU A 7 27.299 1.141 -18.232 1.00 0.00 C ATOM 87 CD GLU A 7 26.611 1.939 -19.322 1.00 0.00 C ATOM 88 OE1 GLU A 7 25.490 2.435 -19.077 1.00 0.00 O ATOM 89 OE2 GLU A 7 27.191 2.070 -20.420 1.00 0.00 O ATOM 0 H GLU A 7 25.679 -0.150 -15.915 1.00 0.00 H new ATOM 0 HA GLU A 7 24.812 -0.004 -18.728 1.00 0.00 H new ATOM 0 HB2 GLU A 7 27.445 -0.846 -17.452 1.00 0.00 H new ATOM 0 HB3 GLU A 7 27.134 -0.772 -19.175 1.00 0.00 H new ATOM 0 HG2 GLU A 7 27.076 1.589 -17.264 1.00 0.00 H new ATOM 0 HG3 GLU A 7 28.379 1.201 -18.370 1.00 0.00 H new ATOM 96 N SER A 8 24.563 -2.545 -16.898 1.00 0.00 N ATOM 97 CA SER A 8 24.199 -3.957 -16.812 1.00 0.00 C ATOM 98 C SER A 8 25.413 -4.847 -17.053 1.00 0.00 C ATOM 99 O SER A 8 25.783 -5.116 -18.197 1.00 0.00 O ATOM 100 CB SER A 8 23.094 -4.289 -17.820 1.00 0.00 C ATOM 101 OG SER A 8 22.730 -5.656 -17.746 1.00 0.00 O ATOM 0 H SER A 8 24.416 -2.021 -16.035 1.00 0.00 H new ATOM 0 HA SER A 8 23.826 -4.148 -15.806 1.00 0.00 H new ATOM 0 HB2 SER A 8 22.221 -3.666 -17.626 1.00 0.00 H new ATOM 0 HB3 SER A 8 23.435 -4.054 -18.828 1.00 0.00 H new ATOM 0 HG SER A 8 22.022 -5.842 -18.398 1.00 0.00 H new ATOM 107 N PHE A 9 26.031 -5.302 -15.966 1.00 0.00 N ATOM 108 CA PHE A 9 27.206 -6.161 -16.058 1.00 0.00 C ATOM 109 C PHE A 9 27.334 -7.052 -14.825 1.00 0.00 C ATOM 110 O PHE A 9 27.119 -8.262 -14.898 1.00 0.00 O ATOM 111 CB PHE A 9 28.469 -5.313 -16.221 1.00 0.00 C ATOM 112 CG PHE A 9 29.705 -6.121 -16.498 1.00 0.00 C ATOM 113 CD1 PHE A 9 29.982 -6.571 -17.778 1.00 0.00 C ATOM 114 CD2 PHE A 9 30.591 -6.429 -15.477 1.00 0.00 C ATOM 115 CE1 PHE A 9 31.119 -7.315 -18.036 1.00 0.00 C ATOM 116 CE2 PHE A 9 31.729 -7.172 -15.729 1.00 0.00 C ATOM 117 CZ PHE A 9 31.993 -7.616 -17.010 1.00 0.00 C ATOM 0 H PHE A 9 25.737 -5.090 -15.013 1.00 0.00 H new ATOM 0 HA PHE A 9 27.087 -6.801 -16.932 1.00 0.00 H new ATOM 0 HB2 PHE A 9 28.318 -4.605 -17.036 1.00 0.00 H new ATOM 0 HB3 PHE A 9 28.623 -4.728 -15.314 1.00 0.00 H new ATOM 0 HD1 PHE A 9 29.302 -6.338 -18.584 1.00 0.00 H new ATOM 0 HD2 PHE A 9 30.390 -6.084 -14.473 1.00 0.00 H new ATOM 0 HE1 PHE A 9 31.323 -7.660 -19.039 1.00 0.00 H new ATOM 0 HE2 PHE A 9 32.411 -7.405 -14.925 1.00 0.00 H new ATOM 0 HZ PHE A 9 32.881 -8.197 -17.209 1.00 0.00 H new ATOM 127 N ALA A 10 27.683 -6.446 -13.693 1.00 0.00 N ATOM 128 CA ALA A 10 27.841 -7.186 -12.446 1.00 0.00 C ATOM 129 C ALA A 10 27.386 -6.357 -11.248 1.00 0.00 C ATOM 130 O ALA A 10 27.655 -6.711 -10.100 1.00 0.00 O ATOM 131 CB ALA A 10 29.291 -7.614 -12.270 1.00 0.00 C ATOM 0 H ALA A 10 27.862 -5.445 -13.615 1.00 0.00 H new ATOM 0 HA ALA A 10 27.211 -8.074 -12.499 1.00 0.00 H new ATOM 0 HB1 ALA A 10 29.397 -8.165 -11.336 1.00 0.00 H new ATOM 0 HB2 ALA A 10 29.586 -8.252 -13.103 1.00 0.00 H new ATOM 0 HB3 ALA A 10 29.930 -6.732 -12.245 1.00 0.00 H new ATOM 137 N LEU A 11 26.696 -5.254 -11.523 1.00 0.00 N ATOM 138 CA LEU A 11 26.204 -4.375 -10.465 1.00 0.00 C ATOM 139 C LEU A 11 25.238 -5.117 -9.546 1.00 0.00 C ATOM 140 O LEU A 11 24.163 -5.540 -9.971 1.00 0.00 O ATOM 141 CB LEU A 11 25.512 -3.152 -11.071 1.00 0.00 C ATOM 142 CG LEU A 11 26.420 -2.226 -11.884 1.00 0.00 C ATOM 143 CD1 LEU A 11 25.597 -1.156 -12.585 1.00 0.00 C ATOM 144 CD2 LEU A 11 27.469 -1.586 -10.988 1.00 0.00 C ATOM 0 H LEU A 11 26.465 -4.947 -12.468 1.00 0.00 H new ATOM 0 HA LEU A 11 27.058 -4.045 -9.874 1.00 0.00 H new ATOM 0 HB2 LEU A 11 24.701 -3.495 -11.713 1.00 0.00 H new ATOM 0 HB3 LEU A 11 25.059 -2.575 -10.265 1.00 0.00 H new ATOM 0 HG LEU A 11 26.930 -2.822 -12.641 1.00 0.00 H new ATOM 0 HD11 LEU A 11 26.258 -0.506 -13.159 1.00 0.00 H new ATOM 0 HD12 LEU A 11 24.881 -1.630 -13.257 1.00 0.00 H new ATOM 0 HD13 LEU A 11 25.061 -0.564 -11.843 1.00 0.00 H new ATOM 0 HD21 LEU A 11 28.105 -0.931 -11.583 1.00 0.00 H new ATOM 0 HD22 LEU A 11 26.976 -1.004 -10.210 1.00 0.00 H new ATOM 0 HD23 LEU A 11 28.078 -2.364 -10.528 1.00 0.00 H new ATOM 156 N SER A 12 25.627 -5.267 -8.283 1.00 0.00 N ATOM 157 CA SER A 12 24.796 -5.959 -7.303 1.00 0.00 C ATOM 158 C SER A 12 25.076 -5.447 -5.892 1.00 0.00 C ATOM 159 O SER A 12 26.146 -5.692 -5.334 1.00 0.00 O ATOM 160 CB SER A 12 25.040 -7.468 -7.366 1.00 0.00 C ATOM 161 OG SER A 12 24.700 -7.989 -8.638 1.00 0.00 O ATOM 0 H SER A 12 26.512 -4.919 -7.914 1.00 0.00 H new ATOM 0 HA SER A 12 23.753 -5.757 -7.545 1.00 0.00 H new ATOM 0 HB2 SER A 12 26.088 -7.679 -7.152 1.00 0.00 H new ATOM 0 HB3 SER A 12 24.451 -7.967 -6.596 1.00 0.00 H new ATOM 0 HG SER A 12 24.867 -8.955 -8.651 1.00 0.00 H new ATOM 167 N PHE A 13 24.108 -4.734 -5.324 1.00 0.00 N ATOM 168 CA PHE A 13 24.248 -4.187 -3.979 1.00 0.00 C ATOM 169 C PHE A 13 22.983 -4.425 -3.160 1.00 0.00 C ATOM 170 O PHE A 13 22.034 -5.049 -3.635 1.00 0.00 O ATOM 171 CB PHE A 13 24.551 -2.688 -4.045 1.00 0.00 C ATOM 172 CG PHE A 13 25.782 -2.357 -4.838 1.00 0.00 C ATOM 173 CD1 PHE A 13 27.026 -2.317 -4.228 1.00 0.00 C ATOM 174 CD2 PHE A 13 25.696 -2.086 -6.195 1.00 0.00 C ATOM 175 CE1 PHE A 13 28.161 -2.014 -4.957 1.00 0.00 C ATOM 176 CE2 PHE A 13 26.827 -1.783 -6.928 1.00 0.00 C ATOM 177 CZ PHE A 13 28.061 -1.746 -6.309 1.00 0.00 C ATOM 0 H PHE A 13 23.218 -4.522 -5.775 1.00 0.00 H new ATOM 0 HA PHE A 13 25.077 -4.698 -3.490 1.00 0.00 H new ATOM 0 HB2 PHE A 13 23.697 -2.172 -4.484 1.00 0.00 H new ATOM 0 HB3 PHE A 13 24.668 -2.305 -3.031 1.00 0.00 H new ATOM 0 HD1 PHE A 13 27.110 -2.525 -3.171 1.00 0.00 H new ATOM 0 HD2 PHE A 13 24.734 -2.112 -6.685 1.00 0.00 H new ATOM 0 HE1 PHE A 13 29.125 -1.987 -4.470 1.00 0.00 H new ATOM 0 HE2 PHE A 13 26.746 -1.575 -7.985 1.00 0.00 H new ATOM 0 HZ PHE A 13 28.946 -1.508 -6.880 1.00 0.00 H new ATOM 187 N SER A 14 22.976 -3.922 -1.928 1.00 0.00 N ATOM 188 CA SER A 14 21.826 -4.078 -1.044 1.00 0.00 C ATOM 189 C SER A 14 21.236 -2.719 -0.676 1.00 0.00 C ATOM 190 O SER A 14 21.934 -1.704 -0.688 1.00 0.00 O ATOM 191 CB SER A 14 22.231 -4.833 0.223 1.00 0.00 C ATOM 192 OG SER A 14 22.696 -6.136 -0.085 1.00 0.00 O ATOM 0 H SER A 14 23.754 -3.403 -1.520 1.00 0.00 H new ATOM 0 HA SER A 14 21.065 -4.652 -1.573 1.00 0.00 H new ATOM 0 HB2 SER A 14 23.011 -4.280 0.746 1.00 0.00 H new ATOM 0 HB3 SER A 14 21.379 -4.898 0.899 1.00 0.00 H new ATOM 0 HG SER A 14 22.950 -6.597 0.742 1.00 0.00 H new ATOM 198 N SER A 15 19.947 -2.707 -0.349 1.00 0.00 N ATOM 199 CA SER A 15 19.262 -1.472 0.024 1.00 0.00 C ATOM 200 C SER A 15 18.093 -1.759 0.961 1.00 0.00 C ATOM 201 O SER A 15 17.706 -0.911 1.766 1.00 0.00 O ATOM 202 CB SER A 15 18.760 -0.746 -1.226 1.00 0.00 C ATOM 203 OG SER A 15 19.833 -0.425 -2.096 1.00 0.00 O ATOM 0 H SER A 15 19.355 -3.538 -0.335 1.00 0.00 H new ATOM 0 HA SER A 15 19.975 -0.834 0.546 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.039 -1.373 -1.750 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.238 0.166 -0.936 1.00 0.00 H new ATOM 0 HG SER A 15 19.486 0.037 -2.887 1.00 0.00 H new ATOM 209 N ALA A 16 17.536 -2.962 0.847 1.00 0.00 N ATOM 210 CA ALA A 16 16.412 -3.369 1.681 1.00 0.00 C ATOM 211 C ALA A 16 16.829 -3.484 3.143 1.00 0.00 C ATOM 212 O ALA A 16 16.013 -3.310 4.048 1.00 0.00 O ATOM 213 CB ALA A 16 15.842 -4.689 1.188 1.00 0.00 C ATOM 0 H ALA A 16 17.846 -3.672 0.184 1.00 0.00 H new ATOM 0 HA ALA A 16 15.640 -2.603 1.609 1.00 0.00 H new ATOM 0 HB1 ALA A 16 15.003 -4.982 1.820 1.00 0.00 H new ATOM 0 HB2 ALA A 16 15.500 -4.576 0.159 1.00 0.00 H new ATOM 0 HB3 ALA A 16 16.614 -5.457 1.231 1.00 0.00 H new ATOM 219 N SER A 17 18.105 -3.781 3.364 1.00 0.00 N ATOM 220 CA SER A 17 18.638 -3.920 4.715 1.00 0.00 C ATOM 221 C SER A 17 19.597 -2.777 5.037 1.00 0.00 C ATOM 222 O SER A 17 20.326 -2.825 6.028 1.00 0.00 O ATOM 223 CB SER A 17 19.353 -5.264 4.867 1.00 0.00 C ATOM 224 OG SER A 17 20.412 -5.387 3.934 1.00 0.00 O ATOM 0 H SER A 17 18.791 -3.930 2.624 1.00 0.00 H new ATOM 0 HA SER A 17 17.805 -3.881 5.417 1.00 0.00 H new ATOM 0 HB2 SER A 17 19.744 -5.359 5.880 1.00 0.00 H new ATOM 0 HB3 SER A 17 18.641 -6.077 4.723 1.00 0.00 H new ATOM 0 HG SER A 17 20.854 -6.254 4.053 1.00 0.00 H new ATOM 230 N ASP A 18 19.586 -1.749 4.193 1.00 0.00 N ATOM 231 CA ASP A 18 20.452 -0.591 4.383 1.00 0.00 C ATOM 232 C ASP A 18 19.639 0.640 4.768 1.00 0.00 C ATOM 233 O ASP A 18 18.448 0.543 5.061 1.00 0.00 O ATOM 234 CB ASP A 18 21.252 -0.314 3.109 1.00 0.00 C ATOM 235 CG ASP A 18 22.233 -1.424 2.791 1.00 0.00 C ATOM 236 OD1 ASP A 18 21.807 -2.444 2.212 1.00 0.00 O ATOM 237 OD2 ASP A 18 23.427 -1.273 3.120 1.00 0.00 O ATOM 0 H ASP A 18 18.986 -1.695 3.370 1.00 0.00 H new ATOM 0 HA ASP A 18 21.143 -0.814 5.196 1.00 0.00 H new ATOM 0 HB2 ASP A 18 20.565 -0.189 2.272 1.00 0.00 H new ATOM 0 HB3 ASP A 18 21.794 0.625 3.220 1.00 0.00 H new ATOM 242 N ALA A 19 20.293 1.798 4.769 1.00 0.00 N ATOM 243 CA ALA A 19 19.633 3.048 5.124 1.00 0.00 C ATOM 244 C ALA A 19 18.597 3.453 4.080 1.00 0.00 C ATOM 245 O ALA A 19 17.641 4.165 4.388 1.00 0.00 O ATOM 246 CB ALA A 19 20.662 4.154 5.302 1.00 0.00 C ATOM 0 H ALA A 19 21.279 1.896 4.528 1.00 0.00 H new ATOM 0 HA ALA A 19 19.109 2.891 6.067 1.00 0.00 H new ATOM 0 HB1 ALA A 19 20.156 5.082 5.567 1.00 0.00 H new ATOM 0 HB2 ALA A 19 21.357 3.880 6.096 1.00 0.00 H new ATOM 0 HB3 ALA A 19 21.211 4.293 4.371 1.00 0.00 H new ATOM 252 N GLU A 20 18.788 2.994 2.846 1.00 0.00 N ATOM 253 CA GLU A 20 17.865 3.320 1.762 1.00 0.00 C ATOM 254 C GLU A 20 16.452 2.845 2.085 1.00 0.00 C ATOM 255 O GLU A 20 15.480 3.563 1.845 1.00 0.00 O ATOM 256 CB GLU A 20 18.341 2.698 0.447 1.00 0.00 C ATOM 257 CG GLU A 20 17.524 3.134 -0.758 1.00 0.00 C ATOM 258 CD GLU A 20 18.061 2.579 -2.062 1.00 0.00 C ATOM 259 OE1 GLU A 20 19.117 3.061 -2.522 1.00 0.00 O ATOM 260 OE2 GLU A 20 17.426 1.661 -2.622 1.00 0.00 O ATOM 0 H GLU A 20 19.569 2.398 2.572 1.00 0.00 H new ATOM 0 HA GLU A 20 17.846 4.404 1.653 1.00 0.00 H new ATOM 0 HB2 GLU A 20 19.385 2.965 0.284 1.00 0.00 H new ATOM 0 HB3 GLU A 20 18.299 1.612 0.531 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.491 2.810 -0.628 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.512 4.223 -0.809 1.00 0.00 H new ATOM 267 N PHE A 21 16.340 1.633 2.626 1.00 0.00 N ATOM 268 CA PHE A 21 15.038 1.075 2.982 1.00 0.00 C ATOM 269 C PHE A 21 14.281 2.017 3.915 1.00 0.00 C ATOM 270 O PHE A 21 13.107 2.315 3.691 1.00 0.00 O ATOM 271 CB PHE A 21 15.208 -0.296 3.645 1.00 0.00 C ATOM 272 CG PHE A 21 13.909 -0.941 4.047 1.00 0.00 C ATOM 273 CD1 PHE A 21 13.166 -1.667 3.128 1.00 0.00 C ATOM 274 CD2 PHE A 21 13.432 -0.820 5.342 1.00 0.00 C ATOM 275 CE1 PHE A 21 11.973 -2.259 3.494 1.00 0.00 C ATOM 276 CE2 PHE A 21 12.239 -1.409 5.714 1.00 0.00 C ATOM 277 CZ PHE A 21 11.508 -2.130 4.789 1.00 0.00 C ATOM 0 H PHE A 21 17.131 1.022 2.826 1.00 0.00 H new ATOM 0 HA PHE A 21 14.458 0.956 2.067 1.00 0.00 H new ATOM 0 HB2 PHE A 21 15.735 -0.959 2.958 1.00 0.00 H new ATOM 0 HB3 PHE A 21 15.837 -0.187 4.528 1.00 0.00 H new ATOM 0 HD1 PHE A 21 13.524 -1.771 2.114 1.00 0.00 H new ATOM 0 HD2 PHE A 21 14.000 -0.259 6.069 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.404 -2.822 2.769 1.00 0.00 H new ATOM 0 HE2 PHE A 21 11.878 -1.306 6.727 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.575 -2.592 5.078 1.00 0.00 H new ATOM 287 N ASP A 22 14.962 2.486 4.958 1.00 0.00 N ATOM 288 CA ASP A 22 14.353 3.398 5.921 1.00 0.00 C ATOM 289 C ASP A 22 13.848 4.658 5.227 1.00 0.00 C ATOM 290 O ASP A 22 12.784 5.182 5.564 1.00 0.00 O ATOM 291 CB ASP A 22 15.361 3.770 7.010 1.00 0.00 C ATOM 292 CG ASP A 22 15.867 2.559 7.767 1.00 0.00 C ATOM 293 OD1 ASP A 22 15.130 2.056 8.641 1.00 0.00 O ATOM 294 OD2 ASP A 22 16.998 2.112 7.486 1.00 0.00 O ATOM 0 H ASP A 22 15.934 2.250 5.157 1.00 0.00 H new ATOM 0 HA ASP A 22 13.504 2.891 6.380 1.00 0.00 H new ATOM 0 HB2 ASP A 22 16.205 4.291 6.558 1.00 0.00 H new ATOM 0 HB3 ASP A 22 14.896 4.464 7.710 1.00 0.00 H new ATOM 299 N ALA A 23 14.618 5.140 4.255 1.00 0.00 N ATOM 300 CA ALA A 23 14.248 6.336 3.508 1.00 0.00 C ATOM 301 C ALA A 23 12.899 6.151 2.825 1.00 0.00 C ATOM 302 O ALA A 23 12.059 7.052 2.838 1.00 0.00 O ATOM 303 CB ALA A 23 15.321 6.674 2.484 1.00 0.00 C ATOM 0 H ALA A 23 15.502 4.720 3.967 1.00 0.00 H new ATOM 0 HA ALA A 23 14.163 7.165 4.210 1.00 0.00 H new ATOM 0 HB1 ALA A 23 15.030 7.569 1.934 1.00 0.00 H new ATOM 0 HB2 ALA A 23 16.267 6.853 2.994 1.00 0.00 H new ATOM 0 HB3 ALA A 23 15.435 5.842 1.789 1.00 0.00 H new ATOM 309 N VAL A 24 12.697 4.979 2.230 1.00 0.00 N ATOM 310 CA VAL A 24 11.444 4.676 1.549 1.00 0.00 C ATOM 311 C VAL A 24 10.274 4.752 2.521 1.00 0.00 C ATOM 312 O VAL A 24 9.213 5.283 2.191 1.00 0.00 O ATOM 313 CB VAL A 24 11.470 3.276 0.903 1.00 0.00 C ATOM 314 CG1 VAL A 24 10.207 3.042 0.086 1.00 0.00 C ATOM 315 CG2 VAL A 24 12.711 3.108 0.041 1.00 0.00 C ATOM 0 H VAL A 24 13.384 4.225 2.206 1.00 0.00 H new ATOM 0 HA VAL A 24 11.320 5.421 0.763 1.00 0.00 H new ATOM 0 HB VAL A 24 11.505 2.530 1.697 1.00 0.00 H new ATOM 0 HG11 VAL A 24 10.243 2.049 -0.363 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.335 3.116 0.735 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.138 3.793 -0.701 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.712 2.114 -0.406 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.711 3.861 -0.747 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.602 3.229 0.658 1.00 0.00 H new ATOM 325 N VAL A 25 10.476 4.215 3.722 1.00 0.00 N ATOM 326 CA VAL A 25 9.444 4.232 4.750 1.00 0.00 C ATOM 327 C VAL A 25 8.980 5.660 5.009 1.00 0.00 C ATOM 328 O VAL A 25 7.788 5.915 5.190 1.00 0.00 O ATOM 329 CB VAL A 25 9.953 3.619 6.069 1.00 0.00 C ATOM 330 CG1 VAL A 25 8.827 3.523 7.087 1.00 0.00 C ATOM 331 CG2 VAL A 25 10.572 2.253 5.818 1.00 0.00 C ATOM 0 H VAL A 25 11.346 3.763 4.005 1.00 0.00 H new ATOM 0 HA VAL A 25 8.610 3.632 4.386 1.00 0.00 H new ATOM 0 HB VAL A 25 10.723 4.273 6.477 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.208 3.088 8.011 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.434 4.519 7.290 1.00 0.00 H new ATOM 0 HG13 VAL A 25 8.031 2.893 6.690 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.926 1.835 6.760 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.824 1.589 5.385 1.00 0.00 H new ATOM 0 HG23 VAL A 25 11.410 2.354 5.129 1.00 0.00 H new ATOM 341 N GLY A 26 9.933 6.587 5.024 1.00 0.00 N ATOM 342 CA GLY A 26 9.610 7.983 5.250 1.00 0.00 C ATOM 343 C GLY A 26 8.767 8.561 4.132 1.00 0.00 C ATOM 344 O GLY A 26 7.801 9.284 4.383 1.00 0.00 O ATOM 0 H GLY A 26 10.925 6.395 4.883 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.076 8.083 6.195 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.532 8.558 5.343 1.00 0.00 H new ATOM 348 N TYR A 27 9.132 8.242 2.893 1.00 0.00 N ATOM 349 CA TYR A 27 8.398 8.731 1.734 1.00 0.00 C ATOM 350 C TYR A 27 6.969 8.202 1.744 1.00 0.00 C ATOM 351 O TYR A 27 6.049 8.858 1.254 1.00 0.00 O ATOM 352 CB TYR A 27 9.101 8.316 0.437 1.00 0.00 C ATOM 353 CG TYR A 27 10.488 8.904 0.278 1.00 0.00 C ATOM 354 CD1 TYR A 27 10.700 10.272 0.387 1.00 0.00 C ATOM 355 CD2 TYR A 27 11.585 8.089 0.018 1.00 0.00 C ATOM 356 CE1 TYR A 27 11.964 10.813 0.241 1.00 0.00 C ATOM 357 CE2 TYR A 27 12.852 8.624 -0.129 1.00 0.00 C ATOM 358 CZ TYR A 27 13.036 9.986 -0.015 1.00 0.00 C ATOM 359 OH TYR A 27 14.296 10.521 -0.160 1.00 0.00 O ATOM 0 H TYR A 27 9.930 7.648 2.668 1.00 0.00 H new ATOM 0 HA TYR A 27 8.370 9.819 1.784 1.00 0.00 H new ATOM 0 HB2 TYR A 27 9.172 7.229 0.405 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.488 8.621 -0.411 1.00 0.00 H new ATOM 0 HD1 TYR A 27 9.863 10.924 0.589 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.445 7.022 -0.070 1.00 0.00 H new ATOM 0 HE1 TYR A 27 12.111 11.880 0.327 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.693 7.978 -0.332 1.00 0.00 H new ATOM 0 HH TYR A 27 14.938 9.802 -0.335 1.00 0.00 H new ATOM 369 N LEU A 28 6.788 7.012 2.312 1.00 0.00 N ATOM 370 CA LEU A 28 5.470 6.394 2.392 1.00 0.00 C ATOM 371 C LEU A 28 4.550 7.195 3.306 1.00 0.00 C ATOM 372 O LEU A 28 3.412 7.495 2.944 1.00 0.00 O ATOM 373 CB LEU A 28 5.585 4.955 2.898 1.00 0.00 C ATOM 374 CG LEU A 28 6.189 3.960 1.904 1.00 0.00 C ATOM 375 CD1 LEU A 28 6.401 2.608 2.565 1.00 0.00 C ATOM 376 CD2 LEU A 28 5.297 3.819 0.678 1.00 0.00 C ATOM 0 H LEU A 28 7.539 6.457 2.723 1.00 0.00 H new ATOM 0 HA LEU A 28 5.040 6.384 1.390 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.192 4.953 3.804 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.592 4.605 3.179 1.00 0.00 H new ATOM 0 HG LEU A 28 7.158 4.343 1.582 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.831 1.914 1.843 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.080 2.719 3.411 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.445 2.221 2.916 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.743 3.108 -0.017 1.00 0.00 H new ATOM 0 HD22 LEU A 28 4.314 3.461 0.983 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.195 4.788 0.189 1.00 0.00 H new ATOM 388 N GLU A 29 5.048 7.539 4.489 1.00 0.00 N ATOM 389 CA GLU A 29 4.265 8.308 5.451 1.00 0.00 C ATOM 390 C GLU A 29 3.879 9.666 4.875 1.00 0.00 C ATOM 391 O GLU A 29 2.806 10.194 5.170 1.00 0.00 O ATOM 392 CB GLU A 29 5.050 8.497 6.750 1.00 0.00 C ATOM 393 CG GLU A 29 5.352 7.195 7.473 1.00 0.00 C ATOM 394 CD GLU A 29 6.109 7.413 8.769 1.00 0.00 C ATOM 395 OE1 GLU A 29 5.452 7.605 9.814 1.00 0.00 O ATOM 396 OE2 GLU A 29 7.357 7.393 8.738 1.00 0.00 O ATOM 0 H GLU A 29 5.988 7.299 4.805 1.00 0.00 H new ATOM 0 HA GLU A 29 3.353 7.750 5.666 1.00 0.00 H new ATOM 0 HB2 GLU A 29 5.988 9.005 6.527 1.00 0.00 H new ATOM 0 HB3 GLU A 29 4.484 9.149 7.415 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.417 6.675 7.685 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.936 6.547 6.819 1.00 0.00 H new ATOM 403 N ASP A 30 4.758 10.228 4.051 1.00 0.00 N ATOM 404 CA ASP A 30 4.508 11.526 3.433 1.00 0.00 C ATOM 405 C ASP A 30 3.332 11.450 2.466 1.00 0.00 C ATOM 406 O ASP A 30 2.466 12.326 2.454 1.00 0.00 O ATOM 407 CB ASP A 30 5.758 12.016 2.698 1.00 0.00 C ATOM 408 CG ASP A 30 5.584 13.411 2.128 1.00 0.00 C ATOM 409 OD1 ASP A 30 5.071 13.530 0.996 1.00 0.00 O ATOM 410 OD2 ASP A 30 5.962 14.384 2.815 1.00 0.00 O ATOM 0 H ASP A 30 5.650 9.805 3.796 1.00 0.00 H new ATOM 0 HA ASP A 30 4.260 12.234 4.223 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.605 12.010 3.384 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.996 11.324 1.891 1.00 0.00 H new ATOM 415 N ILE A 31 3.307 10.396 1.655 1.00 0.00 N ATOM 416 CA ILE A 31 2.240 10.203 0.680 1.00 0.00 C ATOM 417 C ILE A 31 0.903 9.937 1.367 1.00 0.00 C ATOM 418 O ILE A 31 -0.128 10.476 0.968 1.00 0.00 O ATOM 419 CB ILE A 31 2.558 9.036 -0.277 1.00 0.00 C ATOM 420 CG1 ILE A 31 3.878 9.294 -1.008 1.00 0.00 C ATOM 421 CG2 ILE A 31 1.424 8.841 -1.275 1.00 0.00 C ATOM 422 CD1 ILE A 31 4.365 8.113 -1.822 1.00 0.00 C ATOM 0 H ILE A 31 4.015 9.662 1.655 1.00 0.00 H new ATOM 0 HA ILE A 31 2.168 11.126 0.104 1.00 0.00 H new ATOM 0 HB ILE A 31 2.659 8.123 0.310 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.756 10.153 -1.668 1.00 0.00 H new ATOM 0 HG13 ILE A 31 4.642 9.560 -0.277 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.665 8.014 -1.942 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.502 8.618 -0.739 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.293 9.752 -1.859 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.305 8.371 -2.311 1.00 0.00 H new ATOM 0 HD12 ILE A 31 4.521 7.257 -1.165 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.621 7.860 -2.577 1.00 0.00 H new ATOM 434 N ILE A 32 0.927 9.101 2.400 1.00 0.00 N ATOM 435 CA ILE A 32 -0.285 8.762 3.137 1.00 0.00 C ATOM 436 C ILE A 32 -0.889 9.997 3.805 1.00 0.00 C ATOM 437 O ILE A 32 -2.104 10.087 3.981 1.00 0.00 O ATOM 438 CB ILE A 32 -0.010 7.685 4.207 1.00 0.00 C ATOM 439 CG1 ILE A 32 0.515 6.407 3.545 1.00 0.00 C ATOM 440 CG2 ILE A 32 -1.271 7.393 5.010 1.00 0.00 C ATOM 441 CD1 ILE A 32 0.970 5.352 4.531 1.00 0.00 C ATOM 0 H ILE A 32 1.772 8.646 2.746 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.996 8.365 2.413 1.00 0.00 H new ATOM 0 HB ILE A 32 0.750 8.060 4.892 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.268 5.988 2.914 1.00 0.00 H new ATOM 0 HG13 ILE A 32 1.348 6.663 2.891 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.057 6.631 5.759 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.606 8.304 5.505 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -2.053 7.034 4.341 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.328 4.477 3.988 1.00 0.00 H new ATOM 0 HD12 ILE A 32 1.776 5.752 5.146 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.134 5.066 5.169 1.00 0.00 H new ATOM 453 N MET A 33 -0.033 10.947 4.169 1.00 0.00 N ATOM 454 CA MET A 33 -0.486 12.173 4.817 1.00 0.00 C ATOM 455 C MET A 33 -0.571 13.323 3.817 1.00 0.00 C ATOM 456 O MET A 33 -0.652 14.489 4.204 1.00 0.00 O ATOM 457 CB MET A 33 0.457 12.542 5.966 1.00 0.00 C ATOM 458 CG MET A 33 0.588 11.450 7.016 1.00 0.00 C ATOM 459 SD MET A 33 1.834 11.833 8.264 1.00 0.00 S ATOM 460 CE MET A 33 1.148 13.323 8.985 1.00 0.00 C ATOM 0 H MET A 33 0.976 10.892 4.027 1.00 0.00 H new ATOM 0 HA MET A 33 -1.484 11.996 5.217 1.00 0.00 H new ATOM 0 HB2 MET A 33 1.443 12.764 5.559 1.00 0.00 H new ATOM 0 HB3 MET A 33 0.096 13.453 6.443 1.00 0.00 H new ATOM 0 HG2 MET A 33 -0.376 11.302 7.503 1.00 0.00 H new ATOM 0 HG3 MET A 33 0.845 10.510 6.527 1.00 0.00 H new ATOM 0 HE1 MET A 33 1.635 13.523 9.939 1.00 0.00 H new ATOM 0 HE2 MET A 33 1.313 14.163 8.310 1.00 0.00 H new ATOM 0 HE3 MET A 33 0.078 13.190 9.145 1.00 0.00 H new ATOM 470 N ASP A 34 -0.554 12.985 2.532 1.00 0.00 N ATOM 471 CA ASP A 34 -0.633 13.989 1.476 1.00 0.00 C ATOM 472 C ASP A 34 -2.085 14.381 1.213 1.00 0.00 C ATOM 473 O ASP A 34 -2.974 13.528 1.198 1.00 0.00 O ATOM 474 CB ASP A 34 0.011 13.461 0.192 1.00 0.00 C ATOM 475 CG ASP A 34 0.095 14.516 -0.893 1.00 0.00 C ATOM 476 OD1 ASP A 34 -0.863 14.630 -1.686 1.00 0.00 O ATOM 477 OD2 ASP A 34 1.120 15.227 -0.950 1.00 0.00 O ATOM 0 H ASP A 34 -0.486 12.024 2.196 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.090 14.875 1.804 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.013 13.095 0.416 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -0.564 12.611 -0.176 1.00 0.00 H new ATOM 482 N ASP A 35 -2.318 15.674 1.008 1.00 0.00 N ATOM 483 CA ASP A 35 -3.664 16.183 0.753 1.00 0.00 C ATOM 484 C ASP A 35 -4.295 15.495 -0.454 1.00 0.00 C ATOM 485 O ASP A 35 -5.419 14.998 -0.377 1.00 0.00 O ATOM 486 CB ASP A 35 -3.627 17.695 0.528 1.00 0.00 C ATOM 487 CG ASP A 35 -5.004 18.275 0.264 1.00 0.00 C ATOM 488 OD1 ASP A 35 -5.413 18.320 -0.916 1.00 0.00 O ATOM 489 OD2 ASP A 35 -5.673 18.682 1.237 1.00 0.00 O ATOM 0 H ASP A 35 -1.592 16.390 1.013 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.274 15.965 1.630 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.194 18.179 1.403 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -2.974 17.918 -0.316 1.00 0.00 H new ATOM 494 N GLU A 36 -3.569 15.473 -1.566 1.00 0.00 N ATOM 495 CA GLU A 36 -4.061 14.850 -2.791 1.00 0.00 C ATOM 496 C GLU A 36 -4.399 13.381 -2.557 1.00 0.00 C ATOM 497 O GLU A 36 -5.264 12.818 -3.229 1.00 0.00 O ATOM 498 CB GLU A 36 -3.019 14.973 -3.906 1.00 0.00 C ATOM 499 CG GLU A 36 -3.480 14.401 -5.237 1.00 0.00 C ATOM 500 CD GLU A 36 -4.696 15.118 -5.790 1.00 0.00 C ATOM 501 OE1 GLU A 36 -5.829 14.711 -5.455 1.00 0.00 O ATOM 502 OE2 GLU A 36 -4.516 16.086 -6.559 1.00 0.00 O ATOM 0 H GLU A 36 -2.637 15.879 -1.645 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.970 15.370 -3.093 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.766 16.025 -4.040 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.107 14.462 -3.597 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.665 14.466 -5.958 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.712 13.343 -5.113 1.00 0.00 H new ATOM 509 N PHE A 37 -3.714 12.766 -1.596 1.00 0.00 N ATOM 510 CA PHE A 37 -3.940 11.362 -1.272 1.00 0.00 C ATOM 511 C PHE A 37 -5.205 11.191 -0.439 1.00 0.00 C ATOM 512 O PHE A 37 -5.880 10.165 -0.523 1.00 0.00 O ATOM 513 CB PHE A 37 -2.736 10.797 -0.515 1.00 0.00 C ATOM 514 CG PHE A 37 -2.861 9.336 -0.187 1.00 0.00 C ATOM 515 CD1 PHE A 37 -2.516 8.372 -1.119 1.00 0.00 C ATOM 516 CD2 PHE A 37 -3.321 8.928 1.055 1.00 0.00 C ATOM 517 CE1 PHE A 37 -2.629 7.027 -0.820 1.00 0.00 C ATOM 518 CE2 PHE A 37 -3.436 7.586 1.361 1.00 0.00 C ATOM 519 CZ PHE A 37 -3.089 6.634 0.422 1.00 0.00 C ATOM 0 H PHE A 37 -2.998 13.219 -1.028 1.00 0.00 H new ATOM 0 HA PHE A 37 -4.067 10.814 -2.205 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.837 10.951 -1.113 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.604 11.358 0.410 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.154 8.674 -2.091 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -3.593 9.668 1.793 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.358 6.285 -1.556 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.796 7.282 2.332 1.00 0.00 H new ATOM 0 HZ PHE A 37 -3.177 5.584 0.659 1.00 0.00 H new ATOM 529 N GLN A 38 -5.522 12.202 0.364 1.00 0.00 N ATOM 530 CA GLN A 38 -6.708 12.162 1.211 1.00 0.00 C ATOM 531 C GLN A 38 -7.982 12.192 0.373 1.00 0.00 C ATOM 532 O GLN A 38 -8.898 11.400 0.588 1.00 0.00 O ATOM 533 CB GLN A 38 -6.703 13.334 2.190 1.00 0.00 C ATOM 534 CG GLN A 38 -5.600 13.249 3.231 1.00 0.00 C ATOM 535 CD GLN A 38 -5.633 11.952 4.017 1.00 0.00 C ATOM 536 OE1 GLN A 38 -6.343 11.836 5.015 1.00 0.00 O ATOM 537 NE2 GLN A 38 -4.849 10.973 3.577 1.00 0.00 N ATOM 0 H GLN A 38 -4.974 13.058 0.446 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.687 11.228 1.772 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -6.594 14.263 1.631 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.667 13.378 2.696 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -4.633 13.345 2.738 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -5.691 14.089 3.920 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -4.277 11.113 2.744 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -4.820 10.082 4.072 1.00 0.00 H new ATOM 546 N LEU A 39 -8.029 13.112 -0.585 1.00 0.00 N ATOM 547 CA LEU A 39 -9.190 13.256 -1.456 1.00 0.00 C ATOM 548 C LEU A 39 -9.326 12.063 -2.399 1.00 0.00 C ATOM 549 O LEU A 39 -10.423 11.547 -2.603 1.00 0.00 O ATOM 550 CB LEU A 39 -9.085 14.558 -2.258 1.00 0.00 C ATOM 551 CG LEU A 39 -10.374 15.009 -2.951 1.00 0.00 C ATOM 552 CD1 LEU A 39 -10.358 16.514 -3.175 1.00 0.00 C ATOM 553 CD2 LEU A 39 -10.557 14.281 -4.275 1.00 0.00 C ATOM 0 H LEU A 39 -7.274 13.771 -0.778 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.082 13.291 -0.831 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.756 15.352 -1.588 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.309 14.437 -3.014 1.00 0.00 H new ATOM 0 HG LEU A 39 -11.214 14.761 -2.303 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.281 16.818 -3.668 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.274 17.024 -2.215 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.507 16.779 -3.802 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -11.479 14.617 -4.750 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.712 14.497 -4.929 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -10.611 13.207 -4.095 1.00 0.00 H new ATOM 565 N LEU A 40 -8.205 11.631 -2.971 1.00 0.00 N ATOM 566 CA LEU A 40 -8.199 10.504 -3.901 1.00 0.00 C ATOM 567 C LEU A 40 -8.646 9.215 -3.216 1.00 0.00 C ATOM 568 O LEU A 40 -9.440 8.453 -3.766 1.00 0.00 O ATOM 569 CB LEU A 40 -6.802 10.326 -4.505 1.00 0.00 C ATOM 570 CG LEU A 40 -6.657 9.172 -5.503 1.00 0.00 C ATOM 571 CD1 LEU A 40 -5.728 9.564 -6.641 1.00 0.00 C ATOM 572 CD2 LEU A 40 -6.138 7.922 -4.807 1.00 0.00 C ATOM 0 H LEU A 40 -7.287 12.045 -2.807 1.00 0.00 H new ATOM 0 HA LEU A 40 -8.909 10.722 -4.699 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.520 11.253 -5.005 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.091 10.173 -3.693 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.642 8.954 -5.917 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.637 8.732 -7.340 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.135 10.431 -7.161 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -4.745 9.810 -6.240 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.042 7.115 -5.533 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -5.164 8.130 -4.365 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.836 7.625 -4.024 1.00 0.00 H new ATOM 584 N GLN A 41 -8.136 8.979 -2.014 1.00 0.00 N ATOM 585 CA GLN A 41 -8.476 7.775 -1.261 1.00 0.00 C ATOM 586 C GLN A 41 -9.972 7.714 -0.962 1.00 0.00 C ATOM 587 O GLN A 41 -10.630 6.716 -1.250 1.00 0.00 O ATOM 588 CB GLN A 41 -7.681 7.727 0.045 1.00 0.00 C ATOM 589 CG GLN A 41 -7.850 6.427 0.815 1.00 0.00 C ATOM 590 CD GLN A 41 -7.266 5.235 0.083 1.00 0.00 C ATOM 591 OE1 GLN A 41 -7.951 4.570 -0.693 1.00 0.00 O ATOM 592 NE2 GLN A 41 -5.989 4.960 0.326 1.00 0.00 N ATOM 0 H GLN A 41 -7.485 9.604 -1.538 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.215 6.912 -1.873 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.624 7.872 -0.178 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.990 8.558 0.679 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.370 6.521 1.789 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.910 6.253 0.998 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.458 5.538 0.977 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.540 4.171 -0.139 1.00 0.00 H new ATOM 601 N ARG A 42 -10.499 8.788 -0.384 1.00 0.00 N ATOM 602 CA ARG A 42 -11.915 8.858 -0.034 1.00 0.00 C ATOM 603 C ARG A 42 -12.802 8.850 -1.277 1.00 0.00 C ATOM 604 O ARG A 42 -13.916 8.325 -1.252 1.00 0.00 O ATOM 605 CB ARG A 42 -12.191 10.121 0.789 1.00 0.00 C ATOM 606 CG ARG A 42 -11.344 10.230 2.047 1.00 0.00 C ATOM 607 CD ARG A 42 -11.739 9.192 3.086 1.00 0.00 C ATOM 608 NE ARG A 42 -13.094 9.408 3.587 1.00 0.00 N ATOM 609 CZ ARG A 42 -13.531 8.946 4.754 1.00 0.00 C ATOM 610 NH1 ARG A 42 -12.723 8.247 5.541 1.00 0.00 N ATOM 611 NH2 ARG A 42 -14.778 9.185 5.137 1.00 0.00 N ATOM 0 H ARG A 42 -9.966 9.625 -0.147 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.154 7.975 0.558 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.012 10.997 0.165 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -13.244 10.138 1.069 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -10.292 10.104 1.789 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.451 11.228 2.472 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -11.669 8.196 2.649 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -11.035 9.225 3.918 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.741 9.944 3.009 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -11.763 8.063 5.251 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.062 7.894 6.436 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -15.402 9.723 4.536 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -15.113 8.830 6.033 1.00 0.00 H new ATOM 625 N ASN A 43 -12.302 9.433 -2.363 1.00 0.00 N ATOM 626 CA ASN A 43 -13.056 9.507 -3.612 1.00 0.00 C ATOM 627 C ASN A 43 -13.417 8.118 -4.135 1.00 0.00 C ATOM 628 O ASN A 43 -14.571 7.858 -4.475 1.00 0.00 O ATOM 629 CB ASN A 43 -12.251 10.268 -4.667 1.00 0.00 C ATOM 630 CG ASN A 43 -13.031 