USER MOD reduce.3.24.130724 H: found=0, std=0, add=1340, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1344 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 73 ASN : amide:sc= 0.855 K(o=1,f=-11!) USER MOD Set 1.2: A 83 LYS NZ :NH3+ -152:sc= 0.144 (180deg=-2.66!) USER MOD Set 2.1: A 43 SER OG : rot -115:sc= 0.645 USER MOD Set 2.2: A 52 GLN : amide:sc= 0.599 K(o=1.2,f=-0.64) USER MOD Set 3.1: A 34 TYR OH : rot 104:sc= 0.808 USER MOD Set 3.2: A 59 TYR OH : rot -111:sc= 0.00619 USER MOD Set 4.1: A 7 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 10 ASN : amide:sc= -4.05! C(o=-7!,f=-8.7!) USER MOD Set 4.3: A 62 GLN : amide:sc= 0.293 K(o=-7,f=-13!) USER MOD Set 4.4: A 86 HIS : no HE2:sc= -3.25! X(o=-7!,f=-7.1) USER MOD Single : A 1 GLY N :NH3+ 165:sc= 2.33 (180deg=1.79) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 ASN : amide:sc= -0.179 K(o=-0.18,f=-0.84) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot -38:sc= 0.804 USER MOD Single : A 17 ASN : amide:sc= 0.876 K(o=0.88,f=-0.95) USER MOD Single : A 19 ASN : amide:sc= -1.42 K(o=-1.4,f=-2.1!) USER MOD Single : A 23 THR OG1 : rot 62:sc= -2.68! USER MOD Single : A 29 THR OG1 : rot 66:sc= 0.629 USER MOD Single : A 32 SER OG : rot 93:sc= 1.29 USER MOD Single : A 47 ASN : amide:sc= -1.38 K(o=-1.4,f=0) USER MOD Single : A 48 THR OG1 : rot -19:sc= 0.489 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -165:sc= 1.28 (180deg=0.976) USER MOD Single : A 64 SER OG : rot -124:sc= 0.563 USER MOD Single : A 65 THR OG1 : rot -115:sc= 0.465 USER MOD Single : A 71 ASN : amide:sc= 0.522 K(o=0.52,f=-2.2) USER MOD Single : A 76 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0315) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.004) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0.897 K(o=0.9,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 144:sc= 1.2 (180deg=0.281) USER MOD Single : A 98 TYR OH : rot 22:sc= 1.9 USER MOD Single : A 99 TYR OH : rot 70:sc= 0.489 USER MOD Single : A 103 LYS NZ :NH3+ 138:sc= 0.106 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc= -0.32 K(o=-0.32,f=-2.3!) USER MOD Single : A 115 ASN : amide:sc= -0.927 K(o=-0.93,f=-3.1!) USER MOD Single : A 118 LYS NZ :NH3+ -164:sc= -0.0469 (180deg=-0.314) USER MOD Single : B 201 SER OG : rot 180:sc= 0.0241 USER MOD Single : B 202 LYS NZ :NH3+ 171:sc=-0.00227 (180deg=-0.073) USER MOD Single : B 203 SER OG : rot -150:sc= -0.0826 USER MOD Single : B 204 GLN : amide:sc= -1.08 K(o=-1.1,f=-0.018) USER MOD Single : B 205 TYR OH : rot 180:sc= 0 USER MOD Single : B 209 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 213 SER OG : rot 180:sc= 0 USER MOD Single : B 215 SER OG : rot -111:sc= 0.858 USER MOD Single : B 222 SER OG : rot 80:sc= 0.0389 USER MOD Single : C 301 SER OG : rot 180:sc= 0 USER MOD Single : C 302 TYR OH : rot 180:sc= 0 USER MOD Single : C 304 LYS NZ :NH3+ -156:sc= 1.18 (180deg=0.984) USER MOD Single : C 309 ASN : amide:sc= -0.15 K(o=-0.15,f=-7.7!) USER MOD Single : C 314 MET CE :methyl -158:sc= -0.561 (180deg=-1.98!) USER MOD Single : C 317 SER OG : rot 180:sc= 0 USER MOD Single : C 323 HIS : no HE2:sc= 1.04 K(o=1,f=-5!) USER MOD Single : C 325 SER OG : rot 125:sc= 1.25 USER MOD Single : C 326 ASN : amide:sc= 1.17 K(o=1.2,f=-1.3) USER MOD Single : C 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.766 5.958 -13.384 1.00 0.00 N ATOM 2 CA GLY A 1 8.149 6.294 -14.653 1.00 0.00 C ATOM 3 C GLY A 1 6.654 6.315 -14.543 1.00 0.00 C ATOM 4 O GLY A 1 6.075 5.478 -13.843 1.00 0.00 O ATOM 0 H1 GLY A 1 9.762 5.703 -13.539 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.714 6.777 -12.745 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.265 5.153 -12.957 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.505 7.269 -14.986 1.00 0.00 H new ATOM 0 HA3 GLY A 1 8.450 5.569 -15.409 1.00 0.00 H new ATOM 10 N ALA A 2 6.023 7.279 -15.198 1.00 0.00 N ATOM 11 CA ALA A 2 4.569 7.362 -15.266 1.00 0.00 C ATOM 12 C ALA A 2 4.017 6.221 -16.112 1.00 0.00 C ATOM 13 O ALA A 2 2.846 5.870 -16.029 1.00 0.00 O ATOM 14 CB ALA A 2 4.134 8.706 -15.835 1.00 0.00 C ATOM 0 H ALA A 2 6.504 8.027 -15.698 1.00 0.00 H new ATOM 0 HA ALA A 2 4.169 7.274 -14.256 1.00 0.00 H new ATOM 0 HB1 ALA A 2 3.046 8.748 -15.878 1.00 0.00 H new ATOM 0 HB2 ALA A 2 4.503 9.508 -15.196 1.00 0.00 H new ATOM 0 HB3 ALA A 2 4.541 8.825 -16.839 1.00 0.00 H new ATOM 20 N MET A 3 4.851 5.658 -16.941 1.00 0.00 N ATOM 21 CA MET A 3 4.442 4.517 -17.700 1.00 0.00 C ATOM 22 C MET A 3 5.054 3.275 -17.104 1.00 0.00 C ATOM 23 O MET A 3 6.278 3.067 -17.180 1.00 0.00 O ATOM 24 CB MET A 3 4.810 4.652 -19.176 1.00 0.00 C ATOM 25 CG MET A 3 4.164 5.842 -19.858 1.00 0.00 C ATOM 26 SD MET A 3 4.458 5.859 -21.630 1.00 0.00 S ATOM 27 CE MET A 3 3.663 7.403 -22.071 1.00 0.00 C ATOM 0 H MET A 3 5.808 5.969 -17.105 1.00 0.00 H new ATOM 0 HA MET A 3 3.355 4.444 -17.653 1.00 0.00 H new ATOM 0 HB2 MET A 3 5.893 4.737 -19.265 1.00 0.00 H new ATOM 0 HB3 MET A 3 4.518 3.742 -19.699 1.00 0.00 H new ATOM 0 HG2 MET A 3 3.090 5.826 -19.671 1.00 0.00 H new ATOM 0 HG3 MET A 3 4.550 6.762 -19.420 1.00 0.00 H new ATOM 0 HE1 MET A 3 3.755 7.566 -23.145 1.00 0.00 H new ATOM 0 HE2 MET A 3 2.608 7.360 -21.800 1.00 0.00 H new ATOM 0 HE3 MET A 3 4.141 8.224 -21.537 1.00 0.00 H new ATOM 37 N GLY A 4 4.221 2.478 -16.490 1.00 0.00 N ATOM 38 CA GLY A 4 4.654 1.258 -15.881 1.00 0.00 C ATOM 39 C GLY A 4 3.683 0.829 -14.809 1.00 0.00 C ATOM 40 O GLY A 4 2.868 1.634 -14.349 1.00 0.00 O ATOM 0 H GLY A 4 3.222 2.661 -16.400 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.739 0.477 -16.637 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.646 1.392 -15.449 1.00 0.00 H new ATOM 44 N ASN A 5 3.797 -0.406 -14.362 1.00 0.00 N ATOM 45 CA ASN A 5 2.876 -0.961 -13.357 1.00 0.00 C ATOM 46 C ASN A 5 3.280 -0.511 -11.937 1.00 0.00 C ATOM 47 O ASN A 5 2.733 -0.959 -10.931 1.00 0.00 O ATOM 48 CB ASN A 5 2.810 -2.506 -13.475 1.00 0.00 C ATOM 49 CG ASN A 5 1.745 -3.145 -12.580 1.00 0.00 C ATOM 50 OD1 ASN A 5 0.726 -2.526 -12.251 1.00 0.00 O ATOM 51 ND2 ASN A 5 1.953 -4.376 -12.199 1.00 0.00 N ATOM 0 H ASN A 5 4.518 -1.057 -14.673 1.00 0.00 H new ATOM 0 HA ASN A 5 1.875 -0.573 -13.548 1.00 0.00 H new ATOM 0 HB2 ASN A 5 2.609 -2.774 -14.512 1.00 0.00 H new ATOM 0 HB3 ASN A 5 3.784 -2.923 -13.220 1.00 0.00 H new ATOM 0 HD21 ASN A 5 1.266 -4.852 -11.615 1.00 0.00 H new ATOM 0 HD22 ASN A 5 2.803 -4.862 -12.486 1.00 0.00 H new ATOM 58 N GLU A 6 4.196 0.412 -11.880 1.00 0.00 N ATOM 59 CA GLU A 6 4.661 0.993 -10.632 1.00 0.00 C ATOM 60 C GLU A 6 3.764 2.163 -10.213 1.00 0.00 C ATOM 61 O GLU A 6 3.802 2.594 -9.070 1.00 0.00 O ATOM 62 CB GLU A 6 6.113 1.473 -10.804 1.00 0.00 C ATOM 63 CG GLU A 6 6.316 2.391 -12.016 1.00 0.00 C ATOM 64 CD GLU A 6 7.723 2.919 -12.138 1.00 0.00 C ATOM 65 OE1 GLU A 6 8.575 2.253 -12.756 1.00 0.00 O1- ATOM 66 OE2 GLU A 6 8.010 4.025 -11.630 1.00 0.00 O ATOM 0 H GLU A 6 4.655 0.795 -12.707 1.00 0.00 H new ATOM 0 HA GLU A 6 4.618 0.235 -9.850 1.00 0.00 H new ATOM 0 HB2 GLU A 6 6.421 2.002 -9.902 1.00 0.00 H new ATOM 0 HB3 GLU A 6 6.765 0.605 -10.903 1.00 0.00 H new ATOM 0 HG2 GLU A 6 6.061 1.844 -12.924 1.00 0.00 H new ATOM 0 HG3 GLU A 6 5.625 3.231 -11.946 1.00 0.00 H new ATOM 73 N TYR A 7 2.912 2.599 -11.144 1.00 0.00 N ATOM 74 CA TYR A 7 2.071 3.818 -11.042 1.00 0.00 C ATOM 75 C TYR A 7 1.244 3.910 -9.735 1.00 0.00 C ATOM 76 O TYR A 7 0.960 5.000 -9.251 1.00 0.00 O ATOM 77 CB TYR A 7 1.126 3.862 -12.249 1.00 0.00 C ATOM 78 CG TYR A 7 0.573 5.232 -12.591 1.00 0.00 C ATOM 79 CD1 TYR A 7 -0.546 5.764 -11.959 1.00 0.00 C ATOM 80 CD2 TYR A 7 1.178 5.982 -13.570 1.00 0.00 C ATOM 81 CE1 TYR A 7 -1.030 7.015 -12.311 1.00 0.00 C ATOM 82 CE2 TYR A 7 0.707 7.220 -13.926 1.00 0.00 C ATOM 83 CZ TYR A 7 -0.390 7.735 -13.301 1.00 0.00 C ATOM 84 OH TYR A 7 -0.853 8.980 -13.668 1.00 0.00 O ATOM 0 H TYR A 7 2.776 2.103 -12.025 1.00 0.00 H new ATOM 0 HA TYR A 7 2.750 4.671 -11.028 1.00 0.00 H new ATOM 0 HB2 TYR A 7 1.657 3.475 -13.119 1.00 0.00 H new ATOM 0 HB3 TYR A 7 0.290 3.188 -12.060 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -1.043 5.197 -11.186 1.00 0.00 H new ATOM 0 HD2 TYR A 7 2.048 5.586 -14.073 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -1.899 7.422 -11.816 1.00 0.00 H new ATOM 0 HE2 TYR A 7 1.204 7.786 -14.700 1.00 0.00 H new ATOM 0 HH TYR A 7 -0.284 9.345 -14.378 1.00 0.00 H new ATOM 94 N LYS A 8 0.850 2.779 -9.193 1.00 0.00 N ATOM 95 CA LYS A 8 0.027 2.769 -7.992 1.00 0.00 C ATOM 96 C LYS A 8 0.876 2.909 -6.727 1.00 0.00 C ATOM 97 O LYS A 8 0.422 3.447 -5.720 1.00 0.00 O ATOM 98 CB LYS A 8 -0.754 1.459 -7.900 1.00 0.00 C ATOM 99 CG LYS A 8 -1.784 1.438 -6.776 1.00 0.00 C ATOM 100 CD LYS A 8 -2.298 0.038 -6.488 1.00 0.00 C ATOM 101 CE LYS A 8 -1.192 -0.838 -5.903 1.00 0.00 C ATOM 102 NZ LYS A 8 -1.680 -2.155 -5.440 1.00 0.00 N1+ ATOM 0 H LYS A 8 1.082 1.855 -9.559 1.00 0.00 H new ATOM 0 HA LYS A 8 -0.654 3.617 -8.061 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -1.261 1.281 -8.849 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -0.053 0.637 -7.754 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -1.339 1.852 -5.871 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -2.622 2.082 -7.043 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -3.134 0.089 -5.791 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -2.676 -0.411 -7.406 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -0.419 -0.988 -6.656 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -0.726 -0.315 -5.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -0.885 -2.704 -5.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -2.398 -2.019 -4.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -2.100 -2.670 -6.240 1.00 0.00 H new ATOM 116 N ASP A 9 2.106 2.441 -6.787 1.00 0.00 N ATOM 117 CA ASP A 9 2.934 2.364 -5.584 1.00 0.00 C ATOM 118 C ASP A 9 4.011 3.418 -5.545 1.00 0.00 C ATOM 119 O ASP A 9 4.761 3.523 -4.561 1.00 0.00 O ATOM 120 CB ASP A 9 3.571 0.976 -5.414 1.00 0.00 C ATOM 121 CG ASP A 9 2.579 -0.125 -5.134 1.00 0.00 C ATOM 122 OD1 ASP A 9 2.101 -0.234 -3.983 1.00 0.00 O1- ATOM 123 OD2 ASP A 9 2.283 -0.936 -6.052 1.00 0.00 O ATOM 0 H ASP A 9 2.557 2.110 -7.640 1.00 0.00 H new ATOM 0 HA ASP A 9 2.253 2.547 -4.753 1.00 0.00 H new ATOM 0 HB2 ASP A 9 4.126 0.729 -6.319 1.00 0.00 H new ATOM 0 HB3 ASP A 9 4.293 1.016 -4.598 1.00 0.00 H new ATOM 128 N ASN A 10 4.126 4.183 -6.593 1.00 0.00 N ATOM 129 CA ASN A 10 5.121 5.227 -6.625 1.00 0.00 C ATOM 130 C ASN A 10 4.553 6.566 -6.170 1.00 0.00 C ATOM 131 O ASN A 10 4.063 7.364 -6.964 1.00 0.00 O ATOM 132 CB ASN A 10 5.899 5.318 -7.972 1.00 0.00 C ATOM 133 CG ASN A 10 5.048 5.419 -9.234 1.00 0.00 C ATOM 134 OD1 ASN A 10 3.914 5.860 -9.213 1.00 0.00 O ATOM 135 ND2 ASN A 10 5.617 5.051 -10.359 1.00 0.00 N ATOM 0 H ASN A 10 3.551 4.108 -7.432 1.00 0.00 H new ATOM 0 HA ASN A 10 5.878 4.940 -5.895 1.00 0.00 H new ATOM 0 HB2 ASN A 10 6.556 6.187 -7.931 1.00 0.00 H new ATOM 0 HB3 ASN A 10 6.538 4.439 -8.059 1.00 0.00 H new ATOM 0 HD21 ASN A 10 5.107 5.132 -11.239 1.00 0.00 H new ATOM 0 HD22 ASN A 10 6.569 4.684 -10.353 1.00 0.00 H new ATOM 142 N ALA A 11 4.575 6.778 -4.859 1.00 0.00 N ATOM 143 CA ALA A 11 4.044 8.009 -4.270 1.00 0.00 C ATOM 144 C ALA A 11 5.056 9.141 -4.320 1.00 0.00 C ATOM 145 O ALA A 11 4.734 10.297 -4.001 1.00 0.00 O ATOM 146 CB ALA A 11 3.533 7.771 -2.848 1.00 0.00 C ATOM 0 H ALA A 11 4.954 6.116 -4.182 1.00 0.00 H new ATOM 0 HA ALA A 11 3.192 8.317 -4.876 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.146 8.704 -2.440 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.738 7.026 -2.867 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.351 7.413 -2.223 1.00 0.00 H new ATOM 152 N TYR A 12 6.274 8.816 -4.722 1.00 0.00 N ATOM 153 CA TYR A 12 7.291 9.816 -4.898 1.00 0.00 C ATOM 154 C TYR A 12 7.202 10.327 -6.310 1.00 0.00 C ATOM 155 O TYR A 12 6.762 9.622 -7.221 1.00 0.00 O ATOM 156 CB TYR A 12 8.715 9.283 -4.641 1.00 0.00 C ATOM 157 CG TYR A 12 9.045 8.926 -3.210 1.00 0.00 C ATOM 158 CD1 TYR A 12 8.818 7.653 -2.720 1.00 0.00 C ATOM 159 CD2 TYR A 12 9.618 9.865 -2.358 1.00 0.00 C ATOM 160 CE1 TYR A 12 9.148 7.316 -1.424 1.00 0.00 C ATOM 161 CE2 TYR A 12 9.949 9.544 -1.054 1.00 0.00 C ATOM 162 CZ TYR A 12 9.710 8.258 -0.592 1.00 0.00 C ATOM 163 OH TYR A 12 10.040 7.907 0.697 1.00 0.00 O ATOM 0 H TYR A 12 6.574 7.864 -4.930 1.00 0.00 H new ATOM 0 HA TYR A 12 7.115 10.605 -4.167 1.00 0.00 H new ATOM 0 HB2 TYR A 12 8.866 8.398 -5.259 1.00 0.00 H new ATOM 0 HB3 TYR A 12 9.428 10.034 -4.980 1.00 0.00 H new ATOM 0 HD1 TYR A 12 8.374 6.909 -3.364 1.00 0.00 H new ATOM 0 HD2 TYR A 12 9.808 10.864 -2.722 1.00 0.00 H new ATOM 0 HE1 TYR A 12 8.966 6.315 -1.062 1.00 0.00 H new ATOM 0 HE2 TYR A 12 10.388 10.286 -0.403 1.00 0.00 H new ATOM 0 HH TYR A 12 10.428 8.680 1.158 1.00 0.00 H new ATOM 173 N ILE A 13 7.574 11.521 -6.496 1.00 0.00 N ATOM 174 CA ILE A 13 7.551 12.105 -7.779 1.00 0.00 C ATOM 175 C ILE A 13 8.898 12.682 -8.124 1.00 0.00 C ATOM 176 O ILE A 13 9.545 13.341 -7.301 1.00 0.00 O ATOM 177 CB ILE A 13 6.424 13.156 -7.916 1.00 0.00 C ATOM 178 CG1 ILE A 13 6.511 14.193 -6.787 1.00 0.00 C ATOM 179 CG2 ILE A 13 5.053 12.478 -7.950 1.00 0.00 C ATOM 180 CD1 ILE A 13 5.381 15.179 -6.763 1.00 0.00 C ATOM 0 H ILE A 13 7.910 12.137 -5.756 1.00 0.00 H new ATOM 0 HA ILE A 13 7.329 11.317 -8.499 1.00 0.00 H new ATOM 0 HB ILE A 13 6.555 13.683 -8.861 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.541 13.670 -5.831 1.00 0.00 H new ATOM 0 HG13 ILE A 13 7.450 14.738 -6.882 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.275 13.235 -8.047 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.005 11.797 -8.800 1.00 0.00 H new ATOM 0 HG23 ILE A 13 4.901 11.918 -7.027 1.00 0.00 H new ATOM 0 HD11 ILE A 13 5.522 15.874 -5.935 1.00 0.00 H new ATOM 0 HD12 ILE A 13 5.361 15.732 -7.702 1.00 0.00 H new ATOM 0 HD13 ILE A 13 4.438 14.648 -6.635 1.00 0.00 H new ATOM 192 N TYR A 14 9.326 12.362 -9.301 1.00 0.00 N ATOM 193 CA TYR A 14 10.551 12.817 -9.871 1.00 0.00 C ATOM 194 C TYR A 14 10.340 14.196 -10.393 1.00 0.00 C ATOM 195 O TYR A 14 9.456 14.421 -11.205 1.00 0.00 O ATOM 196 CB TYR A 14 10.969 11.868 -11.019 1.00 0.00 C ATOM 197 CG TYR A 14 12.009 12.425 -11.989 1.00 0.00 C ATOM 198 CD1 TYR A 14 13.363 12.395 -11.696 1.00 0.00 C ATOM 199 CD2 TYR A 14 11.614 12.974 -13.216 1.00 0.00 C ATOM 200 CE1 TYR A 14 14.293 12.894 -12.592 1.00 0.00 C ATOM 201 CE2 TYR A 14 12.531 13.474 -14.110 1.00 0.00 C ATOM 202 CZ TYR A 14 13.870 13.432 -13.795 1.00 0.00 C ATOM 203 OH TYR A 14 14.801 13.918 -14.690 1.00 0.00 O ATOM 0 H TYR A 14 8.804 11.745 -9.922 1.00 0.00 H new ATOM 0 HA TYR A 14 11.342 12.824 -9.121 1.00 0.00 H new ATOM 0 HB2 TYR A 14 11.361 10.949 -10.583 1.00 0.00 H new ATOM 0 HB3 TYR A 14 10.078 11.597 -11.585 1.00 0.00 H new ATOM 0 HD1 TYR A 14 13.697 11.977 -10.758 1.00 0.00 H new ATOM 0 HD2 TYR A 14 10.564 13.005 -13.466 1.00 0.00 H new ATOM 0 HE1 TYR A 14 15.346 12.864 -12.353 1.00 0.00 H new ATOM 0 HE2 TYR A 14 12.204 13.895 -15.049 1.00 0.00 H new ATOM 0 HH TYR A 14 15.521 14.368 -14.201 1.00 0.00 H new ATOM 213 N ILE A 15 11.097 15.102 -9.910 1.00 0.00 N ATOM 214 CA ILE A 15 11.046 16.429 -10.389 1.00 0.00 C ATOM 215 C ILE A 15 12.350 16.644 -11.115 1.00 0.00 C ATOM 216 O ILE A 15 13.422 16.516 -10.520 1.00 0.00 O ATOM 217 CB ILE A 15 10.911 17.454 -9.238 1.00 0.00 C ATOM 218 CG1 ILE A 15 9.883 16.962 -8.205 1.00 0.00 C ATOM 219 CG2 ILE A 15 10.453 18.803 -9.811 1.00 0.00 C ATOM 220 CD1 ILE A 15 9.812 17.805 -6.952 1.00 0.00 C ATOM 0 H ILE A 15 11.776 14.945 -9.165 1.00 0.00 H new ATOM 0 HA ILE A 15 10.177 16.573 -11.031 1.00 0.00 H new ATOM 0 HB ILE A 15 11.878 17.568 -8.748 1.00 0.00 H new ATOM 0 HG12 ILE A 15 8.898 16.940 -8.671 1.00 0.00 H new ATOM 0 HG13 ILE A 15 10.127 15.937 -7.926 1.00 0.00 H new ATOM 0 HG21 ILE A 15 10.357 19.528 -9.003 1.00 0.00 H new ATOM 0 HG22 ILE A 15 11.188 19.160 -10.533 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.489 18.680 -10.305 1.00 0.00 H new ATOM 0 HD11 ILE A 15 9.064 17.390 -6.276 1.00 0.00 H new ATOM 0 HD12 ILE A 15 10.784 17.807 -6.459 1.00 0.00 H new ATOM 0 HD13 ILE A 15 9.537 18.826 -7.216 1.00 0.00 H new ATOM 232 N GLY A 16 12.276 16.900 -12.374 1.00 0.00 N ATOM 233 CA GLY A 16 13.464 17.058 -13.148 1.00 0.00 C ATOM 234 C GLY A 16 13.471 18.343 -13.900 1.00 0.00 C ATOM 235 O GLY A 16 12.429 19.003 -14.007 1.00 0.00 O ATOM 0 H GLY A 16 11.405 17.005 -12.894 1.00 0.00 H new ATOM 0 HA2 GLY A 16 14.333 17.017 -12.491 1.00 0.00 H new ATOM 0 HA3 GLY A 16 13.554 16.227 -13.848 1.00 0.00 H new ATOM 239 N ASN A 17 14.645 18.696 -14.400 1.00 0.00 N ATOM 240 CA ASN A 17 14.889 19.904 -15.203 1.00 0.00 C ATOM 241 C ASN A 17 14.713 21.159 -14.349 1.00 0.00 C ATOM 242 O ASN A 17 14.157 22.168 -14.790 1.00 0.00 O ATOM 243 CB ASN A 17 13.974 19.966 -16.450 1.00 0.00 C ATOM 244 CG ASN A 17 14.496 20.941 -17.505 1.00 0.00 C ATOM 245 OD1 ASN A 17 15.712 21.085 -17.690 1.00 0.00 O ATOM 246 ND2 ASN A 17 13.609 21.655 -18.150 1.00 0.00 N ATOM 0 H ASN A 17 15.487 18.138 -14.259 1.00 0.00 H new ATOM 0 HA ASN A 17 15.919 19.857 -15.556 1.00 0.00 H new ATOM 0 HB2 ASN A 17 13.892 18.971 -16.887 1.00 0.00 H new ATOM 0 HB3 ASN A 17 12.971 20.265 -16.147 1.00 0.00 H new ATOM 0 HD21 ASN A 17 13.912 22.354 -18.828 1.00 0.00 H new ATOM 0 HD22 ASN A 17 12.614 21.512 -17.975 1.00 0.00 H new ATOM 253 N LEU A 18 15.199 21.103 -13.125 1.00 0.00 N ATOM 254 CA LEU A 18 15.142 22.261 -12.265 1.00 