10.478 -5.950 1.00 0.00 C ATOM 631 OD1 ASN A 43 -12.965 9.664 -6.871 1.00 0.00 O ATOM 632 ND2 ASN A 43 -13.776 11.575 -6.015 1.00 0.00 N ATOM 0 H ASN A 43 -11.377 9.862 -2.404 1.00 0.00 H new ATOM 0 HA ASN A 43 -13.985 10.040 -3.408 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.953 11.236 -4.264 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -11.336 9.719 -4.887 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -14.324 11.771 -6.853 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -13.801 12.222 -5.227 1.00 0.00 H new ATOM 639 N PHE A 44 -12.429 7.231 -4.200 1.00 0.00 N ATOM 640 CA PHE A 44 -12.657 5.873 -4.689 1.00 0.00 C ATOM 641 C PHE A 44 -13.295 4.998 -3.615 1.00 0.00 C ATOM 642 O PHE A 44 -14.164 4.178 -3.911 1.00 0.00 O ATOM 643 CB PHE A 44 -11.346 5.251 -5.172 1.00 0.00 C ATOM 644 CG PHE A 44 -10.851 5.839 -6.462 1.00 0.00 C ATOM 645 CD1 PHE A 44 -11.340 5.384 -7.677 1.00 0.00 C ATOM 646 CD2 PHE A 44 -9.905 6.850 -6.462 1.00 0.00 C ATOM 647 CE1 PHE A 44 -10.894 5.926 -8.866 1.00 0.00 C ATOM 648 CE2 PHE A 44 -9.454 7.396 -7.648 1.00 0.00 C ATOM 649 CZ PHE A 44 -9.949 6.934 -8.852 1.00 0.00 C ATOM 0 H PHE A 44 -11.467 7.425 -3.922 1.00 0.00 H new ATOM 0 HA PHE A 44 -13.349 5.932 -5.529 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.584 5.384 -4.404 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -11.486 4.178 -5.300 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -12.079 4.596 -7.694 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -9.515 7.216 -5.524 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -11.283 5.563 -9.806 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -8.715 8.183 -7.634 1.00 0.00 H new ATOM 0 HZ PHE A 44 -9.598 7.360 -9.780 1.00 0.00 H new ATOM 659 N MET A 45 -12.861 5.172 -2.372 1.00 0.00 N ATOM 660 CA MET A 45 -13.399 4.394 -1.260 1.00 0.00 C ATOM 661 C MET A 45 -14.910 4.580 -1.144 1.00 0.00 C ATOM 662 O MET A 45 -15.610 3.722 -0.608 1.00 0.00 O ATOM 663 CB MET A 45 -12.718 4.795 0.050 1.00 0.00 C ATOM 664 CG MET A 45 -11.335 4.189 0.228 1.00 0.00 C ATOM 665 SD MET A 45 -11.377 2.393 0.403 1.00 0.00 S ATOM 666 CE MET A 45 -12.298 2.222 1.930 1.00 0.00 C ATOM 0 H MET A 45 -12.140 5.843 -2.108 1.00 0.00 H new ATOM 0 HA MET A 45 -13.197 3.341 -1.456 1.00 0.00 H new ATOM 0 HB2 MET A 45 -12.637 5.881 0.090 1.00 0.00 H new ATOM 0 HB3 MET A 45 -13.349 4.491 0.885 1.00 0.00 H new ATOM 0 HG2 MET A 45 -10.715 4.452 -0.629 1.00 0.00 H new ATOM 0 HG3 MET A 45 -10.863 4.625 1.109 1.00 0.00 H new ATOM 0 HE1 MET A 45 -12.098 1.244 2.368 1.00 0.00 H new ATOM 0 HE2 MET A 45 -11.993 3.002 2.628 1.00 0.00 H new ATOM 0 HE3 MET A 45 -13.364 2.316 1.724 1.00 0.00 H new ATOM 676 N ASP A 46 -15.402 5.706 -1.650 1.00 0.00 N ATOM 677 CA ASP A 46 -16.828 6.011 -1.607 1.00 0.00 C ATOM 678 C ASP A 46 -17.612 5.120 -2.569 1.00 0.00 C ATOM 679 O ASP A 46 -18.774 4.800 -2.325 1.00 0.00 O ATOM 680 CB ASP A 46 -17.065 7.483 -1.948 1.00 0.00 C ATOM 681 CG ASP A 46 -18.535 7.854 -1.926 1.00 0.00 C ATOM 682 OD1 ASP A 46 -19.033 8.243 -0.849 1.00 0.00 O ATOM 683 OD2 ASP A 46 -19.188 7.756 -2.986 1.00 0.00 O ATOM 0 H ASP A 46 -14.832 6.425 -2.096 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.183 5.816 -0.595 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.525 8.109 -1.238 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -16.655 7.695 -2.935 1.00 0.00 H new ATOM 688 N LYS A 47 -16.972 4.730 -3.667 1.00 0.00 N ATOM 689 CA LYS A 47 -17.615 3.882 -4.667 1.00 0.00 C ATOM 690 C LYS A 47 -17.433 2.401 -4.328 1.00 0.00 C ATOM 691 O LYS A 47 -18.365 1.605 -4.446 1.00 0.00 O ATOM 692 CB LYS A 47 -17.035 4.178 -6.053 1.00 0.00 C ATOM 693 CG LYS A 47 -18.065 4.153 -7.174 1.00 0.00 C ATOM 694 CD LYS A 47 -18.563 2.744 -7.456 1.00 0.00 C ATOM 695 CE LYS A 47 -19.568 2.732 -8.599 1.00 0.00 C ATOM 696 NZ LYS A 47 -20.034 1.355 -8.917 1.00 0.00 N ATOM 0 H LYS A 47 -16.010 4.987 -3.887 1.00 0.00 H new ATOM 0 HA LYS A 47 -18.682 4.103 -4.668 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -16.558 5.158 -6.034 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -16.256 3.448 -6.273 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -18.909 4.789 -6.906 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -17.626 4.571 -8.080 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -17.719 2.100 -7.704 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -19.025 2.333 -6.558 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -20.424 3.353 -8.335 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -19.114 3.175 -9.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -20.128 1.249 -9.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -19.344 0.664 -8.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -20.957 1.188 -8.467 1.00 0.00 H new ATOM 710 N TYR A 48 -16.226 2.045 -3.897 1.00 0.00 N ATOM 711 CA TYR A 48 -15.905 0.663 -3.549 1.00 0.00 C ATOM 712 C TYR A 48 -16.787 0.139 -2.415 1.00 0.00 C ATOM 713 O TYR A 48 -17.423 -0.905 -2.552 1.00 0.00 O ATOM 714 CB TYR A 48 -14.432 0.545 -3.152 1.00 0.00 C ATOM 715 CG TYR A 48 -13.480 0.476 -4.326 1.00 0.00 C ATOM 716 CD1 TYR A 48 -13.462 1.472 -5.295 1.00 0.00 C ATOM 717 CD2 TYR A 48 -12.598 -0.589 -4.463 1.00 0.00 C ATOM 718 CE1 TYR A 48 -12.590 1.408 -6.366 1.00 0.00 C ATOM 719 CE2 TYR A 48 -11.722 -0.659 -5.530 1.00 0.00 C ATOM 720 CZ TYR A 48 -11.723 0.341 -6.479 1.00 0.00 C ATOM 721 OH TYR A 48 -10.853 0.274 -7.543 1.00 0.00 O ATOM 0 H TYR A 48 -15.451 2.697 -3.780 1.00 0.00 H new ATOM 0 HA TYR A 48 -16.097 0.054 -4.432 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -14.165 1.400 -2.531 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -14.302 -0.347 -2.540 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -14.139 2.309 -5.210 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -12.597 -1.376 -3.723 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -12.588 2.190 -7.111 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -11.041 -1.492 -5.620 1.00 0.00 H new ATOM 0 HH TYR A 48 -9.965 0.576 -7.259 1.00 0.00 H new ATOM 731 N TYR A 49 -16.821 0.864 -1.299 1.00 0.00 N ATOM 732 CA TYR A 49 -17.614 0.445 -0.143 1.00 0.00 C ATOM 733 C TYR A 49 -19.087 0.267 -0.509 1.00 0.00 C ATOM 734 O TYR A 49 -19.840 -0.379 0.220 1.00 0.00 O ATOM 735 CB TYR A 49 -17.457 1.446 1.012 1.00 0.00 C ATOM 736 CG TYR A 49 -18.604 2.424 1.164 1.00 0.00 C ATOM 737 CD1 TYR A 49 -18.639 3.604 0.433 1.00 0.00 C ATOM 738 CD2 TYR A 49 -19.648 2.166 2.045 1.00 0.00 C ATOM 739 CE1 TYR A 49 -19.682 4.499 0.575 1.00 0.00 C ATOM 740 CE2 TYR A 49 -20.694 3.057 2.193 1.00 0.00 C ATOM 741 CZ TYR A 49 -20.706 4.222 1.455 1.00 0.00 C ATOM 742 OH TYR A 49 -21.746 5.111 1.598 1.00 0.00 O ATOM 0 H TYR A 49 -16.313 1.739 -1.170 1.00 0.00 H new ATOM 0 HA TYR A 49 -17.237 -0.524 0.185 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -17.346 0.891 1.943 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -16.535 2.009 0.864 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -17.839 3.826 -0.257 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -19.642 1.254 2.623 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -19.695 5.412 -0.001 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -21.497 2.842 2.882 1.00 0.00 H new ATOM 0 HH TYR A 49 -22.384 4.765 2.256 1.00 0.00 H new ATOM 752 N LEU A 50 -19.496 0.837 -1.640 1.00 0.00 N ATOM 753 CA LEU A 50 -20.879 0.725 -2.086 1.00 0.00 C ATOM 754 C LEU A 50 -21.118 -0.606 -2.788 1.00 0.00 C ATOM 755 O LEU A 50 -22.093 -1.303 -2.505 1.00 0.00 O ATOM 756 CB LEU A 50 -21.240 1.882 -3.019 1.00 0.00 C ATOM 757 CG LEU A 50 -21.430 3.236 -2.331 1.00 0.00 C ATOM 758 CD1 LEU A 50 -21.685 4.325 -3.361 1.00 0.00 C ATOM 759 CD2 LEU A 50 -22.573 3.166 -1.330 1.00 0.00 C ATOM 0 H LEU A 50 -18.892 1.377 -2.260 1.00 0.00 H new ATOM 0 HA LEU A 50 -21.519 0.771 -1.205 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -20.456 1.980 -3.770 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.159 1.629 -3.548 1.00 0.00 H new ATOM 0 HG LEU A 50 -20.515 3.483 -1.792 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.818 5.281 -2.854 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -20.835 4.389 -4.040 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.585 4.086 -3.927 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -22.695 4.137 -0.849 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -23.494 2.899 -1.848 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -22.350 2.413 -0.575 1.00 0.00 H new ATOM 771 N GLU A 51 -20.222 -0.954 -3.706 1.00 0.00 N ATOM 772 CA GLU A 51 -20.334 -2.205 -4.447 1.00 0.00 C ATOM 773 C GLU A 51 -20.038 -3.399 -3.547 1.00 0.00 C ATOM 774 O GLU A 51 -20.445 -4.525 -3.838 1.00 0.00 O ATOM 775 CB GLU A 51 -19.385 -2.203 -5.646 1.00 0.00 C ATOM 776 CG GLU A 51 -19.648 -1.074 -6.628 1.00 0.00 C ATOM 777 CD GLU A 51 -21.081 -1.054 -7.125 1.00 0.00 C ATOM 778 OE1 GLU A 51 -21.365 -1.718 -8.143 1.00 0.00 O ATOM 779 OE2 GLU A 51 -21.918 -0.375 -6.494 1.00 0.00 O ATOM 0 H GLU A 51 -19.411 -0.388 -3.954 1.00 0.00 H new ATOM 0 HA GLU A 51 -21.359 -2.292 -4.808 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.359 -2.129 -5.286 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.471 -3.156 -6.169 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -19.420 -0.121 -6.150 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -18.974 -1.173 -7.479 1.00 0.00 H new ATOM 786 N PHE A 52 -19.327 -3.151 -2.452 1.00 0.00 N ATOM 787 CA PHE A 52 -18.984 -4.210 -1.513 1.00 0.00 C ATOM 788 C PHE A 52 -20.121 -4.442 -0.526 1.00 0.00 C ATOM 789 O PHE A 52 -20.097 -3.940 0.598 1.00 0.00 O ATOM 790 CB PHE A 52 -17.694 -3.871 -0.763 1.00 0.00 C ATOM 791 CG PHE A 52 -16.451 -4.341 -1.465 1.00 0.00 C ATOM 792 CD1 PHE A 52 -16.019 -3.724 -2.628 1.00 0.00 C ATOM 793 CD2 PHE A 52 -15.718 -5.402 -0.961 1.00 0.00 C ATOM 794 CE1 PHE A 52 -14.878 -4.158 -3.276 1.00 0.00 C ATOM 795 CE2 PHE A 52 -14.575 -5.840 -1.603 1.00 0.00 C ATOM 796 CZ PHE A 52 -14.155 -5.217 -2.763 1.00 0.00 C ATOM 0 H PHE A 52 -18.978 -2.228 -2.194 1.00 0.00 H new ATOM 0 HA PHE A 52 -18.824 -5.127 -2.081 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -17.637 -2.791 -0.624 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -17.732 -4.319 0.230 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -16.580 -2.895 -3.033 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -16.043 -5.893 -0.056 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -14.552 -3.670 -4.182 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -14.011 -6.668 -1.199 1.00 0.00 H new ATOM 0 HZ PHE A 52 -13.263 -5.558 -3.267 1.00 0.00 H new ATOM 806 N GLU A 53 -21.124 -5.197 -0.963 1.00 0.00 N ATOM 807 CA GLU A 53 -22.277 -5.498 -0.124 1.00 0.00 C ATOM 808 C GLU A 53 -22.087 -6.825 0.601 1.00 0.00 C ATOM 809 O GLU A 53 -21.601 -7.797 0.021 1.00 0.00 O ATOM 810 CB GLU A 53 -23.549 -5.542 -0.973 1.00 0.00 C ATOM 811 CG GLU A 53 -24.816 -5.773 -0.167 1.00 0.00 C ATOM 812 CD GLU A 53 -26.063 -5.756 -1.028 1.00 0.00 C ATOM 813 OE1 GLU A 53 -26.428 -6.823 -1.567 1.00 0.00 O ATOM 814 OE2 GLU A 53 -26.674 -4.676 -1.166 1.00 0.00 O ATOM 0 H GLU A 53 -21.161 -5.612 -1.894 1.00 0.00 H new ATOM 0 HA GLU A 53 -22.373 -4.709 0.622 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -23.643 -4.603 -1.519 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -23.452 -6.334 -1.715 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -24.746 -6.732 0.347 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -24.899 -5.005 0.602 1.00 0.00 H new ATOM 821 N ASP A 54 -22.476 -6.860 1.870 1.00 0.00 N ATOM 822 CA ASP A 54 -22.351 -8.058 2.679 1.00 0.00 C ATOM 823 C ASP A 54 -23.468 -9.049 2.369 1.00 0.00 C ATOM 824 O ASP A 54 -24.581 -8.929 2.883 1.00 0.00 O ATOM 825 CB ASP A 54 -22.372 -7.681 4.158 1.00 0.00 C ATOM 826 CG ASP A 54 -23.503 -6.730 4.498 1.00 0.00 C ATOM 827 OD1 ASP A 54 -23.354 -5.516 4.247 1.00 0.00 O ATOM 828 OD2 ASP A 54 -24.538 -7.200 5.015 1.00 0.00 O ATOM 0 H ASP A 54 -22.883 -6.064 2.360 1.00 0.00 H new ATOM 0 HA ASP A 54 -21.402 -8.540 2.442 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -22.469 -8.585 4.759 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -21.421 -7.220 4.426 1.00 0.00 H new ATOM 833 N THR A 55 -23.164 -10.026 1.518 1.00 0.00 N ATOM 834 CA THR A 55 -24.137 -11.041 1.134 1.00 0.00 C ATOM 835 C THR A 55 -23.472 -12.404 0.979 1.00 0.00 C ATOM 836 O THR A 55 -22.266 -12.494 0.750 1.00 0.00 O ATOM 837 CB THR A 55 -24.841 -10.678 -0.188 1.00 0.00 C ATOM 838 OG1 THR A 55 -23.875 -10.544 -1.238 1.00 0.00 O ATOM 839 CG2 THR A 55 -25.627 -9.383 -0.048 1.00 0.00 C ATOM 0 H THR A 55 -22.249 -10.135 1.081 1.00 0.00 H new ATOM 0 HA THR A 55 -24.879 -11.084 1.932 1.00 0.00 H new ATOM 0 HB THR A 55 -25.536 -11.481 -0.434 1.00 0.00 H new ATOM 0 HG1 THR A 55 -23.597 -11.433 -1.543 1.00 0.00 H new ATOM 0 HG21 THR A 55 -26.114 -9.149 -0.995 1.00 0.00 H new ATOM 0 HG22 THR A 55 -26.382 -9.498 0.730 1.00 0.00 H new ATOM 0 HG23 THR A 55 -24.949 -8.573 0.221 1.00 0.00 H new ATOM 847 N GLU A 56 -24.265 -13.464 1.107 1.00 0.00 N ATOM 848 CA GLU A 56 -23.750 -14.822 0.978 1.00 0.00 C ATOM 849 C GLU A 56 -23.513 -15.176 -0.486 1.00 0.00 C ATOM 850 O GLU A 56 -22.965 -16.233 -0.800 1.00 0.00 O ATOM 851 CB GLU A 56 -24.724 -15.823 1.606 1.00 0.00 C ATOM 852 CG GLU A 56 -25.013 -15.550 3.073 1.00 0.00 C ATOM 853 CD GLU A 56 -25.970 -16.561 3.674 1.00 0.00 C ATOM 854 OE1 GLU A 56 -27.197 -16.379 3.524 1.00 0.00 O ATOM 855 OE2 GLU A 56 -25.493 -17.533 4.296 1.00 0.00 O ATOM 0 H GLU A 56 -25.265 -13.408 1.300 1.00 0.00 H new ATOM 0 HA GLU A 56 -22.797 -14.874 1.505 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -25.661 -15.804 1.050 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -24.314 -16.828 1.506 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -24.078 -15.562 3.633 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -25.434 -14.550 3.177 1.00 0.00 H new ATOM 862 N GLU A 57 -23.931 -14.283 -1.378 1.00 0.00 N ATOM 863 CA GLU A 57 -23.763 -14.495 -2.811 1.00 0.00 C ATOM 864 C GLU A 57 -22.501 -13.801 -3.313 1.00 0.00 C ATOM 865 O GLU A 57 -22.282 -12.620 -3.042 1.00 0.00 O ATOM 866 CB GLU A 57 -24.986 -13.974 -3.569 1.00 0.00 C ATOM 867 CG GLU A 57 -24.913 -14.194 -5.070 1.00 0.00 C ATOM 868 CD GLU A 57 -26.129 -13.653 -5.798 1.00 0.00 C ATOM 869 OE1 GLU A 57 -26.114 -12.463 -6.176 1.00 0.00 O ATOM 870 OE2 GLU A 57 -27.097 -14.420 -5.989 1.00 0.00 O ATOM 0 H GLU A 57 -24.389 -13.405 -1.133 1.00 0.00 H new ATOM 0 HA GLU A 57 -23.664 -15.565 -2.991 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -25.879 -14.465 -3.182 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -25.098 -12.908 -3.372 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -24.016 -13.713 -5.461 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -24.817 -15.261 -5.273 1.00 0.00 H new ATOM 877 N ASN A 58 -21.672 -14.541 -4.044 1.00 0.00 N ATOM 878 CA ASN A 58 -20.429 -13.993 -4.577 1.00 0.00 C ATOM 879 C ASN A 58 -20.529 -13.761 -6.081 1.00 0.00 C ATOM 880 O ASN A 58 -20.839 -14.679 -6.843 1.00 0.00 O ATOM 881 CB ASN A 58 -19.260 -14.933 -4.272 1.00 0.00 C ATOM 882 CG ASN A 58 -17.941 -14.410 -4.806 1.00 0.00 C ATOM 883 OD1 ASN A 58 -17.223 -13.684 -4.118 1.00 0.00 O ATOM 884 ND2 ASN A 58 -17.615 -14.776 -6.041 1.00 0.00 N ATOM 0 H ASN A 58 -21.838 -15.519 -4.280 1.00 0.00 H new ATOM 0 HA ASN A 58 -20.253 -13.032 -4.093 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -19.182 -15.073 -3.194 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -19.462 -15.912 -4.707 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -16.740 -14.454 -6.454 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -18.240 -15.379 -6.576 1.00 0.00 H new ATOM 891 N LYS A 59 -20.264 -12.528 -6.501 1.00 0.00 N ATOM 892 CA LYS A 59 -20.318 -12.169 -7.913 1.00 0.00 C ATOM 893 C LYS A 59 -18.910 -12.033 -8.488 1.00 0.00 C ATOM 894 O LYS A 59 -17.937 -11.908 -7.745 1.00 0.00 O ATOM 895 CB LYS A 59 -21.091 -10.863 -8.101 1.00 0.00 C ATOM 896 CG LYS A 59 -22.558 -10.962 -7.708 1.00 0.00 C ATOM 897 CD LYS A 59 -23.281 -9.639 -7.900 1.00 0.00 C ATOM 898 CE LYS A 59 -22.776 -8.576 -6.936 1.00 0.00 C ATOM 899 NZ LYS A 59 -22.959 -8.981 -5.514 1.00 0.00 N ATOM 0 H LYS A 59 -20.009 -11.759 -5.881 1.00 0.00 H new ATOM 0 HA LYS A 59 -20.836 -12.965 -8.448 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -20.617 -10.081 -7.508 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -21.023 -10.557 -9.145 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -23.044 -11.733 -8.306 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -22.636 -11.271 -6.666 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -23.144 -9.295 -8.925 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -24.351 -9.785 -7.753 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -21.720 -8.387 -7.126 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -23.305 -7.641 -7.