0.00 C ATOM 255 C LEU A 18 16.295 23.172 -12.574 1.00 0.00 C ATOM 256 O LEU A 18 17.225 22.811 -13.315 1.00 0.00 O ATOM 257 CB LEU A 18 15.150 21.933 -10.754 1.00 0.00 C ATOM 258 CG LEU A 18 13.923 21.238 -10.159 1.00 0.00 C ATOM 259 CD1 LEU A 18 13.847 19.798 -10.582 1.00 0.00 C ATOM 260 CD2 LEU A 18 13.932 21.352 -8.652 1.00 0.00 C ATOM 0 H LEU A 18 15.632 20.278 -12.710 1.00 0.00 H new ATOM 0 HA LEU A 18 14.185 22.741 -12.472 1.00 0.00 H new ATOM 0 HB2 LEU A 18 16.018 21.305 -10.554 1.00 0.00 H new ATOM 0 HB3 LEU A 18 15.300 22.866 -10.211 1.00 0.00 H new ATOM 0 HG LEU A 18 13.035 21.741 -10.542 1.00 0.00 H new ATOM 0 HD11 LEU A 18 12.964 19.335 -10.141 1.00 0.00 H new ATOM 0 HD12 LEU A 18 13.783 19.741 -11.669 1.00 0.00 H new ATOM 0 HD13 LEU A 18 14.739 19.272 -10.243 1.00 0.00 H new ATOM 0 HD21 LEU A 18 13.053 20.853 -8.244 1.00 0.00 H new ATOM 0 HD22 LEU A 18 14.832 20.882 -8.257 1.00 0.00 H new ATOM 0 HD23 LEU A 18 13.917 22.404 -8.367 1.00 0.00 H new ATOM 272 N ASN A 19 16.239 24.340 -12.039 1.00 0.00 N ATOM 273 CA ASN A 19 17.273 25.291 -12.234 1.00 0.00 C ATOM 274 C ASN A 19 18.139 25.255 -10.975 1.00 0.00 C ATOM 275 O ASN A 19 17.612 25.008 -9.890 1.00 0.00 O ATOM 276 CB ASN A 19 16.646 26.665 -12.507 1.00 0.00 C ATOM 277 CG ASN A 19 17.556 27.590 -13.283 1.00 0.00 C ATOM 278 OD1 ASN A 19 18.432 27.143 -14.024 1.00 0.00 O ATOM 279 ND2 ASN A 19 17.306 28.864 -13.198 1.00 0.00 N ATOM 0 H ASN A 19 15.471 24.664 -11.451 1.00 0.00 H new ATOM 0 HA ASN A 19 17.902 25.070 -13.096 1.00 0.00 H new ATOM 0 HB2 ASN A 19 15.717 26.530 -13.061 1.00 0.00 H new ATOM 0 HB3 ASN A 19 16.386 27.134 -11.558 1.00 0.00 H new ATOM 0 HD21 ASN A 19 17.843 29.528 -13.756 1.00 0.00 H new ATOM 0 HD22 ASN A 19 16.573 29.199 -12.573 1.00 0.00 H new ATOM 286 N ARG A 20 19.429 25.479 -11.127 1.00 0.00 N ATOM 287 CA ARG A 20 20.453 25.305 -10.066 1.00 0.00 C ATOM 288 C ARG A 20 20.082 26.020 -8.741 1.00 0.00 C ATOM 289 O ARG A 20 20.305 25.490 -7.657 1.00 0.00 O ATOM 290 CB ARG A 20 21.776 25.866 -10.583 1.00 0.00 C ATOM 291 CG ARG A 20 23.040 25.412 -9.863 1.00 0.00 C ATOM 292 CD ARG A 20 23.416 23.986 -10.228 1.00 0.00 C ATOM 293 NE ARG A 20 24.830 23.696 -9.923 1.00 0.00 N ATOM 294 CZ ARG A 20 25.391 22.477 -9.888 1.00 0.00 C ATOM 295 NH1 ARG A 20 24.639 21.384 -9.930 1.00 0.00 N1+ ATOM 296 NH2 ARG A 20 26.701 22.357 -9.773 1.00 0.00 N ATOM 0 H ARG A 20 19.825 25.797 -12.011 1.00 0.00 H new ATOM 0 HA ARG A 20 20.524 24.241 -9.842 1.00 0.00 H new ATOM 0 HB2 ARG A 20 21.870 25.600 -11.636 1.00 0.00 H new ATOM 0 HB3 ARG A 20 21.727 26.954 -10.532 1.00 0.00 H new ATOM 0 HG2 ARG A 20 23.863 26.081 -10.116 1.00 0.00 H new ATOM 0 HG3 ARG A 20 22.890 25.484 -8.786 1.00 0.00 H new ATOM 0 HD2 ARG A 20 22.777 23.291 -9.683 1.00 0.00 H new ATOM 0 HD3 ARG A 20 23.232 23.822 -11.290 1.00 0.00 H new ATOM 0 HE ARG A 20 25.435 24.492 -9.721 1.00 0.00 H new ATOM 0 HH11 ARG A 20 23.624 21.465 -9.990 1.00 0.00 H new ATOM 0 HH12 ARG A 20 25.076 20.463 -9.903 1.00 0.00 H new ATOM 0 HH21 ARG A 20 27.286 23.190 -9.711 1.00 0.00 H new ATOM 0 HH22 ARG A 20 27.128 21.431 -9.746 1.00 0.00 H new ATOM 310 N GLU A 21 19.519 27.202 -8.850 1.00 0.00 N ATOM 311 CA GLU A 21 19.166 28.016 -7.695 1.00 0.00 C ATOM 312 C GLU A 21 17.840 27.614 -7.016 1.00 0.00 C ATOM 313 O GLU A 21 17.470 28.191 -5.982 1.00 0.00 O ATOM 314 CB GLU A 21 19.175 29.522 -8.031 1.00 0.00 C ATOM 315 CG GLU A 21 18.468 29.904 -9.311 1.00 0.00 C ATOM 316 CD GLU A 21 19.330 29.778 -10.554 1.00 0.00 C ATOM 317 OE1 GLU A 21 19.513 28.661 -11.053 1.00 0.00 O1- ATOM 318 OE2 GLU A 21 19.836 30.816 -11.049 1.00 0.00 O ATOM 0 H GLU A 21 19.289 27.634 -9.745 1.00 0.00 H new ATOM 0 HA GLU A 21 19.949 27.815 -6.964 1.00 0.00 H new ATOM 0 HB2 GLU A 21 18.714 30.064 -7.205 1.00 0.00 H new ATOM 0 HB3 GLU A 21 20.210 29.857 -8.094 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.586 29.275 -9.428 1.00 0.00 H new ATOM 0 HG3 GLU A 21 18.117 30.933 -9.227 1.00 0.00 H new ATOM 325 N LEU A 22 17.122 26.669 -7.585 1.00 0.00 N ATOM 326 CA LEU A 22 15.909 26.175 -6.967 1.00 0.00 C ATOM 327 C LEU A 22 16.240 25.220 -5.830 1.00 0.00 C ATOM 328 O LEU A 22 16.881 24.192 -6.020 1.00 0.00 O ATOM 329 CB LEU A 22 14.965 25.517 -7.989 1.00 0.00 C ATOM 330 CG LEU A 22 14.360 26.452 -9.046 1.00 0.00 C ATOM 331 CD1 LEU A 22 13.482 25.702 -10.000 1.00 0.00 C ATOM 332 CD2 LEU A 22 13.550 27.535 -8.390 1.00 0.00 C ATOM 0 H LEU A 22 17.357 26.227 -8.474 1.00 0.00 H new ATOM 0 HA LEU A 22 15.378 27.033 -6.554 1.00 0.00 H new ATOM 0 HB2 LEU A 22 15.512 24.726 -8.503 1.00 0.00 H new ATOM 0 HB3 LEU A 22 14.150 25.039 -7.446 1.00 0.00 H new ATOM 0 HG LEU A 22 15.189 26.893 -9.599 1.00 0.00 H new ATOM 0 HD11 LEU A 22 13.070 26.393 -10.735 1.00 0.00 H new ATOM 0 HD12 LEU A 22 14.068 24.937 -10.510 1.00 0.00 H new ATOM 0 HD13 LEU A 22 12.668 25.229 -9.450 1.00 0.00 H new ATOM 0 HD21 LEU A 22 13.129 28.188 -9.154 1.00 0.00 H new ATOM 0 HD22 LEU A 22 12.743 27.086 -7.812 1.00 0.00 H new ATOM 0 HD23 LEU A 22 14.190 28.118 -7.728 1.00 0.00 H new ATOM 344 N THR A 23 15.804 25.589 -4.672 1.00 0.00 N ATOM 345 CA THR A 23 16.035 24.859 -3.457 1.00 0.00 C ATOM 346 C THR A 23 14.729 24.223 -2.985 1.00 0.00 C ATOM 347 O THR A 23 13.647 24.563 -3.498 1.00 0.00 O ATOM 348 CB THR A 23 16.639 25.816 -2.368 1.00 0.00 C ATOM 349 OG1 THR A 23 16.534 25.278 -1.040 1.00 0.00 O ATOM 350 CG2 THR A 23 15.957 27.145 -2.396 1.00 0.00 C ATOM 0 H THR A 23 15.256 26.438 -4.534 1.00 0.00 H new ATOM 0 HA THR A 23 16.754 24.060 -3.635 1.00 0.00 H new ATOM 0 HB THR A 23 17.695 25.925 -2.613 1.00 0.00 H new ATOM 0 HG1 THR A 23 17.046 24.445 -0.983 1.00 0.00 H new ATOM 0 HG21 THR A 23 16.391 27.793 -1.634 1.00 0.00 H new ATOM 0 HG22 THR A 23 16.089 27.601 -3.377 1.00 0.00 H new ATOM 0 HG23 THR A 23 14.894 27.012 -2.197 1.00 0.00 H new ATOM 358 N GLU A 24 14.836 23.347 -1.978 1.00 0.00 N ATOM 359 CA GLU A 24 13.738 22.583 -1.416 1.00 0.00 C ATOM 360 C GLU A 24 12.557 23.488 -1.065 1.00 0.00 C ATOM 361 O GLU A 24 11.403 23.171 -1.348 1.00 0.00 O ATOM 362 CB GLU A 24 14.183 21.869 -0.126 1.00 0.00 C ATOM 363 CG GLU A 24 15.407 20.958 -0.250 1.00 0.00 C ATOM 364 CD GLU A 24 16.754 21.693 -0.209 1.00 0.00 C ATOM 365 OE1 GLU A 24 16.790 22.917 0.097 1.00 0.00 O1- ATOM 366 OE2 GLU A 24 17.790 21.069 -0.484 1.00 0.00 O ATOM 0 H GLU A 24 15.727 23.151 -1.522 1.00 0.00 H new ATOM 0 HA GLU A 24 13.435 21.857 -2.170 1.00 0.00 H new ATOM 0 HB2 GLU A 24 14.393 22.625 0.630 1.00 0.00 H new ATOM 0 HB3 GLU A 24 13.348 21.274 0.242 1.00 0.00 H new ATOM 0 HG2 GLU A 24 15.382 20.226 0.557 1.00 0.00 H new ATOM 0 HG3 GLU A 24 15.338 20.404 -1.186 1.00 0.00 H new ATOM 373 N GLY A 25 12.879 24.642 -0.497 1.00 0.00 N ATOM 374 CA GLY A 25 11.874 25.573 -0.039 1.00 0.00 C ATOM 375 C GLY A 25 11.052 26.165 -1.155 1.00 0.00 C ATOM 376 O GLY A 25 9.862 26.411 -0.983 1.00 0.00 O ATOM 0 H GLY A 25 13.839 24.952 -0.344 1.00 0.00 H new ATOM 0 HA2 GLY A 25 11.210 25.065 0.660 1.00 0.00 H new ATOM 0 HA3 GLY A 25 12.360 26.379 0.511 1.00 0.00 H new ATOM 380 N ASP A 26 11.661 26.338 -2.305 1.00 0.00 N ATOM 381 CA ASP A 26 10.996 26.982 -3.436 1.00 0.00 C ATOM 382 C ASP A 26 10.102 25.961 -4.118 1.00 0.00 C ATOM 383 O ASP A 26 8.993 26.262 -4.593 1.00 0.00 O ATOM 384 CB ASP A 26 12.035 27.510 -4.410 1.00 0.00 C ATOM 385 CG ASP A 26 11.539 28.693 -5.186 1.00 0.00 C ATOM 386 OD1 ASP A 26 11.182 29.714 -4.553 1.00 0.00 O1- ATOM 387 OD2 ASP A 26 11.571 28.666 -6.406 1.00 0.00 O ATOM 0 H ASP A 26 12.620 26.044 -2.492 1.00 0.00 H new ATOM 0 HA ASP A 26 10.393 27.821 -3.089 1.00 0.00 H new ATOM 0 HB2 ASP A 26 12.935 27.789 -3.862 1.00 0.00 H new ATOM 0 HB3 ASP A 26 12.317 26.717 -5.102 1.00 0.00 H new ATOM 392 N ILE A 27 10.578 24.731 -4.105 1.00 0.00 N ATOM 393 CA ILE A 27 9.841 23.590 -4.615 1.00 0.00 C ATOM 394 C ILE A 27 8.565 23.429 -3.796 1.00 0.00 C ATOM 395 O ILE A 27 7.480 23.227 -4.333 1.00 0.00 O ATOM 396 CB ILE A 27 10.709 22.315 -4.509 1.00 0.00 C ATOM 397 CG1 ILE A 27 11.999 22.522 -5.301 1.00 0.00 C ATOM 398 CG2 ILE A 27 9.954 21.091 -5.022 1.00 0.00 C ATOM 399 CD1 ILE A 27 13.029 21.448 -5.098 1.00 0.00 C ATOM 0 H ILE A 27 11.498 24.493 -3.736 1.00 0.00 H new ATOM 0 HA ILE A 27 9.586 23.748 -5.663 1.00 0.00 H new ATOM 0 HB ILE A 27 10.949 22.135 -3.461 1.00 0.00 H new ATOM 0 HG12 ILE A 27 11.755 22.579 -6.362 1.00 0.00 H new ATOM 0 HG13 ILE A 27 12.433 23.482 -5.022 1.00 0.00 H new ATOM 0 HG21 ILE A 27 10.589 20.209 -4.935 1.00 0.00 H new ATOM 0 HG22 ILE A 27 9.050 20.947 -4.430 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.683 21.242 -6.067 1.00 0.00 H new ATOM 0 HD11 ILE A 27 13.912 21.673 -5.696 1.00 0.00 H new ATOM 0 HD12 ILE A 27 13.306 21.404 -4.045 1.00 0.00 H new ATOM 0 HD13 ILE A 27 12.618 20.487 -5.406 1.00 0.00 H new ATOM 411 N LEU A 28 8.703 23.579 -2.489 1.00 0.00 N ATOM 412 CA LEU A 28 7.565 23.534 -1.592 1.00 0.00 C ATOM 413 C LEU A 28 6.583 24.629 -1.937 1.00 0.00 C ATOM 414 O LEU A 28 5.387 24.398 -1.944 1.00 0.00 O ATOM 415 CB LEU A 28 8.001 23.700 -0.153 1.00 0.00 C ATOM 416 CG LEU A 28 8.885 22.617 0.417 1.00 0.00 C ATOM 417 CD1 LEU A 28 9.334 23.005 1.802 1.00 0.00 C ATOM 418 CD2 LEU A 28 8.136 21.301 0.457 1.00 0.00 C ATOM 0 H LEU A 28 9.598 23.734 -2.025 1.00 0.00 H new ATOM 0 HA LEU A 28 7.089 22.560 -1.709 1.00 0.00 H new ATOM 0 HB2 LEU A 28 8.527 24.650 -0.064 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.107 23.771 0.467 1.00 0.00 H new ATOM 0 HG LEU A 28 9.762 22.498 -0.220 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.972 22.221 2.211 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.893 23.940 1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.463 23.135 2.444 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.783 20.527 0.870 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.250 21.406 1.083 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.836 21.022 -0.553 1.00 0.00 H new ATOM 430 N THR A 29 7.105 25.813 -2.236 1.00 0.00 N ATOM 431 CA THR A 29 6.303 26.959 -2.611 1.00 0.00 C ATOM 432 C THR A 29 5.348 26.615 -3.771 1.00 0.00 C ATOM 433 O THR A 29 4.151 26.971 -3.727 1.00 0.00 O ATOM 434 CB THR A 29 7.218 28.144 -3.009 1.00 0.00 C ATOM 435 OG1 THR A 29 8.110 28.431 -1.928 1.00 0.00 O ATOM 436 CG2 THR A 29 6.412 29.397 -3.342 1.00 0.00 C ATOM 0 H THR A 29 8.108 26.001 -2.223 1.00 0.00 H new ATOM 0 HA THR A 29 5.700 27.246 -1.749 1.00 0.00 H new ATOM 0 HB THR A 29 7.774 27.856 -3.901 1.00 0.00 H new ATOM 0 HG1 THR A 29 8.718 27.674 -1.796 1.00 0.00 H new ATOM 0 HG21 THR A 29 7.091 30.204 -3.616 1.00 0.00 H new ATOM 0 HG22 THR A 29 5.742 29.188 -4.176 1.00 0.00 H new ATOM 0 HG23 THR A 29 5.826 29.695 -2.472 1.00 0.00 H new ATOM 444 N VAL A 30 5.851 25.928 -4.794 1.00 0.00 N ATOM 445 CA VAL A 30 4.992 25.546 -5.915 1.00 0.00 C ATOM 446 C VAL A 30 4.130 24.302 -5.648 1.00 0.00 C ATOM 447 O VAL A 30 2.986 24.265 -6.046 1.00 0.00 O ATOM 448 CB VAL A 30 5.717 25.454 -7.301 1.00 0.00 C ATOM 449 CG1 VAL A 30 6.216 26.809 -7.736 1.00 0.00 C ATOM 450 CG2 VAL A 30 6.867 24.466 -7.284 1.00 0.00 C ATOM 0 H VAL A 30 6.823 25.630 -4.872 1.00 0.00 H new ATOM 0 HA VAL A 30 4.310 26.393 -5.992 1.00 0.00 H new ATOM 0 HB VAL A 30 4.978 25.094 -8.017 1.00 0.00 H new ATOM 0 HG11 VAL A 30 6.716 26.720 -8.701 1.00 0.00 H new ATOM 0 HG12 VAL A 30 5.374 27.495 -7.825 1.00 0.00 H new ATOM 0 HG13 VAL A 30 6.920 27.192 -6.997 1.00 0.00 H new ATOM 0 HG21 VAL A 30 7.337 24.438 -8.267 1.00 0.00 H new ATOM 0 HG22 VAL A 30 7.601 24.774 -6.539 1.00 0.00 H new ATOM 0 HG23 VAL A 30 6.491 23.474 -7.034 1.00 0.00 H new ATOM 460 N PHE A 31 4.662 23.317 -4.939 1.00 0.00 N ATOM 461 CA PHE A 31 3.909 22.071 -4.672 1.00 0.00 C ATOM 462 C PHE A 31 2.789 22.243 -3.641 1.00 0.00 C ATOM 463 O PHE A 31 1.763 21.567 -3.709 1.00 0.00 O ATOM 464 CB PHE A 31 4.844 20.895 -4.330 1.00 0.00 C ATOM 465 CG PHE A 31 5.530 20.315 -5.546 1.00 0.00 C ATOM 466 CD1 PHE A 31 6.466 21.049 -6.238 1.00 0.00 C ATOM 467 CD2 PHE A 31 5.214 19.042 -6.010 1.00 0.00 C ATOM 468 CE1 PHE A 31 7.075 20.555 -7.365 1.00 0.00 C ATOM 469 CE2 PHE A 31 5.830 18.544 -7.138 1.00 0.00 C ATOM 470 CZ PHE A 31 6.756 19.302 -7.817 1.00 0.00 C ATOM 0 H PHE A 31 5.599 23.342 -4.537 1.00 0.00 H new ATOM 0 HA PHE A 31 3.406 21.821 -5.606 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.599 21.232 -3.620 1.00 0.00 H new ATOM 0 HB3 PHE A 31 4.269 20.112 -3.836 1.00 0.00 H new ATOM 0 HD1 PHE A 31 6.728 22.036 -5.887 1.00 0.00 H new ATOM 0 HD2 PHE A 31 4.485 18.443 -5.485 1.00 0.00 H new ATOM 0 HE1 PHE A 31 7.803 21.152 -7.893 1.00 0.00 H new ATOM 0 HE2 PHE A 31 5.584 17.553 -7.491 1.00 0.00 H new ATOM 0 HZ PHE A 31 7.230 18.910 -8.704 1.00 0.00 H new ATOM 480 N SER A 32 2.952 23.204 -2.736 1.00 0.00 N ATOM 481 CA SER A 32 1.934 23.485 -1.708 1.00 0.00 C ATOM 482 C SER A 32 0.633 24.049 -2.326 1.00 0.00 C ATOM 483 O SER A 32 -0.363 24.216 -1.647 1.00 0.00 O ATOM 484 CB SER A 32 2.481 24.423 -0.629 1.00 0.00 C ATOM 485 OG SER A 32 3.644 23.882 -0.022 1.00 0.00 O ATOM 0 H SER A 32 3.775 23.805 -2.687 1.00 0.00 H new ATOM 0 HA SER A 32 1.684 22.535 -1.235 1.00 0.00 H new ATOM 0 HB2 SER A 32 2.715 25.392 -1.070 1.00 0.00 H new ATOM 0 HB3 SER A 32 1.717 24.594 0.130 1.00 0.00 H new ATOM 0 HG SER A 32 4.440 24.210 -0.490 1.00 0.00 H new ATOM 491 N GLU A 33 0.691 24.355 -3.610 1.00 0.00 N ATOM 492 CA GLU A 33 -0.435 24.854 -4.402 1.00 0.00 C ATOM 493 C GLU A 33 -1.651 23.926 -4.291 1.00 0.00 C ATOM 494 O GLU A 33 -2.775 24.362 -4.057 1.00 0.00 O ATOM 495 CB GLU A 33 0.032 24.893 -5.866 1.00 0.00 C ATOM 496 CG GLU A 33 -1.011 25.231 -6.916 1.00 0.00 C ATOM 497 CD GLU A 33 -1.520 26.618 -6.789 1.00 0.00 C ATOM 498 OE1 GLU A 33 -0.689 27.537 -6.832 1.00 0.00 O ATOM 499 OE2 GLU A 33 -2.747 26.808 -6.697 1.00 0.00 O1- ATOM 0 H GLU A 33 1.549 24.262 -4.154 1.00 0.00 H new ATOM 0 HA GLU A 33 -0.734 25.838 -4.040 1.00 0.00 H new ATOM 0 HB2 GLU A 33 0.839 25.621 -5.944 1.00 0.00 H new ATOM 0 HB3 GLU A 33 0.456 23.919 -6.112 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.580 25.096 -7.908 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -1.844 24.533 -6.833 1.00 0.00 H new ATOM 506 N TYR A 34 -1.396 22.656 -4.415 1.00 0.00 N ATOM 507 CA TYR A 34 -2.447 21.670 -4.535 1.00 0.00 C ATOM 508 C TYR A 34 -2.248 20.524 -3.571 1.00 0.00 C ATOM 509 O TYR A 34 -2.721 19.410 -3.814 1.00 0.00 O ATOM 510 CB TYR A 34 -2.473 21.157 -5.986 1.00 0.00 C ATOM 511 CG TYR A 34 -1.114 20.717 -6.490 1.00 0.00 C ATOM 512 CD1 TYR A 34 -0.259 21.624 -7.083 1.00 0.00 C ATOM 513 CD2 TYR A 34 -0.677 19.415 -6.343 1.00 0.00 C ATOM 514 CE1 TYR A 34 0.973 21.259 -7.516 1.00 0.00 C ATOM 515 CE2 TYR A 34 0.564 19.043 -6.774 1.00 0.00 C ATOM 516 CZ TYR A 34 1.388 19.975 -7.361 1.00 0.00 C ATOM 517 OH TYR A 34 2.634 19.618 -7.787 1.00 0.00 O ATOM 0 H TYR A 34 -0.453 22.267 -4.437 1.00 0.00 H new ATOM 0 HA TYR A 34 -3.401 22.135 -4.284 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -3.167 20.320 -6.056 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -2.856 21.944 -6.636 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.579 22.648 -7.205 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -1.324 18.683 -5.882 1.00 0.00 H new ATOM 0 HE1 TYR A 34 1.621 21.986 -7.982 1.00 0.00 H new ATOM 0 HE2 TYR A 34 0.897 18.023 -6.655 1.00 0.00 H new ATOM 0 HH TYR A 34 3.230 19.525 -7.014 1.00 0.00 H new ATOM 527 N GLY A 35 -1.573 20.777 -2.492 1.00 0.00 N ATOM 528 CA GLY A 35 -1.369 19.741 -1.544 1.00 0.00 C ATOM 529 C GLY A 35 -0.365 20.114 -0.515 1.00 0.00 C ATOM 530 O GLY A 35 0.124 21.245 -0.491 1.00 0.00 O ATOM 0 H GLY A 35 -1.162 21.680 -2.253 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -2.315 19.504 -1.057 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -1.041 18.838 -2.059 1.00 0.00 H new ATOM 534 N VAL A 36 -0.062 19.172 0.335 1.00 0.00 N ATOM 535 CA VAL A 36 0.887 19.357 1.396 1.00 0.00 C ATOM 536 C VAL A 36 2.022 18.352 1.213 1.00 0.00 C ATOM 537 O VAL A 36 1.807 17.136 1.372 1.00 0.00 O ATOM 538 CB VAL A 36 0.232 19.138 2.790 1.00 0.00 C ATOM 539 CG1 VAL A 36 1.251 19.326 3.897 1.00 0.00 C ATOM 540 CG2 VAL A 36 -0.952 20.080 2.996 1.00 0.00 C ATOM 0 H VAL A 36 -0.475 18.240 0.309 1.00 0.00 H new ATOM 0 HA VAL A 36 1.261 20.380 1.355 1.00 0.00 H new ATOM 0 HB VAL A 36 -0.137 18.113 2.826 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.772 19.168 4.863 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.061 18.607 3.772 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.654 20.338 3.853 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -1.390 19.904 3.979 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -0.611 21.113 2.930 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.702 19.896 2.226 1.00 0.00 H new ATOM 550 N PRO A 37 3.203 18.819 0.797 1.00 0.00 N ATOM 551 CA PRO A 37 4.384 17.968 0.619 1.00 0.00 C ATOM 552 C PRO A 37 4.824 17.320 1.936 1.00 0.00 C ATOM 553 O PRO A 37 5.078 18.003 2.927 1.00 0.00 O ATOM 554 CB PRO A 37 5.457 18.936 0.115 1.00 0.00 C ATOM 555 CG PRO A 37 4.700 20.097 -0.426 1.00 0.00 C ATOM 556 CD PRO A 37 3.488 20.222 0.439 1.00 0.00 C ATOM 0 HA PRO A 37 4.192 17.140 -0.064 1.00 0.00 H new ATOM 0 HB2 PRO A 37 6.125 19.240 0.921 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.076 18.474 -0.654 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.300 21.006 -0.394 1.00 0.00 H new ATOM 0 HG3 PRO A 37 4.424 19.934 -1.468 1.00 0.00 H new ATOM 0 HD2 PRO A 37 3.680 20.834 1.320 1.00 0.00 H new ATOM 0 HD3 PRO A 37 2.655 20.682 -0.093 1.00 0.00 H new ATOM 564 N VAL A 38 4.908 16.008 1.929 1.00 0.00 N ATOM 565 CA VAL A 38 5.260 15.248 3.116 1.00 0.00 C ATOM 566 C VAL A 38 6.759 15.028 3.193 1.00 0.00 C ATOM 567 O VAL A 38 7.374 15.095 4.269 1.00 0.00 O ATOM 568 CB VAL A 38 4.523 13.893 3.126 1.00 0.00 C ATOM 569 CG1 VAL A 38 4.941 13.027 4.302 1.00 0.00 C ATOM 570 CG2 VAL A 38 3.034 14.121 3.154 1.00 0.00 C ATOM 0 H VAL A 38 4.735 15.435 1.103 1.00 0.00 H new ATOM 0 HA VAL A 38 4.952 15.823 3.989 1.00 0.00 H new ATOM 0 HB VAL A 38 4.796 13.360 2.215 1.00 0.00 H new ATOM 0 HG11 VAL A 38 4.398 12.083 4.270 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.012 12.831 4.247 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.714 13.545 5.234 1.00 0.00 H new ATOM 0 HG21 VAL A 38 2.519 13.160 3.161 1.00 0.00 H new ATOM 0 HG22 VAL A 38 2.769 14.682 4.050 1.00 0.00 H new ATOM 0 HG23 VAL A 38 2.736 14.686 2.271 1.00 0.00 H new ATOM 580 N ASP A 39 7.327 14.757 2.064 1.00 0.00 N ATOM 581 CA ASP A 39 8.741 14.547 1.928 1.00 0.00 C ATOM 582 C ASP A 39 9.186 15.227 0.682 1.00 0.00 C ATOM 583 O ASP A 39 8.474 15.205 -0.313 1.00 0.00 O ATOM 584 CB ASP A 39 9.112 13.038 1.858 1.00 0.00 C ATOM 585 CG ASP A 39 9.124 12.325 3.193 1.00 0.00 C ATOM 586 OD1 ASP A 39 10.147 12.357 3.879 1.00 0.00 O1- ATOM 587 OD2 ASP A 39 8.118 11.680 3.559 1.00 0.00 O ATOM 0 H ASP A 39 6.814 14.672 1.187 1.00 0.00 H new ATOM 0 HA ASP A 39 9.240 14.956 2.807 1.00 0.00 H new ATOM 0 HB2 ASP A 39 8.404 12.534 1.199 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.097 12.941 1.401 1.00 0.00 H new ATOM 592 N VAL A 40 10.296 15.880 0.742 1.00 0.00 N ATOM 593 CA VAL A 40 10.893 16.482 -0.410 1.00 0.00 C ATOM 594 C VAL A 40 12.372 16.421 -0.222 1.00 0.00 C ATOM 595 O VAL A 40 12.865 16.595 0.888 1.00 0.00 O ATOM 596 CB VAL A 40 10.424 17.964 -0.699 1.00 0.00 C ATOM 597 CG1 VAL A 40 10.789 18.916 0.424 1.00 0.00 C ATOM 598 CG2 VAL A 40 10.987 18.477 -2.021 1.00 0.00 C ATOM 0 H VAL A 40 10.825 16.015 1.603 1.00 0.00 H new ATOM 0 HA VAL A 40 10.568 15.924 -1.288 1.00 0.00 H new ATOM 0 HB VAL A 40 9.337 17.932 -0.767 1.00 0.00 H new ATOM 0 HG11 VAL A 40 10.445 19.920 0.176 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.314 18.587 1.348 1.00 0.00 H new ATOM 0 HG13 VAL A 40 11.871 18.926 0.556 1.00 0.00 H new ATOM 0 HG21 VAL A 40 10.646 19.498 -2.190 1.00 0.00 H new ATOM 0 HG22 VAL A 40 12.076 18.460 -1.984 1.00 0.00 H new ATOM 0 HG23 VAL A 40 10.642 17.840 -2.835 1.00 0.00 H new ATOM 608 N ILE A 41 13.049 16.092 -1.260 1.00 0.00 N ATOM 609 CA ILE A 41 14.474 15.991 -1.254 1.00 0.00 C ATOM 610 C ILE A 41 15.017 16.487 -2.565 1.00 0.00 C ATOM 611 O ILE A 41 14.619 16.010 -3.640 1.00 0.00 O ATOM 612 CB ILE A 41 15.028 14.538 -0.939 1.00 0.00 C ATOM 613 CG1 ILE A 41 14.377 13.414 -1.797 1.00 0.00 C ATOM 614 CG2 ILE A 41 14.916 14.210 0.542 1.00 0.00 C ATOM 615 CD1 ILE A 41 12.949 13.020 -1.398 1.00 0.00 C ATOM 0 H ILE A 41 12.624 15.879 -2.162 1.00 0.00 H new ATOM 0 HA ILE A 41 14.822 16.616 -0.432 1.00 0.00 H new ATOM 0 HB ILE A 41 16.081 14.565 -1.219 1.00 0.00 H new ATOM 0 HG12 ILE A 41 14.369 13.735 -2.839 1.00 0.00 H new ATOM 0 HG13 ILE A 41 15.008 12.527 -1.742 1.00 0.00 H new ATOM 0 HG21 ILE A 41 15.304 13.208 0.723 1.00 0.00 H new ATOM 0 HG22 ILE A 41 15.493 14.932 1.119 1.00 0.00 H new ATOM 0 HG23 ILE A 41 13.870 14.255 0.846 1.00 0.00 H new ATOM 0 HD11 ILE A 41 12.591 12.230 -2.059 1.00 0.00 H new ATOM 0 HD12 ILE A 41 12.945 12.661 -0.369 1.00 0.00 H new ATOM 0 HD13 ILE A 41 12.295 13.888 -1.483 1.00 0.00 H new ATOM 627 N LEU A 42 15.867 17.459 -2.496 1.00 0.00 N ATOM 628 CA LEU A 42 16.476 18.004 -3.667 1.00 0.00 C ATOM 629 C LEU A 42 17.751 17.215 -3.862 1.00 0.00 C ATOM 630 O LEU A 42 18.511 17.021 -2.910 1.00 0.00 O ATOM 631 CB LEU A 42 16.709 19.539 -3.462 1.00 0.00 C ATOM 632 CG LEU A 42 17.168 20.419 -4.664 1.00 0.00 C ATOM 633 CD1 LEU A 42 18.603 20.224 -5.009 1.00 0.00 C ATOM 634 CD2 LEU A 42 16.326 20.167 -5.875 1.00 0.00 C ATOM 0 H LEU A 42 16.160 17.899 -1.624 1.00 0.00 H new ATOM 0 HA LEU A 42 15.860 17.920 -4.562 1.00 0.00 H new ATOM 0 HB2 LEU A 42 15.778 19.962 -3.086 1.00 0.00 H new ATOM 0 HB3 LEU A 42 17.452 19.653 -2.673 1.00 0.00 H new ATOM 0 HG LEU A 42 17.040 21.452 -4.341 1.00 0.00 H new ATOM 0 HD11 LEU A 42 18.864 20.863 -5.853 1.00 0.00 H new ATOM 0 HD12 LEU A 42 19.222 20.485 -4.151 1.00 0.00 H new ATOM 0 HD13 LEU A 42 18.774 19.181 -5.276 1.00 0.00 H new ATOM 0 HD21 LEU A 42 16.671 20.796 -6.696 1.00 0.00 H new ATOM 0 HD22 LEU A 42 16.407 19.119 -6.162 1.00 0.00 H new ATOM 0 HD23 LEU A 42 15.286 20.403 -5.650 1.00 0.00 H new ATOM 646 N SER A 43 17.959 16.708 -5.052 1.00 0.00 N ATOM 647 CA SER A 43 19.101 15.888 -5.313 1.00 0.00 C ATOM 648 C SER A 43 20.334 16.779 -5.373 1.00 0.00 C ATOM 649 O SER A 43 20.589 17.476 -6.366 1.00 0.00 O ATOM 650 CB SER A 43 18.901 15.072 -6.608 1.00 0.00 C ATOM 651 OG SER A 43 19.877 14.050 -6.757 1.00 0.00 O ATOM 0 H SER A 43 17.346 16.853 -5.854 1.00 0.00 H new ATOM 0 HA SER A 43 19.237 15.162 -4.511 1.00 0.00 H new ATOM 0 HB2 SER A 43 17.907 14.624 -6.603 1.00 0.00 H new ATOM 0 HB3 SER A 43 18.945 15.741 -7.467 1.00 0.00 H new ATOM 0 HG SER A 43 20.428 14.236 -7.546 1.00 0.00 H new ATOM 657 N ARG A 44 21.017 16.832 -4.271 1.00 0.00 N ATOM 658 CA ARG A 44 22.208 17.605 -4.123 1.00 0.00 C ATOM 659 C ARG A 44 23.344 16.638 -3.998 1.00 0.00 C ATOM 660 O ARG A 44 23.167 15.559 -3.427 1.00 0.00 O ATOM 661 CB ARG A 44 22.118 18.463 -2.853 1.00 0.00 C ATOM 662 CG ARG A 44 20.849 19.279 -2.781 1.00 0.00 C ATOM 663 CD ARG A 44 20.671 20.056 -1.486 1.00 0.00 C ATOM 664 NE ARG A 44 21.542 21.227 -1.402 1.00 0.00 N ATOM 665 CZ ARG A 44 21.119 22.465 -1.153 1.00 0.00 C ATOM 666 NH1 ARG A 44 19.851 22.714 -0.889 1.00 0.00 N1+ ATOM 667 NH2 ARG A 44 21.977 23.465 -1.130 1.00 0.00 N ATOM 0 H ARG A 44 20.752 16.324 -3.427 1.00 0.00 H new ATOM 0 HA ARG A 44 22.350 18.269 -4.976 1.00 0.00 H new ATOM 0 HB2 ARG A 44 22.177 17.815 -1.978 1.00 0.00 H new ATOM 0 HB3 ARG A 44 22.977 19.133 -2.812 1.00 0.00 H new ATOM 0 HG2 ARG A 44 20.835 19.980 -3.615 1.00 0.00 H new ATOM 0 HG3 ARG A 44 19.996 18.613 -2.910 1.00 0.00 H new ATOM 0 HD2 ARG A 44 19.632 20.375 -1.399 1.00 0.00 H new ATOM 0 HD3 ARG A 44 20.874 19.397 -0.642 1.00 0.00 H new ATOM 0 HE ARG A 44 22.542 21.086 -1.544 1.00 0.00 H new ATOM 0 HH11 ARG A 44 19.174 21.951 -0.873 1.00 0.00 H new ATOM 0 HH12 ARG A 44 19.547 23.669 -0.701 1.00 0.00 H new ATOM 0 HH21 ARG A 44 22.967 23.292 -1.303 1.00 0.00 H new ATOM 0 HH22 ARG A 44 21.651 24.412 -0.939 1.00 0.00 H new ATOM 681 N ASP A 45 24.472 16.976 -4.565 1.00 0.00 N ATOM 682 CA ASP A 45 25.649 16.122 -4.470 1.00 0.00 C ATOM 683 C ASP A 45 26.070 15.995 -3.020 1.00 0.00 C ATOM 684 O ASP A 45 26.143 16.995 -2.304 1.00 0.00 O ATOM 685 CB ASP A 45 26.803 16.673 -5.282 1.00 0.00 C ATOM 686 CG ASP A 45 27.992 15.747 -5.287 1.00 0.00 C ATOM 687 OD1 ASP A 45 28.827 15.813 -4.353 1.00 0.00 O1- ATOM 688 OD2 ASP A 45 28.113 14.930 -6.229 1.00 0.00 O ATOM 0 H ASP A 45 24.611 17.834 -5.099 1.00 0.00 H new ATOM 0 HA ASP A 45 25.387 15.143 -4.872 1.00 0.00 H new ATOM 0 HB2 ASP A 45 26.474 16.844 -6.307 1.00 0.00 H new ATOM 0 HB3 ASP A 45 27.100 17.640 -4.877 1.00 0.00 H new ATOM 693 N GLU A 46 26.368 14.790 -2.618 1.00 0.00 N ATOM 694 CA GLU A 46 26.687 14.460 -1.249 1.00 0.00 C ATOM 695 C GLU A 46 27.952 15.155 -0.751 1.00 0.00 C ATOM 696 O GLU A 46 28.035 15.554 0.411 1.00 0.00 O ATOM 697 CB GLU A 46 26.822 12.942 -1.113 1.00 0.00 C ATOM 698 CG GLU A 46 27.061 12.439 0.300 1.00 0.00 C ATOM 699 CD GLU A 46 27.209 10.939 0.346 1.00 0.00 C ATOM 700 OE1 GLU A 46 26.218 10.225 0.120 1.00 0.00 O1- ATOM 701 OE2 GLU A 46 28.335 10.442 0.564 1.00 0.00 O ATOM 0 H GLU A 46 26.397 13.987 -3.247 1.00 0.00 H new ATOM 0 HA GLU A 46 25.871 14.822 -0.624 1.00 0.00 H new ATOM 0 HB2 GLU A 46 25.915 12.476 -1.499 1.00 0.00 H new ATOM 0 HB3 GLU A 46 27.645 12.608 -1.745 1.00 0.00 H new ATOM 0 HG2 GLU A 46 27.960 12.905 0.704 1.00 0.00 H new ATOM 0 HG3 GLU A 46 26.231 12.742 0.938 1.00 0.00 H new ATOM 708 N ASN A 47 28.904 15.343 -1.625 1.00 0.00 N ATOM 709 CA ASN A 47 30.203 15.847 -1.203 1.00 0.00 C ATOM 710 C ASN A 47 30.325 17.331 -1.376 1.00 0.00 C ATOM 711 O ASN A 47 30.754 18.038 -0.461 1.00 0.00 O ATOM 712 CB ASN A 47 31.343 15.152 -1.950 1.00 0.00 C ATOM 713 CG ASN A 47 31.634 13.718 -1.502 1.00 0.00 C ATOM 714 OD1 ASN A 47 32.773 13.251 -1.604 1.00 0.00 O ATOM 715 ND2 ASN A 47 30.643 13.012 -1.010 1.00 0.00 N ATOM 0 H ASN A 47 28.817 15.160 -2.625 1.00 0.00 H new ATOM 0 HA ASN A 47 30.281 15.621 -0.139 1.00 0.00 H new ATOM 0 HB2 ASN A 47 31.107 15.143 -3.014 1.00 0.00 H new ATOM 0 HB3 ASN A 47 32.250 15.745 -1.830 1.00 0.00 H new ATOM 0 HD21 ASN A 47 30.804 12.053 -0.701 1.00 0.00 H new ATOM 0 HD22 ASN A 47 29.712 13.422 -0.937 1.00 0.00 H new ATOM 722 N THR A 48 29.938 17.820 -2.522 1.00 0.00 N ATOM 723 CA THR A 48 30.144 19.220 -2.822 1.00 0.00 C ATOM 724 C THR A 48 28.884 20.053 -2.590 1.00 0.00 C ATOM 725 O THR A 48 28.937 21.288 -2.614 1.00 0.00 O ATOM 726 CB THR A 48 30.709 19.420 -4.262 1.00 0.00 C ATOM 727 OG1 THR A 48 30.925 20.805 -4.562 1.00 0.00 O ATOM 728 CG2 THR A 48 29.802 18.812 -5.297 1.00 0.00 C ATOM 0 H THR A 48 29.483 17.282 -3.259 1.00 0.00 H new ATOM 0 HA THR A 48 30.895 19.586 -2.122 1.00 0.00 H new ATOM 0 HB THR A 48 31.671 18.908 -4.293 1.00 0.00 H new ATOM 0 HG1 THR A 48 30.404 21.359 -3.944 1.00 0.00 H new ATOM 0 HG21 THR A 48 30.225 18.969 -6.289 1.00 0.00 H new ATOM 0 HG22 THR A 48 29.702 17.743 -5.110 1.00 0.00 H new ATOM 0 HG23 THR A 48 28.821 19.283 -5.242 1.00 0.00 H new ATOM 736 N GLY A 49 27.772 19.376 -2.351 1.00 0.00 N ATOM 737 CA GLY A 49 26.518 20.042 -2.081 1.00 0.00 C ATOM 738 C GLY A 49 26.026 20.879 -3.235 1.00 0.00 C ATOM 739 O GLY A 49 25.593 22.014 -3.049 1.00 0.00 O ATOM 0 H GLY A 49 27.718 18.357 -2.340 1.00 0.00 H new ATOM 0 HA2 GLY A 49 25.763 19.295 -1.836 1.00 0.00 H new ATOM 0 HA3 GLY A 49 26.634 20.678 -1.203 1.00 0.00 H new ATOM 743 N GLU A 50 26.114 20.352 -4.418 1.00 0.00 N ATOM 744 CA GLU A 50 25.652 21.070 -5.571 1.00 0.00 C ATOM 745 C GLU A 50 24.271 20.570 -5.993 1.00 0.00 C ATOM 746 O GLU A 50 24.003 19.363 -5.946 1.00 0.00 O ATOM 747 CB GLU A 50 26.702 21.023 -6.696 1.00 0.00 C ATOM 748 CG GLU A 50 27.069 19.632 -7.198 1.00 0.00 C ATOM 749 CD GLU A 50 26.605 19.374 -8.600 1.00 0.00 C ATOM 750 OE1 GLU A 50 27.345 19.727 -9.543 1.00 0.00 O ATOM 751 OE2 GLU A 50 25.504 18.861 -8.808 1.00 0.00 O1- ATOM 0 H GLU A 50 26.501 19.428 -4.612 1.00 0.00 H new ATOM 0 HA GLU A 50 25.529 22.124 -5.321 1.00 0.00 H new ATOM 0 HB2 GLU A 50 26.332 21.607 -7.538 1.00 0.00 H new ATOM 0 HB3 GLU A 50 27.609 21.513 -6.342 1.00 0.00 H new ATOM 0 HG2 GLU A 50 28.151 19.508 -7.151 1.00 0.00 H new ATOM 0 HG3 GLU A 50 26.634 18.885 -6.534 1.00 0.00 H new ATOM 758 N SER A 51 23.392 21.494 -6.322 1.00 0.00 N ATOM 759 CA SER A 51 22.027 21.185 -6.713 1.00 0.00 C ATOM 760 C SER A 51 21.973 20.651 -8.144 1.00 0.00 C ATOM 761 O SER A 51 22.090 21.401 -9.109 1.00 0.00 O ATOM 762 CB SER A 51 21.182 22.442 -6.556 1.00 0.00 C ATOM 763 OG SER A 51 21.262 22.899 -5.216 1.00 0.00 O ATOM 0 H SER A 51 23.605 22.492 -6.326 1.00 0.00 H new ATOM 0 HA SER A 51 21.629 20.400 -6.070 1.00 0.00 H new ATOM 0 HB2 SER A 51 21.533 23.217 -7.238 1.00 0.00 H new ATOM 0 HB3 SER A 51 20.145 22.232 -6.819 1.00 0.00 H new ATOM 0 HG SER A 51 20.720 23.709 -5.114 1.00 0.00 H new ATOM 769 N GLN A 52 21.781 19.353 -8.262 1.00 0.00 N ATOM 770 CA GLN A 52 21.806 18.632 -9.548 1.00 0.00 C ATOM 771 C GLN A 52 20.674 19.046 -10.493 1.00 0.00 C ATOM 772 O GLN A 52 20.722 18.763 -11.691 1.00 0.00 O ATOM 773 CB GLN A 52 21.732 17.131 -9.296 1.00 0.00 C ATOM 774 CG GLN A 52 22.908 16.569 -8.516 1.00 0.00 C ATOM 775 CD GLN A 52 22.659 15.152 -8.047 1.00 0.00 C ATOM 776 OE1 GLN A 52 21.923 14.387 -8.674 1.00 0.00 O ATOM 777 NE2 GLN A 52 23.243 14.790 -6.941 1.00 0.00 N ATOM 0 H GLN A 52 21.599 18.747 -7.462 1.00 0.00 H new ATOM 0 HA GLN A 52 22.743 18.895 -10.038 1.00 0.00 H new ATOM 0 HB2 GLN A 52 20.813 16.910 -8.754 1.00 0.00 H new ATOM 0 HB3 GLN A 52 21.668 16.616 -10.255 1.00 0.00 H new ATOM 0 HG2 GLN A 52 23.800 16.591 -9.142 1.00 0.00 H new ATOM 0 HG3 GLN A 52 23.107 17.205 -7.654 1.00 0.00 H new ATOM 0 HE21 GLN A 52 23.847 15.446 -6.445 1.00 0.00 H new ATOM 0 HE22 GLN A 52 23.097 13.851 -6.571 1.00 0.00 H new ATOM 786 N GLY A 53 19.666 19.701 -9.964 1.00 0.00 N ATOM 787 CA GLY A 53 18.545 20.107 -10.788 1.00 0.00 C ATOM 788 C GLY A 53 17.521 19.003 -10.917 1.00 0.00 C ATOM 789 O GLY A 53 16.740 18.964 -11.873 1.00 0.00 O ATOM 0 H GLY A 53 19.596 19.962 -8.981 1.00 0.00 H new ATOM 0 HA2 GLY A 53 18.076 20.991 -10.355 1.00 0.00 H new ATOM 0 HA3 GLY A 53 18.904 20.389 -11.778 1.00 0.00 H new ATOM 793 N PHE A 54 17.543 18.104 -9.963 1.00 0.00 N ATOM 794 CA PHE A 54 16.599 17.014 -9.876 1.00 0.00 C ATOM 795 C PHE A 54 16.137 16.955 -8.449 1.00 0.00 C ATOM 796 O PHE A 54 16.895 17.321 -7.547 1.00 0.00 O ATOM 797 CB PHE A 54 17.248 15.660 -10.230 1.00 0.00 C ATOM 798 CG PHE A 54 17.863 15.580 -11.594 1.00 0.00 C ATOM 799 CD1 PHE A 54 17.071 15.473 -12.719 1.00 0.00 C ATOM 800 CD2 PHE A 54 19.237 15.605 -11.748 1.00 0.00 C ATOM 801 CE1 PHE A 54 17.636 15.395 -13.975 1.00 0.00 C ATOM 802 CE2 PHE A 54 19.809 15.524 -12.997 1.00 0.00 C ATOM 803 CZ PHE A 54 19.006 15.418 -14.113 1.00 0.00 C ATOM 0 H PHE A 54 18.231 18.109 -9.210 1.00 0.00 H new ATOM 0 HA PHE A 54 15.784 17.187 -10.579 1.00 0.00 H new ATOM 0 HB2 PHE A 54 18.017 15.440 -9.490 1.00 0.00 H new ATOM 0 HB3 PHE A 54 16.491 14.880 -10.145 1.00 0.00 H new ATOM 0 HD1 PHE A 54 15.996 15.450 -12.615 1.00 0.00 H new ATOM 0 HD2 PHE A 54 19.869 15.689 -10.877 1.00 0.00 H new ATOM 0 HE1 PHE A 54 17.005 15.316 -14.848 1.00 0.00 H new ATOM 0 HE2 PHE A 54 20.884 15.543 -13.103 1.00 0.00 H new ATOM 0 HZ PHE A 54 19.451 15.353 -15.095 1.00 0.00 H new ATOM 813 N ALA A 55 14.938 16.533 -8.232 1.00 0.00 N ATOM 814 CA ALA A 55 14.402 16.415 -6.905 1.00 0.00 C ATOM 815 C ALA A 55 13.394 15.300 -6.863 1.00 0.00 C ATOM 816 O ALA A 55 12.971 14.799 -7.907 1.00 0.00 O ATOM 817 CB ALA A 55 13.746 17.723 -6.469 1.00 0.00 C ATOM 0 H ALA A 55 14.292 16.256 -8.971 1.00 0.00 H new ATOM 0 HA ALA A 55 15.219 16.193 -6.219 1.00 0.00 H new ATOM 0 HB1 ALA A 55 13.347 17.611 -5.461 1.00 0.00 H new ATOM 0 HB2 ALA A 55 14.487 18.523 -6.479 1.00 0.00 H new ATOM 0 HB3 ALA A 55 12.936 17.970 -7.155 1.00 0.00 H new ATOM 823 N TYR A 56 13.042 14.898 -5.683 1.00 0.00 N ATOM 824 CA TYR A 56 12.010 13.924 -5.474 1.00 0.00 C ATOM 825 C TYR A 56 11.104 14.496 -4.404 1.00 0.00 C ATOM 826 O TYR A 56 11.586 15.163 -3.483 1.00 0.00 O ATOM 827 CB TYR A 56 12.569 12.578 -4.972 1.00 0.00 C ATOM 828 CG TYR A 56 13.687 11.951 -5.788 1.00 0.00 C ATOM 829 CD1 TYR A 56 13.433 11.312 -6.994 1.00 0.00 C ATOM 830 CD2 TYR A 56 14.998 11.977 -5.324 1.00 0.00 C ATOM 831 CE1 TYR A 56 14.458 10.719 -7.715 1.00 0.00 C ATOM 832 CE2 TYR A 56 16.021 11.385 -6.030 1.00 0.00 C ATOM 833 CZ TYR A 56 15.751 10.758 -7.223 1.00 0.00 C ATOM 834 OH TYR A 56 16.778 10.157 -7.921 1.00 0.00 O ATOM 0 H TYR A 56 13.468 15.241 -4.822 1.00 0.00 H new ATOM 0 HA TYR A 56 11.496 13.729 -6.415 1.00 0.00 H new ATOM 0 HB2 TYR A 56 12.931 12.719 -3.954 1.00 0.00 H new ATOM 0 HB3 TYR A 56 11.745 11.866 -4.922 1.00 0.00 H new ATOM 0 HD1 TYR A 56 12.423 11.276 -7.376 1.00 0.00 H new ATOM 0 HD2 TYR A 56 15.218 12.472 -4.390 1.00 0.00 H new ATOM 0 HE1 TYR A 56 14.249 10.230 -8.655 1.00 0.00 H new ATOM 0 HE2 TYR A 56 17.031 11.413 -5.648 1.00 0.00 H new ATOM 0 HH TYR A 56 17.620 10.280 -7.435 1.00 0.00 H new ATOM 844 N LEU A 57 9.837 14.291 -4.521 1.00 0.00 N ATOM 845 CA LEU A 57 8.911 14.767 -3.521 1.00 0.00 C ATOM 846 C LEU A 57 7.868 13.689 -3.300 1.00 0.00 C ATOM 847 O LEU A 57 7.703 12.834 -4.141 1.00 0.00 O ATOM 848 CB LEU A 57 8.322 16.136 -3.967 1.00 0.00 C ATOM 849 CG LEU A 57 7.493 16.945 -2.948 1.00 0.00 C ATOM 850 CD1 LEU A 57 7.559 18.413 -3.298 1.00 0.00 C ATOM 851 CD2 LEU A 57 6.040 16.512 -2.951 1.00 0.00 C ATOM 0 H LEU A 57 9.405 13.795 -5.300 1.00 0.00 H new ATOM 0 HA LEU A 57 9.399 14.951 -2.564 1.00 0.00 H new ATOM 0 HB2 LEU A 57 9.151 16.764 -4.293 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.694 15.959 -4.840 1.00 0.00 H new ATOM 0 HG LEU A 57 7.911 16.766 -1.957 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.973 18.985 -2.578 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.596 18.747 -3.270 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.155 18.567 -4.299 1.00 0.00 H new ATOM 0 HD21 LEU A 57 5.483 17.101 -2.222 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.616 16.667 -3.943 1.00 0.00 H new ATOM 0 HD23 LEU A 57 5.975 15.456 -2.690 1.00 0.00 H new ATOM 863 N LYS A 58 7.228 13.690 -2.166 1.00 0.00 N ATOM 864 CA LYS A 58 6.263 12.674 -1.843 1.00 0.00 C ATOM 865 C LYS A 58 5.091 13.294 -1.109 1.00 0.00 C ATOM 866 O LYS A 58 5.285 14.037 -0.129 1.00 0.00 O ATOM 867 CB LYS A 58 6.901 11.690 -0.881 1.00 0.00 C ATOM 868 CG LYS A 58 6.150 10.388 -0.671 1.00 0.00 C ATOM 869 CD LYS A 58 6.526 9.770 0.668 1.00 0.00 C ATOM 870 CE LYS A 58 5.728 10.409 1.803 1.00 0.00 C ATOM 871 NZ LYS A 58 6.165 9.947 3.136 1.00 0.00 N1+ ATOM 0 H LYS A 58 7.359 14.393 -1.439 1.00 0.00 H new ATOM 0 HA LYS A 58 5.935 12.193 -2.764 1.00 0.00 H new ATOM 0 HB2 LYS A 58 7.902 11.455 -1.242 1.00 0.00 H new ATOM 0 HB3 LYS A 58 7.018 12.180 0.086 1.00 0.00 H new ATOM 0 HG2 LYS A 58 5.076 10.570 -0.706 1.00 0.00 H new ATOM 0 HG3 LYS A 58 6.382 9.693 -1.478 1.00 0.00 H new ATOM 0 HD2 LYS A 58 6.337 8.697 0.644 1.00 0.00 H new ATOM 0 HD3 LYS A 58 7.593 9.902 0.848 1.00 0.00 H new ATOM 0 HE2 LYS A 58 5.829 11.493 1.747 1.00 0.00 H new ATOM 0 HE3 LYS A 58 4.670 10.180 1.