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -22.845 -8.150 -4.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -23.911 -9.379 -5.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -22.248 -9.697 -5.263 1.00 0.00 H new ATOM 913 N LEU A 60 -18.809 -12.061 -9.812 1.00 0.00 N ATOM 914 CA LEU A 60 -17.518 -11.947 -10.484 1.00 0.00 C ATOM 915 C LEU A 60 -17.060 -10.492 -10.568 1.00 0.00 C ATOM 916 O LEU A 60 -15.927 -10.214 -10.953 1.00 0.00 O ATOM 917 CB LEU A 60 -17.589 -12.555 -11.890 1.00 0.00 C ATOM 918 CG LEU A 60 -17.705 -14.084 -11.951 1.00 0.00 C ATOM 919 CD1 LEU A 60 -16.574 -14.744 -11.175 1.00 0.00 C ATOM 920 CD2 LEU A 60 -19.057 -14.545 -11.422 1.00 0.00 C ATOM 0 H LEU A 60 -19.605 -12.162 -10.442 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.788 -12.500 -9.892 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -18.445 -12.124 -12.409 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -16.698 -12.255 -12.441 1.00 0.00 H new ATOM 0 HG LEU A 60 -17.625 -14.387 -12.995 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -16.677 -15.828 -11.232 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -15.617 -14.447 -11.604 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -16.617 -14.430 -10.132 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -19.117 -15.632 -11.475 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -19.171 -14.225 -10.386 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -19.852 -14.108 -12.026 1.00 0.00 H new ATOM 932 N ILE A 61 -17.949 -9.569 -10.205 1.00 0.00 N ATOM 933 CA ILE A 61 -17.636 -8.141 -10.249 1.00 0.00 C ATOM 934 C ILE A 61 -16.471 -7.791 -9.319 1.00 0.00 C ATOM 935 O ILE A 61 -15.904 -6.697 -9.400 1.00 0.00 O ATOM 936 CB ILE A 61 -18.868 -7.288 -9.869 1.00 0.00 C ATOM 937 CG1 ILE A 61 -18.646 -5.820 -10.243 1.00 0.00 C ATOM 938 CG2 ILE A 61 -19.172 -7.422 -8.384 1.00 0.00 C ATOM 939 CD1 ILE A 61 -18.542 -5.580 -11.735 1.00 0.00 C ATOM 0 H ILE A 61 -18.891 -9.784 -9.877 1.00 0.00 H new ATOM 0 HA ILE A 61 -17.346 -7.913 -11.275 1.00 0.00 H new ATOM 0 HB ILE A 61 -19.726 -7.657 -10.431 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -19.468 -5.225 -9.845 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -17.734 -5.466 -9.763 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -20.042 -6.815 -8.135 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -19.378 -8.466 -8.148 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -18.314 -7.081 -7.805 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -18.385 -4.518 -11.923 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -17.703 -6.147 -12.137 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -19.463 -5.902 -12.220 1.00 0.00 H new ATOM 951 N TYR A 62 -16.108 -8.725 -8.445 1.00 0.00 N ATOM 952 CA TYR A 62 -15.012 -8.506 -7.507 1.00 0.00 C ATOM 953 C TYR A 62 -13.661 -8.491 -8.217 1.00 0.00 C ATOM 954 O TYR A 62 -12.704 -7.891 -7.727 1.00 0.00 O ATOM 955 CB TYR A 62 -15.012 -9.585 -6.421 1.00 0.00 C ATOM 956 CG TYR A 62 -16.128 -9.436 -5.411 1.00 0.00 C ATOM 957 CD1 TYR A 62 -16.250 -8.284 -4.643 1.00 0.00 C ATOM 958 CD2 TYR A 62 -17.058 -10.451 -5.223 1.00 0.00 C ATOM 959 CE1 TYR A 62 -17.266 -8.149 -3.717 1.00 0.00 C ATOM 960 CE2 TYR A 62 -18.078 -10.322 -4.300 1.00 0.00 C ATOM 961 CZ TYR A 62 -18.178 -9.170 -3.550 1.00 0.00 C ATOM 962 OH TYR A 62 -19.192 -9.040 -2.628 1.00 0.00 O ATOM 0 H TYR A 62 -16.555 -9.638 -8.367 1.00 0.00 H new ATOM 0 HA TYR A 62 -15.167 -7.530 -7.047 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -15.092 -10.564 -6.894 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -14.056 -9.561 -5.898 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -15.539 -7.481 -4.772 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -16.982 -11.356 -5.808 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -17.346 -7.248 -3.127 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -18.793 -11.120 -4.167 1.00 0.00 H new ATOM 0 HH TYR A 62 -19.747 -9.848 -2.636 1.00 0.00 H new ATOM 972 N THR A 63 -13.582 -9.150 -9.371 1.00 0.00 N ATOM 973 CA THR A 63 -12.336 -9.203 -10.127 1.00 0.00 C ATOM 974 C THR A 63 -12.039 -7.869 -10.820 1.00 0.00 C ATOM 975 O THR A 63 -10.946 -7.326 -10.663 1.00 0.00 O ATOM 976 CB THR A 63 -12.342 -10.343 -11.168 1.00 0.00 C ATOM 977 OG1 THR A 63 -12.606 -11.593 -10.520 1.00 0.00 O ATOM 978 CG2 THR A 63 -11.010 -10.421 -11.901 1.00 0.00 C ATOM 0 H THR A 63 -14.361 -9.651 -9.799 1.00 0.00 H new ATOM 0 HA THR A 63 -11.546 -9.403 -9.404 1.00 0.00 H new ATOM 0 HB THR A 63 -13.126 -10.134 -11.896 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.610 -12.312 -11.186 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.042 -11.232 -12.628 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.823 -9.479 -12.416 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.211 -10.608 -11.184 1.00 0.00 H new ATOM 986 N PRO A 64 -12.996 -7.312 -11.599 1.00 0.00 N ATOM 987 CA PRO A 64 -12.791 -6.030 -12.286 1.00 0.00 C ATOM 988 C PRO A 64 -12.503 -4.899 -11.307 1.00 0.00 C ATOM 989 O PRO A 64 -11.586 -4.105 -11.517 1.00 0.00 O ATOM 990 CB PRO A 64 -14.118 -5.781 -13.012 1.00 0.00 C ATOM 991 CG PRO A 64 -14.762 -7.119 -13.110 1.00 0.00 C ATOM 992 CD PRO A 64 -14.330 -7.871 -11.884 1.00 0.00 C ATOM 0 HA PRO A 64 -11.932 -6.064 -12.956 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -14.745 -5.081 -12.459 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -13.953 -5.350 -13.999 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -15.847 -7.029 -13.151 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -14.451 -7.637 -14.017 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -15.018 -7.715 -11.053 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -14.286 -8.945 -12.065 1.00 0.00 H new ATOM 1000 N ILE A 65 -13.293 -4.829 -10.238 1.00 0.00 N ATOM 1001 CA ILE A 65 -13.118 -3.792 -9.227 1.00 0.00 C ATOM 1002 C ILE A 65 -11.730 -3.869 -8.598 1.00 0.00 C ATOM 1003 O ILE A 65 -11.046 -2.854 -8.450 1.00 0.00 O ATOM 1004 CB ILE A 65 -14.186 -3.899 -8.120 1.00 0.00 C ATOM 1005 CG1 ILE A 65 -15.586 -3.732 -8.719 1.00 0.00 C ATOM 1006 CG2 ILE A 65 -13.937 -2.856 -7.039 1.00 0.00 C ATOM 1007 CD1 ILE A 65 -16.706 -3.950 -7.724 1.00 0.00 C ATOM 0 H ILE A 65 -14.058 -5.477 -10.051 1.00 0.00 H new ATOM 0 HA ILE A 65 -13.230 -2.833 -9.732 1.00 0.00 H new ATOM 0 HB ILE A 65 -14.120 -4.887 -7.664 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.675 -2.730 -9.138 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.704 -4.434 -9.544 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -14.699 -2.945 -6.265 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -12.953 -3.016 -6.599 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.980 -1.859 -7.478 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.666 -3.815 -8.222 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.645 -4.962 -7.323 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.615 -3.231 -6.910 1.00 0.00 H new ATOM 1019 N PHE A 66 -11.318 -5.079 -8.227 1.00 0.00 N ATOM 1020 CA PHE A 66 -10.010 -5.287 -7.615 1.00 0.00 C ATOM 1021 C PHE A 66 -8.897 -4.804 -8.540 1.00 0.00 C ATOM 1022 O PHE A 66 -7.928 -4.192 -8.092 1.00 0.00 O ATOM 1023 CB PHE A 66 -9.808 -6.767 -7.279 1.00 0.00 C ATOM 1024 CG PHE A 66 -8.540 -7.045 -6.520 1.00 0.00 C ATOM 1025 CD1 PHE A 66 -8.485 -6.859 -5.148 1.00 0.00 C ATOM 1026 CD2 PHE A 66 -7.405 -7.493 -7.178 1.00 0.00 C ATOM 1027 CE1 PHE A 66 -7.321 -7.115 -4.446 1.00 0.00 C ATOM 1028 CE2 PHE A 66 -6.239 -7.751 -6.481 1.00 0.00 C ATOM 1029 CZ PHE A 66 -6.197 -7.561 -5.113 1.00 0.00 C ATOM 0 H PHE A 66 -11.871 -5.929 -8.340 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.970 -4.707 -6.693 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -10.657 -7.117 -6.692 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -9.801 -7.343 -8.204 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -9.361 -6.510 -4.621 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -7.432 -7.642 -8.247 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -7.291 -6.966 -3.377 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.362 -8.101 -7.005 1.00 0.00 H new ATOM 0 HZ PHE A 66 -5.287 -7.761 -4.567 1.00 0.00 H new ATOM 1039 N ASN A 67 -9.044 -5.083 -9.832 1.00 0.00 N ATOM 1040 CA ASN A 67 -8.053 -4.674 -10.821 1.00 0.00 C ATOM 1041 C ASN A 67 -7.907 -3.156 -10.840 1.00 0.00 C ATOM 1042 O ASN A 67 -6.807 -2.630 -11.017 1.00 0.00 O ATOM 1043 CB ASN A 67 -8.447 -5.176 -12.212 1.00 0.00 C ATOM 1044 CG ASN A 67 -8.544 -6.688 -12.275 1.00 0.00 C ATOM 1045 OD1 ASN A 67 -7.835 -7.398 -11.562 1.00 0.00 O ATOM 1046 ND2 ASN A 67 -9.426 -7.188 -13.133 1.00 0.00 N ATOM 0 H ASN A 67 -9.840 -5.591 -10.218 1.00 0.00 H new ATOM 0 HA ASN A 67 -7.095 -5.115 -10.544 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -9.406 -4.741 -12.494 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -7.714 -4.831 -12.941 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -9.536 -8.198 -13.220 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -9.993 -6.562 -13.704 1.00 0.00 H new ATOM 1053 N GLU A 68 -9.023 -2.459 -10.656 1.00 0.00 N ATOM 1054 CA GLU A 68 -9.021 -1.002 -10.647 1.00 0.00 C ATOM 1055 C GLU A 68 -8.232 -0.472 -9.455 1.00 0.00 C ATOM 1056 O GLU A 68 -7.552 0.548 -9.550 1.00 0.00 O ATOM 1057 CB GLU A 68 -10.454 -0.467 -10.606 1.00 0.00 C ATOM 1058 CG GLU A 68 -10.538 1.050 -10.534 1.00 0.00 C ATOM 1059 CD GLU A 68 -9.878 1.728 -11.719 1.00 0.00 C ATOM 1060 OE1 GLU A 68 -10.528 1.833 -12.781 1.00 0.00 O ATOM 1061 OE2 GLU A 68 -8.712 2.154 -11.586 1.00 0.00 O ATOM 0 H GLU A 68 -9.941 -2.880 -10.511 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.541 -0.657 -11.563 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -10.986 -0.810 -11.493 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.967 -0.892 -9.743 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -11.585 1.350 -10.485 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.065 1.393 -9.614 1.00 0.00 H new ATOM 1068 N TYR A 69 -8.332 -1.176 -8.332 1.00 0.00 N ATOM 1069 CA TYR A 69 -7.629 -0.784 -7.113 1.00 0.00 C ATOM 1070 C TYR A 69 -6.119 -0.943 -7.277 1.00 0.00 C ATOM 1071 O TYR A 69 -5.340 -0.109 -6.815 1.00 0.00 O ATOM 1072 CB TYR A 69 -8.116 -1.633 -5.936 1.00 0.00 C ATOM 1073 CG TYR A 69 -7.544 -1.214 -4.600 1.00 0.00 C ATOM 1074 CD1 TYR A 69 -8.124 -0.188 -3.867 1.00 0.00 C ATOM 1075 CD2 TYR A 69 -6.426 -1.850 -4.071 1.00 0.00 C ATOM 1076 CE1 TYR A 69 -7.607 0.196 -2.643 1.00 0.00 C ATOM 1077 CE2 TYR A 69 -5.904 -1.473 -2.848 1.00 0.00 C ATOM 1078 CZ TYR A 69 -6.498 -0.450 -2.139 1.00 0.00 C ATOM 1079 OH TYR A 69 -5.981 -0.071 -0.921 1.00 0.00 O ATOM 0 H TYR A 69 -8.894 -2.022 -8.240 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.844 0.267 -6.917 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.204 -1.579 -5.887 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -7.856 -2.675 -6.121 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -8.993 0.319 -4.259 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -5.958 -2.651 -4.624 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.069 0.997 -2.085 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.036 -1.977 -2.450 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.201 -0.626 -0.710 1.00 0.00 H new ATOM 1089 N ILE A 70 -5.719 -2.023 -7.940 1.00 0.00 N ATOM 1090 CA ILE A 70 -4.306 -2.310 -8.165 1.00 0.00 C ATOM 1091 C ILE A 70 -3.695 -1.363 -9.194 1.00 0.00 C ATOM 1092 O ILE A 70 -2.500 -1.073 -9.152 1.00 0.00 O ATOM 1093 CB ILE A 70 -4.105 -3.768 -8.630 1.00 0.00 C ATOM 1094 CG1 ILE A 70 -4.748 -4.737 -7.632 1.00 0.00 C ATOM 1095 CG2 ILE A 70 -2.625 -4.078 -8.805 1.00 0.00 C ATOM 1096 CD1 ILE A 70 -4.155 -4.666 -6.239 1.00 0.00 C ATOM 0 H ILE A 70 -6.356 -2.717 -8.332 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.798 -2.162 -7.212 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.593 -3.893 -9.597 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.816 -4.527 -7.573 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.644 -5.754 -8.009 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.506 -5.111 -9.133 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.199 -3.408 -9.552 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.109 -3.937 -7.855 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.662 -5.381 -5.591 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.093 -4.906 -6.283 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -4.283 -3.660 -5.840 1.00 0.00 H new ATOM 1108 N SER A 71 -4.512 -0.885 -10.124 1.00 0.00 N ATOM 1109 CA SER A 71 -4.033 0.020 -11.162 1.00 0.00 C ATOM 1110 C SER A 71 -4.114 1.478 -10.716 1.00 0.00 C ATOM 1111 O SER A 71 -3.349 2.320 -11.185 1.00 0.00 O ATOM 1112 CB SER A 71 -4.837 -0.175 -12.448 1.00 0.00 C ATOM 1113 OG SER A 71 -4.384 0.696 -13.471 1.00 0.00 O ATOM 0 H SER A 71 -5.506 -1.108 -10.181 1.00 0.00 H new ATOM 0 HA SER A 71 -2.986 -0.218 -11.350 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.750 -1.209 -12.782 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.893 0.008 -12.251 1.00 0.00 H new ATOM 0 HG SER A 71 -4.913 0.550 -14.283 1.00 0.00 H new ATOM 1119 N LEU A 72 -5.055 1.779 -9.828 1.00 0.00 N ATOM 1120 CA LEU A 72 -5.228 3.145 -9.341 1.00 0.00 C ATOM 1121 C LEU A 72 -4.394 3.422 -8.090 1.00 0.00 C ATOM 1122 O LEU A 72 -3.496 4.264 -8.105 1.00 0.00 O ATOM 1123 CB LEU A 72 -6.715 3.412 -9.054 1.00 0.00 C ATOM 1124 CG LEU A 72 -7.098 4.868 -8.743 1.00 0.00 C ATOM 1125 CD1 LEU A 72 -6.742 5.234 -7.309 1.00 0.00 C ATOM 1126 CD2 LEU A 72 -6.430 5.826 -9.721 1.00 0.00 C ATOM 0 H LEU A 72 -5.706 1.101 -9.432 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.876 3.820 -10.121 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -7.294 3.083 -9.917 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.018 2.791 -8.211 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.178 4.959 -8.858 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.024 6.269 -7.117 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -7.278 4.579 -6.622 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.669 5.117 -7.159 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -6.716 6.850 -9.480 