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 5.447 10.201 3.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 6.288 8.914 3.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 7.069 10.400 3.381 1.00 0.00 H new ATOM 885 N TYR A 59 3.914 13.057 -1.597 1.00 0.00 N ATOM 886 CA TYR A 59 2.713 13.361 -0.849 1.00 0.00 C ATOM 887 C TYR A 59 2.312 12.129 -0.037 1.00 0.00 C ATOM 888 O TYR A 59 2.900 11.059 -0.205 1.00 0.00 O ATOM 889 CB TYR A 59 1.578 13.780 -1.778 1.00 0.00 C ATOM 890 CG TYR A 59 1.837 15.083 -2.476 1.00 0.00 C ATOM 891 CD1 TYR A 59 1.570 16.284 -1.839 1.00 0.00 C ATOM 892 CD2 TYR A 59 2.364 15.122 -3.757 1.00 0.00 C ATOM 893 CE1 TYR A 59 1.811 17.483 -2.457 1.00 0.00 C ATOM 894 CE2 TYR A 59 2.613 16.321 -4.379 1.00 0.00 C ATOM 895 CZ TYR A 59 2.334 17.496 -3.721 1.00 0.00 C ATOM 896 OH TYR A 59 2.584 18.684 -4.326 1.00 0.00 O ATOM 0 H TYR A 59 3.748 12.650 -2.518 1.00 0.00 H new ATOM 0 HA TYR A 59 2.912 14.197 -0.178 1.00 0.00 H new ATOM 0 HB2 TYR A 59 1.421 13.001 -2.524 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.656 13.861 -1.202 1.00 0.00 H new ATOM 0 HD1 TYR A 59 1.165 16.275 -0.838 1.00 0.00 H new ATOM 0 HD2 TYR A 59 2.582 14.198 -4.273 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.590 18.411 -1.950 1.00 0.00 H new ATOM 0 HE2 TYR A 59 3.025 16.341 -5.377 1.00 0.00 H new ATOM 0 HH TYR A 59 1.959 18.810 -5.070 1.00 0.00 H new ATOM 906 N GLU A 60 1.356 12.283 0.855 1.00 0.00 N ATOM 907 CA GLU A 60 0.875 11.164 1.653 1.00 0.00 C ATOM 908 C GLU A 60 -0.171 10.417 0.842 1.00 0.00 C ATOM 909 O GLU A 60 -0.369 9.205 0.985 1.00 0.00 O ATOM 910 CB GLU A 60 0.234 11.669 2.962 1.00 0.00 C ATOM 911 CG GLU A 60 -0.122 10.566 3.938 1.00 0.00 C ATOM 912 CD GLU A 60 -0.873 11.058 5.145 1.00 0.00 C ATOM 913 OE1 GLU A 60 -0.241 11.484 6.137 1.00 0.00 O1- ATOM 914 OE2 GLU A 60 -2.117 10.999 5.138 1.00 0.00 O ATOM 0 H GLU A 60 0.893 13.171 1.049 1.00 0.00 H new ATOM 0 HA GLU A 60 1.711 10.511 1.905 1.00 0.00 H new ATOM 0 HB2 GLU A 60 0.921 12.362 3.447 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.668 12.231 2.720 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.725 9.817 3.425 1.00 0.00 H new ATOM 0 HG3 GLU A 60 0.792 10.071 4.265 1.00 0.00 H new ATOM 921 N ASP A 61 -0.825 11.154 -0.013 1.00 0.00 N ATOM 922 CA ASP A 61 -1.894 10.635 -0.821 1.00 0.00 C ATOM 923 C ASP A 61 -1.440 10.535 -2.268 1.00 0.00 C ATOM 924 O ASP A 61 -1.027 11.540 -2.873 1.00 0.00 O ATOM 925 CB ASP A 61 -3.113 11.544 -0.709 1.00 0.00 C ATOM 926 CG ASP A 61 -4.342 10.963 -1.353 1.00 0.00 C ATOM 927 OD1 ASP A 61 -4.438 10.949 -2.583 1.00 0.00 O ATOM 928 OD2 ASP A 61 -5.264 10.557 -0.628 1.00 0.00 O1- ATOM 0 H ASP A 61 -0.629 12.143 -0.170 1.00 0.00 H new ATOM 0 HA ASP A 61 -2.165 9.640 -0.468 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -3.319 11.738 0.344 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -2.887 12.504 -1.172 1.00 0.00 H new ATOM 933 N GLN A 62 -1.547 9.344 -2.817 1.00 0.00 N ATOM 934 CA GLN A 62 -1.098 9.026 -4.173 1.00 0.00 C ATOM 935 C GLN A 62 -1.853 9.847 -5.253 1.00 0.00 C ATOM 936 O GLN A 62 -1.348 10.048 -6.350 1.00 0.00 O ATOM 937 CB GLN A 62 -1.270 7.514 -4.425 1.00 0.00 C ATOM 938 CG GLN A 62 -0.772 6.997 -5.781 1.00 0.00 C ATOM 939 CD GLN A 62 0.721 6.926 -5.865 1.00 0.00 C ATOM 940 OE1 GLN A 62 1.380 6.739 -4.870 1.00 0.00 O ATOM 941 NE2 GLN A 62 1.253 6.999 -7.053 1.00 0.00 N ATOM 0 H GLN A 62 -1.956 8.547 -2.330 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.046 9.298 -4.252 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -0.746 6.973 -3.637 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -2.328 7.268 -4.331 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -1.189 6.006 -5.961 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -1.145 7.648 -6.572 1.00 0.00 H new ATOM 0 HE21 GLN A 62 0.661 7.158 -7.868 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.261 6.897 -7.167 1.00 0.00 H new ATOM 950 N ARG A 63 -3.032 10.361 -4.936 1.00 0.00 N ATOM 951 CA ARG A 63 -3.802 11.127 -5.922 1.00 0.00 C ATOM 952 C ARG A 63 -3.206 12.517 -6.104 1.00 0.00 C ATOM 953 O ARG A 63 -3.290 13.097 -7.183 1.00 0.00 O ATOM 954 CB ARG A 63 -5.264 11.241 -5.515 1.00 0.00 C ATOM 955 CG ARG A 63 -6.005 9.923 -5.420 1.00 0.00 C ATOM 956 CD ARG A 63 -7.325 10.127 -4.708 1.00 0.00 C ATOM 957 NE ARG A 63 -7.102 10.608 -3.335 1.00 0.00 N ATOM 958 CZ ARG A 63 -7.980 11.270 -2.583 1.00 0.00 C ATOM 959 NH1 ARG A 63 -9.170 11.592 -3.062 1.00 0.00 N1+ ATOM 960 NH2 ARG A 63 -7.657 11.610 -1.344 1.00 0.00 N ATOM 0 H ARG A 63 -3.476 10.268 -4.022 1.00 0.00 H new ATOM 0 HA ARG A 63 -3.751 10.590 -6.869 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.319 11.742 -4.549 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.778 11.879 -6.235 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.178 9.520 -6.418 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.400 9.193 -4.882 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.934 10.846 -5.257 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.881 9.190 -4.685 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.190 10.417 -2.921 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.423 11.333 -4.016 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.835 12.099 -2.478 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -6.740 11.365 -0.970 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.325 12.117 -0.764 1.00 0.00 H new ATOM 974 N SER A 64 -2.538 13.007 -5.073 1.00 0.00 N ATOM 975 CA SER A 64 -1.938 14.327 -5.119 1.00 0.00 C ATOM 976 C SER A 64 -0.629 14.177 -5.870 1.00 0.00 C ATOM 977 O SER A 64 -0.196 15.058 -6.611 1.00 0.00 O ATOM 978 CB SER A 64 -1.730 14.878 -3.688 1.00 0.00 C ATOM 979 OG SER A 64 -1.226 16.208 -3.692 1.00 0.00 O ATOM 0 H SER A 64 -2.398 12.509 -4.194 1.00 0.00 H new ATOM 0 HA SER A 64 -2.581 15.046 -5.627 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.677 14.852 -3.149 1.00 0.00 H new ATOM 0 HB3 SER A 64 -1.038 14.231 -3.148 1.00 0.00 H new ATOM 0 HG SER A 64 -0.391 16.243 -3.180 1.00 0.00 H new ATOM 985 N THR A 65 -0.051 13.011 -5.693 1.00 0.00 N ATOM 986 CA THR A 65 1.101 12.552 -6.392 1.00 0.00 C ATOM 987 C THR A 65 0.813 12.558 -7.925 1.00 0.00 C ATOM 988 O THR A 65 1.563 13.150 -8.705 1.00 0.00 O ATOM 989 CB THR A 65 1.393 11.134 -5.848 1.00 0.00 C ATOM 990 OG1 THR A 65 1.937 11.208 -4.519 1.00 0.00 O ATOM 991 CG2 THR A 65 2.251 10.290 -6.743 1.00 0.00 C ATOM 0 H THR A 65 -0.400 12.330 -5.019 1.00 0.00 H new ATOM 0 HA THR A 65 1.971 13.190 -6.241 1.00 0.00 H new ATOM 0 HB THR A 65 0.431 10.622 -5.817 1.00 0.00 H new ATOM 0 HG1 THR A 65 2.857 10.871 -4.523 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.405 9.313 -6.284 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.758 10.164 -7.707 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.215 10.778 -6.889 1.00 0.00 H new ATOM 999 N ILE A 66 -0.314 11.956 -8.318 1.00 0.00 N ATOM 1000 CA ILE A 66 -0.752 11.922 -9.725 1.00 0.00 C ATOM 1001 C ILE A 66 -0.995 13.351 -10.241 1.00 0.00 C ATOM 1002 O ILE A 66 -0.482 13.750 -11.310 1.00 0.00 O ATOM 1003 CB ILE A 66 -2.065 11.096 -9.868 1.00 0.00 C ATOM 1004 CG1 ILE A 66 -1.840 9.650 -9.400 1.00 0.00 C ATOM 1005 CG2 ILE A 66 -2.571 11.119 -11.311 1.00 0.00 C ATOM 1006 CD1 ILE A 66 -3.099 8.819 -9.326 1.00 0.00 C ATOM 0 H ILE A 66 -0.948 11.480 -7.677 1.00 0.00 H new ATOM 0 HA ILE A 66 0.034 11.451 -10.314 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.826 11.553 -9.236 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.138 9.166 -10.079 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.371 9.667 -8.416 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.489 10.535 -11.384 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.771 12.148 -11.610 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.815 10.690 -11.969 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -2.851 7.813 -8.988 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.796 9.277 -8.624 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.559 8.767 -10.313 1.00 0.00 H new ATOM 1018 N LEU A 67 -1.747 14.115 -9.439 1.00 0.00 N ATOM 1019 CA LEU A 67 -2.087 15.494 -9.738 1.00 0.00 C ATOM 1020 C LEU A 67 -0.826 16.297 -10.031 1.00 0.00 C ATOM 1021 O LEU A 67 -0.762 17.005 -11.020 1.00 0.00 O ATOM 1022 CB LEU A 67 -2.856 16.109 -8.551 1.00 0.00 C ATOM 1023 CG LEU A 67 -3.321 17.564 -8.694 1.00 0.00 C ATOM 1024 CD1 LEU A 67 -4.285 17.719 -9.853 1.00 0.00 C ATOM 1025 CD2 LEU A 67 -3.970 18.034 -7.407 1.00 0.00 C ATOM 0 H LEU A 67 -2.136 13.781 -8.557 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.723 15.521 -10.623 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -3.734 15.491 -8.361 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -2.222 16.043 -7.667 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.446 18.181 -8.898 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.597 18.760 -9.930 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.793 17.419 -10.778 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -5.159 17.089 -9.686 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.296 19.068 -7.520 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -4.831 17.405 -7.183 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.250 17.968 -6.591 1.00 0.00 H new ATOM 1037 N ALA A 68 0.176 16.125 -9.180 1.00 0.00 N ATOM 1038 CA ALA A 68 1.459 16.796 -9.305 1.00 0.00 C ATOM 1039 C ALA A 68 2.115 16.507 -10.634 1.00 0.00 C ATOM 1040 O ALA A 68 2.590 17.425 -11.319 1.00 0.00 O ATOM 1041 CB ALA A 68 2.386 16.352 -8.193 1.00 0.00 C ATOM 0 H ALA A 68 0.118 15.506 -8.372 1.00 0.00 H new ATOM 0 HA ALA A 68 1.273 17.868 -9.237 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.345 16.860 -8.294 1.00 0.00 H new ATOM 0 HB2 ALA A 68 1.943 16.602 -7.229 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.538 15.274 -8.254 1.00 0.00 H new ATOM 1047 N VAL A 69 2.116 15.232 -10.991 1.00 0.00 N ATOM 1048 CA VAL A 69 2.741 14.740 -12.202 1.00 0.00 C ATOM 1049 C VAL A 69 2.222 15.432 -13.444 1.00 0.00 C ATOM 1050 O VAL A 69 3.007 15.857 -14.294 1.00 0.00 O ATOM 1051 CB VAL A 69 2.607 13.192 -12.330 1.00 0.00 C ATOM 1052 CG1 VAL A 69 3.137 12.684 -13.668 1.00 0.00 C ATOM 1053 CG2 VAL A 69 3.361 12.524 -11.203 1.00 0.00 C ATOM 0 H VAL A 69 1.674 14.500 -10.435 1.00 0.00 H new ATOM 0 HA VAL A 69 3.801 14.982 -12.120 1.00 0.00 H new ATOM 0 HB VAL A 69 1.547 12.944 -12.274 1.00 0.00 H new ATOM 0 HG11 VAL A 69 3.025 11.601 -13.716 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.574 13.144 -14.480 1.00 0.00 H new ATOM 0 HG13 VAL A 69 4.191 12.944 -13.764 1.00 0.00 H new ATOM 0 HG21 VAL A 69 3.267 11.442 -11.293 1.00 0.00 H new ATOM 0 HG22 VAL A 69 4.414 12.802 -11.254 1.00 0.00 H new ATOM 0 HG23 VAL A 69 2.947 12.846 -10.247 1.00 0.00 H new ATOM 1063 N ASP A 70 0.930 15.582 -13.560 1.00 0.00 N ATOM 1064 CA ASP A 70 0.419 16.194 -14.780 1.00 0.00 C ATOM 1065 C ASP A 70 0.017 17.666 -14.666 1.00 0.00 C ATOM 1066 O ASP A 70 -0.289 18.294 -15.688 1.00 0.00 O ATOM 1067 CB ASP A 70 -0.674 15.359 -15.478 1.00 0.00 C ATOM 1068 CG ASP A 70 -1.938 15.154 -14.680 1.00 0.00 C ATOM 1069 OD1 ASP A 70 -2.754 16.088 -14.571 1.00 0.00 O ATOM 1070 OD2 ASP A 70 -2.178 14.028 -14.224 1.00 0.00 O1- ATOM 0 H ASP A 70 0.232 15.308 -12.868 1.00 0.00 H new ATOM 0 HA ASP A 70 1.295 16.193 -15.428 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.933 15.844 -16.419 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.259 14.382 -15.727 1.00 0.00 H new ATOM 1075 N ASN A 71 0.048 18.258 -13.478 1.00 0.00 N ATOM 1076 CA ASN A 71 -0.384 19.660 -13.398 1.00 0.00 C ATOM 1077 C ASN A 71 0.766 20.661 -13.454 1.00 0.00 C ATOM 1078 O ASN A 71 0.672 21.659 -14.166 1.00 0.00 O ATOM 1079 CB ASN A 71 -1.354 19.977 -12.228 1.00 0.00 C ATOM 1080 CG ASN A 71 -0.710 20.201 -10.864 1.00 0.00 C ATOM 1081 OD1 ASN A 71 0.314 19.625 -10.517 1.00 0.00 O ATOM 1082 ND2 ASN A 71 -1.310 21.067 -10.088 1.00 0.00 N ATOM 0 H ASN A 71 0.347 17.828 -12.603 1.00 0.00 H new ATOM 0 HA ASN A 71 -0.966 19.789 -14.310 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -1.925 20.868 -12.488 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -2.066 19.156 -12.141 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -0.926 21.278 -9.167 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -2.161 21.531 -10.404 1.00 0.00 H new ATOM 1089 N LEU A 72 1.846 20.421 -12.725 1.00 0.00 N ATOM 1090 CA LEU A 72 2.967 21.364 -12.745 1.00 0.00 C ATOM 1091 C LEU A 72 3.969 21.051 -13.819 1.00 0.00 C ATOM 1092 O LEU A 72 4.872 21.842 -14.073 1.00 0.00 O ATOM 1093 CB LEU A 72 3.667 21.520 -11.389 1.00 0.00 C ATOM 1094 CG LEU A 72 2.940 22.323 -10.308 1.00 0.00 C ATOM 1095 CD1 LEU A 72 3.839 22.465 -9.090 1.00 0.00 C ATOM 1096 CD2 LEU A 72 2.534 23.702 -10.823 1.00 0.00 C ATOM 0 H LEU A 72 1.975 19.606 -12.126 1.00 0.00 H new ATOM 0 HA LEU A 72 2.508 22.325 -12.979 1.00 0.00 H new ATOM 0 HB2 LEU A 72 3.861 20.523 -10.994 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.636 21.989 -11.562 1.00 0.00 H new ATOM 0 HG LEU A 72 2.031 21.788 -10.033 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.321 23.037 -8.320 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.086 21.476 -8.703 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.755 22.984 -9.372 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.020 24.249 -10.033 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.424 24.254 -11.126 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.868 23.589 -11.679 1.00 0.00 H new ATOM 1108 N ASN A 73 3.818 19.907 -14.448 1.00 0.00 N ATOM 1109 CA ASN A 73 4.702 19.510 -15.538 1.00 0.00 C ATOM 1110 C ASN A 73 4.594 20.521 -16.660 1.00 0.00 C ATOM 1111 O ASN A 73 3.527 20.702 -17.239 1.00 0.00 O ATOM 1112 CB ASN A 73 4.334 18.119 -16.051 1.00 0.00 C ATOM 1113 CG ASN A 73 5.179 17.656 -17.236 1.00 0.00 C ATOM 1114 OD1 ASN A 73 6.364 18.002 -17.368 1.00 0.00 O ATOM 1115 ND2 ASN A 73 4.590 16.863 -18.083 1.00 0.00 N ATOM 0 H ASN A 73 3.090 19.228 -14.227 1.00 0.00 H new ATOM 0 HA ASN A 73 5.728 19.477 -15.170 1.00 0.00 H new ATOM 0 HB2 ASN A 73 4.442 17.402 -15.237 1.00 0.00 H new ATOM 0 HB3 ASN A 73 3.284 18.115 -16.342 1.00 0.00 H new ATOM 0 HD21 ASN A 73 5.104 16.504 -18.888 1.00 0.00 H new ATOM 0 HD22 ASN A 73 3.615 16.600 -17.942 1.00 0.00 H new ATOM 1122 N GLY A 74 5.662 21.217 -16.912 1.00 0.00 N ATOM 1123 CA GLY A 74 5.645 22.205 -17.939 1.00 0.00 C ATOM 1124 C GLY A 74 5.560 23.616 -17.394 1.00 0.00 C ATOM 1125 O GLY A 74 5.477 24.562 -18.161 1.00 0.00 O ATOM 0 H GLY A 74 6.550 21.117 -16.421 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.546 22.108 -18.545 1.00 0.00 H new ATOM 0 HA3 GLY A 74 4.796 22.023 -18.598 1.00 0.00 H new ATOM 1129 N PHE A 75 5.554 23.772 -16.073 1.00 0.00 N ATOM 1130 CA PHE A 75 5.544 25.113 -15.491 1.00 0.00 C ATOM 1131 C PHE A 75 6.956 25.698 -15.592 1.00 0.00 C ATOM 1132 O PHE A 75 7.940 25.061 -15.180 1.00 0.00 O ATOM 1133 CB PHE A 75 4.998 25.114 -14.040 1.00 0.00 C ATOM 1134 CG PHE A 75 4.868 26.482 -13.403 1.00 0.00 C ATOM 1135 CD1 PHE A 75 3.782 27.301 -13.695 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.817 26.943 -12.506 1.00 0.00 C ATOM 1137 CE1 PHE A 75 3.657 28.547 -13.102 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.693 28.187 -11.915 1.00 0.00 C ATOM 1139 CZ PHE A 75 4.615 28.986 -12.215 1.00 0.00 C ATOM 0 H PHE A 75 5.556 23.007 -15.398 1.00 0.00 H new ATOM 0 HA PHE A 75 4.859 25.749 -16.052 1.00 0.00 H new ATOM 0 HB2 PHE A 75 4.019 24.634 -14.036 1.00 0.00 H new ATOM 0 HB3 PHE A 75 5.655 24.503 -13.421 1.00 0.00 H new ATOM 0 HD1 PHE A 75 3.029 26.962 -14.391 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.667 26.322 -12.264 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.809 29.174 -13.335 1.00 0.00 H new ATOM 0 HE2 PHE A 75 6.443 28.531 -11.218 1.00 0.00 H new ATOM 0 HZ PHE A 75 4.519 29.958 -11.755 1.00 0.00 H new ATOM 1149 N LYS A 76 7.042 26.871 -16.173 1.00 0.00 N ATOM 1150 CA LYS A 76 8.305 27.510 -16.495 1.00 0.00 C ATOM 1151 C LYS A 76 8.899 28.206 -15.266 1.00 0.00 C ATOM 1152 O LYS A 76 8.253 29.072 -14.667 1.00 0.00 O ATOM 1153 CB LYS A 76 8.056 28.540 -17.612 1.00 0.00 C ATOM 1154 CG LYS A 76 9.296 29.030 -18.351 1.00 0.00 C ATOM 1155 CD LYS A 76 9.938 27.919 -19.187 1.00 0.00 C ATOM 1156 CE LYS A 76 9.019 27.397 -20.301 1.00 0.00 C ATOM 1157 NZ LYS A 76 8.689 28.433 -21.299 1.00 0.00 N1+ ATOM 0 H LYS A 76 6.226 27.421 -16.441 1.00 0.00 H new ATOM 0 HA LYS A 76 9.018 26.754 -16.825 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.373 28.101 -18.339 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.550 29.403 -17.179 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.026 29.863 -19.000 1.00 0.00 H new ATOM 0 HG3 LYS A 76 10.022 29.408 -17.631 1.00 0.00 H new ATOM 0 HD2 LYS A 76 10.861 28.293 -19.631 1.00 0.00 H new ATOM 0 HD3 LYS A 76 10.212 27.092 -18.532 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.502 26.557 -20.801 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.098 27.018 -19.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.138 28.008 -22.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 8.130 29.184 -20.