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.347 5.725 -9.647 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -6.748 5.589 -10.736 1.00 0.00 H new ATOM 1138 N VAL A 73 -4.691 2.701 -7.013 1.00 0.00 N ATOM 1139 CA VAL A 73 -4.003 2.899 -5.739 1.00 0.00 C ATOM 1140 C VAL A 73 -2.575 2.356 -5.734 1.00 0.00 C ATOM 1141 O VAL A 73 -1.621 3.112 -5.544 1.00 0.00 O ATOM 1142 CB VAL A 73 -4.789 2.253 -4.583 1.00 0.00 C ATOM 1143 CG1 VAL A 73 -4.121 2.543 -3.247 1.00 0.00 C ATOM 1144 CG2 VAL A 73 -6.229 2.743 -4.585 1.00 0.00 C ATOM 0 H VAL A 73 -5.405 1.973 -6.996 1.00 0.00 H new ATOM 0 HA VAL A 73 -3.948 3.979 -5.599 1.00 0.00 H new ATOM 0 HB VAL A 73 -4.792 1.173 -4.729 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -4.694 2.077 -2.445 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -3.108 2.140 -3.251 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -4.082 3.620 -3.086 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -6.773 2.278 -3.763 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.245 3.826 -4.464 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -6.703 2.476 -5.530 1.00 0.00 H new ATOM 1154 N GLU A 74 -2.429 1.049 -5.935 1.00 0.00 N ATOM 1155 CA GLU A 74 -1.109 0.422 -5.925 1.00 0.00 C ATOM 1156 C GLU A 74 -0.147 1.128 -6.875 1.00 0.00 C ATOM 1157 O GLU A 74 1.014 1.365 -6.536 1.00 0.00 O ATOM 1158 CB GLU A 74 -1.215 -1.061 -6.289 1.00 0.00 C ATOM 1159 CG GLU A 74 0.114 -1.797 -6.225 1.00 0.00 C ATOM 1160 CD GLU A 74 -0.023 -3.274 -6.541 1.00 0.00 C ATOM 1161 OE1 GLU A 74 -0.411 -4.042 -5.635 1.00 0.00 O ATOM 1162 OE2 GLU A 74 0.260 -3.663 -7.694 1.00 0.00 O ATOM 0 H GLU A 74 -3.203 0.406 -6.106 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.711 0.512 -4.914 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -1.921 -1.543 -5.613 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.624 -1.152 -7.295 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.812 -1.342 -6.928 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.543 -1.680 -5.230 1.00 0.00 H new ATOM 1169 N LYS A 75 -0.634 1.469 -8.062 1.00 0.00 N ATOM 1170 CA LYS A 75 0.192 2.147 -9.055 1.00 0.00 C ATOM 1171 C LYS A 75 0.515 3.569 -8.611 1.00 0.00 C ATOM 1172 O LYS A 75 1.591 4.088 -8.907 1.00 0.00 O ATOM 1173 CB LYS A 75 -0.515 2.171 -10.411 1.00 0.00 C ATOM 1174 CG LYS A 75 0.319 2.779 -11.528 1.00 0.00 C ATOM 1175 CD LYS A 75 1.514 1.905 -11.874 1.00 0.00 C ATOM 1176 CE LYS A 75 2.372 2.541 -12.956 1.00 0.00 C ATOM 1177 NZ LYS A 75 1.586 2.839 -14.185 1.00 0.00 N ATOM 0 H LYS A 75 -1.593 1.288 -8.360 1.00 0.00 H new ATOM 0 HA LYS A 75 1.126 1.594 -9.153 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -0.787 1.152 -10.687 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.444 2.734 -10.316 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -0.302 2.915 -12.414 1.00 0.00 H new ATOM 0 HG3 LYS A 75 0.666 3.768 -11.227 1.00 0.00 H new ATOM 0 HD2 LYS A 75 2.116 1.739 -10.981 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.167 0.928 -12.210 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.813 3.462 -12.575 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.196 1.873 -13.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.235 3.062 -14.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.011 2.011 -14.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.963 3.653 -14.010 1.00 0.00 H new ATOM 1191 N TYR A 76 -0.420 4.197 -7.901 1.00 0.00 N ATOM 1192 CA TYR A 76 -0.223 5.561 -7.420 1.00 0.00 C ATOM 1193 C TYR A 76 1.020 5.651 -6.538 1.00 0.00 C ATOM 1194 O TYR A 76 1.865 6.525 -6.729 1.00 0.00 O ATOM 1195 CB TYR A 76 -1.452 6.040 -6.643 1.00 0.00 C ATOM 1196 CG TYR A 76 -1.346 7.473 -6.169 1.00 0.00 C ATOM 1197 CD1 TYR A 76 -1.617 8.530 -7.030 1.00 0.00 C ATOM 1198 CD2 TYR A 76 -0.978 7.769 -4.863 1.00 0.00 C ATOM 1199 CE1 TYR A 76 -1.521 9.840 -6.601 1.00 0.00 C ATOM 1200 CE2 TYR A 76 -0.881 9.076 -4.427 1.00 0.00 C ATOM 1201 CZ TYR A 76 -1.154 10.108 -5.299 1.00 0.00 C ATOM 1202 OH TYR A 76 -1.056 11.411 -4.868 1.00 0.00 O ATOM 0 H TYR A 76 -1.318 3.784 -7.647 1.00 0.00 H new ATOM 0 HA TYR A 76 -0.081 6.206 -8.287 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.334 5.939 -7.276 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -1.603 5.391 -5.781 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -1.907 8.324 -8.050 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.764 6.963 -4.176 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -1.733 10.651 -7.283 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -0.593 9.288 -3.408 1.00 0.00 H new ATOM 0 HH TYR A 76 -0.788 11.425 -3.925 1.00 0.00 H new ATOM 1212 N ILE A 77 1.125 4.744 -5.571 1.00 0.00 N ATOM 1213 CA ILE A 77 2.267 4.724 -4.661 1.00 0.00 C ATOM 1214 C ILE A 77 3.562 4.435 -5.413 1.00 0.00 C ATOM 1215 O ILE A 77 4.592 5.062 -5.161 1.00 0.00 O ATOM 1216 CB ILE A 77 2.086 3.666 -3.554 1.00 0.00 C ATOM 1217 CG1 ILE A 77 0.750 3.870 -2.835 1.00 0.00 C ATOM 1218 CG2 ILE A 77 3.242 3.732 -2.564 1.00 0.00 C ATOM 1219 CD1 ILE A 77 0.418 2.767 -1.853 1.00 0.00 C ATOM 0 H ILE A 77 0.434 4.014 -5.397 1.00 0.00 H new ATOM 0 HA ILE A 77 2.325 5.712 -4.204 1.00 0.00 H new ATOM 0 HB ILE A 77 2.082 2.678 -4.014 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.773 4.822 -2.305 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.046 3.937 -3.577 1.00 0.00 H new ATOM 0 HG21 ILE A 77 3.100 2.979 -1.788 1.00 0.00 H new ATOM 0 HG22 ILE A 77 4.180 3.543 -3.086 1.00 0.00 H new ATOM 0 HG23 ILE A 77 3.274 4.721 -2.108 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.542 2.977 -1.381 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.362 1.815 -2.381 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.194 2.714 -1.090 1.00 0.00 H new ATOM 1231 N GLU A 78 3.502 3.479 -6.334 1.00 0.00 N ATOM 1232 CA GLU A 78 4.671 3.096 -7.121 1.00 0.00 C ATOM 1233 C GLU A 78 5.217 4.275 -7.924 1.00 0.00 C ATOM 1234 O GLU A 78 6.428 4.494 -7.971 1.00 0.00 O ATOM 1235 CB GLU A 78 4.313 1.944 -8.063 1.00 0.00 C ATOM 1236 CG GLU A 78 5.464 1.506 -8.953 1.00 0.00 C ATOM 1237 CD GLU A 78 5.092 0.347 -9.857 1.00 0.00 C ATOM 1238 OE1 GLU A 78 4.366 0.574 -10.848 1.00 0.00 O ATOM 1239 OE2 GLU A 78 5.524 -0.790 -9.572 1.00 0.00 O ATOM 0 H GLU A 78 2.656 2.954 -6.555 1.00 0.00 H new ATOM 0 HA GLU A 78 5.449 2.773 -6.429 1.00 0.00 H new ATOM 0 HB2 GLU A 78 3.978 1.092 -7.471 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.474 2.246 -8.690 1.00 0.00 H new ATOM 0 HG2 GLU A 78 5.788 2.349 -9.563 1.00 0.00 H new ATOM 0 HG3 GLU A 78 6.311 1.219 -8.330 1.00 0.00 H new ATOM 1246 N GLU A 79 4.323 5.031 -8.553 1.00 0.00 N ATOM 1247 CA GLU A 79 4.722 6.179 -9.365 1.00 0.00 C ATOM 1248 C GLU A 79 5.371 7.270 -8.518 1.00 0.00 C ATOM 1249 O GLU A 79 6.419 7.805 -8.881 1.00 0.00 O ATOM 1250 CB GLU A 79 3.512 6.751 -10.107 1.00 0.00 C ATOM 1251 CG GLU A 79 2.952 5.818 -11.169 1.00 0.00 C ATOM 1252 CD GLU A 79 1.784 6.426 -11.920 1.00 0.00 C ATOM 1253 OE1 GLU A 79 2.025 7.151 -12.908 1.00 0.00 O ATOM 1254 OE2 GLU A 79 0.626 6.177 -11.520 1.00 0.00 O ATOM 0 H GLU A 79 3.316 4.871 -8.517 1.00 0.00 H new ATOM 0 HA GLU A 79 5.459 5.829 -10.088 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.728 6.978 -9.385 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.796 7.693 -10.576 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.741 5.563 -11.876 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.633 4.888 -10.699 1.00 0.00 H new ATOM 1261 N GLN A 80 4.743 7.597 -7.393 1.00 0.00 N ATOM 1262 CA GLN A 80 5.258 8.632 -6.504 1.00 0.00 C ATOM 1263 C GLN A 80 6.670 8.299 -6.030 1.00 0.00 C ATOM 1264 O GLN A 80 7.488 9.194 -5.812 1.00 0.00 O ATOM 1265 CB GLN A 80 4.331 8.806 -5.298 1.00 0.00 C ATOM 1266 CG GLN A 80 2.938 9.294 -5.663 1.00 0.00 C ATOM 1267 CD GLN A 80 2.944 10.683 -6.270 1.00 0.00 C ATOM 1268 OE1 GLN A 80 3.038 10.841 -7.487 1.00 0.00 O ATOM 1269 NE2 GLN A 80 2.843 11.701 -5.422 1.00 0.00 N ATOM 0 H GLN A 80 3.877 7.161 -7.076 1.00 0.00 H new ATOM 0 HA GLN A 80 5.296 9.566 -7.065 1.00 0.00 H new ATOM 0 HB2 GLN A 80 4.247 7.853 -4.775 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.783 9.513 -4.602 1.00 0.00 H new ATOM 0 HG2 GLN A 80 2.486 8.596 -6.368 1.00 0.00 H new ATOM 0 HG3 GLN A 80 2.313 9.295 -4.770 1.00 0.00 H new ATOM 0 HE21 GLN A 80 2.767 11.525 -4.420 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.841 12.659 -5.773 1.00 0.00 H new ATOM 1278 N LEU A 81 6.950 7.010 -5.873 1.00 0.00 N ATOM 1279 CA LEU A 81 8.264 6.563 -5.423 1.00 0.00 C ATOM 1280 C LEU A 81 9.287 6.608 -6.556 1.00 0.00 C ATOM 1281 O LEU A 81 10.459 6.908 -6.331 1.00 0.00 O ATOM 1282 CB LEU A 81 8.176 5.143 -4.856 1.00 0.00 C ATOM 1283 CG LEU A 81 7.331 5.004 -3.586 1.00 0.00 C ATOM 1284 CD1 LEU A 81 7.169 3.539 -3.211 1.00 0.00 C ATOM 1285 CD2 LEU A 81 7.960 5.782 -2.438 1.00 0.00 C ATOM 0 H LEU A 81 6.286 6.257 -6.050 1.00 0.00 H new ATOM 0 HA LEU A 81 8.596 7.244 -4.640 1.00 0.00 H new ATOM 0 HB2 LEU A 81 7.763 4.487 -5.622 1.00 0.00 H new ATOM 0 HB3 LEU A 81 9.185 4.790 -4.643 1.00 0.00 H new ATOM 0 HG LEU A 81 6.343 5.420 -3.783 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.566 3.459 -2.306 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.675 3.008 -4.024 1.00 0.00 H new ATOM 0 HD13 LEU A 81 8.150 3.098 -3.033 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.346 5.672 -1.544 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.960 5.395 -2.241 1.00 0.00 H new ATOM 0 HD23 LEU A 81 8.025 6.837 -2.706 1.00 0.00 H new ATOM 1297 N LEU A 82 8.838 6.311 -7.774 1.00 0.00 N ATOM 1298 CA LEU A 82 9.721 6.311 -8.938 1.00 0.00 C ATOM 1299 C LEU A 82 10.190 7.721 -9.283 1.00 0.00 C ATOM 1300 O LEU A 82 11.253 7.899 -9.881 1.00 0.00 O ATOM 1301 CB LEU A 82 9.016 5.690 -10.148 1.00 0.00 C ATOM 1302 CG LEU A 82 8.783 4.180 -10.066 1.00 0.00 C ATOM 1303 CD1 LEU A 82 8.008 3.695 -11.281 1.00 0.00 C ATOM 1304 CD2 LEU A 82 10.108 3.441 -9.949 1.00 0.00 C ATOM 0 H LEU A 82 7.869 6.068 -7.980 1.00 0.00 H new ATOM 0 HA LEU A 82 10.595 5.712 -8.685 1.00 0.00 H new ATOM 0 HB2 LEU A 82 8.053 6.183 -10.279 1.00 0.00 H new ATOM 0 HB3 LEU A 82 9.606 5.902 -11.040 1.00 0.00 H new ATOM 0 HG LEU A 82 8.193 3.970 -9.174 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.851 2.619 -11.207 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.043 4.200 -11.323 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.574 3.917 -12.186 1.00 0.00 H new ATOM 0 HD21 LEU A 82 9.923 2.368 -9.892 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.723 3.657 -10.822 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.629 3.768 -9.049 1.00 0.00 H new ATOM 1316 N GLN A 83 9.398 8.719 -8.906 1.00 0.00 N ATOM 1317 CA GLN A 83 9.739 10.110 -9.187 1.00 0.00 C ATOM 1318 C GLN A 83 11.079 10.492 -8.565 1.00 0.00 C ATOM 1319 O GLN A 83 11.697 11.479 -8.964 1.00 0.00 O ATOM 1320 CB GLN A 83 8.644 11.045 -8.670 1.00 0.00 C ATOM 1321 CG GLN A 83 7.340 10.944 -9.447 1.00 0.00 C ATOM 1322 CD GLN A 83 6.379 12.071 -9.119 1.00 0.00 C ATOM 1323 OE1 GLN A 83 6.386 13.115 -9.771 1.00 0.00 O ATOM 1324 NE2 GLN A 83 5.550 11.867 -8.103 1.00 0.00 N ATOM 0 H GLN A 83 8.518 8.592 -8.406 1.00 0.00 H new ATOM 0 HA GLN A 83 9.821 10.216 -10.269 1.00 0.00 H new ATOM 0 HB2 GLN A 83 8.451 10.820 -7.621 1.00 0.00 H new ATOM 0 HB3 GLN A 83 9.005 12.073 -8.714 1.00 0.00 H new ATOM 0 HG2 GLN A 83 7.556 10.954 -10.515 1.00 0.00 H new ATOM 0 HG3 GLN A 83 6.863 9.989 -9.227 1.00 0.00 H new ATOM 0 HE21 GLN A 83 5.579 10.986 -7.590 1.00 0.00 H new ATOM 0 HE22 GLN A 83 4.884 12.591 -7.835 1.00 0.00 H new ATOM 1333 N ARG A 84 11.525 9.707 -7.589 1.00 0.00 N ATOM 1334 CA ARG A 84 12.794 9.974 -6.918 1.00 0.00 C ATOM 1335 C ARG A 84 13.731 8.774 -7.013 1.00 0.00 C ATOM 1336 O ARG A 84 14.952 8.928 -7.022 1.00 0.00 O ATOM 1337 CB ARG A 84 12.555 10.330 -5.450 1.00 0.00 C ATOM 1338 CG ARG A 84 11.656 11.540 -5.255 1.00 0.00 C ATOM 1339 CD ARG A 84 11.506 11.891 -3.785 1.00 0.00 C ATOM 1340 NE ARG A 84 10.606 13.023 -3.581 1.00 0.00 N ATOM 1341 CZ ARG A 84 10.607 13.780 -2.488 1.00 0.00 C ATOM 1342 NH1 ARG A 84 11.465 13.534 -1.506 1.00 0.00 N ATOM 1343 NH2 ARG A 84 9.749 14.785 -2.376 1.00 0.00 N ATOM 0 H ARG A 84 11.029 8.884 -7.246 1.00 0.00 H new ATOM 0 HA ARG A 84 13.265 10.819 -7.420 1.00 0.00 H new ATOM 0 HB2 ARG A 84 12.110 9.473 -4.945 1.00 0.00 H new ATOM 0 HB3 ARG A 84 13.515 10.520 -4.970 1.00 0.00 H new ATOM 0 HG2 ARG A 84 12.070 12.393 -5.793 1.00 0.00 H new ATOM 0 HG3 ARG A 84 10.674 11.338 -5.684 1.00 0.00 H new ATOM 0 HD2 ARG A 84 11.127 11.025 -3.242 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.485 12.126 -3.367 1.00 0.00 H new ATOM 0 HE ARG A 84 9.938 13.246 -4.319 1.00 0.00 H new ATOM 0 HH11 ARG A 84 12.127 12.762 -1.588 1.00 0.00 H new ATOM 0 HH12 ARG A 84 11.463 14.117 -0.669 1.00 0.00 H new ATOM 0 HH21 ARG A 84 9.088 14.977 -3.129 1.00 0.00 H new ATOM 0 HH22 ARG A 84 9.750 15.365 -1.537 1.00 0.00 H new ATOM 1357 N ILE A 85 13.152 7.579 -7.083 1.00 0.00 N ATOM 1358 CA ILE A 85 13.939 6.354 -7.175 1.00 0.00 C ATOM 1359 C ILE A 85 13.578 5.564 -8.434 1.00 0.00 C ATOM 1360 O ILE A 85 12.668 4.736 -8.411 1.00 0.00 O ATOM 1361 CB ILE A 85 13.728 5.456 -5.938 1.00 0.00 C ATOM 1362 CG1 ILE A 85 13.808 6.289 -4.656 1.00 0.00 C ATOM 1363 CG2 ILE A 85 14.762 4.338 -5.917 1.00 0.00 C ATOM 1364 CD1 ILE A 85 13.424 5.522 -3.408 1.00 0.00 C ATOM 0 H ILE A 85 12.143 7.433 -7.078 1.00 0.00 H new ATOM 0 HA ILE A 85 14.987 6.651 -7.223 1.00 0.00 H new ATOM 0 HB ILE A 85 12.736 5.008 -5.995 1.00 0.00 H new ATOM 0 HG12 ILE A 85 14.824 6.667 -4.541 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.155 7.156 -4.755 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.603 3.711 -5.039 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.662 3.733 -6.818 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.763 4.769 -5.878 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.505 6.176 -2.540 1.00 0.00 H new ATOM 0 HD12 ILE A 85 12.398 5.167 -3.501 1.00 0.00 H new ATOM 0 HD13 ILE A 85 14.093 4.670 -3.284 1.00 0.00 H new ATOM 1376 N PRO A 86 14.285 5.816 -9.553 1.00 0.00 N ATOM 1377 CA PRO A 86 14.027 5.124 -10.821 1.00 0.00 C ATOM 1378 C PRO A 86 14.498 3.676 -10.800 1.00 0.00 C ATOM 1379 O PRO A 86 14.230 2.909 -11.726 1.00 0.00 O ATOM 1380 CB PRO A 86 14.833 5.936 -11.836 1.00 0.00 C ATOM 1381 CG PRO A 86 15.946 6.531 -11.044 1.00 0.00 C ATOM 1382 CD PRO A 86 15.387 6.792 -9.672 1.00 0.00 C ATOM 0 HA PRO A 86 12.962 5.070 -11.046 1.00 0.00 H new ATOM 0 HB2 PRO A 86 15.212 5.303 -12.638 1.00 0.00 H new ATOM 0 HB3 PRO A 86 14.221 6.708 -12.301 1.00 0.00 H new ATOM 0 HG2 PRO A 86 16.797 5.851 -10.996 1.00 0.00 H new ATOM 0 HG3 PRO A 86 16.301 7.454 -11.503 1.00 0.00 H new ATOM 0 HD2 PRO A 86 16.140 6.643 -8.898 1.00 0.00 H new ATOM 0 HD3 PRO A 86 15.027 7.816 -9.574 1.00 0.00 H new ATOM 1390 N GLU A 87 15.197 3.308 -9.734 1.00 0.00 N ATOM 1391 CA GLU A 87 15.709 1.952 -9.579 1.00 0.00 C ATOM 1392 C GLU A 87 14.950 1.216 -8.478 1.00 0.00 C ATOM 1393 O GLU A 87 15.380 0.160 -8.011 1.00 0.00 O ATOM 1394 CB GLU A 87 17.204 1.984 -9.250 1.00 0.00 C ATOM 1395 CG GLU A 87 18.047 2.688 -10.302 1.00 0.00 C ATOM 1396 CD GLU A 87 19.519 2.723 -9.943 1.00 0.00 C ATOM 1397 OE1 GLU A 87 19.944 3.685 -9.268 1.00 0.00 O ATOM 1398 OE2 GLU A 87 20.250 1.788 -10.336 1.00 0.00 O ATOM 0 H GLU A 87 15.423 3.933 -8.960 1.00 0.00 H new ATOM 0 HA GLU A 87 15.564 1.420 -10.520 1.00 0.00 H new ATOM 0 HB2 GLU A 87 17.345 2.482 -8.291 1.00 0.00 H new ATOM 0 HB3 GLU A 87 17.563 0.962 -9.134 1.00 0.00 H new ATOM 0 HG2 GLU A 87 17.923 2.183 -11.260 1.00 0.00 H new ATOM 0 HG3 GLU A 87 17.684 3.708 -10.430 1.00 0.00 H new ATOM 1405 N PHE A 88 13.817 1.781 -8.075 1.00 0.00 N ATOM 1406 CA PHE A 88 12.993 1.195 -7.023 1.00 0.00 C ATOM 1407 C PHE A 88 12.272 -0.058 -7.515 1.00 0.00 C ATOM 1408 O PHE A 88 11.866 -0.140 -8.675 1.00 0.00 O ATOM 1409 CB PHE A 88 11.973 2.221 -6.523 1.00 0.00 C ATOM 1410 CG PHE A 88 11.185 1.763 -5.329 1.00 0.00 C ATOM 1411 CD1 PHE A 88 11.717 1.866 -4.054 1.00 0.00 C ATOM 1412 CD2 PHE A 88 9.913 1.237 -5.481 1.00 0.00 C ATOM 1413 CE1 PHE A 88 10.995 1.452 -2.952 1.00 0.00 C ATOM 1414 CE2 PHE A 88 9.185 0.820 -4.382 1.00 0.00 C ATOM 1415 CZ PHE A 88 9.727 0.929 -3.116 1.00 0.00 C ATOM 0 H PHE A 88 13.447 2.649 -8.463 1.00 0.00 H new ATOM 0 HA PHE A 88 13.650 0.907 -6.202 1.00 0.00 H new ATOM 0 HB2 PHE A 88 12.495 3.144 -6.270 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.283 2.457 -7.333 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.708 2.275 -3.920 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.485 1.152 -6.469 1.00 0.00 H new ATOM 0 HE1 PHE A 88 11.421 1.537 -1.963 1.00 0.00 H new ATOM 0 HE2 PHE A 88 8.195 0.410 -4.513 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.160 0.606 -2.256 1.00 0.00 H new ATOM 1425 N ASN A 89 12.117 -1.030 -6.620 1.00 0.00 N ATOM 1426 CA ASN A 89 11.440 -2.279 -6.950 1.00 0.00 C ATOM 1427 C ASN A 89 10.303 -2.547 -5.968 1.00 0.00 C ATOM 1428 O ASN A 89 10.528 -3.034 -4.860 1.00 0.00 O ATOM 1429 CB ASN A 89 12.431 -3.445 -6.934 1.00 0.00 C ATOM 1430 CG ASN A 89 13.546 -3.267 -7.945 1.00 0.00 C ATOM 1431 OD1 ASN A 89 14.585 -2.677 -7.645 1.00 0.00 O ATOM 1432 ND2 ASN A 89 13.337 -3.780 -9.153 1.00 0.00 N ATOM 0 H ASN A 89 12.452 -0.975 -5.658 1.00 0.00 H new ATOM 0 HA ASN A 89 11.022 -2.187 -7.953 1.00 0.00 H new ATOM 0 HB2 ASN A 89 12.860 -3.540 -5.937 1.00 0.00 H new ATOM 0 HB3 ASN A 89 11.899 -4.373 -7.143 1.00 0.00 H new ATOM 0 HD21 ASN A 89 14.052 -3.693 -9.875 1.00 0.00 H new ATOM 0 HD22 ASN A 89 12.461 -4.261 -9.358 1.00 0.00 H new ATOM 1439 N MET A 90 9.084 -2.220 -6.383 1.00 0.00 N ATOM 1440 CA MET A 90 7.907 -2.413 -5.543 1.00 0.00 C ATOM 1441 C MET A 90 7.707 -3.887 -5.198 1.00 0.00 C ATOM 1442 O MET A 90 7.061 -4.218 -4.204 1.00 0.00 O ATOM 1443 CB MET A 90 6.665 -1.872 -6.253 1.00 0.00 C ATOM 1444 CG MET A 90 5.433 -1.800 -5.365 1.00 0.00 C ATOM 1445 SD MET A 90 5.667 -0.714 -3.944 1.00 0.00 S ATOM 1446 CE MET A 90 4.015 -0.705 -3.253 1.00 0.00 C ATOM 0 H MET A 90 8.885 -1.819 -7.299 1.00 0.00 H new ATOM 0 HA MET A 90 8.063 -1.866 -4.613 1.00 0.00 H new ATOM 0 HB2 MET A 90 6.883 -0.876 -6.638 1.00 0.00 H new ATOM 0 HB3 MET A 90 6.445 -2.505 -7.113 1.00 0.00 H new ATOM 0 HG2 MET A 90 4.586 -1.446 -5.953 1.00 0.00 H new ATOM 0 HG3 MET A 90 5.182 -2.801 -5.015 1.00 0.00 H new ATOM 0 HE1 MET A 90 3.996 -0.074 -2.364 1.00 0.00 H new ATOM 0 HE2 MET A 90 3.314 -0.314 -3.991 1.00 0.00 H new ATOM 0 HE3 MET A 90 3.728 -1.721 -2.983 1.00 0.00 H new ATOM 1456 N ALA A 91 8.266 -4.767 -6.023 1.00 0.00 N ATOM 1457 CA ALA A 91 8.145 -6.204 -5.805 1.00 0.00 C ATOM 1458 C ALA A 91 9.017 -6.662 -4.641 1.00 0.00 C ATOM 1459 O ALA A 91 8.525 -7.244 -3.673 1.00 0.00 O ATOM 1460 CB ALA A 91 8.514 -6.963 -7.071 1.00 0.00 C ATOM 0 H ALA A 91 8.807 -4.510 -6.849 1.00 0.00 H new ATOM 0 HA ALA A 91 7.107 -6.419 -5.553 1.00 0.00 H new ATOM 0 HB1 ALA A 91 8.419 -8.034 -6.894 1.00 0.00 H new ATOM 0 HB2 ALA A 91 7.845 -6.668 -7.880 1.00 0.00 H new ATOM 0 HB3 ALA A 91 9.542 -6.731 -7.348 1.00 0.00 H new ATOM 1466 N ALA A 92 10.315 -6.397 -4.742 1.00 0.00 N ATOM 1467 CA ALA A 92 11.261 -6.783 -3.700 1.00 0.00 C ATOM 1468 C ALA A 92 11.030 -5.989 -2.418 1.00 0.00 C ATOM 1469 O ALA A 92 11.364 -6.445 -1.325 1.00 0.00 O ATOM 1470 CB ALA A 92 12.689 -6.590 -4.190 1.00 0.00 C ATOM 0 H ALA A 92 10.737 -5.916 -5.536 1.00 0.00 H new ATOM 0 HA ALA A 92 11.101 -7.837 -3.474 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.386 -6.881 -3.404 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.858 -7.208 -5.072 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.848 -5.542 -4.445 1.00 0.00 H new ATOM 1476 N PHE A 93 10.457 -4.800 -2.562 1.00 0.00 N ATOM 1477 CA PHE A 93 10.185 -3.937 -1.418 1.00 0.00 C ATOM 1478 C PHE A 93 9.087 -4.519 -0.533 1.00 0.00 C ATOM 1479 O PHE A 93 9.279 -4.699 0.669 1.00 0.00 O ATOM 1480 CB PHE A 93 9.787 -2.538 -1.892 1.00 0.00 C ATOM 1481 CG PHE A 93 9.421 -1.605 -0.772 1.00 0.00 C ATOM 1482 CD1 PHE A 93 10.387 -1.139 0.106 1.00 0.00 C ATOM 1483 CD2 PHE A 93 8.109 -1.196 -0.599 1.00 0.00 C ATOM 1484 CE1 PHE A 93 10.050 -0.282 1.135 1.00 0.00 C ATOM 1485 CE2 PHE A 93 7.766 -0.339 0.429 1.00 0.00 C ATOM 1486 CZ PHE A 93 8.739 0.119 1.297 1.00 0.00 C ATOM 0 H PHE A 93 10.171 -4.411 -3.461 1.00 0.00 H new ATOM 0 HA PHE A 93 11.098 -3.870 -0.826 1.00 0.00 H new ATOM 0 HB2 PHE A 93 10.613 -2.107 -2.458 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.942 -2.622 -2.575 1.00 0.00 H new ATOM 0 HD1 PHE A 93 11.414 -1.449 -0.016 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.345 -1.551 -1.275 1.00 0.00 H new ATOM 0 HE1 PHE A 93 10.812 0.074 1.813 1.00 0.00 H new ATOM 0 HE2 PHE A 93 6.739 -0.028 0.554 1.00 0.00 H new ATOM 0 HZ PHE A 93 8.474 0.790 2.101 1.00 0.00 H new ATOM 1496 N THR A 94 7.935 -4.810 -1.133 1.00 0.00 N ATOM 1497 CA THR A 94 6.804 -5.366 -0.395 1.00 0.00 C ATOM 1498 C THR A 94 7.157 -6.703 0.246 1.00 0.00 C ATOM 1499 O THR A 94 6.847 -6.942 1.414 1.00 0.00 O ATOM 1500 CB THR A 94 5.577 -5.560 -1.306 1.00 0.00 C ATOM 1501 OG1 THR A 94 5.919 -6.390 -2.422 1.00 0.00 O ATOM 1502 CG2 THR A 94 5.054 -4.222 -1.805 1.00 0.00 C ATOM 0 H THR A 94 7.760 -4.670 -2.128 1.00 0.00 H new ATOM 0 HA THR A 94 6.562 -4.646 0.387 1.00 0.00 H new ATOM 0 HB THR A 94 4.794 -6.043 -0.722 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.332 -5.843 -3.122 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.188 -4.386 -2.446 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.764 -3.605 -0.955 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.834 -3.715 -2.372 1.00 0.00 H new ATOM 1510 N THR A 95 7.804 -7.571 -0.524 1.00 0.00 N ATOM 1511 CA THR A 95 8.196 -8.889 -0.038 1.00 0.00 C ATOM 1512 C THR A 95 9.064 -8.790 1.213 1.00 0.00 C ATOM 1513 O THR A 95 8.843 -9.503 2.192 1.00 0.00 O ATOM 1514 CB THR A 95 8.961 -9.674 -1.117 1.00 0.00 C ATOM 1515 OG1 THR A 95 10.044 -8.885 -1.623 1.00 0.00 O ATOM 1516 CG2 THR A 95 8.036 -10.066 -2.260 1.00 0.00 C ATOM 0 H THR A 95 8.069 -7.384 -1.491 1.00 0.00 H new ATOM 0 HA THR A 95 7.276 -9.418 0.210 1.00 0.00 H new ATOM 0 HB THR A 95 9.356 -10.582 -0.662 1.00 0.00 H new ATOM 0 HG1 THR A 95 10.703 -9.470 -2.052 1.00 0.00 H new ATOM 0 HG21 THR A 95 8.600 -10.620 -3.011 1.00 0.00 H new ATOM 0 HG22 THR A 95 7.229 -10.691 -1.877 1.00 0.00 H new ATOM 0 HG23 THR A 95 7.615 -9.168 -2.712 1.00 0.00 H new ATOM 1524 N THR A 96 10.052 -7.904 1.171 1.00 0.00 N ATOM 1525 CA THR A 96 10.960 -7.711 2.296 1.00 0.00 C ATOM 1526 C THR A 96 10.280 -6.953 3.435 1.00 0.00 C ATOM 1527 O THR A 96 10.609 -7.146 4.606 1.00 0.00 O ATOM 1528 CB THR A 96 12.226 -6.945 1.862 1.00 0.00 C ATOM 1529 OG1 THR A 96 12.873 -7.639 0.789 1.00 0.00 O ATOM 1530 CG2 THR A 96 13.196 -6.787 3.024 1.00 0.00 C ATOM 0 H THR A 96 10.245 -7.306 0.368 1.00 0.00 H new ATOM 0 HA THR A 96 11.244 -8.702 2.650 1.00 0.00 H new ATOM 0 HB THR A 96 11.923 -5.953 1.527 1.00 0.00 H new ATOM 0 HG1 THR A 96 12.481 -7.359 -0.065 1.00 0.00 H new ATOM 0 HG21 THR A 96 14.079 -6.243 2.689 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.713 -6.233 3.829 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.492 -7.771 3.387 1.00 0.00 H new ATOM 1538 N LEU A 97 9.327 -6.096 3.082 1.00 0.00 N ATOM 1539 CA LEU A 97 8.602 -5.301 4.068 1.00 0.00 C ATOM 1540 C LEU A 97 7.835 -6.195 5.039 1.00 0.00 C ATOM 1541 O LEU A 97 7.740 -5.893 6.229 1.00 0.00 O ATOM 1542 CB LEU A 97 7.630 -4.345 3.371 1.00 0.00 C ATOM 1543 CG LEU A 97 7.521 -2.947 3.991 1.00 0.00 C ATOM 1544 CD1 LEU A 97 6.537 -2.095 3.206 1.00 0.00 C ATOM 1545 CD2 LEU A 97 7.101 -3.030 5.451 1.00 0.00 C ATOM 0 H LEU A 97 9.038 -5.934 2.117 1.00 0.00 H new ATOM 0 HA LEU A 97 9.333 -4.723 4.633 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.936 -4.239 2.330 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.640 -4.800 3.368 1.00 0.00 H new ATOM 0 HG LEU A 97 8.504 -2.479 3.946 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.471 -1.106 3.659 1.00 0.00 H new ATOM 0 HD12 LEU A 97 6.879 -2.000 2.175 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.555 -2.567 3.220 1.00 0.00 H new ATOM 0 HD21 LEU A 97 7.031 -2.025 5.867 1.00 0.00 H new ATOM 0 HD22 LEU A 97 6.130 -3.521 5.523 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.840 -3.604 6.010 1.00 0.00 H new ATOM 1557 N GLN A 98 7.289 -7.294 4.524 1.00 0.00 N ATOM 1558 CA GLN A 98 6.520 -8.224 5.345 1.00 0.00 C ATOM 1559 C GLN A 98 7.291 -8.629 6.597 1.00 0.00 C ATOM 1560 O GLN A 98 6.703 -8.834 7.659 1.00 0.00 O ATOM 1561 CB GLN A 98 6.141 -9.465 4.535 1.00 0.00 C ATOM 1562 CG GLN A 98 5.235 -9.163 3.351 1.00 0.00 C ATOM 1563 CD GLN A 98 4.811 -10.413 2.604 1.00 0.00 C ATOM 1564 OE1 GLN A 98 3.789 -11.022 2.920 1.00 0.00 O ATOM 1565 NE2 GLN A 98 5.596 -10.803 1.606 1.00 0.00 N ATOM 0 H GLN A 98 7.365 -7.562 3.543 1.00 0.00 H new ATOM 0 HA GLN A 98 5.610 -7.714 5.660 1.00 0.00 H new ATOM 0 HB2 GLN A 98 7.050 -9.945 4.173 1.00 0.00 H new ATOM 0 HB3 GLN A 98 5.643 -10.179 5.191 1.00 0.00 H new ATOM 0 HG2 GLN A 98 4.348 -8.637 3.703 1.00 0.00 H new ATOM 0 HG3 GLN A 98 5.752 -8.493 2.665 1.00 0.00 H new ATOM 0 HE21 GLN A 98 6.434 -10.268 1.378 1.00 0.00 H new ATOM 0 HE22 GLN A 98 5.361 -11.637 1.068 1.00 0.00 H new ATOM 1574 N HIS A 99 8.607 -8.739 6.469 1.00 0.00 N ATOM 1575 CA HIS A 99 9.451 -9.103 7.599 1.00 0.00 C ATOM 1576 C HIS A 99 9.786 -7.869 8.427 1.00 0.00 C ATOM 1577 O HIS A 99 9.764 -7.902 9.660 1.00 0.00 O ATOM 1578 CB HIS A 99 10.739 -9.772 7.109 1.00 0.00 C ATOM 1579 CG HIS A 99 10.503 -11.026 6.326 1.00 0.00 C ATOM 1580 ND1 HIS A 99 10.523 -12.283 6.892 1.00 0.00 N ATOM 1581 CD2 HIS A 99 10.241 -11.213 5.009 1.00 0.00 C ATOM 1582 CE1 HIS A 99 10.286 -13.188 5.960 1.00 0.00 C ATOM 1583 NE2 HIS A 99 10.110 -12.565 4.809 1.00 0.00 N ATOM 0 H HIS A 99 9.112 -8.582 5.597 1.00 0.00 H new ATOM 0 HA HIS A 99 8.906 -9.809 8.225 1.00 0.00 H new ATOM 0 HB2 HIS A 99 11.292 -9.066 6.490 1.00 0.00 H new ATOM 0 HB3 HIS A 99 11.368 -10.003 7.969 1.00 0.00 H new ATOM 0 HD2 HIS A 99 10.152 -10.442 4.258 1.00 0.00 H new ATOM 0 HE1 HIS A 99 10.243 -14.256 6.113 1.00 0.00 H new ATOM 0 HE2 HIS A 99 9.909 -13.015 3.916 1.00 0.00 H new ATOM 1592 N HIS A 100 10.070 -6.768 7.737 1.00 0.00 N ATOM 1593 CA HIS A 100 10.413 -5.516 8.398 1.00 0.00 C ATOM 1594 C HIS A 100 9.190 -4.900 9.065 1.00 0.00 C ATOM 1595 O HIS A 100 9.282 -3.855 9.707 1.00 0.00 O ATOM 1596 CB HIS A 100 11.021 -4.531 7.399 1.00 0.00 C ATOM 1597 CG HIS A 100 12.407 -4.899 6.969 1.00 0.00 C ATOM 1598 ND1 HIS A 100 13.487 -4.055 7.111 1.00 0.00 N ATOM 1599 CD2 HIS A 100 12.888 -6.030 6.400 1.00 0.00 C ATOM 1600 CE1 HIS A 100 14.573 -4.650 6.648 1.00 0.00 C ATOM 1601 NE2 HIS A 100 14.235 -5.848 6.211 1.00 0.00 N ATOM 0 H HIS A 100 10.069 -6.719 6.718 1.00 0.00 H new ATOM 0 HA HIS A 100 11.152 -5.734 9.169 1.00 0.00 H new ATOM 0 HB2 HIS A 100 10.379 -4.474 6.520 1.00 0.00 H new ATOM 0 HB3 HIS A 100 11.039 -3.537 7.846 1.00 0.00 H new ATOM 0 HD2 HIS A 100 12.318 -6.911 6.143 1.00 0.00 H new ATOM 0 HE1 HIS A 100 15.567 -4.228 6.631 1.00 0.00 H new ATOM 0 HE2 HIS A 100 14.872 -6.529 5.799 1.00 0.00 H new ATOM 1610 N LYS A 101 8.044 -5.553 8.903 1.00 0.00 N ATOM 1611 CA LYS A 101 6.805 -5.076 9.500 1.00 0.00 C ATOM 1612 C LYS A 101 6.899 -5.126 11.020 1.00 0.00 C ATOM 1613 O LYS A 101 6.186 -4.409 11.722 1.00 0.00 O ATOM 1614 CB LYS A 101 5.621 -5.916 9.014 1.00 0.00 C ATOM 1615 CG LYS A 101 4.284 -5.472 9.585 1.00 0.00 C ATOM 1616 CD LYS A 101 3.132 -6.294 9.026 1.00 0.00 C ATOM 1617 CE LYS A 101 3.230 -7.753 9.440 1.00 0.00 C ATOM 1618 NZ LYS A 101 2.067 -8.546 8.953 1.00 0.00 N ATOM 0 H LYS A 101 7.949 -6.413 8.363 1.00 0.00 H new ATOM 0 HA LYS A 101 6.646 -4.042 9.193 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.575 -5.869 7.926 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.792 -6.959 9.281 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.303 -5.564 10.671 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.123 -4.418 9.357 1.00 0.00 H new ATOM 0 HD2 LYS A 101 2.186 -5.879 9.375 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.129 -6.224 7.938 1.00 0.00 H new ATOM 0 HE2 LYS A 101 4.152 -8.181 9.047 1.00 0.00 H new ATOM 0 HE3 LYS A 101 3.286 -7.819 10.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 2.171 -9.536 9.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 1.189 -8.153 9.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 2.028 -8.504 7.915 1.00 0.00 H new ATOM 1632 N ASP A 102 7.789 -5.979 11.520 1.00 0.00 N ATOM 1633 CA ASP A 102 7.984 -6.122 12.959 1.00 0.00 C ATOM 1634 C ASP A 102 8.779 -4.944 13.514 1.00 0.00 C ATOM 1635 O ASP A 102 8.863 -4.753 14.727 1.00 0.00 O ATOM 1636 CB ASP A 102 8.706 -7.435 13.269 1.00 0.00 C ATOM 1637 CG ASP A 102 8.922 -7.642 14.755 1.00 0.00 C ATOM 1638 OD1 ASP A 102 7.996 -8.145 15.427 1.00 0.00 O ATOM 1639 OD2 ASP A 102 10.018 -7.301 15.249 1.00 0.00 O ATOM 0 H ASP A 102 8.385 -6.580 10.951 1.00 0.00 H new ATOM 0 HA ASP A 102 7.005 -6.136 13.437 1.00 0.00 H new ATOM 0 HB2 ASP A 102 8.127 -8.267 12.870 1.00 0.00 H new ATOM 0 HB3 ASP A 102 9.670 -7.445 12.760 1.00 0.00 H new ATOM 1644 N GLU A 103 9.357 -4.153 12.613 1.00 0.00 N ATOM 1645 CA GLU A 103 10.148 -2.992 13.008 1.00 0.00 C ATOM 1646 C GLU A 103 9.386 -1.696 12.746 1.00 0.00 C ATOM 1647 O GLU A 103 9.135 -0.916 13.666 1.00 0.00 O ATOM 1648 CB GLU A 103 11.479 -2.978 12.254 1.00 0.00 C ATOM 1649 CG GLU A 103 12.401 -1.838 12.660 1.00 0.00 C ATOM 1650 CD GLU A 103 13.700 -1.834 11.880 1.00 0.00 C ATOM 1651 OE1 GLU A 103 14.638 -2.554 12.284 1.00 0.00 O ATOM 1652 OE2 GLU A 103 13.782 -1.110 10.865 1.00 0.00 O ATOM 0 H GLU A 103 9.292 -4.295 11.605 1.00 0.00 H new ATOM 0 HA GLU A 103 10.344 -3.064 14.078 1.00 0.00 H new ATOM 0 HB2 GLU A 103 11.991 -3.925 12.422 1.00 0.00 H new ATOM 0 HB3 GLU A 103 11.280 -2.909 11.185 1.00 0.00 H new ATOM 0 HG2 GLU A 103 11.887 -0.889 12.508 1.00 0.00 H new ATOM 0 HG3 GLU A 103 12.621 -1.915 13.725 1.00 0.00 H new ATOM 1659 N VAL A 104 9.021 -1.472 11.487 1.00 0.00 N ATOM 1660 CA VAL A 104 8.291 -0.268 11.106 1.00 0.00 C ATOM 1661 C VAL A 104 6.924 -0.214 11.780 1.00 0.00 C ATOM 1662 O VAL A 104 6.545 -1.129 12.512 1.00 0.00 O ATOM 1663 CB VAL A 104 8.102 -0.186 9.577 1.00 0.00 C ATOM 1664 CG1 VAL A 104 9.445 -0.246 8.868 1.00 0.00 C ATOM 1665 CG2 VAL A 104 7.181 -1.294 9.087 1.00 0.00 C ATOM 0 H VAL A 104 9.219 -2.108 10.714 1.00 0.00 H new ATOM 0 HA VAL A 104 8.888 0.581 11.438 1.00 0.00 H new ATOM 0 HB VAL A 104 7.635 0.770 9.341 1.00 0.00 H new ATOM 0 HG11 VAL A 104 9.291 -0.187 7.791 1.00 0.00 H new ATOM 0 HG12 VAL A 104 10.065 0.590 9.192 1.00 0.00 H new ATOM 0 HG13 VAL A 104 9.944 -1.184 9.112 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.062 -1.217 8.006 1.00 0.00 H new ATOM 0 HG22 VAL A 104 7.613 -2.263 9.336 1.00 0.00 H new ATOM 0 HG23 VAL A 104 6.207 -1.197 9.567 1.00 0.00 H new ATOM 1675 N ALA A 105 6.189 0.865 11.530 1.00 0.00 N ATOM 1676 CA ALA A 105 4.863 1.037 12.110 1.00 0.00 C ATOM 1677 C ALA A 105 3.874 0.046 11.508 1.00 0.00 C ATOM 1678 O ALA A 105 3.470 0.183 10.354 1.00 0.00 O ATOM 1679 CB ALA A 105 4.379 2.464 11.904 1.00 0.00 C ATOM 0 