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 9.567 28.838 -21.682 1.00 0.00 H new ATOM 1171 N ILE A 77 10.102 27.804 -14.881 1.00 0.00 N ATOM 1172 CA ILE A 77 10.817 28.425 -13.781 1.00 0.00 C ATOM 1173 C ILE A 77 12.286 28.609 -14.174 1.00 0.00 C ATOM 1174 O ILE A 77 13.029 27.636 -14.314 1.00 0.00 O ATOM 1175 CB ILE A 77 10.762 27.595 -12.458 1.00 0.00 C ATOM 1176 CG1 ILE A 77 9.320 27.224 -12.095 1.00 0.00 C ATOM 1177 CG2 ILE A 77 11.393 28.407 -11.313 1.00 0.00 C ATOM 1178 CD1 ILE A 77 9.197 26.348 -10.867 1.00 0.00 C ATOM 0 H ILE A 77 10.608 27.037 -15.324 1.00 0.00 H new ATOM 0 HA ILE A 77 10.326 29.379 -13.590 1.00 0.00 H new ATOM 0 HB ILE A 77 11.322 26.672 -12.610 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.751 28.139 -11.934 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.864 26.710 -12.942 1.00 0.00 H new ATOM 0 HG21 ILE A 77 11.354 27.827 -10.391 1.00 0.00 H new ATOM 0 HG22 ILE A 77 12.431 28.632 -11.556 1.00 0.00 H new ATOM 0 HG23 ILE A 77 10.841 29.338 -11.180 1.00 0.00 H new ATOM 0 HD11 ILE A 77 8.146 26.131 -10.679 1.00 0.00 H new ATOM 0 HD12 ILE A 77 9.736 25.415 -11.030 1.00 0.00 H new ATOM 0 HD13 ILE A 77 9.621 26.866 -10.007 1.00 0.00 H new ATOM 1190 N GLY A 78 12.680 29.841 -14.371 1.00 0.00 N ATOM 1191 CA GLY A 78 14.041 30.166 -14.710 1.00 0.00 C ATOM 1192 C GLY A 78 14.364 29.759 -16.115 1.00 0.00 C ATOM 1193 O GLY A 78 15.402 29.146 -16.379 1.00 0.00 O ATOM 0 H GLY A 78 12.063 30.650 -14.300 1.00 0.00 H new ATOM 0 HA2 GLY A 78 14.201 31.238 -14.594 1.00 0.00 H new ATOM 0 HA3 GLY A 78 14.720 29.666 -14.019 1.00 0.00 H new ATOM 1197 N GLY A 79 13.438 30.045 -17.011 1.00 0.00 N ATOM 1198 CA GLY A 79 13.637 29.771 -18.423 1.00 0.00 C ATOM 1199 C GLY A 79 13.373 28.325 -18.811 1.00 0.00 C ATOM 1200 O GLY A 79 13.216 28.021 -19.987 1.00 0.00 O ATOM 0 H GLY A 79 12.538 30.468 -16.786 1.00 0.00 H new ATOM 0 HA2 GLY A 79 12.982 30.419 -19.005 1.00 0.00 H new ATOM 0 HA3 GLY A 79 14.661 30.028 -18.693 1.00 0.00 H new ATOM 1204 N ARG A 80 13.298 27.449 -17.838 1.00 0.00 N ATOM 1205 CA ARG A 80 13.097 26.038 -18.098 1.00 0.00 C ATOM 1206 C ARG A 80 11.855 25.539 -17.391 1.00 0.00 C ATOM 1207 O ARG A 80 11.531 25.995 -16.302 1.00 0.00 O ATOM 1208 CB ARG A 80 14.328 25.230 -17.665 1.00 0.00 C ATOM 1209 CG ARG A 80 14.716 25.417 -16.203 1.00 0.00 C ATOM 1210 CD ARG A 80 15.966 24.641 -15.856 1.00 0.00 C ATOM 1211 NE ARG A 80 17.126 25.071 -16.640 1.00 0.00 N ATOM 1212 CZ ARG A 80 18.342 24.526 -16.568 1.00 0.00 C ATOM 1213 NH1 ARG A 80 18.618 23.593 -15.649 1.00 0.00 N1+ ATOM 1214 NH2 ARG A 80 19.295 24.945 -17.392 1.00 0.00 N ATOM 0 H ARG A 80 13.374 27.688 -16.849 1.00 0.00 H new ATOM 0 HA ARG A 80 12.958 25.902 -19.171 1.00 0.00 H new ATOM 0 HB2 ARG A 80 14.136 24.172 -17.846 1.00 0.00 H new ATOM 0 HB3 ARG A 80 15.173 25.513 -18.293 1.00 0.00 H new ATOM 0 HG2 ARG A 80 14.877 26.476 -16.001 1.00 0.00 H new ATOM 0 HG3 ARG A 80 13.896 25.091 -15.564 1.00 0.00 H new ATOM 0 HD2 ARG A 80 16.183 24.763 -14.795 1.00 0.00 H new ATOM 0 HD3 ARG A 80 15.790 23.579 -16.026 1.00 0.00 H new ATOM 0 HE ARG A 80 16.994 25.846 -17.290 1.00 0.00 H new ATOM 0 HH11 ARG A 80 17.896 23.292 -14.995 1.00 0.00 H new ATOM 0 HH12 ARG A 80 19.551 23.183 -15.603 1.00 0.00 H new ATOM 0 HH21 ARG A 80 19.095 25.678 -18.073 1.00 0.00 H new ATOM 0 HH22 ARG A 80 20.227 24.534 -17.344 1.00 0.00 H new ATOM 1228 N ALA A 81 11.138 24.664 -18.027 1.00 0.00 N ATOM 1229 CA ALA A 81 9.960 24.094 -17.441 1.00 0.00 C ATOM 1230 C ALA A 81 10.309 22.802 -16.755 1.00 0.00 C ATOM 1231 O ALA A 81 10.987 21.943 -17.338 1.00 0.00 O ATOM 1232 CB ALA A 81 8.901 23.864 -18.489 1.00 0.00 C ATOM 0 H ALA A 81 11.351 24.324 -18.965 1.00 0.00 H new ATOM 0 HA ALA A 81 9.561 24.792 -16.705 1.00 0.00 H new ATOM 0 HB1 ALA A 81 8.016 23.431 -18.023 1.00 0.00 H new ATOM 0 HB2 ALA A 81 8.638 24.814 -18.955 1.00 0.00 H new ATOM 0 HB3 ALA A 81 9.282 23.181 -19.248 1.00 0.00 H new ATOM 1238 N LEU A 82 9.874 22.657 -15.538 1.00 0.00 N ATOM 1239 CA LEU A 82 10.172 21.470 -14.783 1.00 0.00 C ATOM 1240 C LEU A 82 9.264 20.290 -15.130 1.00 0.00 C ATOM 1241 O LEU A 82 8.132 20.458 -15.621 1.00 0.00 O ATOM 1242 CB LEU A 82 10.273 21.744 -13.265 1.00 0.00 C ATOM 1243 CG LEU A 82 9.198 22.637 -12.608 1.00 0.00 C ATOM 1244 CD1 LEU A 82 7.809 22.055 -12.741 1.00 0.00 C ATOM 1245 CD2 LEU A 82 9.532 22.852 -11.147 1.00 0.00 C ATOM 0 H LEU A 82 9.309 23.347 -15.043 1.00 0.00 H new ATOM 0 HA LEU A 82 11.169 21.157 -15.094 1.00 0.00 H new ATOM 0 HB2 LEU A 82 10.264 20.782 -12.752 1.00 0.00 H new ATOM 0 HB3 LEU A 82 11.245 22.199 -13.073 1.00 0.00 H new ATOM 0 HG LEU A 82 9.200 23.592 -13.133 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.089 22.719 -12.263 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.559 21.947 -13.797 1.00 0.00 H new ATOM 0 HD13 LEU A 82 7.776 21.078 -12.259 1.00 0.00 H new ATOM 0 HD21 LEU A 82 8.770 23.483 -10.689 1.00 0.00 H new ATOM 0 HD22 LEU A 82 9.563 21.890 -10.635 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.504 23.338 -11.064 1.00 0.00 H new ATOM 1257 N LYS A 83 9.778 19.124 -14.884 1.00 0.00 N ATOM 1258 CA LYS A 83 9.140 17.870 -15.185 1.00 0.00 C ATOM 1259 C LYS A 83 8.794 17.147 -13.900 1.00 0.00 C ATOM 1260 O LYS A 83 9.623 17.071 -13.015 1.00 0.00 O ATOM 1261 CB LYS A 83 10.143 17.018 -15.990 1.00 0.00 C ATOM 1262 CG LYS A 83 9.754 15.556 -16.217 1.00 0.00 C ATOM 1263 CD LYS A 83 8.480 15.352 -17.052 1.00 0.00 C ATOM 1264 CE LYS A 83 8.645 15.744 -18.520 1.00 0.00 C ATOM 1265 NZ LYS A 83 8.627 17.213 -18.763 1.00 0.00 N1+ ATOM 0 H LYS A 83 10.694 19.011 -14.449 1.00 0.00 H new ATOM 0 HA LYS A 83 8.224 18.037 -15.752 1.00 0.00 H new ATOM 0 HB2 LYS A 83 10.290 17.489 -16.962 1.00 0.00 H new ATOM 0 HB3 LYS A 83 11.104 17.042 -15.475 1.00 0.00 H new ATOM 0 HG2 LYS A 83 10.581 15.047 -16.711 1.00 0.00 H new ATOM 0 HG3 LYS A 83 9.618 15.076 -15.248 1.00 0.00 H new ATOM 0 HD2 LYS A 83 8.181 14.305 -16.995 1.00 0.00 H new ATOM 0 HD3 LYS A 83 7.671 15.939 -16.616 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.586 15.337 -18.890 1.00 0.00 H new ATOM 0 HE3 LYS A 83 7.847 15.281 -19.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.273 17.402 -19.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 8.005 17.672 -18.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 9.591 17.592 -18.669 1.00 0.00 H new ATOM 1279 N ILE A 84 7.584 16.638 -13.796 1.00 0.00 N ATOM 1280 CA ILE A 84 7.210 15.810 -12.666 1.00 0.00 C ATOM 1281 C ILE A 84 6.781 14.457 -13.219 1.00 0.00 C ATOM 1282 O ILE A 84 5.994 14.401 -14.158 1.00 0.00 O ATOM 1283 CB ILE A 84 6.059 16.391 -11.755 1.00 0.00 C ATOM 1284 CG1 ILE A 84 6.381 17.779 -11.181 1.00 0.00 C ATOM 1285 CG2 ILE A 84 5.787 15.455 -10.596 1.00 0.00 C ATOM 1286 CD1 ILE A 84 6.241 18.915 -12.148 1.00 0.00 C ATOM 0 H ILE A 84 6.841 16.783 -14.480 1.00 0.00 H new ATOM 0 HA ILE A 84 8.080 15.751 -12.012 1.00 0.00 H new ATOM 0 HB ILE A 84 5.186 16.486 -12.401 1.00 0.00 H new ATOM 0 HG12 ILE A 84 5.726 17.964 -10.330 1.00 0.00 H new ATOM 0 HG13 ILE A 84 7.402 17.770 -10.801 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.991 15.867 -9.975 1.00 0.00 H new ATOM 0 HG22 ILE A 84 5.482 14.481 -10.979 1.00 0.00 H new ATOM 0 HG23 ILE A 84 6.692 15.343 -9.999 1.00 0.00 H new ATOM 0 HD11 ILE A 84 6.490 19.851 -11.648 1.00 0.00 H new ATOM 0 HD12 ILE A 84 6.917 18.762 -12.989 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.214 18.959 -12.511 1.00 0.00 H new ATOM 1298 N ASP A 85 7.337 13.403 -12.686 1.00 0.00 N ATOM 1299 CA ASP A 85 7.061 12.035 -13.136 1.00 0.00 C ATOM 1300 C ASP A 85 6.877 11.133 -11.926 1.00 0.00 C ATOM 1301 O ASP A 85 7.324 11.469 -10.850 1.00 0.00 O ATOM 1302 CB ASP A 85 8.236 11.537 -14.006 1.00 0.00 C ATOM 1303 CG ASP A 85 8.104 10.102 -14.476 1.00 0.00 C ATOM 1304 OD1 ASP A 85 7.159 9.791 -15.204 1.00 0.00 O ATOM 1305 OD2 ASP A 85 8.987 9.273 -14.160 1.00 0.00 O1- ATOM 0 H ASP A 85 8.005 13.454 -11.917 1.00 0.00 H new ATOM 0 HA ASP A 85 6.148 12.016 -13.731 1.00 0.00 H new ATOM 0 HB2 ASP A 85 8.327 12.185 -14.878 1.00 0.00 H new ATOM 0 HB3 ASP A 85 9.161 11.637 -13.437 1.00 0.00 H new ATOM 1310 N HIS A 86 6.209 10.024 -12.088 1.00 0.00 N ATOM 1311 CA HIS A 86 6.018 9.074 -10.990 1.00 0.00 C ATOM 1312 C HIS A 86 7.295 8.280 -10.753 1.00 0.00 C ATOM 1313 O HIS A 86 7.860 7.756 -11.694 1.00 0.00 O ATOM 1314 CB HIS A 86 4.886 8.104 -11.312 1.00 0.00 C ATOM 1315 CG HIS A 86 3.510 8.644 -11.128 1.00 0.00 C ATOM 1316 ND1 HIS A 86 2.810 8.532 -9.955 1.00 0.00 N ATOM 1317 CD2 HIS A 86 2.694 9.284 -11.990 1.00 0.00 C ATOM 1318 CE1 HIS A 86 1.622 9.092 -10.124 1.00 0.00 C ATOM 1319 NE2 HIS A 86 1.490 9.570 -11.346 1.00 0.00 N ATOM 0 H HIS A 86 5.780 9.741 -12.969 1.00 0.00 H new ATOM 0 HA HIS A 86 5.765 9.640 -10.094 1.00 0.00 H new ATOM 0 HB2 HIS A 86 4.994 7.776 -12.346 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.998 7.220 -10.684 1.00 0.00 H new ATOM 0 HD1 HIS A 86 3.147 8.092 -9.098 1.00 0.00 H new ATOM 0 HD2 HIS A 86 2.934 9.534 -13.013 1.00 0.00 H new ATOM 0 HE1 HIS A 86 0.860 9.150 -9.360 1.00 0.00 H new ATOM 1327 N THR A 87 7.767 8.204 -9.527 1.00 0.00 N ATOM 1328 CA THR A 87 8.972 7.449 -9.251 1.00 0.00 C ATOM 1329 C THR A 87 8.947 6.901 -7.812 1.00 0.00 C ATOM 1330 O THR A 87 8.164 7.344 -6.990 1.00 0.00 O ATOM 1331 CB THR A 87 10.255 8.312 -9.490 1.00 0.00 C ATOM 1332 OG1 THR A 87 11.414 7.469 -9.584 1.00 0.00 O ATOM 1333 CG2 THR A 87 10.470 9.314 -8.360 1.00 0.00 C ATOM 0 H THR A 87 7.342 8.649 -8.714 1.00 0.00 H new ATOM 0 HA THR A 87 9.005 6.608 -9.944 1.00 0.00 H new ATOM 0 HB THR A 87 10.111 8.855 -10.424 1.00 0.00 H new ATOM 0 HG1 THR A 87 12.209 8.022 -9.735 1.00 0.00 H new ATOM 0 HG21 THR A 87 11.369 9.897 -8.557 1.00 0.00 H new ATOM 0 HG22 THR A 87 9.611 9.982 -8.298 1.00 0.00 H new ATOM 0 HG23 THR A 87 10.584 8.780 -7.417 1.00 0.00 H new ATOM 1341 N PHE A 88 9.742 5.917 -7.531 1.00 0.00 N ATOM 1342 CA PHE A 88 9.874 5.441 -6.181 1.00 0.00 C ATOM 1343 C PHE A 88 11.314 5.079 -5.957 1.00 0.00 C ATOM 1344 O PHE A 88 11.881 4.307 -6.722 1.00 0.00 O ATOM 1345 CB PHE A 88 8.968 4.233 -5.907 1.00 0.00 C ATOM 1346 CG PHE A 88 8.893 3.850 -4.448 1.00 0.00 C ATOM 1347 CD1 PHE A 88 9.821 2.987 -3.883 1.00 0.00 C ATOM 1348 CD2 PHE A 88 7.889 4.359 -3.641 1.00 0.00 C ATOM 1349 CE1 PHE A 88 9.748 2.646 -2.550 1.00 0.00 C ATOM 1350 CE2 PHE A 88 7.811 4.019 -2.306 1.00 0.00 C ATOM 1351 CZ PHE A 88 8.742 3.162 -1.758 1.00 0.00 C ATOM 0 H PHE A 88 10.313 5.423 -8.217 1.00 0.00 H new ATOM 0 HA PHE A 88 9.562 6.226 -5.492 1.00 0.00 H new ATOM 0 HB2 PHE A 88 7.963 4.454 -6.268 1.00 0.00 H new ATOM 0 HB3 PHE A 88 9.332 3.380 -6.479 1.00 0.00 H new ATOM 0 HD1 PHE A 88 10.610 2.577 -4.496 1.00 0.00 H new ATOM 0 HD2 PHE A 88 7.157 5.032 -4.063 1.00 0.00 H new ATOM 0 HE1 PHE A 88 10.479 1.974 -2.124 1.00 0.00 H new ATOM 0 HE2 PHE A 88 7.021 4.424 -1.691 1.00 0.00 H new ATOM 0 HZ PHE A 88 8.684 2.895 -0.713 1.00 0.00 H new ATOM 1361 N TYR A 89 11.911 5.637 -4.942 1.00 0.00 N ATOM 1362 CA TYR A 89 13.284 5.351 -4.650 1.00 0.00 C ATOM 1363 C TYR A 89 13.366 4.906 -3.209 1.00 0.00 C ATOM 1364 O TYR A 89 12.469 5.216 -2.412 1.00 0.00 O ATOM 1365 CB TYR A 89 14.183 6.606 -4.882 1.00 0.00 C ATOM 1366 CG TYR A 89 14.225 7.615 -3.736 1.00 0.00 C ATOM 1367 CD1 TYR A 89 13.139 8.418 -3.415 1.00 0.00 C ATOM 1368 CD2 TYR A 89 15.370 7.732 -2.959 1.00 0.00 C ATOM 1369 CE1 TYR A 89 13.207 9.306 -2.354 1.00 0.00 C ATOM 1370 CE2 TYR A 89 15.440 8.605 -1.904 1.00 0.00 C ATOM 1371 CZ TYR A 89 14.364 9.387 -1.603 1.00 0.00 C ATOM 1372 OH TYR A 89 14.438 10.252 -0.539 1.00 0.00 O ATOM 0 H TYR A 89 11.465 6.294 -4.302 1.00 0.00 H new ATOM 0 HA TYR A 89 13.647 4.567 -5.315 1.00 0.00 H new ATOM 0 HB2 TYR A 89 15.200 6.269 -5.082 1.00 0.00 H new ATOM 0 HB3 TYR A 89 13.835 7.118 -5.779 1.00 0.00 H new ATOM 0 HD1 TYR A 89 12.232 8.350 -3.998 1.00 0.00 H new ATOM 0 HD2 TYR A 89 16.228 7.119 -3.192 1.00 0.00 H new ATOM 0 HE1 TYR A 89 12.360 9.932 -2.115 1.00 0.00 H new ATOM 0 HE2 TYR A 89 16.342 8.673 -1.315 1.00 0.00 H new ATOM 0 HH TYR A 89 15.321 10.181 -0.121 1.00 0.00 H new ATOM 1382 N ARG A 90 14.389 4.178 -2.877 1.00 0.00 N ATOM 1383 CA ARG A 90 14.604 3.785 -1.514 1.00 0.00 C ATOM 1384 C ARG A 90 15.483 4.817 -0.832 1.00 0.00 C ATOM 1385 O ARG A 90 16.570 5.137 -1.339 1.00 0.00 O ATOM 1386 CB ARG A 90 15.226 2.390 -1.422 1.00 0.00 C ATOM 1387 CG ARG A 90 14.294 1.261 -1.853 1.00 0.00 C ATOM 1388 CD ARG A 90 13.055 1.188 -0.959 1.00 0.00 C ATOM 1389 NE ARG A 90 13.400 1.016 0.467 1.00 0.00 N ATOM 1390 CZ ARG A 90 12.535 1.099 1.494 1.00 0.00 C ATOM 1391 NH1 ARG A 90 11.233 1.214 1.270 1.00 0.00 N1+ ATOM 1392 NH2 ARG A 90 12.973 1.013 2.742 1.00 0.00 N ATOM 0 H ARG A 90 15.093 3.842 -3.534 1.00 0.00 H new ATOM 0 HA ARG A 90 13.641 3.736 -1.006 1.00 0.00 H new ATOM 0 HB2 ARG A 90 16.123 2.362 -2.041 1.00 0.00 H new ATOM 0 HB3 ARG A 90 15.543 2.212 -0.394 1.00 0.00 H new ATOM 0 HG2 ARG A 90 13.989 1.414 -2.888 1.00 0.00 H new ATOM 0 HG3 ARG A 90 14.828 0.312 -1.815 1.00 0.00 H new ATOM 0 HD2 ARG A 90 12.468 2.098 -1.081 1.00 0.00 H new ATOM 0 HD3 ARG A 90 12.426 0.358 -1.281 1.00 0.00 H new ATOM 0 HE ARG A 90 14.375 0.818 0.692 1.00 0.00 H new ATOM 0 HH11 ARG A 90 10.880 1.240 0.313 1.00 0.00 H new ATOM 0 HH12 ARG A 90 10.584 1.276 2.054 1.00 0.00 H new ATOM 0 HH21 ARG A 90 13.968 0.884 2.926 1.00 0.00 H new ATOM 0 HH22 ARG A 90 12.315 1.076 3.519 1.00 0.00 H new ATOM 1406 N PRO A 91 14.996 5.406 0.279 1.00 0.00 N ATOM 1407 CA PRO A 91 15.743 6.416 1.029 1.00 0.00 C ATOM 1408 C PRO A 91 17.081 5.872 1.509 1.00 0.00 C ATOM 1409 O PRO A 91 17.150 4.792 2.114 1.00 0.00 O ATOM 1410 CB PRO A 91 14.827 6.759 2.220 1.00 0.00 C ATOM 1411 CG PRO A 91 13.808 5.675 2.276 1.00 0.00 C ATOM 1412 CD PRO A 91 13.674 5.140 0.883 1.00 0.00 C ATOM 0 HA PRO A 91 15.982 7.288 0.421 1.00 0.00 H new ATOM 0 HB2 PRO A 91 15.396 6.809 3.149 1.00 0.00 H new ATOM 0 HB3 PRO A 91 14.355 7.732 2.082 1.00 0.00 H new ATOM 0 HG2 PRO A 91 14.117 4.889 2.965 1.00 0.00 H new ATOM 0 HG3 PRO A 91 12.854 6.059 2.637 1.00 0.00 H new ATOM 0 HD2 PRO A 91 13.440 4.075 0.883 1.00 0.00 H new ATOM 0 HD3 PRO A 91 12.875 5.641 0.336 1.00 0.00 H new ATOM 1420 N LYS A 92 18.130 6.600 1.230 1.00 0.00 N ATOM 1421 CA LYS A 92 19.458 6.175 1.584 1.00 0.00 C ATOM 1422 C LYS A 92 19.729 6.507 3.041 1.00 0.00 C ATOM 1423 O LYS A 92 19.465 7.626 3.490 1.00 0.00 O ATOM 1424 CB LYS A 92 20.452 6.907 0.691 1.00 0.00 C ATOM 1425 CG LYS A 92 20.328 6.564 -0.790 1.00 0.00 C ATOM 1426 CD LYS A 92 21.173 7.495 -1.653 1.00 0.00 C ATOM 1427 CE LYS A 92 22.651 7.455 -1.287 1.00 0.00 C ATOM 1428 NZ LYS A 92 23.274 6.141 -1.548 1.00 0.00 N1+ ATOM 0 H LYS A 92 18.088 7.501 0.753 1.00 0.00 H new ATOM 0 HA LYS A 92 19.558 5.098 1.446 1.00 0.00 H new ATOM 0 HB2 LYS A 92 20.315 7.981 0.817 1.00 0.00 H new ATOM 0 HB3 LYS A 92 21.463 6.674 1.024 1.00 0.00 H new ATOM 0 HG2 LYS A 92 20.640 5.532 -0.953 1.00 0.00 H new ATOM 0 HG3 LYS A 92 19.284 6.633 -1.094 1.00 0.00 H new ATOM 0 HD2 LYS A 92 21.055 7.219 -2.701 1.00 0.00 H new ATOM 0 HD3 LYS A 92 20.804 8.515 -1.548 1.00 0.00 H new ATOM 0 HE2 LYS A 92 23.181 8.221 -1.853 1.00 0.00 H new ATOM 0 HE3 LYS A 92 22.765 7.702 -0.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 24.286 6.184 -1.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 22.812 5.416 -0.