H ALA A 105 6.490 1.633 10.930 1.00 0.00 H new ATOM 0 HA ALA A 105 4.929 0.841 13.180 1.00 0.00 H new ATOM 0 HB1 ALA A 105 3.387 2.579 12.342 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.070 3.156 12.385 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.332 2.682 10.837 1.00 0.00 H new ATOM 1685 N GLY A 106 3.490 -0.952 12.297 1.00 0.00 N ATOM 1686 CA GLY A 106 2.553 -1.954 11.826 1.00 0.00 C ATOM 1687 C GLY A 106 1.198 -1.366 11.488 1.00 0.00 C ATOM 1688 O GLY A 106 0.500 -1.863 10.603 1.00 0.00 O ATOM 0 H GLY A 106 3.812 -1.084 13.256 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.963 -2.444 10.943 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.432 -2.722 12.590 1.00 0.00 H new ATOM 1692 N ASP A 107 0.825 -0.305 12.196 1.00 0.00 N ATOM 1693 CA ASP A 107 -0.457 0.355 11.973 1.00 0.00 C ATOM 1694 C ASP A 107 -0.501 1.042 10.612 1.00 0.00 C ATOM 1695 O ASP A 107 -1.551 1.100 9.972 1.00 0.00 O ATOM 1696 CB ASP A 107 -0.724 1.378 13.079 1.00 0.00 C ATOM 1697 CG ASP A 107 -2.048 2.092 12.898 1.00 0.00 C ATOM 1698 OD1 ASP A 107 -3.071 1.587 13.407 1.00 0.00 O ATOM 1699 OD2 ASP A 107 -2.063 3.159 12.247 1.00 0.00 O ATOM 0 H ASP A 107 1.393 0.117 12.930 1.00 0.00 H new ATOM 0 HA ASP A 107 -1.233 -0.411 11.992 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -0.715 0.875 14.046 1.00 0.00 H new ATOM 0 HB3 ASP A 107 0.082 2.111 13.094 1.00 0.00 H new ATOM 1704 N ILE A 108 0.642 1.559 10.171 1.00 0.00 N ATOM 1705 CA ILE A 108 0.720 2.247 8.886 1.00 0.00 C ATOM 1706 C ILE A 108 0.665 1.259 7.725 1.00 0.00 C ATOM 1707 O ILE A 108 -0.129 1.418 6.797 1.00 0.00 O ATOM 1708 CB ILE A 108 2.013 3.082 8.774 1.00 0.00 C ATOM 1709 CG1 ILE A 108 2.029 4.190 9.828 1.00 0.00 C ATOM 1710 CG2 ILE A 108 2.157 3.666 7.374 1.00 0.00 C ATOM 1711 CD1 ILE A 108 0.946 5.225 9.635 1.00 0.00 C ATOM 0 H ILE A 108 1.524 1.515 10.682 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.142 2.912 8.832 1.00 0.00 H new ATOM 0 HB ILE A 108 2.863 2.425 8.956 1.00 0.00 H new ATOM 0 HG12 ILE A 108 1.920 3.742 10.816 1.00 0.00 H new ATOM 0 HG13 ILE A 108 3.000 4.685 9.808 1.00 0.00 H new ATOM 0 HG21 ILE A 108 3.075 4.251 7.316 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.196 2.857 6.645 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.303 4.308 7.158 1.00 0.00 H new ATOM 0 HD11 ILE A 108 1.019 5.979 10.419 1.00 0.00 H new ATOM 0 HD12 ILE A 108 1.067 5.701 8.662 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -0.031 4.743 9.685 1.00 0.00 H new ATOM 1723 N PHE A 109 1.502 0.229 7.789 1.00 0.00 N ATOM 1724 CA PHE A 109 1.548 -0.776 6.737 1.00 0.00 C ATOM 1725 C PHE A 109 0.247 -1.565 6.677 1.00 0.00 C ATOM 1726 O PHE A 109 -0.145 -2.037 5.612 1.00 0.00 O ATOM 1727 CB PHE A 109 2.730 -1.728 6.933 1.00 0.00 C ATOM 1728 CG PHE A 109 2.845 -2.758 5.841 1.00 0.00 C ATOM 1729 CD1 PHE A 109 2.849 -2.376 4.506 1.00 0.00 C ATOM 1730 CD2 PHE A 109 2.940 -4.106 6.147 1.00 0.00 C ATOM 1731 CE1 PHE A 109 2.943 -3.319 3.500 1.00 0.00 C ATOM 1732 CE2 PHE A 109 3.036 -5.053 5.145 1.00 0.00 C ATOM 1733 CZ PHE A 109 3.037 -4.659 3.821 1.00 0.00 C ATOM 0 H PHE A 109 2.155 0.070 8.556 1.00 0.00 H new ATOM 0 HA PHE A 109 1.680 -0.251 5.791 1.00 0.00 H new ATOM 0 HB2 PHE A 109 3.652 -1.149 6.977 1.00 0.00 H new ATOM 0 HB3 PHE A 109 2.626 -2.234 7.893 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.778 -1.329 4.251 1.00 0.00 H new ATOM 0 HD2 PHE A 109 2.939 -4.420 7.180 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.943 -3.009 2.465 1.00 0.00 H new ATOM 0 HE2 PHE A 109 3.110 -6.101 5.397 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.111 -5.398 3.037 1.00 0.00 H new ATOM 1743 N ASP A 110 -0.422 -1.698 7.822 1.00 0.00 N ATOM 1744 CA ASP A 110 -1.677 -2.442 7.896 1.00 0.00 C ATOM 1745 C ASP A 110 -2.629 -2.018 6.783 1.00 0.00 C ATOM 1746 O ASP A 110 -3.450 -2.811 6.321 1.00 0.00 O ATOM 1747 CB ASP A 110 -2.343 -2.232 9.256 1.00 0.00 C ATOM 1748 CG ASP A 110 -3.626 -3.026 9.400 1.00 0.00 C ATOM 1749 OD1 ASP A 110 -4.683 -2.534 8.952 1.00 0.00 O ATOM 1750 OD2 ASP A 110 -3.574 -4.141 9.959 1.00 0.00 O ATOM 0 H ASP A 110 -0.115 -1.300 8.710 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.447 -3.500 7.771 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.649 -2.521 10.046 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -2.558 -1.172 9.393 1.00 0.00 H new ATOM 1755 N MET A 111 -2.515 -0.766 6.356 1.00 0.00 N ATOM 1756 CA MET A 111 -3.354 -0.253 5.280 1.00 0.00 C ATOM 1757 C MET A 111 -2.913 -0.854 3.949 1.00 0.00 C ATOM 1758 O MET A 111 -3.719 -1.414 3.204 1.00 0.00 O ATOM 1759 CB MET A 111 -3.269 1.275 5.221 1.00 0.00 C ATOM 1760 CG MET A 111 -4.085 1.887 4.095 1.00 0.00 C ATOM 1761 SD MET A 111 -3.786 3.655 3.902 1.00 0.00 S ATOM 1762 CE MET A 111 -2.052 3.656 3.450 1.00 0.00 C ATOM 0 H MET A 111 -1.853 -0.090 6.736 1.00 0.00 H new ATOM 0 HA MET A 111 -4.388 -0.536 5.474 1.00 0.00 H new ATOM 0 HB2 MET A 111 -3.610 1.686 6.171 1.00 0.00 H new ATOM 0 HB3 MET A 111 -2.226 1.568 5.103 1.00 0.00 H new ATOM 0 HG2 MET A 111 -3.847 1.378 3.161 1.00 0.00 H new ATOM 0 HG3 MET A 111 -5.145 1.721 4.288 1.00 0.00 H new ATOM 0 HE1 MET A 111 -1.889 4.362 2.636 1.00 0.00 H new ATOM 0 HE2 MET A 111 -1.452 3.950 4.311 1.00 0.00 H new ATOM 0 HE3 MET A 111 -1.759 2.657 3.128 1.00 0.00 H new ATOM 1772 N LEU A 112 -1.619 -0.743 3.672 1.00 0.00 N ATOM 1773 CA LEU A 112 -1.041 -1.268 2.440 1.00 0.00 C ATOM 1774 C LEU A 112 -1.118 -2.791 2.416 1.00 0.00 C ATOM 1775 O LEU A 112 -1.083 -3.408 1.352 1.00 0.00 O ATOM 1776 CB LEU A 112 0.413 -0.811 2.301 1.00 0.00 C ATOM 1777 CG LEU A 112 0.627 0.705 2.369 1.00 0.00 C ATOM 1778 CD1 LEU A 112 2.107 1.041 2.269 1.00 0.00 C ATOM 1779 CD2 LEU A 112 -0.153 1.406 1.267 1.00 0.00 C ATOM 0 H LEU A 112 -0.945 -0.290 4.290 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.615 -0.880 1.598 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.002 -1.281 3.088 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.803 -1.175 1.350 1.00 0.00 H new ATOM 0 HG LEU A 112 0.257 1.060 3.331 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.239 2.122 2.319 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.643 0.571 3.094 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.501 0.671 1.322 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.012 2.481 1.332 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.185 1.045 0.296 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.216 1.194 1.382 1.00 0.00 H new ATOM 1791 N LEU A 113 -1.227 -3.387 3.599 1.00 0.00 N ATOM 1792 CA LEU A 113 -1.299 -4.838 3.738 1.00 0.00 C ATOM 1793 C LEU A 113 -2.364 -5.426 2.818 1.00 0.00 C ATOM 1794 O LEU A 113 -2.269 -6.583 2.403 1.00 0.00 O ATOM 1795 CB LEU A 113 -1.597 -5.212 5.192 1.00 0.00 C ATOM 1796 CG LEU A 113 -1.539 -6.709 5.506 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -0.154 -7.266 5.213 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -1.918 -6.961 6.957 1.00 0.00 C ATOM 0 H LEU A 113 -1.268 -2.882 4.484 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.334 -5.255 3.450 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.886 -4.694 5.836 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -2.589 -4.841 5.449 1.00 0.00 H new ATOM 0 HG LEU A 113 -2.256 -7.222 4.866 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.134 -8.331 5.443 1.00 0.00 H new ATOM 0 HD12 LEU A 113 0.082 -7.118 4.159 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.584 -6.749 5.827 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -1.872 -8.030 7.165 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.223 -6.434 7.611 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.931 -6.600 7.137 1.00 0.00 H new ATOM 1810 N THR A 114 -3.379 -4.625 2.506 1.00 0.00 N ATOM 1811 CA THR A 114 -4.465 -5.065 1.636 1.00 0.00 C ATOM 1812 C THR A 114 -3.974 -5.376 0.220 1.00 0.00 C ATOM 1813 O THR A 114 -4.776 -5.675 -0.665 1.00 0.00 O ATOM 1814 CB THR A 114 -5.576 -4.004 1.555 1.00 0.00 C ATOM 1815 OG1 THR A 114 -5.048 -2.781 1.029 1.00 0.00 O ATOM 1816 CG2 THR A 114 -6.185 -3.752 2.927 1.00 0.00 C ATOM 0 H THR A 114 -3.472 -3.667 2.843 1.00 0.00 H new ATOM 0 HA THR A 114 -4.862 -5.979 2.078 1.00 0.00 H new ATOM 0 HB THR A 114 -6.357 -4.377 0.892 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.590 -2.289 1.742 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.968 -2.998 2.845 1.00 0.00 H new ATOM 0 HG22 THR A 114 -6.612 -4.678 3.311 1.00 0.00 H new ATOM 0 HG23 THR A 114 -5.412 -3.399 3.609 1.00 0.00 H new ATOM 1824 N PHE A 115 -2.660 -5.307 0.008 1.00 0.00 N ATOM 1825 CA PHE A 115 -2.084 -5.591 -1.303 1.00 0.00 C ATOM 1826 C PHE A 115 -2.307 -7.050 -1.690 1.00 0.00 C ATOM 1827 O PHE A 115 -2.498 -7.367 -2.864 1.00 0.00 O ATOM 1828 CB PHE A 115 -0.580 -5.282 -1.317 1.00 0.00 C ATOM 1829 CG PHE A 115 -0.244 -3.837 -1.578 1.00 0.00 C ATOM 1830 CD1 PHE A 115 -0.933 -3.107 -2.535 1.00 0.00 C ATOM 1831 CD2 PHE A 115 0.769 -3.209 -0.866 1.00 0.00 C ATOM 1832 CE1 PHE A 115 -0.621 -1.784 -2.776 1.00 0.00 C ATOM 1833 CE2 PHE A 115 1.085 -1.885 -1.105 1.00 0.00 C ATOM 1834 CZ PHE A 115 0.389 -1.172 -2.060 1.00 0.00 C ATOM 0 H PHE A 115 -1.978 -5.058 0.725 1.00 0.00 H new ATOM 0 HA PHE A 115 -2.585 -4.951 -2.029 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -0.152 -5.574 -0.358 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -0.102 -5.897 -2.080 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -1.724 -3.580 -3.099 1.00 0.00 H new ATOM 0 HD2 PHE A 115 1.316 -3.762 -0.117 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -1.166 -1.228 -3.524 1.00 0.00 H new ATOM 0 HE2 PHE A 115 1.876 -1.409 -0.545 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.634 -0.137 -2.247 1.00 0.00 H new ATOM 1844 N THR A 116 -2.280 -7.932 -0.696 1.00 0.00 N ATOM 1845 CA THR A 116 -2.476 -9.358 -0.935 1.00 0.00 C ATOM 1846 C THR A 116 -3.452 -9.961 0.070 1.00 0.00 C ATOM 1847 O THR A 116 -4.037 -11.016 -0.177 1.00 0.00 O ATOM 1848 CB THR A 116 -1.142 -10.126 -0.860 1.00 0.00 C ATOM 1849 OG1 THR A 116 -0.533 -9.927 0.422 1.00 0.00 O ATOM 1850 CG2 THR A 116 -0.191 -9.667 -1.956 1.00 0.00 C ATOM 0 H THR A 116 -2.125 -7.685 0.281 1.00 0.00 H new ATOM 0 HA THR A 116 -2.891 -9.454 -1.938 1.00 0.00 H new ATOM 0 HB THR A 116 -1.350 -11.186 -1.002 1.00 0.00 H new ATOM 0 HG1 THR A 116 0.313 -10.420 0.462 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.744 -10.223 -1.883 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.645 -9.847 -2.930 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.010 -8.602 -1.840 1.00 0.00 H new ATOM 1858 N ASP A 117 -3.623 -9.287 1.201 1.00 0.00 N ATOM 1859 CA ASP A 117 -4.530 -9.760 2.240 1.00 0.00 C ATOM 1860 C ASP A 117 -5.977 -9.417 1.899 1.00 0.00 C ATOM 1861 O ASP A 117 -6.532 -8.443 2.407 1.00 0.00 O ATOM 1862 CB ASP A 117 -4.151 -9.154 3.592 1.00 0.00 C ATOM 1863 CG ASP A 117 -2.780 -9.600 4.058 1.00 0.00 C ATOM 1864 OD1 ASP A 117 -1.778 -9.166 3.452 1.00 0.00 O ATOM 1865 OD2 ASP A 117 -2.708 -10.386 5.025 1.00 0.00 O ATOM 0 H ASP A 117 -3.146 -8.413 1.422 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.440 -10.845 2.300 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -4.171 -8.067 3.519 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.895 -9.437 4.336 1.00 0.00 H new ATOM 1870 N PHE A 118 -6.582 -10.225 1.032 1.00 0.00 N ATOM 1871 CA PHE A 118 -7.963 -10.006 0.619 1.00 0.00 C ATOM 1872 C PHE A 118 -8.902 -10.049 1.819 1.00 0.00 C ATOM 1873 O PHE A 118 -9.963 -9.423 1.813 1.00 0.00 O ATOM 1874 CB PHE A 118 -8.383 -11.056 -0.413 1.00 0.00 C ATOM 1875 CG PHE A 118 -9.752 -10.820 -0.985 1.00 0.00 C ATOM 1876 CD1 PHE A 118 -9.944 -9.889 -1.991 1.00 0.00 C ATOM 1877 CD2 PHE A 118 -10.845 -11.530 -0.516 1.00 0.00 C ATOM 1878 CE1 PHE A 118 -11.202 -9.670 -2.522 1.00 0.00 C ATOM 1879 CE2 PHE A 118 -12.105 -11.316 -1.041 1.00 0.00 C ATOM 1880 CZ PHE A 118 -12.283 -10.385 -2.046 1.00 0.00 C ATOM 0 H PHE A 118 -6.137 -11.036 0.603 1.00 0.00 H new ATOM 0 HA PHE A 118 -8.028 -9.017 0.165 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -7.656 -11.067 -1.225 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -8.357 -12.042 0.052 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -9.101 -9.327 -2.366 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -10.711 -12.259 0.269 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -11.339 -8.941 -3.307 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -12.949 -11.876 -0.666 1.00 0.00 H new ATOM 0 HZ PHE A 118 -13.267 -10.217 -2.459 1.00 0.00 H new ATOM 1890 N LEU A 119 -8.503 -10.789 2.849 1.00 0.00 N ATOM 1891 CA LEU A 119 -9.308 -10.911 4.059 1.00 0.00 C ATOM 1892 C LEU A 119 -9.481 -9.552 4.728 1.00 0.00 C ATOM 1893 O LEU A 119 -10.569 -9.211 5.192 1.00 0.00 O ATOM 1894 CB LEU A 119 -8.658 -11.897 5.038 1.00 0.00 C ATOM 1895 CG LEU A 119 -8.804 -13.381 4.680 1.00 0.00 C ATOM 1896 CD1 LEU A 119 -10.272 -13.780 4.631 1.00 0.00 C ATOM 1897 CD2 LEU A 119 -8.120 -13.690 3.355 1.00 0.00 C ATOM 0 H LEU A 119 -7.628 -11.313 2.870 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.290 -11.290 3.777 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.596 -11.662 5.110 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -9.088 -11.736 6.027 1.00 0.00 H new ATOM 0 HG LEU A 119 -8.315 -13.966 5.459 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -10.354 -14.836 4.375 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -10.729 -13.606 5.605 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -10.786 -13.184 3.877 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -8.237 -14.749 3.123 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -8.573 -13.093 2.564 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -7.059 -13.450 3.429 1.00 0.00 H new ATOM 1909 N ALA A 120 -8.400 -8.778 4.770 1.00 0.00 N ATOM 1910 CA ALA A 120 -8.432 -7.455 5.380 1.00 0.00 C ATOM 1911 C ALA A 120 -9.120 -6.451 4.462 1.00 0.00 C ATOM 1912 O ALA A 120 -9.688 -5.462 4.923 1.00 0.00 O ATOM 1913 CB ALA A 120 -7.021 -6.994 5.713 1.00 0.00 C ATOM 0 H ALA A 120 -7.492 -9.045 4.389 1.00 0.00 H new ATOM 0 HA ALA A 120 -9.006 -7.517 6.304 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -7.059 -6.004 6.168 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -6.564 -7.696 6.410 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -6.427 -6.951 4.800 1.00 0.00 H new ATOM 1919 N PHE A 121 -9.062 -6.715 3.161 1.00 0.00 N ATOM 1920 CA PHE A 121 -9.678 -5.840 2.168 1.00 0.00 C ATOM 1921 C PHE A 121 -11.197 -5.823 2.336 1.00 0.00 C ATOM 1922 O PHE A 121 -11.805 -4.762 2.501 1.00 0.00 O ATOM 1923 CB PHE A 121 -9.304 -6.320 0.763 1.00 0.00 C ATOM 1924 CG PHE A 121 -9.500 -5.294 -0.319 1.00 0.00 C ATOM 1925 CD1 PHE A 121 -8.931 -4.034 -0.215 1.00 0.00 C ATOM 1926 CD2 PHE A 121 -10.244 -5.597 -1.449 1.00 0.00 C ATOM 1927 CE1 PHE A 121 -9.102 -3.096 -1.215 1.00 0.00 C ATOM 1928 CE2 PHE A 121 -10.416 -4.664 -2.454 1.00 0.00 C ATOM 1929 CZ PHE A 121 -9.844 -3.412 -2.337 1.00 0.00 C ATOM 0 H PHE A 121 -8.593 -7.531 2.768 1.00 0.00 H new ATOM 0 HA PHE A 121 -9.309 -4.824 2.312 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -8.260 -6.632 0.765 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -9.899 -7.201 0.523 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -8.347 -3.783 0.658 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -10.695 -6.574 -1.545 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.656 -2.117 -1.120 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -10.997 -4.913 -3.330 1.00 0.00 H new ATOM 0 HZ PHE A 121 -9.977 -2.681 -3.121 1.00 0.00 H new ATOM 1939 N LYS A 122 -11.798 -7.009 2.310 1.00 0.00 N ATOM 1940 CA LYS A 122 -13.242 -7.141 2.464 1.00 0.00 C ATOM 1941 C LYS A 122 -13.672 -6.668 3.848 1.00 0.00 C ATOM 1942 O LYS A 122 -14.677 -5.973 3.995 1.00 0.00 O ATOM 1943 CB LYS A 122 -13.670 -8.596 2.255 1.00 0.00 C ATOM 1944 CG LYS A 122 -15.176 -8.799 2.272 1.00 0.00 C ATOM 1945 CD LYS A 122 -15.799 -8.463 0.927 1.00 0.00 C ATOM 1946 CE LYS A 122 -17.313 -8.595 0.968 1.00 0.00 C ATOM 1947 NZ LYS A 122 -17.943 -8.190 -0.320 1.00 0.00 N ATOM 0 H LYS A 122 -11.306 -7.893 2.183 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.727 -6.519 1.711 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.276 -8.948 1.302 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.220 -9.213 3.033 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.402 -9.834 2.530 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -15.620 -8.173 3.046 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.529 -7.446 0.643 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -15.395 -9.126 0.162 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -17.581 -9.627 1.194 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -17.709 -7.979 1.