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 23.163 5.898 -2.553 1.00 0.00 H new ATOM 1442 N ARG A 93 20.342 5.589 3.749 1.00 0.00 N ATOM 1443 CA ARG A 93 20.575 5.781 5.164 1.00 0.00 C ATOM 1444 C ARG A 93 21.709 6.758 5.411 1.00 0.00 C ATOM 1445 O ARG A 93 21.739 7.443 6.418 1.00 0.00 O ATOM 1446 CB ARG A 93 20.756 4.429 5.915 1.00 0.00 C ATOM 1447 CG ARG A 93 21.972 3.558 5.531 1.00 0.00 C ATOM 1448 CD ARG A 93 23.277 4.092 6.089 1.00 0.00 C ATOM 1449 NE ARG A 93 23.213 4.244 7.546 1.00 0.00 N ATOM 1450 CZ ARG A 93 24.133 4.859 8.294 1.00 0.00 C ATOM 1451 NH1 ARG A 93 25.214 5.379 7.730 1.00 0.00 N1+ ATOM 1452 NH2 ARG A 93 23.958 4.947 9.609 1.00 0.00 N ATOM 0 H ARG A 93 20.688 4.706 3.373 1.00 0.00 H new ATOM 0 HA ARG A 93 19.680 6.236 5.588 1.00 0.00 H new ATOM 0 HB2 ARG A 93 20.819 4.643 6.982 1.00 0.00 H new ATOM 0 HB3 ARG A 93 19.855 3.835 5.761 1.00 0.00 H new ATOM 0 HG2 ARG A 93 21.815 2.543 5.895 1.00 0.00 H new ATOM 0 HG3 ARG A 93 22.043 3.500 4.445 1.00 0.00 H new ATOM 0 HD2 ARG A 93 24.090 3.415 5.828 1.00 0.00 H new ATOM 0 HD3 ARG A 93 23.504 5.055 5.631 1.00 0.00 H new ATOM 0 HE ARG A 93 22.404 3.850 8.025 1.00 0.00 H new ATOM 0 HH11 ARG A 93 25.346 5.310 6.721 1.00 0.00 H new ATOM 0 HH12 ARG A 93 25.914 5.848 8.305 1.00 0.00 H new ATOM 0 HH21 ARG A 93 23.125 4.546 10.041 1.00 0.00 H new ATOM 0 HH22 ARG A 93 24.657 5.415 10.186 1.00 0.00 H new ATOM 1466 N SER A 94 22.619 6.843 4.464 1.00 0.00 N ATOM 1467 CA SER A 94 23.750 7.732 4.566 1.00 0.00 C ATOM 1468 C SER A 94 23.299 9.189 4.474 1.00 0.00 C ATOM 1469 O SER A 94 23.955 10.082 4.984 1.00 0.00 O ATOM 1470 CB SER A 94 24.741 7.403 3.460 1.00 0.00 C ATOM 1471 OG SER A 94 25.068 6.019 3.494 1.00 0.00 O ATOM 0 H SER A 94 22.593 6.297 3.603 1.00 0.00 H new ATOM 0 HA SER A 94 24.233 7.596 5.534 1.00 0.00 H new ATOM 0 HB2 SER A 94 24.315 7.660 2.490 1.00 0.00 H new ATOM 0 HB3 SER A 94 25.644 8.001 3.580 1.00 0.00 H new ATOM 0 HG SER A 94 25.705 5.816 2.778 1.00 0.00 H new ATOM 1477 N LEU A 95 22.149 9.407 3.865 1.00 0.00 N ATOM 1478 CA LEU A 95 21.625 10.742 3.691 1.00 0.00 C ATOM 1479 C LEU A 95 20.400 10.962 4.554 1.00 0.00 C ATOM 1480 O LEU A 95 19.668 11.938 4.351 1.00 0.00 O ATOM 1481 CB LEU A 95 21.283 10.998 2.217 1.00 0.00 C ATOM 1482 CG LEU A 95 22.455 10.984 1.232 1.00 0.00 C ATOM 1483 CD1 LEU A 95 21.955 11.217 -0.183 1.00 0.00 C ATOM 1484 CD2 LEU A 95 23.482 12.042 1.609 1.00 0.00 C ATOM 0 H LEU A 95 21.559 8.669 3.481 1.00 0.00 H new ATOM 0 HA LEU A 95 22.396 11.447 4.002 1.00 0.00 H new ATOM 0 HB2 LEU A 95 20.561 10.246 1.899 1.00 0.00 H new ATOM 0 HB3 LEU A 95 20.788 11.966 2.145 1.00 0.00 H new ATOM 0 HG LEU A 95 22.934 10.006 1.278 1.00 0.00 H new ATOM 0 HD11 LEU A 95 22.798 11.205 -0.874 1.00 0.00 H new ATOM 0 HD12 LEU A 95 21.252 10.430 -0.455 1.00 0.00 H new ATOM 0 HD13 LEU A 95 21.455 12.184 -0.238 1.00 0.00 H new ATOM 0 HD21 LEU A 95 24.308 12.017 0.898 1.00 0.00 H new ATOM 0 HD22 LEU A 95 23.015 13.026 1.588 1.00 0.00 H new ATOM 0 HD23 LEU A 95 23.860 11.841 2.611 1.00 0.00 H new ATOM 1496 N GLN A 96 20.205 10.098 5.557 1.00 0.00 N ATOM 1497 CA GLN A 96 19.004 10.170 6.398 1.00 0.00 C ATOM 1498 C GLN A 96 18.901 11.495 7.129 1.00 0.00 C ATOM 1499 O GLN A 96 17.810 12.000 7.327 1.00 0.00 O ATOM 1500 CB GLN A 96 18.910 9.036 7.425 1.00 0.00 C ATOM 1501 CG GLN A 96 19.998 9.049 8.485 1.00 0.00 C ATOM 1502 CD GLN A 96 19.650 8.201 9.679 1.00 0.00 C ATOM 1503 OE1 GLN A 96 19.951 7.005 9.726 1.00 0.00 O ATOM 1504 NE2 GLN A 96 19.003 8.801 10.646 1.00 0.00 N ATOM 0 H GLN A 96 20.853 9.350 5.804 1.00 0.00 H new ATOM 0 HA GLN A 96 18.173 10.068 5.700 1.00 0.00 H new ATOM 0 HB2 GLN A 96 17.940 9.091 7.919 1.00 0.00 H new ATOM 0 HB3 GLN A 96 18.946 8.083 6.898 1.00 0.00 H new ATOM 0 HG2 GLN A 96 20.930 8.691 8.048 1.00 0.00 H new ATOM 0 HG3 GLN A 96 20.172 10.075 8.810 1.00 0.00 H new ATOM 0 HE21 GLN A 96 18.773 9.792 10.568 1.00 0.00 H new ATOM 0 HE22 GLN A 96 18.729 8.278 11.477 1.00 0.00 H new ATOM 1513 N LYS A 97 20.047 12.067 7.493 1.00 0.00 N ATOM 1514 CA LYS A 97 20.063 13.302 8.249 1.00 0.00 C ATOM 1515 C LYS A 97 19.526 14.448 7.430 1.00 0.00 C ATOM 1516 O LYS A 97 18.873 15.319 7.960 1.00 0.00 O ATOM 1517 CB LYS A 97 21.448 13.620 8.792 1.00 0.00 C ATOM 1518 CG LYS A 97 22.039 12.530 9.675 1.00 0.00 C ATOM 1519 CD LYS A 97 21.152 12.176 10.878 1.00 0.00 C ATOM 1520 CE LYS A 97 21.003 13.335 11.855 1.00 0.00 C ATOM 1521 NZ LYS A 97 20.135 12.993 13.000 1.00 0.00 N1+ ATOM 0 H LYS A 97 20.970 11.691 7.274 1.00 0.00 H new ATOM 0 HA LYS A 97 19.405 13.161 9.107 1.00 0.00 H new ATOM 0 HB2 LYS A 97 22.122 13.798 7.954 1.00 0.00 H new ATOM 0 HB3 LYS A 97 21.398 14.547 9.363 1.00 0.00 H new ATOM 0 HG2 LYS A 97 22.201 11.634 9.075 1.00 0.00 H new ATOM 0 HG3 LYS A 97 23.016 12.853 10.035 1.00 0.00 H new ATOM 0 HD2 LYS A 97 20.166 11.876 10.522 1.00 0.00 H new ATOM 0 HD3 LYS A 97 21.578 11.318 11.399 1.00 0.00 H new ATOM 0 HE2 LYS A 97 21.987 13.627 12.222 1.00 0.00 H new ATOM 0 HE3 LYS A 97 20.589 14.197 11.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 20.498 13.452 13.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 19.167 13.324 12.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 20.129 11.962 13.135 1.00 0.00 H new ATOM 1535 N TYR A 98 19.795 14.427 6.131 1.00 0.00 N ATOM 1536 CA TYR A 98 19.244 15.410 5.234 1.00 0.00 C ATOM 1537 C TYR A 98 17.732 15.213 5.161 1.00 0.00 C ATOM 1538 O TYR A 98 16.984 16.158 5.289 1.00 0.00 O ATOM 1539 CB TYR A 98 19.900 15.305 3.829 1.00 0.00 C ATOM 1540 CG TYR A 98 19.226 16.147 2.751 1.00 0.00 C ATOM 1541 CD1 TYR A 98 19.265 17.535 2.783 1.00 0.00 C ATOM 1542 CD2 TYR A 98 18.539 15.541 1.708 1.00 0.00 C ATOM 1543 CE1 TYR A 98 18.629 18.292 1.812 1.00 0.00 C ATOM 1544 CE2 TYR A 98 17.910 16.288 0.734 1.00 0.00 C ATOM 1545 CZ TYR A 98 17.953 17.660 0.790 1.00 0.00 C ATOM 1546 OH TYR A 98 17.303 18.399 -0.174 1.00 0.00 O ATOM 0 H TYR A 98 20.394 13.734 5.683 1.00 0.00 H new ATOM 0 HA TYR A 98 19.456 16.411 5.609 1.00 0.00 H new ATOM 0 HB2 TYR A 98 20.945 15.606 3.907 1.00 0.00 H new ATOM 0 HB3 TYR A 98 19.891 14.261 3.515 1.00 0.00 H new ATOM 0 HD1 TYR A 98 19.800 18.033 3.578 1.00 0.00 H new ATOM 0 HD2 TYR A 98 18.496 14.463 1.658 1.00 0.00 H new ATOM 0 HE1 TYR A 98 18.663 19.371 1.856 1.00 0.00 H new ATOM 0 HE2 TYR A 98 17.385 15.795 -0.071 1.00 0.00 H new ATOM 0 HH TYR A 98 17.686 19.300 -0.209 1.00 0.00 H new ATOM 1556 N TYR A 99 17.318 13.958 5.035 1.00 0.00 N ATOM 1557 CA TYR A 99 15.900 13.588 4.923 1.00 0.00 C ATOM 1558 C TYR A 99 15.106 14.073 6.126 1.00 0.00 C ATOM 1559 O TYR A 99 14.106 14.801 5.981 1.00 0.00 O ATOM 1560 CB TYR A 99 15.733 12.069 4.822 1.00 0.00 C ATOM 1561 CG TYR A 99 16.389 11.402 3.637 1.00 0.00 C ATOM 1562 CD1 TYR A 99 16.738 12.105 2.492 1.00 0.00 C ATOM 1563 CD2 TYR A 99 16.638 10.050 3.665 1.00 0.00 C ATOM 1564 CE1 TYR A 99 17.321 11.469 1.414 1.00 0.00 C ATOM 1565 CE2 TYR A 99 17.217 9.414 2.601 1.00 0.00 C ATOM 1566 CZ TYR A 99 17.556 10.119 1.478 1.00 0.00 C ATOM 1567 OH TYR A 99 18.147 9.467 0.413 1.00 0.00 O ATOM 0 H TYR A 99 17.953 13.161 5.007 1.00 0.00 H new ATOM 0 HA TYR A 99 15.523 14.064 4.018 1.00 0.00 H new ATOM 0 HB2 TYR A 99 16.131 11.620 5.732 1.00 0.00 H new ATOM 0 HB3 TYR A 99 14.667 11.843 4.795 1.00 0.00 H new ATOM 0 HD1 TYR A 99 16.550 13.167 2.444 1.00 0.00 H new ATOM 0 HD2 TYR A 99 16.372 9.480 4.543 1.00 0.00 H new ATOM 0 HE1 TYR A 99 17.589 12.028 0.530 1.00 0.00 H new ATOM 0 HE2 TYR A 99 17.407 8.352 2.647 1.00 0.00 H new ATOM 0 HH TYR A 99 19.086 9.739 0.343 1.00 0.00 H new ATOM 1577 N GLU A 100 15.555 13.676 7.309 1.00 0.00 N ATOM 1578 CA GLU A 100 14.891 14.045 8.536 1.00 0.00 C ATOM 1579 C GLU A 100 14.898 15.559 8.739 1.00 0.00 C ATOM 1580 O GLU A 100 13.866 16.135 9.031 1.00 0.00 O ATOM 1581 CB GLU A 100 15.455 13.274 9.758 1.00 0.00 C ATOM 1582 CG GLU A 100 16.950 13.406 9.963 1.00 0.00 C ATOM 1583 CD GLU A 100 17.477 12.581 11.114 1.00 0.00 C ATOM 1584 OE1 GLU A 100 17.498 13.077 12.270 1.00 0.00 O ATOM 1585 OE2 GLU A 100 17.914 11.431 10.895 1.00 0.00 O1- ATOM 0 H GLU A 100 16.383 13.094 7.437 1.00 0.00 H new ATOM 0 HA GLU A 100 13.847 13.745 8.447 1.00 0.00 H new ATOM 0 HB2 GLU A 100 14.948 13.626 10.656 1.00 0.00 H new ATOM 0 HB3 GLU A 100 15.210 12.218 9.647 1.00 0.00 H new ATOM 0 HG2 GLU A 100 17.462 13.107 9.048 1.00 0.00 H new ATOM 0 HG3 GLU A 100 17.194 14.454 10.137 1.00 0.00 H new ATOM 1592 N ALA A 101 16.040 16.203 8.473 1.00 0.00 N ATOM 1593 CA ALA A 101 16.181 17.657 8.646 1.00 0.00 C ATOM 1594 C ALA A 101 15.227 18.432 7.745 1.00 0.00 C ATOM 1595 O ALA A 101 14.812 19.547 8.076 1.00 0.00 O ATOM 1596 CB ALA A 101 17.611 18.100 8.387 1.00 0.00 C ATOM 0 H ALA A 101 16.884 15.740 8.136 1.00 0.00 H new ATOM 0 HA ALA A 101 15.923 17.879 9.681 1.00 0.00 H new ATOM 0 HB1 ALA A 101 17.688 19.179 8.522 1.00 0.00 H new ATOM 0 HB2 ALA A 101 18.280 17.599 9.087 1.00 0.00 H new ATOM 0 HB3 ALA A 101 17.893 17.841 7.367 1.00 0.00 H new ATOM 1602 N VAL A 102 14.886 17.854 6.611 1.00 0.00 N ATOM 1603 CA VAL A 102 13.949 18.482 5.718 1.00 0.00 C ATOM 1604 C VAL A 102 12.524 18.364 6.276 1.00 0.00 C ATOM 1605 O VAL A 102 11.797 19.364 6.403 1.00 0.00 O ATOM 1606 CB VAL A 102 13.996 17.889 4.276 1.00 0.00 C ATOM 1607 CG1 VAL A 102 12.951 18.540 3.398 1.00 0.00 C ATOM 1608 CG2 VAL A 102 15.350 18.100 3.651 1.00 0.00 C ATOM 0 H VAL A 102 15.245 16.954 6.292 1.00 0.00 H new ATOM 0 HA VAL A 102 14.239 19.530 5.648 1.00 0.00 H new ATOM 0 HB VAL A 102 13.796 16.820 4.356 1.00 0.00 H new ATOM 0 HG11 VAL A 102 13.000 18.113 2.396 1.00 0.00 H new ATOM 0 HG12 VAL A 102 11.961 18.365 3.819 1.00 0.00 H new ATOM 0 HG13 VAL A 102 13.138 19.613 3.344 1.00 0.00 H new ATOM 0 HG21 VAL A 102 15.357 17.678 2.646 1.00 0.00 H new ATOM 0 HG22 VAL A 102 15.564 19.168 3.597 1.00 0.00 H new ATOM 0 HG23 VAL A 102 16.111 17.608 4.257 1.00 0.00 H new ATOM 1618 N LYS A 103 12.146 17.153 6.668 1.00 0.00 N ATOM 1619 CA LYS A 103 10.781 16.905 7.103 1.00 0.00 C ATOM 1620 C LYS A 103 10.468 17.540 8.430 1.00 0.00 C ATOM 1621 O LYS A 103 9.301 17.710 8.759 1.00 0.00 O ATOM 1622 CB LYS A 103 10.410 15.440 7.112 1.00 0.00 C ATOM 1623 CG LYS A 103 11.053 14.626 8.206 1.00 0.00 C ATOM 1624 CD LYS A 103 10.601 13.194 8.132 1.00 0.00 C ATOM 1625 CE LYS A 103 11.024 12.541 6.819 1.00 0.00 C ATOM 1626 NZ LYS A 103 10.493 11.179 6.654 1.00 0.00 N1+ ATOM 0 H LYS A 103 12.759 16.338 6.693 1.00 0.00 H new ATOM 0 HA LYS A 103 10.160 17.387 6.349 1.00 0.00 H new ATOM 0 HB2 LYS A 103 9.327 15.356 7.206 1.00 0.00 H new ATOM 0 HB3 LYS A 103 10.682 15.006 6.150 1.00 0.00 H new ATOM 0 HG2 LYS A 103 12.138 14.676 8.115 1.00 0.00 H new ATOM 0 HG3 LYS A 103 10.795 15.045 9.179 1.00 0.00 H new ATOM 0 HD2 LYS A 103 11.020 12.635 8.969 1.00 0.00 H new ATOM 0 HD3 LYS A 103 9.516 13.148 8.229 1.00 0.00 H new ATOM 0 HE2 LYS A 103 10.686 13.159 5.987 1.00 0.00 H new ATOM 0 HE3 LYS A 103 12.112 12.508 6.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 10.166 11.050 5.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 11.241 10.487 6.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 9.697 11.035 7.307 1.00 0.00 H new ATOM 1640 N GLU A 104 11.498 17.884 9.197 1.00 0.00 N ATOM 1641 CA GLU A 104 11.306 18.568 10.466 1.00 0.00 C ATOM 1642 C GLU A 104 10.505 19.853 10.282 1.00 0.00 C ATOM 1643 O GLU A 104 9.815 20.264 11.169 1.00 0.00 O ATOM 1644 CB GLU A 104 12.633 18.853 11.177 1.00 0.00 C ATOM 1645 CG GLU A 104 13.396 17.602 11.590 1.00 0.00 C ATOM 1646 CD GLU A 104 12.583 16.685 12.473 1.00 0.00 C ATOM 1647 OE1 GLU A 104 12.577 16.885 13.709 1.00 0.00 O ATOM 1648 OE2 GLU A 104 11.926 15.749 11.964 1.00 0.00 O1- ATOM 0 H GLU A 104 12.473 17.699 8.960 1.00 0.00 H new ATOM 0 HA GLU A 104 10.735 17.894 11.105 1.00 0.00 H new ATOM 0 HB2 GLU A 104 13.264 19.451 10.520 1.00 0.00 H new ATOM 0 HB3 GLU A 104 12.436 19.455 12.064 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.705 17.059 10.697 1.00 0.00 H new ATOM 0 HG3 GLU A 104 14.305 17.894 12.116 1.00 0.00 H new ATOM 1655 N GLU A 105 10.611 20.466 9.115 1.00 0.00 N ATOM 1656 CA GLU A 105 9.808 21.639 8.780 1.00 0.00 C ATOM 1657 C GLU A 105 8.514 21.204 8.106 1.00 0.00 C ATOM 1658 O GLU A 105 7.455 21.736 8.380 1.00 0.00 O ATOM 1659 CB GLU A 105 10.566 22.535 7.807 1.00 0.00 C ATOM 1660 CG GLU A 105 11.904 23.012 8.304 1.00 0.00 C ATOM 1661 CD GLU A 105 11.778 23.881 9.523 1.00 0.00 C ATOM 1662 OE1 GLU A 105 11.435 25.070 9.383 1.00 0.00 O1- ATOM 1663 OE2 GLU A 105 11.984 23.404 10.647 1.00 0.00 O ATOM 0 H GLU A 105 11.249 20.171 8.376 1.00 0.00 H new ATOM 0 HA GLU A 105 9.595 22.181 9.701 1.00 0.00 H new ATOM 0 HB2 GLU A 105 10.713 21.992 6.873 1.00 0.00 H new ATOM 0 HB3 GLU A 105 9.948 23.403 7.577 1.00 0.00 H new ATOM 0 HG2 GLU A 105 12.532 22.152 8.536 1.00 0.00 H new ATOM 0 HG3 GLU A 105 12.406 23.569 7.513 1.00 0.00 H new ATOM 1670 N LEU A 106 8.622 20.217 7.238 1.00 0.00 N ATOM 1671 CA LEU A 106 7.501 19.761 6.400 1.00 0.00 C ATOM 1672 C LEU A 106 6.362 19.238 7.236 1.00 0.00 C ATOM 1673 O LEU A 106 5.201 19.550 6.990 1.00 0.00 O ATOM 1674 CB LEU A 106 7.937 18.649 5.459 1.00 0.00 C ATOM 1675 CG LEU A 106 9.174 18.902 4.621 1.00 0.00 C ATOM 1676 CD1 LEU A 106 9.392 17.754 3.671 1.00 0.00 C ATOM 1677 CD2 LEU A 106 9.084 20.217 3.885 1.00 0.00 C ATOM 0 H LEU A 106 9.487 19.699 7.084 1.00 0.00 H new ATOM 0 HA LEU A 106 7.171 20.629 5.829 1.00 0.00 H new ATOM 0 HB2 LEU A 106 8.108 17.751 6.052 1.00 0.00 H new ATOM 0 HB3 LEU A 106 7.109 18.432 4.784 1.00 0.00 H new ATOM 0 HG LEU A 106 10.035 18.970 5.286 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.283 17.942 3.071 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.524 16.833 4.238 1.00 0.00 H new ATOM 0 HD13 LEU A 106 8.527 17.655 3.015 1.00 0.00 H new ATOM 0 HD21 LEU A 106 9.988 20.366 3.294 1.00 0.00 H new ATOM 0 HD22 LEU A 106 8.217 20.206 3.225 1.00 0.00 H new ATOM 0 HD23 LEU A 106 8.982 21.030 4.604 1.00 0.00 H new ATOM 1689 N ASP A 107 6.711 18.481 8.260 1.00 0.00 N ATOM 1690 CA ASP A 107 5.743 17.838 9.142 1.00 0.00 C ATOM 1691 C ASP A 107 4.847 18.872 9.839 1.00 0.00 C ATOM 1692 O ASP A 107 3.764 18.567 10.272 1.00 0.00 O ATOM 1693 CB ASP A 107 6.466 16.908 10.141 1.00 0.00 C ATOM 1694 CG ASP A 107 5.536 16.107 11.023 1.00 0.00 C ATOM 1695 OD1 ASP A 107 5.163 14.978 10.633 1.00 0.00 O ATOM 1696 OD2 ASP A 107 5.199 16.557 12.143 1.00 0.00 O1- ATOM 0 H ASP A 107 7.682 18.291 8.509 1.00 0.00 H new ATOM 0 HA ASP A 107 5.079 17.217 8.541 1.00 0.00 H new ATOM 0 HB2 ASP A 107 7.104 16.221 9.585 1.00 0.00 H new ATOM 0 HB3 ASP A 107 7.120 17.509 10.772 1.00 0.00 H new ATOM 1701 N ARG A 108 5.298 20.113 9.857 1.00 0.00 N ATOM 1702 CA ARG A 108 4.572 21.243 10.447 1.00 0.00 C ATOM 1703 C ARG A 108 3.372 21.624 9.590 1.00 0.00 C ATOM 1704 O ARG A 108 2.384 22.156 10.090 1.00 0.00 O ATOM 1705 CB ARG A 108 5.508 22.450 10.573 1.00 0.00 C ATOM 1706 CG ARG A 108 6.526 22.460 11.737 1.00 0.00 C ATOM 1707 CD ARG A 108 7.214 21.134 12.050 1.00 0.00 C ATOM 1708 NE ARG A 108 6.324 20.087 12.604 1.00 0.00 N ATOM 1709 CZ ARG A 108 6.513 19.468 13.774 1.00 0.00 C ATOM 1710 NH1 ARG A 108 7.476 19.879 14.591 1.00 0.00 N1+ ATOM 1711 NH2 ARG A 108 5.757 18.419 14.106 1.00 0.00 N ATOM 0 H ARG A 108 6.197 20.378 9.456 1.00 0.00 H new ATOM 0 HA ARG A 108 4.217 20.944 11.433 1.00 0.00 H new ATOM 0 HB2 ARG A 108 6.066 22.539 9.641 1.00 0.00 H new ATOM 0 HB3 ARG A 108 4.890 23.344 10.662 1.00 0.00 H new ATOM 0 HG2 ARG A 108 7.295 23.199 11.512 1.00 0.00 H new ATOM 0 HG3 ARG A 108 6.012 22.799 12.637 1.00 0.00 H new ATOM 0 HD2 ARG A 108 7.673 20.755 11.137 1.00 0.00 H new ATOM 0 HD3 ARG A 108 8.021 21.318 12.760 1.00 0.00 H new ATOM 0 HE ARG A 108 5.508 19.819 12.053 1.00 0.00 H new ATOM 0 HH11 ARG A 108 8.069 20.665 14.325 1.00 0.00 H new ATOM 0 HH12 ARG A 108 7.622 19.409 15.484 1.00 0.00 H new ATOM 0 HH21 ARG A 108 5.034 18.089 13.467 1.00 0.00 H new ATOM 0 HH22 ARG A 108 5.902 17.948 14.999 1.00 0.00 H new ATOM 1725 N ASP A 109 3.457 21.352 8.312 1.00 0.00 N ATOM 1726 CA ASP A 109 2.372 21.679 7.397 1.00 0.00 C ATOM 1727 C ASP A 109 1.421 20.480 7.362 1.00 0.00 C ATOM 1728 O ASP A 109 0.215 20.621 7.273 1.00 0.00 O ATOM 1729 CB ASP A 109 2.945 21.946 5.986 1.00 0.00 C ATOM 1730 CG ASP A 109 2.059 22.825 5.099 1.00 0.00 C ATOM 1731 OD1 ASP A 109 0.850 22.564 4.957 1.00 0.00 O ATOM 1732 OD2 ASP A 109 2.580 23.812 4.520 1.00 0.00 O1- ATOM 0 H ASP A 109 4.262 20.905 7.874 1.00 0.00 H new ATOM 0 HA ASP A 109 1.843 22.573 7.726 1.00 0.00 H new ATOM 0 HB2 ASP A 109 3.921 22.421 6.087 1.00 0.00 H new ATOM 0 HB3 ASP A 109 3.105 20.991 5.486 1.00 0.00 H new ATOM 1737 N ILE A 110 1.998 19.294 7.528 1.00 0.00 N ATOM 1738 CA ILE A 110 1.259 18.023 7.459 1.00 0.00 C ATOM 1739 C ILE A 110 0.425 17.782 8.722 1.00 0.00 C ATOM 1740 O ILE A 110 -0.766 17.442 8.645 1.00 0.00 O ATOM 1741 CB ILE A 110 2.227 16.821 7.355 1.00 0.00 C ATOM 1742 CG1 ILE A 110 3.332 17.080 6.342 1.00 0.00 C ATOM 1743 CG2 ILE A 110 1.455 15.554 6.977 1.00 0.00 C ATOM 1744 CD1 ILE A 110 4.391 16.008 6.342 1.00 0.00 C ATOM 0 H ILE A 110 2.994 19.179 7.715 1.00 0.00 H new ATOM 0 HA ILE A 110 0.620 18.100 6.579 1.00 0.00 H new ATOM 0 HB ILE A 110 2.693 16.683 8.331 1.00 0.00 H new ATOM 0 HG12 ILE A 110 2.895 17.152 5.346 1.00 0.00 H new ATOM 0 HG13 ILE A 110 3.796 18.042 6.557 1.00 0.00 H new ATOM 0 HG21 ILE A 110 2.146 14.714 6.907 1.00 0.00 H new ATOM 0 HG22 ILE A 110 0.705 15.344 7.740 1.00 0.00 H new ATOM 0 HG23 ILE A 110 0.963 15.701 6.015 1.00 0.00 H new ATOM 0 HD11 ILE A 110 5.152 16.248 5.599 1.00 0.00 H new ATOM 0 HD12 ILE A 110 4.852 15.952 7.328 1.00 0.00 H new ATOM 0 HD13 ILE A 110 3.937 15.048 6.099 1.00 0.00 H new ATOM 1756 N VAL A 111 1.078 17.923 9.872 1.00 0.00 N ATOM 1757 CA VAL A 111 0.494 17.592 11.164 1.00 0.00 C ATOM 1758 C VAL A 111 -0.797 18.386 11.421 1.00 0.00 C ATOM 1759 O VAL A 111 -0.894 19.581 11.098 1.00 0.00 O ATOM 1760 CB VAL A 111 1.533 17.787 12.337 1.00 0.00 C ATOM 1761 CG1 VAL A 111 1.818 19.258 12.642 1.00 0.00 C ATOM 1762 CG2 VAL A 111 1.126 17.028 13.594 1.00 0.00 C ATOM 0 H VAL A 111 2.034 18.273 9.932 1.00 0.00 H new ATOM 0 HA VAL A 111 0.227 16.536 11.136 1.00 0.00 H new ATOM 0 HB VAL A 111 2.468 17.356 11.980 1.00 0.00 H new ATOM 0 HG11 VAL A 111 2.539 19.328 13.457 1.00 0.00 H new ATOM 0 HG12 VAL A 111 2.226 19.741 11.754 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.893 19.755 12.933 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.869 17.191 14.374 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.155 17.386 13.937 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.062 15.963 13.371 1.00 0.00 H new ATOM 1772 N SER A 112 -1.787 17.720 11.971 1.00 0.00 N ATOM 1773 CA SER A 112 -3.060 18.351 12.258 1.00 0.00 C ATOM 1774 C SER A 112 -3.047 18.962 13.657 1.00 0.00 C ATOM 1775 O SER A 112 -4.022 19.559 14.091 1.00 0.00 O ATOM 1776 CB SER A 112 -4.175 17.321 12.122 1.00 0.00 C ATOM 1777 OG SER A 112 -4.112 16.701 10.841 1.00 0.00 O ATOM 0 H SER A 112 -1.736 16.735 12.231 1.00 0.00 H new ATOM 0 HA SER A 112 -3.236 19.157 11.545 1.00 0.00 H new ATOM 0 HB2 SER A 112 -4.083 16.568 12.905 1.00 0.00 H new ATOM 0 HB3 SER A 112 -5.144 17.802 12.255 1.00 0.00 H new ATOM 0 HG SER A 112 -4.831 16.039 10.762 1.00 0.00 H new ATOM 1783 N LYS A 113 -1.892 18.811 14.338 1.00 0.00 N ATOM 1784 CA LYS A 113 -1.619 19.291 15.725 1.00 0.00 C ATOM 1785 C LYS A 113 -2.743 18.958 16.709 1.00 0.00 C ATOM 1786 O LYS A 113 -2.906 19.606 17.742 1.00 0.00 O ATOM 1787 CB LYS A 113 -1.166 20.797 15.826 1.00 0.00 C ATOM 1788 CG LYS A 113 -2.105 21.890 15.272 1.00 0.00 C ATOM 1789 CD LYS A 113 -1.991 22.046 13.760 1.00 0.00 C ATOM 1790 CE LYS A 113 -2.919 23.127 13.235 1.00 0.00 C ATOM 1791 NZ LYS A 113 -2.832 23.280 11.763 1.00 0.00 N1+ ATOM 0 H LYS A 113 -1.088 18.335 13.929 1.00 0.00 H new ATOM 0 HA LYS A 113 -0.747 18.714 16.033 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -0.985 21.018 16.878 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -0.210 20.890 15.311 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -3.135 21.646 15.532 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -1.872 22.841 15.751 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -0.962 22.290 13.496 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -2.227 21.098 13.278 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -3.945 22.887 13.513 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -2.673 24.076 13.