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -18.756 -7.571 -0.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -17.248 -7.679 -0.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -18.265 -9.037 -0.830 1.00 0.00 H new ATOM 1961 N GLU A 123 -12.896 -7.050 4.857 1.00 0.00 N ATOM 1962 CA GLU A 123 -13.184 -6.672 6.236 1.00 0.00 C ATOM 1963 C GLU A 123 -13.064 -5.162 6.424 1.00 0.00 C ATOM 1964 O GLU A 123 -13.735 -4.579 7.276 1.00 0.00 O ATOM 1965 CB GLU A 123 -12.232 -7.393 7.193 1.00 0.00 C ATOM 1966 CG GLU A 123 -12.522 -7.124 8.661 1.00 0.00 C ATOM 1967 CD GLU A 123 -11.503 -7.767 9.582 1.00 0.00 C ATOM 1968 OE1 GLU A 123 -11.659 -8.967 9.895 1.00 0.00 O ATOM 1969 OE2 GLU A 123 -10.551 -7.072 9.991 1.00 0.00 O ATOM 0 H GLU A 123 -12.060 -7.623 4.745 1.00 0.00 H new ATOM 0 HA GLU A 123 -14.209 -6.968 6.461 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -12.291 -8.466 7.011 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -11.209 -7.088 6.972 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -12.535 -6.048 8.834 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -13.516 -7.499 8.906 1.00 0.00 H new ATOM 1976 N MET A 124 -12.206 -4.535 5.623 1.00 0.00 N ATOM 1977 CA MET A 124 -12.001 -3.094 5.706 1.00 0.00 C ATOM 1978 C MET A 124 -13.260 -2.342 5.290 1.00 0.00 C ATOM 1979 O MET A 124 -13.700 -1.423 5.981 1.00 0.00 O ATOM 1980 CB MET A 124 -10.825 -2.670 4.823 1.00 0.00 C ATOM 1981 CG MET A 124 -10.495 -1.188 4.916 1.00 0.00 C ATOM 1982 SD MET A 124 -9.063 -0.728 3.922 1.00 0.00 S ATOM 1983 CE MET A 124 -9.651 -1.110 2.274 1.00 0.00 C ATOM 0 H MET A 124 -11.644 -5.002 4.911 1.00 0.00 H new ATOM 0 HA MET A 124 -11.774 -2.845 6.743 1.00 0.00 H new ATOM 0 HB2 MET A 124 -9.944 -3.248 5.104 1.00 0.00 H new ATOM 0 HB3 MET A 124 -11.052 -2.918 3.786 1.00 0.00 H new ATOM 0 HG2 MET A 124 -11.358 -0.607 4.592 1.00 0.00 H new ATOM 0 HG3 MET A 124 -10.308 -0.927 5.958 1.00 0.00 H new ATOM 0 HE1 MET A 124 -9.009 -0.626 1.538 1.00 0.00 H new ATOM 0 HE2 MET A 124 -9.630 -2.189 2.121 1.00 0.00 H new ATOM 0 HE3 MET A 124 -10.672 -0.747 2.159 1.00 0.00 H new ATOM 1993 N PHE A 125 -13.837 -2.739 4.158 1.00 0.00 N ATOM 1994 CA PHE A 125 -15.050 -2.095 3.658 1.00 0.00 C ATOM 1995 C PHE A 125 -16.229 -2.323 4.601 1.00 0.00 C ATOM 1996 O PHE A 125 -17.009 -1.408 4.862 1.00 0.00 O ATOM 1997 CB PHE A 125 -15.395 -2.609 2.261 1.00 0.00 C ATOM 1998 CG PHE A 125 -14.377 -2.244 1.221 1.00 0.00 C ATOM 1999 CD1 PHE A 125 -14.210 -0.926 0.828 1.00 0.00 C ATOM 2000 CD2 PHE A 125 -13.586 -3.218 0.638 1.00 0.00 C ATOM 2001 CE1 PHE A 125 -13.272 -0.587 -0.129 1.00 0.00 C ATOM 2002 CE2 PHE A 125 -12.647 -2.886 -0.320 1.00 0.00 C ATOM 2003 CZ PHE A 125 -12.490 -1.570 -0.704 1.00 0.00 C ATOM 0 H PHE A 125 -13.488 -3.498 3.573 1.00 0.00 H new ATOM 0 HA PHE A 125 -14.856 -1.024 3.605 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -15.494 -3.694 2.296 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -16.365 -2.210 1.965 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.820 -0.155 1.275 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -13.704 -4.250 0.935 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -13.151 0.444 -0.427 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -12.036 -3.656 -0.768 1.00 0.00 H new ATOM 0 HZ PHE A 125 -11.757 -1.309 -1.453 1.00 0.00 H new ATOM 2013 N LEU A 126 -16.353 -3.544 5.111 1.00 0.00 N ATOM 2014 CA LEU A 126 -17.443 -3.882 6.023 1.00 0.00 C ATOM 2015 C LEU A 126 -17.349 -3.076 7.317 1.00 0.00 C ATOM 2016 O LEU A 126 -18.366 -2.668 7.877 1.00 0.00 O ATOM 2017 CB LEU A 126 -17.431 -5.380 6.336 1.00 0.00 C ATOM 2018 CG LEU A 126 -18.331 -6.238 5.442 1.00 0.00 C ATOM 2019 CD1 LEU A 126 -17.871 -6.176 3.992 1.00 0.00 C ATOM 2020 CD2 LEU A 126 -18.352 -7.676 5.936 1.00 0.00 C ATOM 0 H LEU A 126 -15.715 -4.314 4.910 1.00 0.00 H new ATOM 0 HA LEU A 126 -18.382 -3.629 5.531 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -16.407 -5.745 6.251 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -17.735 -5.521 7.373 1.00 0.00 H new ATOM 0 HG LEU A 126 -19.344 -5.839 5.493 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -18.525 -6.793 3.376 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -17.910 -5.144 3.642 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -16.848 -6.546 3.919 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -18.996 -8.273 5.290 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -17.341 -8.082 5.916 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -18.734 -7.705 6.956 1.00 0.00 H new ATOM 2032 N ASP A 127 -16.124 -2.852 7.786 1.00 0.00 N ATOM 2033 CA ASP A 127 -15.903 -2.092 9.013 1.00 0.00 C ATOM 2034 C ASP A 127 -16.188 -0.609 8.793 1.00 0.00 C ATOM 2035 O ASP A 127 -16.764 0.059 9.653 1.00 0.00 O ATOM 2036 CB ASP A 127 -14.464 -2.280 9.501 1.00 0.00 C ATOM 2037 CG ASP A 127 -14.183 -1.519 10.782 1.00 0.00 C ATOM 2038 OD1 ASP A 127 -14.420 -2.082 11.871 1.00 0.00 O ATOM 2039 OD2 ASP A 127 -13.727 -0.360 10.695 1.00 0.00 O ATOM 0 H ASP A 127 -15.271 -3.185 7.336 1.00 0.00 H new ATOM 0 HA ASP A 127 -16.589 -2.467 9.772 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.274 -3.341 9.663 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.774 -1.947 8.725 1.00 0.00 H new ATOM 2044 N TYR A 128 -15.780 -0.105 7.633 1.00 0.00 N ATOM 2045 CA TYR A 128 -15.988 1.296 7.286 1.00 0.00 C ATOM 2046 C TYR A 128 -17.477 1.629 7.227 1.00 0.00 C ATOM 2047 O TYR A 128 -17.941 2.559 7.886 1.00 0.00 O ATOM 2048 CB TYR A 128 -15.321 1.604 5.942 1.00 0.00 C ATOM 2049 CG TYR A 128 -15.626 2.984 5.404 1.00 0.00 C ATOM 2050 CD1 TYR A 128 -15.039 4.114 5.958 1.00 0.00 C ATOM 2051 CD2 TYR A 128 -16.500 3.154 4.338 1.00 0.00 C ATOM 2052 CE1 TYR A 128 -15.316 5.375 5.465 1.00 0.00 C ATOM 2053 CE2 TYR A 128 -16.781 4.411 3.839 1.00 0.00 C ATOM 2054 CZ TYR A 128 -16.186 5.518 4.406 1.00 0.00 C ATOM 2055 OH TYR A 128 -16.464 6.772 3.912 1.00 0.00 O ATOM 0 H TYR A 128 -15.301 -0.649 6.915 1.00 0.00 H new ATOM 0 HA TYR A 128 -15.535 1.915 8.061 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -14.242 1.499 6.052 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -15.641 0.862 5.211 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -14.355 4.006 6.787 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -16.968 2.289 3.892 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -14.853 6.244 5.908 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -17.463 4.526 3.009 1.00 0.00 H new ATOM 0 HH TYR A 128 -17.095 6.697 3.166 1.00 0.00 H new ATOM 2065 N ARG A 129 -18.218 0.861 6.435 1.00 0.00 N ATOM 2066 CA ARG A 129 -19.654 1.071 6.284 1.00 0.00 C ATOM 2067 C ARG A 129 -20.375 0.904 7.620 1.00 0.00 C ATOM 2068 O ARG A 129 -21.342 1.609 7.906 1.00 0.00 O ATOM 2069 CB ARG A 129 -20.224 0.088 5.257 1.00 0.00 C ATOM 2070 CG ARG A 129 -21.731 0.184 5.085 1.00 0.00 C ATOM 2071 CD ARG A 129 -22.243 -0.849 4.095 1.00 0.00 C ATOM 2072 NE ARG A 129 -23.700 -0.839 3.996 1.00 0.00 N ATOM 2073 CZ ARG A 129 -24.378 -1.438 3.022 1.00 0.00 C ATOM 2074 NH1 ARG A 129 -23.733 -2.088 2.062 1.00 0.00 N ATOM 2075 NH2 ARG A 129 -25.703 -1.386 3.006 1.00 0.00 N ATOM 0 H ARG A 129 -17.847 0.085 5.886 1.00 0.00 H new ATOM 0 HA ARG A 129 -19.813 2.091 5.933 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -19.746 0.266 4.294 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -19.966 -0.927 5.558 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -22.219 0.039 6.049 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -21.996 1.183 4.740 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -21.812 -0.654 3.113 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -21.907 -1.840 4.400 1.00 0.00 H new ATOM 0 HE ARG A 129 -24.227 -0.344 4.715 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -22.714 -2.129 2.070 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -24.256 -2.547 1.316 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -26.203 -0.886 3.741 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -26.222 -1.846 2.258 1.00 0.00 H new ATOM 2089 N ALA A 130 -19.897 -0.033 8.433 1.00 0.00 N ATOM 2090 CA ALA A 130 -20.498 -0.296 9.735 1.00 0.00 C ATOM 2091 C ALA A 130 -20.450 0.938 10.630 1.00 0.00 C ATOM 2092 O ALA A 130 -21.405 1.233 11.347 1.00 0.00 O ATOM 2093 CB ALA A 130 -19.798 -1.465 10.413 1.00 0.00 C ATOM 0 H ALA A 130 -19.095 -0.623 8.212 1.00 0.00 H new ATOM 0 HA ALA A 130 -21.545 -0.553 9.574 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -20.257 -1.650 11.384 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -19.892 -2.355 9.791 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -18.743 -1.228 10.550 1.00 0.00 H new ATOM 2099 N GLU A 131 -19.332 1.654 10.579 1.00 0.00 N ATOM 2100 CA GLU A 131 -19.155 2.855 11.387 1.00 0.00 C ATOM 2101 C GLU A 131 -19.990 4.011 10.842 1.00 0.00 C ATOM 2102 O GLU A 131 -20.320 4.947 11.571 1.00 0.00 O ATOM 2103 CB GLU A 131 -17.675 3.246 11.430 1.00 0.00 C ATOM 2104 CG GLU A 131 -17.385 4.441 12.324 1.00 0.00 C ATOM 2105 CD GLU A 131 -15.905 4.755 12.413 1.00 0.00 C ATOM 2106 OE1 GLU A 131 -15.394 5.461 11.518 1.00 0.00 O ATOM 2107 OE2 GLU A 131 -15.257 4.296 13.376 1.00 0.00 O ATOM 0 H GLU A 131 -18.534 1.423 9.986 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.497 2.638 12.399 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -17.093 2.393 11.778 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.338 3.470 10.418 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -17.916 5.313 11.942 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -17.772 4.245 13.324 1.00 0.00 H new ATOM 2114 N LYS A 132 -20.332 3.937 9.559 1.00 0.00 N ATOM 2115 CA LYS A 132 -21.125 4.981 8.918 1.00 0.00 C ATOM 2116 C LYS A 132 -22.528 5.048 9.512 1.00 0.00 C ATOM 2117 O LYS A 132 -23.087 6.131 9.689 1.00 0.00 O ATOM 2118 CB LYS A 132 -21.209 4.732 7.410 1.00 0.00 C ATOM 2119 CG LYS A 132 -19.878 4.894 6.691 1.00 0.00 C ATOM 2120 CD LYS A 132 -19.390 6.335 6.728 1.00 0.00 C ATOM 2121 CE LYS A 132 -20.281 7.250 5.904 1.00 0.00 C ATOM 2122 NZ LYS A 132 -19.785 8.654 5.901 1.00 0.00 N ATOM 0 H LYS A 132 -20.073 3.166 8.943 1.00 0.00 H new ATOM 0 HA LYS A 132 -20.631 5.936 9.097 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -21.586 3.724 7.237 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -21.933 5.422 6.976 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -19.134 4.246 7.153 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -19.982 4.572 5.655 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -19.364 6.684 7.760 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -18.369 6.384 6.350 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -20.332 6.881 4.880 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -21.295 7.224 6.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -20.420 9.245 5.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -19.761 9.016 6.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -18.827 8.683 5.497 1.00 0.00 H new ATOM 2136 N GLU A 133 -23.091 3.884 9.820 1.00 0.00 N ATOM 2137 CA GLU A 133 -24.430 3.810 10.393 1.00 0.00 C ATOM 2138 C GLU A 133 -24.378 3.907 11.917 1.00 0.00 C ATOM 2139 O GLU A 133 -25.415 3.931 12.581 1.00 0.00 O ATOM 2140 CB GLU A 133 -25.120 2.517 9.959 1.00 0.00 C ATOM 2141 CG GLU A 133 -24.800 1.339 10.851 1.00 0.00 C ATOM 2142 CD GLU A 133 -25.669 0.131 10.563 1.00 0.00 C ATOM 2143 OE1 GLU A 133 -26.750 0.018 11.178 1.00 0.00 O ATOM 2144 OE2 GLU A 133 -25.271 -0.701 9.720 1.00 0.00 O ATOM 0 H GLU A 133 -22.641 2.979 9.682 1.00 0.00 H new ATOM 0 HA GLU A 133 -25.009 4.656 10.022 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -26.199 2.674 9.950 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -24.824 2.281 8.937 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -23.753 1.066 10.723 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -24.928 1.633 11.893 1.00 0.00 H new ATOM 2151 N GLY A 134 -23.166 3.968 12.463 1.00 0.00 N ATOM 2152 CA GLY A 134 -23.005 4.062 13.902 1.00 0.00 C ATOM 2153 C GLY A 134 -23.435 5.411 14.448 1.00 0.00 C ATOM 2154 O GLY A 134 -23.897 5.506 15.584 1.00 0.00 O ATOM 0 H GLY A 134 -22.294 3.954 11.934 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -23.589 3.277 14.382 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -21.961 3.885 14.160 1.00 0.00 H new ATOM 2158 N ARG A 135 -23.280 6.452 13.628 1.00 0.00 N ATOM 2159 CA ARG A 135 -23.652 7.813 14.016 1.00 0.00 C ATOM 2160 C ARG A 135 -22.790 8.316 15.172 1.00 0.00 C ATOM 2161 O ARG A 135 -21.835 9.066 14.964 1.00 0.00 O ATOM 2162 CB ARG A 135 -25.136 7.883 14.387 1.00 0.00 C ATOM 2163 CG ARG A 135 -25.574 9.248 14.895 1.00 0.00 C ATOM 2164 CD ARG A 135 -27.055 9.268 15.233 1.00 0.00 C ATOM 2165 NE ARG A 135 -27.487 10.576 15.718 1.00 0.00 N ATOM 2166 CZ ARG A 135 -28.751 10.988 15.699 1.00 0.00 C ATOM 2167 NH1 ARG A 135 -29.703 10.202 15.215 1.00 0.00 N ATOM 2168 NH2 ARG A 135 -29.062 12.191 16.164 1.00 0.00 N ATOM 0 H ARG A 135 -22.897 6.377 12.686 1.00 0.00 H new ATOM 0 HA ARG A 135 -23.476 8.462 13.158 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -25.733 7.621 13.513 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -25.346 7.136 15.152 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -24.994 9.511 15.780 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -25.362 10.004 14.139 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -27.633 9.000 14.348 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -27.264 8.513 15.991 1.00 0.00 H new ATOM 0 HE ARG A 135 -26.780 11.209 16.092 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -29.467 9.277 14.855 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -30.671 10.522 15.202 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -28.332 12.799 16.535 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -30.031 12.508 16.150 1.00 0.00 H new ATOM 2182 N GLY A 136 -23.129 7.900 16.390 1.00 0.00 N ATOM 2183 CA GLY A 136 -22.374 8.325 17.555 1.00 0.00 C ATOM 2184 C GLY A 136 -23.270 8.742 18.705 1.00 0.00 C ATOM 2185 O GLY A 136 -22.860 8.567 19.871 1.00 0.00 O ATOM 2186 OXT GLY A 136 -24.382 9.245 18.438 1.00 0.00 O ATOM 0 H GLY A 136 -23.912 7.277 16.590 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -21.725 7.512 17.880 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -21.728 9.159 17.281 1.00 0.00 H new TER 2190 GLY A 136