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -3.483 24.029 11.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -1.859 23.535 11.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -3.092 22.383 11.305 1.00 0.00 H new ATOM 1805 N ASN A 114 -3.439 17.886 16.422 1.00 0.00 N ATOM 1806 CA ASN A 114 -4.573 17.462 17.215 1.00 0.00 C ATOM 1807 C ASN A 114 -4.093 16.481 18.262 1.00 0.00 C ATOM 1808 O ASN A 114 -4.350 16.647 19.454 1.00 0.00 O ATOM 1809 CB ASN A 114 -5.645 16.817 16.297 1.00 0.00 C ATOM 1810 CG ASN A 114 -6.951 16.419 17.005 1.00 0.00 C ATOM 1811 OD1 ASN A 114 -6.977 16.065 18.182 1.00 0.00 O ATOM 1812 ND2 ASN A 114 -8.042 16.471 16.283 1.00 0.00 N ATOM 0 H ASN A 114 -3.236 17.278 15.628 1.00 0.00 H new ATOM 0 HA ASN A 114 -5.028 18.319 17.712 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -5.882 17.515 15.494 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -5.217 15.930 15.831 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -8.939 16.215 16.695 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -7.995 16.768 15.308 1.00 0.00 H new ATOM 1819 N ASN A 115 -3.358 15.500 17.824 1.00 0.00 N ATOM 1820 CA ASN A 115 -2.866 14.461 18.704 1.00 0.00 C ATOM 1821 C ASN A 115 -1.358 14.368 18.586 1.00 0.00 C ATOM 1822 O ASN A 115 -0.766 14.916 17.634 1.00 0.00 O ATOM 1823 CB ASN A 115 -3.505 13.091 18.357 1.00 0.00 C ATOM 1824 CG ASN A 115 -3.058 12.530 17.005 1.00 0.00 C ATOM 1825 OD1 ASN A 115 -2.074 11.810 16.919 1.00 0.00 O ATOM 1826 ND2 ASN A 115 -3.796 12.819 15.963 1.00 0.00 N ATOM 0 H ASN A 115 -3.079 15.391 16.849 1.00 0.00 H new ATOM 0 HA ASN A 115 -3.140 14.717 19.728 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -3.254 12.374 19.139 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -4.590 13.195 18.357 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -3.556 12.440 15.047 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -4.611 13.423 16.067 1.00 0.00 H new ATOM 1833 N ALA A 116 -0.742 13.708 19.538 1.00 0.00 N ATOM 1834 CA ALA A 116 0.678 13.464 19.515 1.00 0.00 C ATOM 1835 C ALA A 116 0.918 12.199 18.721 1.00 0.00 C ATOM 1836 O ALA A 116 0.644 11.089 19.197 1.00 0.00 O ATOM 1837 CB ALA A 116 1.225 13.330 20.930 1.00 0.00 C ATOM 0 H ALA A 116 -1.216 13.323 20.355 1.00 0.00 H new ATOM 0 HA ALA A 116 1.197 14.302 19.049 1.00 0.00 H new ATOM 0 HB1 ALA A 116 2.299 13.146 20.889 1.00 0.00 H new ATOM 0 HB2 ALA A 116 1.035 14.250 21.482 1.00 0.00 H new ATOM 0 HB3 ALA A 116 0.733 12.497 21.433 1.00 0.00 H new ATOM 1843 N GLU A 117 1.373 12.364 17.512 1.00 0.00 N ATOM 1844 CA GLU A 117 1.537 11.252 16.605 1.00 0.00 C ATOM 1845 C GLU A 117 3.003 10.938 16.325 1.00 0.00 C ATOM 1846 O GLU A 117 3.325 9.934 15.667 1.00 0.00 O ATOM 1847 CB GLU A 117 0.746 11.506 15.320 1.00 0.00 C ATOM 1848 CG GLU A 117 1.062 12.821 14.628 1.00 0.00 C ATOM 1849 CD GLU A 117 0.166 13.065 13.445 1.00 0.00 C ATOM 1850 OE1 GLU A 117 0.322 12.369 12.413 1.00 0.00 O ATOM 1851 OE2 GLU A 117 -0.710 13.955 13.517 1.00 0.00 O1- ATOM 0 H GLU A 117 1.641 13.268 17.123 1.00 0.00 H new ATOM 0 HA GLU A 117 1.134 10.362 17.087 1.00 0.00 H new ATOM 0 HB2 GLU A 117 0.939 10.690 14.624 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -0.318 11.481 15.554 1.00 0.00 H new ATOM 0 HG2 GLU A 117 0.954 13.640 15.339 1.00 0.00 H new ATOM 0 HG3 GLU A 117 2.102 12.818 14.301 1.00 0.00 H new ATOM 1858 N LYS A 118 3.885 11.773 16.822 1.00 0.00 N ATOM 1859 CA LYS A 118 5.295 11.547 16.670 1.00 0.00 C ATOM 1860 C LYS A 118 5.971 12.125 17.907 1.00 0.00 C ATOM 1861 O LYS A 118 6.523 13.230 17.842 1.00 0.00 O ATOM 1862 CB LYS A 118 5.807 12.228 15.369 1.00 0.00 C ATOM 1863 CG LYS A 118 7.047 11.573 14.714 1.00 0.00 C ATOM 1864 CD LYS A 118 8.314 11.622 15.569 1.00 0.00 C ATOM 1865 CE LYS A 118 8.856 13.035 15.717 1.00 0.00 C ATOM 1866 NZ LYS A 118 9.228 13.625 14.417 1.00 0.00 N1+ ATOM 1867 OXT LYS A 118 5.885 11.503 18.982 1.00 0.00 O1- ATOM 0 H LYS A 118 3.644 12.619 17.338 1.00 0.00 H new ATOM 0 HA LYS A 118 5.523 10.485 16.582 1.00 0.00 H new ATOM 0 HB2 LYS A 118 4.996 12.236 14.641 1.00 0.00 H new ATOM 0 HB3 LYS A 118 6.044 13.268 15.594 1.00 0.00 H new ATOM 0 HG2 LYS A 118 6.816 10.532 14.488 1.00 0.00 H new ATOM 0 HG3 LYS A 118 7.245 12.069 13.764 1.00 0.00 H new ATOM 0 HD2 LYS A 118 8.100 11.212 16.556 1.00 0.00 H new ATOM 0 HD3 LYS A 118 9.078 10.987 15.119 1.00 0.00 H new ATOM 0 HE2 LYS A 118 8.105 13.662 16.198 1.00 0.00 H new ATOM 0 HE3 LYS A 118 9.728 13.022 16.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 9.832 14.457 14.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 9.747 12.922 13.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 8.368 13.912 13.907 1.00 0.00 H new TER 1881 LYS A 118 ATOM 1882 N GLY B 200 35.449 18.541 15.375 1.00 0.00 N ATOM 1883 CA GLY B 200 34.048 18.179 15.371 1.00 0.00 C ATOM 1884 C GLY B 200 33.861 16.816 14.784 1.00 0.00 C ATOM 1885 O GLY B 200 34.680 16.361 13.977 1.00 0.00 O ATOM 0 HA2 GLY B 200 33.658 18.200 16.389 1.00 0.00 H new ATOM 0 HA3 GLY B 200 33.479 18.910 14.797 1.00 0.00 H new ATOM 1891 N SER B 201 32.836 16.153 15.196 1.00 0.00 N ATOM 1892 CA SER B 201 32.521 14.852 14.695 1.00 0.00 C ATOM 1893 C SER B 201 31.044 14.787 14.335 1.00 0.00 C ATOM 1894 O SER B 201 30.679 14.619 13.173 1.00 0.00 O ATOM 1895 CB SER B 201 32.918 13.808 15.740 1.00 0.00 C ATOM 1896 OG SER B 201 32.471 14.196 17.040 1.00 0.00 O ATOM 0 H SER B 201 32.183 16.500 15.899 1.00 0.00 H new ATOM 0 HA SER B 201 33.082 14.641 13.784 1.00 0.00 H new ATOM 0 HB2 SER B 201 32.489 12.841 15.476 1.00 0.00 H new ATOM 0 HB3 SER B 201 34.001 13.685 15.745 1.00 0.00 H new ATOM 0 HG SER B 201 32.733 13.514 17.693 1.00 0.00 H new ATOM 1902 N LYS B 202 30.208 14.991 15.327 1.00 0.00 N ATOM 1903 CA LYS B 202 28.773 14.991 15.143 1.00 0.00 C ATOM 1904 C LYS B 202 28.266 16.411 14.999 1.00 0.00 C ATOM 1905 O LYS B 202 27.063 16.640 15.008 1.00 0.00 O ATOM 1906 CB LYS B 202 28.029 14.287 16.304 1.00 0.00 C ATOM 1907 CG LYS B 202 28.102 12.751 16.335 1.00 0.00 C ATOM 1908 CD LYS B 202 29.491 12.219 16.639 1.00 0.00 C ATOM 1909 CE LYS B 202 29.510 10.694 16.715 1.00 0.00 C ATOM 1910 NZ LYS B 202 29.160 10.051 15.423 1.00 0.00 N1+ ATOM 0 H LYS B 202 30.504 15.162 16.288 1.00 0.00 H new ATOM 0 HA LYS B 202 28.567 14.429 14.232 1.00 0.00 H new ATOM 0 HB2 LYS B 202 28.428 14.666 17.245 1.00 0.00 H new ATOM 0 HB3 LYS B 202 26.979 14.578 16.263 1.00 0.00 H new ATOM 0 HG2 LYS B 202 27.406 12.377 17.085 1.00 0.00 H new ATOM 0 HG3 LYS B 202 27.774 12.360 15.372 1.00 0.00 H new ATOM 0 HD2 LYS B 202 30.185 12.553 15.868 1.00 0.00 H new ATOM 0 HD3 LYS B 202 29.841 12.634 17.584 1.00 0.00 H new ATOM 0 HE2 LYS B 202 30.501 10.362 17.024 1.00 0.00 H new ATOM 0 HE3 LYS B 202 28.809 10.364 17.482 1.00 0.00 H new ATOM 0 HZ1 LYS B 202 29.335 9.028 15.486 1.00 0.00 H new ATOM 0 HZ2 LYS B 202 28.155 10.218 15.213 1.00 0.00 H new ATOM 0 HZ3 LYS B 202 29.744 10.456 14.664 1.00 0.00 H new ATOM 1924 N SER B 203 29.200 17.358 14.868 1.00 0.00 N ATOM 1925 CA SER B 203 28.900 18.775 14.677 1.00 0.00 C ATOM 1926 C SER B 203 27.978 18.949 13.465 1.00 0.00 C ATOM 1927 O SER B 203 27.036 19.742 13.481 1.00 0.00 O ATOM 1928 CB SER B 203 30.213 19.516 14.470 1.00 0.00 C ATOM 1929 OG SER B 203 31.126 19.173 15.503 1.00 0.00 O ATOM 0 H SER B 203 30.199 17.156 14.892 1.00 0.00 H new ATOM 0 HA SER B 203 28.388 19.180 15.550 1.00 0.00 H new ATOM 0 HB2 SER B 203 30.636 19.261 13.498 1.00 0.00 H new ATOM 0 HB3 SER B 203 30.038 20.592 14.469 1.00 0.00 H new ATOM 0 HG SER B 203 31.728 19.927 15.671 1.00 0.00 H new ATOM 1935 N GLN B 204 28.261 18.197 12.429 1.00 0.00 N ATOM 1936 CA GLN B 204 27.417 18.108 11.287 1.00 0.00 C ATOM 1937 C GLN B 204 27.682 16.754 10.680 1.00 0.00 C ATOM 1938 O GLN B 204 28.830 16.323 10.605 1.00 0.00 O ATOM 1939 CB GLN B 204 27.667 19.215 10.273 1.00 0.00 C ATOM 1940 CG GLN B 204 26.567 19.295 9.228 1.00 0.00 C ATOM 1941 CD GLN B 204 26.815 20.330 8.149 1.00 0.00 C ATOM 1942 OE1 GLN B 204 25.883 20.907 7.610 1.00 0.00 O ATOM 1943 NE2 GLN B 204 28.057 20.552 7.811 1.00 0.00 N ATOM 0 H GLN B 204 29.102 17.624 12.366 1.00 0.00 H new ATOM 0 HA GLN B 204 26.375 18.229 11.584 1.00 0.00 H new ATOM 0 HB2 GLN B 204 27.743 20.170 10.792 1.00 0.00 H new ATOM 0 HB3 GLN B 204 28.623 19.044 9.779 1.00 0.00 H new ATOM 0 HG2 GLN B 204 26.453 18.317 8.760 1.00 0.00 H new ATOM 0 HG3 GLN B 204 25.624 19.522 9.725 1.00 0.00 H new ATOM 0 HE21 GLN B 204 28.811 20.052 8.282 1.00 0.00 H new ATOM 0 HE22 GLN B 204 28.273 21.225 7.076 1.00 0.00 H new ATOM 1952 N TYR B 205 26.648 16.091 10.288 1.00 0.00 N ATOM 1953 CA TYR B 205 26.742 14.716 9.834 1.00 0.00 C ATOM 1954 C TYR B 205 26.945 14.679 8.336 1.00 0.00 C ATOM 1955 O TYR B 205 27.858 14.019 7.826 1.00 0.00 O ATOM 1956 CB TYR B 205 25.452 13.991 10.208 1.00 0.00 C ATOM 1957 CG TYR B 205 24.951 14.375 11.582 1.00 0.00 C ATOM 1958 CD1 TYR B 205 25.444 13.775 12.730 1.00 0.00 C ATOM 1959 CD2 TYR B 205 23.999 15.377 11.720 1.00 0.00 C ATOM 1960 CE1 TYR B 205 24.999 14.166 13.977 1.00 0.00 C ATOM 1961 CE2 TYR B 205 23.551 15.769 12.952 1.00 0.00 C ATOM 1962 CZ TYR B 205 24.050 15.166 14.080 1.00 0.00 C ATOM 1963 OH TYR B 205 23.600 15.566 15.317 1.00 0.00 O ATOM 0 H TYR B 205 25.703 16.475 10.267 1.00 0.00 H new ATOM 0 HA TYR B 205 27.592 14.225 10.308 1.00 0.00 H new ATOM 0 HB2 TYR B 205 24.684 14.217 9.468 1.00 0.00 H new ATOM 0 HB3 TYR B 205 25.621 12.915 10.174 1.00 0.00 H new ATOM 0 HD1 TYR B 205 26.184 12.993 12.648 1.00 0.00 H new ATOM 0 HD2 TYR B 205 23.604 15.857 10.837 1.00 0.00 H new ATOM 0 HE1 TYR B 205 25.390 13.694 14.866 1.00 0.00 H new ATOM 0 HE2 TYR B 205 22.809 16.549 13.037 1.00 0.00 H new ATOM 0 HH TYR B 205 22.936 16.279 15.209 1.00 0.00 H new ATOM 1973 N ILE B 206 26.099 15.399 7.634 1.00 0.00 N ATOM 1974 CA ILE B 206 26.171 15.481 6.199 1.00 0.00 C ATOM 1975 C ILE B 206 26.435 16.927 5.919 1.00 0.00 C ATOM 1976 O ILE B 206 25.848 17.771 6.574 1.00 0.00 O ATOM 1977 CB ILE B 206 24.833 15.141 5.502 1.00 0.00 C ATOM 1978 CG1 ILE B 206 24.001 14.111 6.284 1.00 0.00 C ATOM 1979 CG2 ILE B 206 25.118 14.610 4.099 1.00 0.00 C ATOM 1980 CD1 ILE B 206 24.644 12.749 6.439 1.00 0.00 C ATOM 0 H ILE B 206 25.342 15.944 8.046 1.00 0.00 H new ATOM 0 HA ILE B 206 26.922 14.780 5.834 1.00 0.00 H new ATOM 0 HB ILE B 206 24.246 16.058 5.456 1.00 0.00 H new ATOM 0 HG12 ILE B 206 23.794 14.513 7.276 1.00 0.00 H new ATOM 0 HG13 ILE B 206 23.041 13.987 5.783 1.00 0.00 H new ATOM 0 HG21 ILE B 206 24.178 14.369 3.603 1.00 0.00 H new ATOM 0 HG22 ILE B 206 25.647 15.369 3.523 1.00 0.00 H new ATOM 0 HG23 ILE B 206 25.733 13.712 4.168 1.00 0.00 H new ATOM 0 HD11 ILE B 206 23.980 12.095 7.004 1.00 0.00 H new ATOM 0 HD12 ILE B 206 24.826 12.318 5.454 1.00 0.00 H new ATOM 0 HD13 ILE B 206 25.590 12.852 6.970 1.00 0.00 H new ATOM 1992 N ASP B 207 27.228 17.221 4.948 1.00 0.00 N ATOM 1993 CA ASP B 207 27.660 18.603 4.728 1.00 0.00 C ATOM 1994 C ASP B 207 26.772 19.325 3.725 1.00 0.00 C ATOM 1995 O ASP B 207 27.038 20.457 3.308 1.00 0.00 O ATOM 1996 CB ASP B 207 29.110 18.594 4.279 1.00 0.00 C ATOM 1997 CG ASP B 207 29.737 19.979 4.234 1.00 0.00 C ATOM 1998 OD1 ASP B 207 29.811 20.658 5.286 1.00 0.00 O1- ATOM 1999 OD2 ASP B 207 30.133 20.430 3.142 1.00 0.00 O ATOM 0 H ASP B 207 27.602 16.544 4.283 1.00 0.00 H new ATOM 0 HA ASP B 207 27.571 19.155 5.663 1.00 0.00 H new ATOM 0 HB2 ASP B 207 29.688 17.963 4.955 1.00 0.00 H new ATOM 0 HB3 ASP B 207 29.173 18.142 3.289 1.00 0.00 H new ATOM 2004 N ILE B 208 25.691 18.710 3.375 1.00 0.00 N ATOM 2005 CA ILE B 208 24.824 19.301 2.397 1.00 0.00 C ATOM 2006 C ILE B 208 23.823 20.179 3.125 1.00 0.00 C ATOM 2007 O ILE B 208 23.999 21.398 3.221 1.00 0.00 O ATOM 2008 CB ILE B 208 24.049 18.250 1.565 1.00 0.00 C ATOM 2009 CG1 ILE B 208 24.861 16.972 1.390 1.00 0.00 C ATOM 2010 CG2 ILE B 208 23.751 18.837 0.210 1.00 0.00 C ATOM 2011 CD1 ILE B 208 24.091 15.855 0.699 1.00 0.00 C ATOM 0 H ILE B 208 25.385 17.809 3.743 1.00 0.00 H new ATOM 0 HA ILE B 208 25.442 19.871 1.703 1.00 0.00 H new ATOM 0 HB ILE B 208 23.128 17.997 2.091 1.00 0.00 H new ATOM 0 HG12 ILE B 208 25.757 17.196 0.812 1.00 0.00 H new ATOM 0 HG13 ILE B 208 25.192 16.624 2.369 1.00 0.00 H new ATOM 0 HG21 ILE B 208 23.205 18.109 -0.390 1.00 0.00 H new ATOM 0 HG22 ILE B 208 23.147 19.736 0.328 1.00 0.00 H new ATOM 0 HG23 ILE B 208 24.686 19.091 -0.290 1.00 0.00 H new ATOM 0 HD11 ILE B 208 24.729 14.976 0.607 1.00 0.00 H new ATOM 0 HD12 ILE B 208 23.209 15.603 1.287 1.00 0.00 H new ATOM 0 HD13 ILE B 208 23.783 16.185 -0.293 1.00 0.00 H new ATOM 2023 N MET B 209 22.838 19.514 3.734 1.00 0.00 N ATOM 2024 CA MET B 209 21.737 20.149 4.461 1.00 0.00 C ATOM 2025 C MET B 209 20.831 21.053 3.592 1.00 0.00 C ATOM 2026 O MET B 209 21.277 21.670 2.619 1.00 0.00 O ATOM 2027 CB MET B 209 22.212 20.812 5.758 1.00 0.00 C ATOM 2028 CG MET B 209 22.526 19.778 6.810 1.00 0.00 C ATOM 2029 SD MET B 209 21.071 18.766 7.130 1.00 0.00 S ATOM 2030 CE MET B 209 21.736 17.548 8.212 1.00 0.00 C ATOM 0 H MET B 209 22.783 18.495 3.735 1.00 0.00 H new ATOM 0 HA MET B 209 21.073 19.336 4.756 1.00 0.00 H new ATOM 0 HB2 MET B 209 23.098 21.414 5.559 1.00 0.00 H new ATOM 0 HB3 MET B 209 21.442 21.490 6.127 1.00 0.00 H new ATOM 0 HG2 MET B 209 23.352 19.148 6.478 1.00 0.00 H new ATOM 0 HG3 MET B 209 22.848 20.268 7.729 1.00 0.00 H new ATOM 0 HE1 MET B 209 20.951 16.848 8.498 1.00 0.00 H new ATOM 0 HE2 MET B 209 22.536 17.009 7.705 1.00 0.00 H new ATOM 0 HE3 MET B 209 22.133 18.032 9.104 1.00 0.00 H new ATOM 2040 N PRO B 210 19.528 21.105 3.907 1.00 0.00 N ATOM 2041 CA PRO B 210 18.563 21.851 3.106 1.00 0.00 C ATOM 2042 C PRO B 210 18.679 23.374 3.263 1.00 0.00 C ATOM 2043 O PRO B 210 19.216 23.873 4.273 1.00 0.00 O ATOM 2044 CB PRO B 210 17.218 21.371 3.638 1.00 0.00 C ATOM 2045 CG PRO B 210 17.488 20.993 5.052 1.00 0.00 C ATOM 2046 CD PRO B 210 18.873 20.426 5.058 1.00 0.00 C ATOM 0 HA PRO B 210 18.718 21.675 2.042 1.00 0.00 H new ATOM 0 HB2 PRO B 210 16.464 22.155 3.574 1.00 0.00 H new ATOM 0 HB3 PRO B 210 16.845 20.522 3.065 1.00 0.00 H new ATOM 0 HG2 PRO B 210 17.416 21.859 5.710 1.00 0.00 H new ATOM 0 HG3 PRO B 210 16.763 20.261 5.408 1.00 0.00 H new ATOM 0 HD2 PRO B 210 19.389 20.636 5.995 1.00 0.00 H new ATOM 0 HD3 PRO B 210 18.865 19.343 4.934 1.00 0.00 H new ATOM 2054 N ASP B 211 18.180 24.111 2.272 1.00 0.00 N ATOM 2055 CA ASP B 211 18.193 25.579 2.347 1.00 0.00 C ATOM 2056 C ASP B 211 16.852 26.099 2.815 1.00 0.00 C ATOM 2057 O ASP B 211 16.785 26.896 3.736 1.00 0.00 O ATOM 2058 CB ASP B 211 18.531 26.260 1.009 1.00 0.00 C ATOM 2059 CG ASP B 211 19.896 25.978 0.479 1.00 0.00 C ATOM 2060 OD1 ASP B 211 20.898 26.328 1.129 1.00 0.00 O1- ATOM 2061 OD2 ASP B 211 20.001 25.390 -0.606 1.00 0.00 O ATOM 0 H ASP B 211 17.768 23.729 1.421 1.00 0.00 H new ATOM 0 HA ASP B 211 18.980 25.826 3.059 1.00 0.00 H new ATOM 0 HB2 ASP B 211 17.798 25.947 0.265 1.00 0.00 H new ATOM 0 HB3 ASP B 211 18.421 27.338 1.130 1.00 0.00 H new ATOM 2066 N PHE B 212 15.777 25.641 2.152 1.00 0.00 N ATOM 2067 CA PHE B 212 14.377 26.061 2.457 1.00 0.00 C ATOM 2068 C PHE B 212 14.095 27.516 2.119 1.00 0.00 C ATOM 2069 O PHE B 212 13.111 28.092 2.584 1.00 0.00 O ATOM 2070 CB PHE B 212 13.958 25.785 3.908 1.00 0.00 C ATOM 2071 CG PHE B 212 13.688 24.360 4.218 1.00 0.00 C ATOM 2072 CD1 PHE B 212 12.635 23.709 3.607 1.00 0.00 C ATOM 2073 CD2 PHE B 212 14.451 23.679 5.140 1.00 0.00 C ATOM 2074 CE1 PHE B 212 12.350 22.408 3.909 1.00 0.00 C ATOM 2075 CE2 PHE B 212 14.171 22.369 5.442 1.00 0.00 C ATOM 2076 CZ PHE B 212 13.115 21.739 4.822 1.00 0.00 C ATOM 0 H PHE B 212 15.842 24.969 1.388 1.00 0.00 H new ATOM 0 HA PHE B 212 13.772 25.434 1.802 1.00 0.00 H new ATOM 0 HB2 PHE B 212 14.744 26.144 4.573 1.00 0.00 H new ATOM 0 HB3 PHE B 212 13.063 26.366 4.130 1.00 0.00 H new ATOM 0 HD1 PHE B 212 12.030 24.234 2.883 1.00 0.00 H new ATOM 0 HD2 PHE B 212 15.275 24.178 5.629 1.00 0.00 H new ATOM 0 HE1 PHE B 212 11.522 21.909 3.427 1.00 0.00 H new ATOM 0 HE2 PHE B 212 14.775 21.836 6.161 1.00 0.00 H new ATOM 0 HZ PHE B 212 12.890 20.710 5.059 1.00 0.00 H new ATOM 2086 N SER B 213 14.878 28.074 1.267 1.00 0.00 N ATOM 2087 CA SER B 213 14.708 29.429 0.898 1.00 0.00 C ATOM 2088 C SER B 213 13.922 29.460 -0.392 1.00 0.00 C ATOM 2089 O SER B 213 13.682 28.405 -0.986 1.00 0.00 O ATOM 2090 CB SER B 213 16.088 30.054 0.700 1.00 0.00 C ATOM 2091 OG SER B 213 16.856 29.983 1.894 1.00 0.00 O ATOM 0 H SER B 213 15.656 27.601 0.806 1.00 0.00 H new ATOM 0 HA SER B 213 14.174 29.990 1.665 1.00 0.00 H new ATOM 0 HB2 SER B 213 16.612 29.539 -0.105 1.00 0.00 H new ATOM 0 HB3 SER B 213 15.979 31.095 0.395 1.00 0.00 H new ATOM 0 HG SER B 213 17.735 30.388 1.742 1.00 0.00 H new ATOM 2097 N PRO B 214 13.412 30.597 -0.801 1.00 0.00 N ATOM 2098 CA PRO B 214 12.879 30.717 -2.122 1.00 0.00 C ATOM 2099 C PRO B 214 13.988 30.969 -3.100 1.00 0.00 C ATOM 2100 O PRO B 214 15.137 31.301 -2.724 1.00 0.00 O ATOM 2101 CB PRO B 214 12.047 31.979 -2.077 1.00 0.00 C ATOM 2102 CG PRO B 214 12.686 32.801 -1.023 1.00 0.00 C ATOM 2103 CD PRO B 214 13.215 31.832 -0.004 1.00 0.00 C ATOM 0 HA PRO B 214 12.331 29.822 -2.416 1.00 0.00 H new ATOM 0 HB2 PRO B 214 12.050 32.492 -3.039 1.00 0.00 H new ATOM 0 HB3 PRO B 214 11.007 31.761 -1.836 1.00 0.00 H new ATOM 0 HG2 PRO B 214 13.490 33.409 -1.437 1.00 0.00 H new ATOM 0 HG3 PRO B 214 11.967 33.486 -0.573 1.00 0.00 H new ATOM 0 HD2 PRO B 214 14.147 32.180 0.440 1.00 0.00 H new ATOM 0 HD3 PRO B 214 12.510 31.679 0.813 1.00 0.00 H new ATOM 2111 N SER B 215 13.676 30.797 -4.303 1.00 0.00 N ATOM 2112 CA SER B 215 14.478 31.264 -5.335 1.00 0.00 C ATOM 2113 C SER B 215 14.039 32.703 -5.584 1.00 0.00 C ATOM 2114 O SER B 215 13.204 33.258 -4.872 1.00 0.00 O ATOM 2115 CB SER B 215 14.332 30.429 -6.612 1.00 0.00 C ATOM 2116 OG SER B 215 13.083 30.662 -7.271 1.00 0.00 O ATOM 0 H SER B 215 12.832 30.314 -4.610 1.00 0.00 H new ATOM 0 HA SER B 215 15.530 31.196 -5.058 1.00 0.00 H new ATOM 0 HB2 SER B 215 15.150 30.664 -7.293 1.00 0.00 H new ATOM 0 HB3 SER B 215 14.418 29.371 -6.364 1.00 0.00 H new ATOM 0 HG SER B 215 12.521 29.862 -7.199 1.00 0.00 H new ATOM 2122 N GLY B 216 14.608 33.268 -6.517 1.00 0.00 N ATOM 2123 CA GLY B 216 14.323 34.611 -6.918 1.00 0.00 C ATOM 2124 C GLY B 216 13.847 34.596 -8.336 1.00 0.00 C ATOM 2125 O GLY B 216 13.559 35.634 -8.925 1.00 0.00 O ATOM 0 H GLY B 216 15.331 32.820 -7.080 1.00 0.00 H new ATOM 0 HA2 GLY B 216 13.563 35.046 -6.269 1.00 0.00 H new ATOM 0 HA3 GLY B 216 15.215 35.231 -6.825 1.00 0.00 H new ATOM 2129 N LEU B 217 13.758 33.390 -8.886 1.00 0.00 N ATOM 2130 CA LEU B 217 13.295 33.189 -10.242 1.00 0.00 C ATOM 2131 C LEU B 217 11.808 33.251 -10.185 1.00 0.00 C ATOM 2132 O LEU B 217 11.149 33.985 -10.910 1.00 0.00 O ATOM 2133 CB LEU B 217 13.604 31.753 -10.715 1.00 0.00 C ATOM 2134 CG LEU B 217 14.960 31.149 -10.393 1.00 0.00 C ATOM 2135 CD1 LEU B 217 15.000 29.721 -10.864 1.00 0.00 C ATOM 2136 CD2 LEU B 217 16.070 31.929 -11.020 1.00 0.00 C ATOM 0 H LEU B 217 14.006 32.529 -8.399 1.00 0.00 H new ATOM 0 HA LEU B 217 13.763 33.924 -10.897 1.00 0.00 H new ATOM 0 HB2 LEU B 217 12.843 31.096 -10.294 1.00 0.00 H new ATOM 0 HB3 LEU B 217 13.482 31.729 -11.798 1.00 0.00 H new ATOM 0 HG LEU B 217 15.101 31.183 -9.313 1.00 0.00 H new ATOM 0 HD11 LEU B 217 15.973 29.289 -10.632 1.00 0.00 H new ATOM 0 HD12 LEU B 217 14.220 29.150 -10.360 1.00 0.00 H new ATOM 0 HD13 LEU B 217 14.835 29.688 -11.941 1.00 0.00 H new ATOM 0 HD21 LEU B 217 17.025 31.468 -10.769 1.00 0.00 H new ATOM 0 HD22 LEU B 217 15.944 31.935 -12.103 1.00 0.00 H new ATOM 0 HD23 LEU B 217 16.051 32.953 -10.647 1.00 0.00 H new ATOM 2148 N LEU B 218 11.321 32.496 -9.238 1.00 0.00 N ATOM 2149 CA LEU B 218 9.946 32.157 -9.057 1.00 0.00 C ATOM 2150 C LEU B 218 9.010 33.364 -9.043 1.00 0.00 C ATOM 2151 O LEU B 218 7.960 33.339 -9.687 1.00 0.00 O ATOM 2152 CB LEU B 218 9.821 31.347 -7.793 1.00 0.00 C ATOM 2153 CG LEU B 218 8.704 30.297 -7.829 1.00 0.00 C ATOM 2154 CD1 LEU B 218 8.926 29.304 -8.935 1.00 0.00 C ATOM 2155 CD2 LEU B 218 8.569 29.583 -6.532 1.00 0.00 C ATOM 0 H LEU B 218 11.920 32.076 -8.527 1.00 0.00 H new ATOM 0 HA LEU B 218 9.627 31.572 -9.919 1.00 0.00 H new ATOM 0 HB2 LEU B 218 10.770 30.846 -7.600 1.00 0.00 H new ATOM 0 HB3 LEU B 218 9.642 32.023 -6.957 1.00 0.00 H new ATOM 0 HG LEU B 218 7.776 30.836 -8.018 1.00 0.00 H new ATOM 0 HD11 LEU B 218 8.118 28.573 -8.935 1.00 0.00 H new ATOM 0 HD12 LEU B 218 8.945 29.824 -9.893 1.00 0.00 H new ATOM 0 HD13 LEU B 218 9.877 28.794 -8.781 1.00 0.00 H new ATOM 0 HD21 LEU B 218 7.766 28.849 -6.603 1.00 0.00 H new ATOM 0 HD22 LEU B 218 9.505 29.076 -6.297 1.00 0.00 H new ATOM 0 HD23 LEU B 218 8.337 30.300 -5.744 1.00 0.00 H new ATOM 2167 N GLU B 219 9.416 34.422 -8.362 1.00 0.00 N ATOM 2168 CA GLU B 219 8.640 35.661 -8.268 1.00 0.00 C ATOM 2169 C GLU B 219 8.400 36.316 -9.648 1.00 0.00 C ATOM 2170 O GLU B 219 7.490 37.125 -9.808 1.00 0.00 O ATOM 2171 CB GLU B 219 9.346 36.645 -7.333 1.00 0.00 C ATOM 2172 CG GLU B 219 10.769 36.981 -7.752 1.00 0.00 C ATOM 2173 CD GLU B 219 11.438 37.949 -6.823 1.00 0.00 C ATOM 2174 OE1 GLU B 219 11.299 39.162 -7.017 1.00 0.00 O ATOM 2175 OE2 GLU B 219 12.133 37.521 -5.887 1.00 0.00 O1- ATOM 0 H GLU B 219 10.299 34.452 -7.853 1.00 0.00 H new ATOM 0 HA GLU B 219 7.661 35.402 -7.864 1.00 0.00 H new ATOM 0 HB2 GLU B 219 8.765 37.566 -7.285 1.00 0.00 H new ATOM 0 HB3 GLU B 219 9.363 36.226 -6.327 1.00 0.00 H new ATOM 0 HG2 GLU B 219 11.356 36.063 -7.796 1.00 0.00 H new ATOM 0 HG3 GLU B 219 10.757 37.400 -8.758 1.00 0.00 H new ATOM 2182 N LEU B 220 9.225 35.977 -10.618 1.00 0.00 N ATOM 2183 CA LEU B 220 9.098 36.513 -11.965 1.00 0.00 C ATOM 2184 C LEU B 220 8.438 35.486 -12.871 1.00 0.00 C ATOM 2185 O LEU B 220 7.703 35.827 -13.799 1.00 0.00 O ATOM 2186 CB LEU B 220 10.486 36.859 -12.529 1.00 0.00 C ATOM 2187 CG LEU B 220 11.340 37.820 -11.697 1.00 0.00 C ATOM 2188 CD1 LEU B 220 12.688 38.048 -12.360 1.00 0.00 C ATOM 2189 CD2 LEU B 220 10.622 39.140 -11.484 1.00 0.00 C ATOM 0 H LEU B 220 10.000 35.325 -10.499 1.00 0.00 H new ATOM 0 HA LEU B 220 8.486 37.414 -11.924 1.00 0.00 H new ATOM 0 HB2 LEU B 220 11.043 35.931 -12.658 1.00 0.00 H new ATOM 0 HB3 LEU B 220 10.353 37.291 -13.521 1.00 0.00 H new ATOM 0 HG LEU B 220 11.507 37.364 -10.721 1.00 0.00 H new ATOM 0 HD11 LEU B 220 13.280 38.734 -11.754 1.00 0.00 H new ATOM 0 HD12 LEU B 220 13.214 37.098 -12.452 1.00 0.00 H new ATOM 0 HD13 LEU B 220 12.538 38.477 -13.351 1.00 0.00 H new ATOM 0 HD21 LEU B 220 11.250 39.804 -10.890 1.00 0.00 H new ATOM 0 HD22 LEU B 220 10.416 39.602 -12.449 1.00 0.00 H new ATOM 0 HD23 LEU B 220 9.683 38.963 -10.959 1.00 0.00 H new ATOM 2201 N GLU B 221 8.689 34.229 -12.578 1.00 0.00 N ATOM 2202 CA GLU B 221 8.207 33.127 -13.396 1.00 0.00 C ATOM 2203 C GLU B 221 6.732 32.847 -13.146 1.00 0.00 C ATOM 2204 O GLU B 221 6.000 32.443 -14.055 1.00 0.00 O ATOM 2205 CB GLU B 221 9.030 31.880 -13.117 1.00 0.00 C ATOM 2206 CG GLU B 221 10.520 32.090 -13.313 1.00 0.00 C ATOM 2207 CD GLU B 221 10.881 32.525 -14.709 1.00 0.00 C ATOM 2208 OE1 GLU B 221 11.027 31.655 -15.595 1.00 0.00 O ATOM 2209 OE2 GLU B 221 11.055 33.725 -14.932 1.00 0.00 O1- ATOM 0 H GLU B 221 9.233 33.937 -11.766 1.00 0.00 H new ATOM 0 HA GLU B 221 8.318 33.411 -14.443 1.00 0.00 H new ATOM 0 HB2 GLU B 221 8.847 31.554 -12.093 1.00 0.00 H new ATOM 0 HB3 GLU B 221 8.694 31.077 -13.772 1.00 0.00 H new ATOM 0 HG2 GLU B 221 10.871 32.840 -12.604 1.00 0.00 H new ATOM 0 HG3 GLU B 221 11.044 31.163 -13.082 1.00 0.00 H new ATOM 2216 N SER B 222 6.303 33.045 -11.930 1.00 0.00 N ATOM 2217 CA SER B 222 4.932 32.850 -11.590 1.00 0.00 C ATOM 2218 C SER B 222 4.185 34.160 -11.819 1.00 0.00 C ATOM 2219 O SER B 222 4.038 34.959 -10.873 1.00 0.00 O ATOM 2220 CB SER B 222 4.812 32.395 -10.139 1.00 0.00 C ATOM 2221 OG SER B 222 5.627 31.245 -9.899 1.00 0.00 O ATOM 2222 OXT SER B 222 3.792 34.428 -12.964 1.00 0.00 O1- ATOM 0 H SER B 222 6.895 33.344 -11.155 1.00 0.00 H new ATOM 0 HA SER B 222 4.494 32.073 -12.217 1.00 0.00 H new ATOM 0 HB2 SER B 222 5.112 33.204 -9.473 1.00 0.00 H new ATOM 0 HB3 SER B 222 3.772 32.163 -9.911 1.00 0.00 H new ATOM 0 HG SER B 222 6.557 31.525 -9.767 1.00 0.00 H new TER 2228 SER B 222 ATOM 2229 N GLY C 300 -0.788 35.435 0.694 1.00 0.00 N ATOM 2230 CA GLY C 300 -0.544 35.291 2.130 1.00 0.00 C ATOM 2231 C GLY C 300 -0.913 33.912 2.598 1.00 0.00 C ATOM 2232 O GLY C 300 -0.126 32.978 2.469 1.00 0.00 O ATOM 0 HA2 GLY C 300 0.507 35.484 2.346 1.00 0.00 H new ATOM 0 HA3 GLY C 300 -1.124 36.033 2.678 1.00 0.00 H new ATOM 2238 N SER C 301 -2.105 33.763 3.104 1.00 0.00 N ATOM 2239 CA SER C 301 -2.569 32.487 3.571 1.00 0.00 C ATOM 2240 C SER C 301 -3.789 32.102 2.751 1.00 0.00 C ATOM 2241 O SER C 301 -4.379 32.966 2.081 1.00 0.00 O ATOM 2242 CB SER C 301 -2.918 32.569 5.075 1.00 0.00 C ATOM 2243 OG SER C 301 -3.229 31.286 5.618 1.00 0.00 O ATOM 0 H SER C 301 -2.781 34.520 3.204 1.00 0.00 H new ATOM 0 HA SER C 301 -1.794 31.730 3.452 1.00 0.00 H new ATOM 0 HB2 SER C 301 -2.078 33.000 5.620 1.00 0.00 H new ATOM 0 HB3 SER C 301 -3.767 33.238 5.215 1.00 0.00 H new ATOM 0 HG SER C 301 -3.443 31.377 6.570 1.00 0.00 H new ATOM 2249 N TYR C 302 -4.145 30.834 2.766 1.00 0.00 N ATOM 2250 CA TYR C 302 -5.309 30.377 2.062 1.00 0.00 C ATOM 2251 C TYR C 302 -6.582 30.831 2.751 1.00 0.00 C ATOM 2252 O TYR C 302 -6.884 30.440 3.880 1.00 0.00 O ATOM 2253 CB TYR C 302 -5.282 28.857 1.767 1.00 0.00 C ATOM 2254 CG TYR C 302 -4.895 27.940 2.923 1.00 0.00 C ATOM 2255 CD1 TYR C 302 -5.828 27.484 3.840 1.00 0.00 C ATOM 2256 CD2 TYR C 302 -3.589 27.507 3.060 1.00 0.00 C ATOM 2257 CE1 TYR C 302 -5.463 26.631 4.860 1.00 0.00 C ATOM 2258 CE2 TYR C 302 -3.217 26.661 4.077 1.00 0.00 C ATOM 2259 CZ TYR C 302 -4.154 26.224 4.971 1.00 0.00 C ATOM 2260 OH TYR C 302 -3.782 25.371 5.987 1.00 0.00 O ATOM 0 H TYR C 302 -3.636 30.103 3.264 1.00 0.00 H new ATOM 0 HA TYR C 302 -5.295 30.851 1.080 1.00 0.00 H new ATOM 0 HB2 TYR C 302 -6.270 28.561 1.415 1.00 0.00 H new ATOM 0 HB3 TYR C 302 -4.586 28.682 0.947 1.00 0.00 H new ATOM 0 HD1 TYR C 302 -6.857 27.801 3.755 1.00 0.00 H new ATOM 0 HD2 TYR C 302 -2.845 27.841 2.352 1.00 0.00 H new ATOM 0 HE1 TYR C 302 -6.201 26.284 5.568 1.00 0.00 H new ATOM 0 HE2 TYR C 302 -2.189 26.343 4.169 1.00 0.00 H new ATOM 0 HH TYR C 302 -2.823 25.182 5.921 1.00 0.00 H new ATOM 2270 N ASP C 303 -7.275 31.708 2.077 1.00 0.00 N ATOM 2271 CA ASP C 303 -8.517 32.304 2.562 1.00 0.00 C ATOM 2272 C ASP C 303 -9.646 31.945 1.638 1.00 0.00 C ATOM 2273 O ASP C 303 -10.770 32.409 1.801 1.00 0.00 O ATOM 2274 CB ASP C 303 -8.401 33.841 2.607 1.00 0.00 C ATOM 2275 CG ASP C 303 -8.083 34.460 1.247 1.00 0.00 C ATOM 2276 OD1 ASP C 303 -9.000 34.644 0.401 1.00 0.00 O1- ATOM 2277 OD2 ASP C 303 -6.896 34.777 0.998 1.00 0.00 O ATOM 0 H ASP C 303 -6.997 32.044 1.155 1.00 0.00 H new ATOM 0 HA ASP C 303 -8.707 31.922 3.565 1.00 0.00 H new ATOM 0 HB2 ASP C 303 -9.336 34.259 2.980 1.00 0.00 H new ATOM 0 HB3 ASP C 303 -7.622 34.120 3.317 1.00 0.00 H new ATOM 2282 N LYS C 304 -9.354 31.126 0.676 1.00 0.00 N ATOM 2283 CA LYS C 304 -10.326 30.769 -0.319 1.00 0.00 C ATOM 2284 C LYS C 304 -11.252 29.674 0.191 1.00 0.00 C ATOM 2285 O LYS C 304 -10.801 28.708 0.799 1.00 0.00 O ATOM 2286 CB LYS C 304 -9.632 30.379 -1.627 1.00 0.00 C ATOM 2287 CG LYS C 304 -8.821 31.519 -2.245 1.00 0.00 C ATOM 2288 CD LYS C 304 -9.707 32.714 -2.599 1.00 0.00 C ATOM 2289 CE LYS C 304 -8.904 33.891 -3.134 1.00 0.00 C ATOM 2290 NZ LYS C 304 -7.940 34.412 -2.132 1.00 0.00 N1+ ATOM 0 H LYS C 304 -8.442 30.686 0.555 1.00 0.00 H new ATOM 0 HA LYS C 304 -10.951 31.638 -0.527 1.00 0.00 H new ATOM 0 HB2 LYS C 304 -8.972 29.532 -1.441 1.00 0.00 H new ATOM 0 HB3 LYS C 304 -10.383 30.047 -2.344 1.00 0.00 H new ATOM 0 HG2 LYS C 304 -8.046 31.835 -1.547 1.00 0.00 H new ATOM 0 HG3 LYS C 304 -8.316 31.162 -3.142 1.00 0.00 H new ATOM 0 HD2 LYS C 304 -10.442 32.410 -3.344 1.00 0.00 H new ATOM 0 HD3 LYS C 304 -10.261 33.027 -1.714 1.00 0.00 H new ATOM 0 HE2 LYS C 304 -8.364 33.584 -4.030 1.00 0.00 H new ATOM 0 HE3 LYS C 304 -9.585 34.689 -3.430 1.00 0.00 H new ATOM 0 HZ1 LYS C 304 -7.719 35.405 -2.347 1.00 0.00 H new ATOM 0 HZ2 LYS C 304 -8.358 34.348 -1.182 1.00 0.00 H new ATOM 0 HZ3 LYS C 304 -7.067 33.848 -2.164 1.00 0.00 H new ATOM 2304 N PRO C 305 -12.566 29.831 -0.017 1.00 0.00 N ATOM 2305 CA PRO C 305 -13.562 28.855 0.442 1.00 0.00 C ATOM 2306 C PRO C 305 -13.466 27.534 -0.324 1.00 0.00 C ATOM 2307 O PRO C 305 -13.797 26.460 0.195 1.00 0.00 O ATOM 2308 CB PRO C 305 -14.897 29.548 0.146 1.00 0.00 C ATOM 2309 CG PRO C 305 -14.598 30.514 -0.945 1.00 0.00 C ATOM 2310 CD PRO C 305 -13.200 30.987 -0.697 1.00 0.00 C ATOM 0 HA PRO C 305 -13.427 28.591 1.491 1.00 0.00 H new ATOM 0 HB2 PRO C 305 -15.655 28.828 -0.162 1.00 0.00 H new ATOM 0 HB3 PRO C 305 -15.281 30.058 1.030 1.00 0.00 H new ATOM 0 HG2 PRO C 305 -14.683 30.039 -1.922 1.00 0.00 H new ATOM 0 HG3 PRO C 305 -15.301 31.347 -0.934 1.00 0.00 H new ATOM 0 HD2 PRO C 305 -12.689 31.237 -1.627 1.00 0.00 H new ATOM 0 HD3 PRO C 305 -13.182 31.881 -0.073 1.00 0.00 H new ATOM 2318 N ALA C 306 -12.994 27.622 -1.540 1.00 0.00 N ATOM 2319 CA ALA C 306 -12.864 26.485 -2.400 1.00 0.00 C ATOM 2320 C ALA C 306 -11.519 26.532 -3.089 1.00 0.00 C ATOM 2321 O ALA C 306 -11.022 27.618 -3.388 1.00 0.00 O ATOM 2322 CB ALA C 306 -13.981 26.491 -3.424 1.00 0.00 C ATOM 0 H ALA C 306 -12.686 28.498 -1.962 1.00 0.00 H new ATOM 0 HA ALA C 306 -12.932 25.569 -1.814 1.00 0.00 H new ATOM 0 HB1 ALA C 306 -13.880 25.625 -4.078 1.00 0.00 H new ATOM 0 HB2 ALA C 306 -14.943 26.450 -2.913 1.00 0.00 H new ATOM 0 HB3 ALA C 306 -13.924 27.403 -4.019 1.00 0.00 H new ATOM 2328 N PRO C 307 -10.882 25.374 -3.294 1.00 0.00 N ATOM 2329 CA PRO C 307 -9.600 25.282 -4.009 1.00 0.00 C ATOM 2330 C PRO C 307 -9.716 25.749 -5.468 1.00 0.00 C ATOM 2331 O PRO C 307 -8.815 26.416 -5.991 1.00 0.00 O ATOM 2332 CB PRO C 307 -9.291 23.777 -3.970 1.00 0.00 C ATOM 2333 CG PRO C 307 -10.067 23.253 -2.824 1.00 0.00 C ATOM 2334 CD PRO C 307 -11.320 24.054 -2.789 1.00 0.00 C ATOM 0 HA PRO C 307 -8.833 25.912 -3.559 1.00 0.00 H new ATOM 0 HB2 PRO C 307 -9.584 23.290 -4.900 1.00 0.00 H new ATOM 0 HB3 PRO C 307 -8.224 23.597 -3.839 1.00 0.00 H new ATOM 0 HG2 PRO C 307 -10.283 22.192 -2.950 1.00 0.00 H new ATOM 0 HG3 PRO C 307 -9.510 23.357 -1.893 1.00 0.00 H new ATOM 0 HD2 PRO C 307 -12.096 23.618 -3.418 1.00 0.00 H new ATOM 0 HD3 PRO C 307 -11.728 24.122 -1.781 1.00 0.00 H new ATOM 2342 N GLU C 308 -10.851 25.388 -6.106 1.00 0.00 N ATOM 2343 CA GLU C 308 -11.149 25.680 -7.526 1.00 0.00 C ATOM 2344 C GLU C 308 -10.161 24.930 -8.415 1.00 0.00 C ATOM 2345 O GLU C 308 -9.822 25.345 -9.534 1.00 0.00 O ATOM 2346 CB GLU C 308 -11.150 27.185 -7.815 1.00 0.00 C ATOM 2347 CG GLU C 308 -12.116 27.965 -6.947 1.00 0.00 C ATOM 2348 CD GLU C 308 -12.249 29.398 -7.370 1.00 0.00 C ATOM 2349 OE1 GLU C 308 -11.234 30.111 -7.422 1.00 0.00 O1- ATOM 2350 OE2 GLU C 308 -13.380 29.841 -7.688 1.00 0.00 O ATOM 0 H GLU C 308 -11.600 24.876 -5.640 1.00 0.00 H new ATOM 0 HA GLU C 308 -12.157 25.331 -7.750 1.00 0.00 H new ATOM 0 HB2 GLU C 308 -10.143 27.576 -7.667 1.00 0.00 H new ATOM 0 HB3 GLU C 308 -11.404 27.346 -8.863 1.00 0.00 H new ATOM 0 HG2 GLU C 308 -13.095 27.488 -6.982 1.00 0.00 H new ATOM 0 HG3 GLU C 308 -11.779 27.926 -5.911 1.00 0.00 H new ATOM 2357 N ASN C 309 -9.778 23.786 -7.915 1.00 0.00 N ATOM 2358 CA ASN C 309 -8.815 22.899 -8.527 1.00 0.00 C ATOM 2359 C ASN C 309 -9.553 21.627 -8.903 1.00 0.00 C ATOM 2360 O ASN C 309 -10.504 21.253 -8.216 1.00 0.00 O ATOM 2361 CB ASN C 309 -7.669 22.650 -7.494 1.00 0.00 C ATOM 2362 CG ASN C 309 -6.565 21.651 -7.895 1.00 0.00 C ATOM 2363 OD1 ASN C 309 -6.803 20.626 -8.541 1.00 0.00 O ATOM 2364 ND2 ASN C 309 -5.348 21.960 -7.520 1.00 0.00 N ATOM 0 H ASN C 309 -10.142 23.428 -7.032 1.00 0.00 H new ATOM 0 HA ASN C 309 -8.363 23.312 -9.429 1.00 0.00 H new ATOM 0 HB2 ASN C 309 -7.196 23.608 -7.277 1.00 0.00 H new ATOM 0 HB3 ASN C 309 -8.121 22.300 -6.566 1.00 0.00 H new ATOM 0 HD21 ASN C 309 -4.569 21.347 -7.761 1.00 0.00 H new ATOM 0 HD22 ASN C 309 -5.180 22.813 -6.987 1.00 0.00 H new ATOM 2371 N ARG C 310 -9.143 20.994 -9.992 1.00 0.00 N ATOM 2372 CA ARG C 310 -9.768 19.768 -10.519 1.00 0.00 C ATOM 2373 C ARG C 310 -9.959 18.691 -9.433 1.00 0.00 C ATOM 2374 O ARG C 310 -10.996 18.049 -9.371 1.00 0.00 O ATOM 2375 CB ARG C 310 -8.907 19.202 -11.656 1.00 0.00 C ATOM 2376 CG ARG C 310 -9.452 17.932 -12.310 1.00 0.00 C ATOM 2377 CD ARG C 310 -10.733 18.197 -13.068 1.00 0.00 C ATOM 2378 NE ARG C 310 -11.281 16.978 -13.650 1.00 0.00 N ATOM 2379 CZ ARG C 310 -11.593 16.799 -14.938 1.00 0.00 C ATOM 2380 NH1 ARG C 310 -11.350 17.750 -15.840 1.00 0.00 N1+ ATOM 2381 NH2 ARG C 310 -12.152 15.664 -15.320 1.00 0.00 N ATOM 0 H ARG C 310 -8.353 21.316 -10.552 1.00 0.00 H new ATOM 0 HA ARG C 310 -10.757 20.039 -10.888 1.00 0.00 H new ATOM 0 HB2 ARG C 310 -8.796 19.968 -12.423 1.00 0.00 H new ATOM 0 HB3 ARG C 310 -7.910 18.993 -11.267 1.00 0.00 H new ATOM 0 HG2 ARG C 310 -8.705 17.524 -12.990 1.00 0.00 H new ATOM 0 HG3 ARG C 310 -9.632 17.177 -11.544 1.00 0.00 H new ATOM 0 HD2 ARG C 310 -11.468 18.641 -12.396 1.00 0.00 H new ATOM 0 HD3 ARG C 310 -10.544 18.924 -13.858 1.00 0.00 H new ATOM 0 HE ARG C 310 -11.441 16.192 -13.019 1.00 0.00 H new ATOM 0 HH11 ARG C 310 -10.920 18.629 -15.551 1.00 0.00 H new ATOM 0 HH12 ARG C 310 -11.594 17.599 -16.819 1.00 0.00 H new ATOM 0 HH21 ARG C 310 -12.342 14.933 -14.634 1.00 0.00 H new ATOM 0 HH22 ARG C 310 -12.393 15.519 -16.300 1.00 0.00 H new ATOM 2395 N PHE C 311 -8.962 18.514 -8.584 1.00 0.00 N ATOM 2396 CA PHE C 311 -9.020 17.476 -7.538 1.00 0.00 C ATOM 2397 C PHE C 311 -9.532 18.031 -6.216 1.00 0.00 C ATOM 2398 O PHE C 311 -9.780 17.274 -5.271 1.00 0.00 O ATOM 2399 CB PHE C 311 -7.648 16.813 -7.340 1.00 0.00 C ATOM 2400 CG PHE C 311 -7.235 15.824 -8.411 1.00 0.00 C ATOM 2401 CD1 PHE C 311 -7.570 16.015 -9.742 1.00 0.00 C ATOM 2402 CD2 PHE C 311 -6.494 14.701 -8.071 1.00 0.00 C ATOM 2403 CE1 PHE C 311 -7.185 15.114 -10.709 1.00 0.00 C ATOM 2404 CE2 PHE C 311 -6.103 13.791 -9.033 1.00 0.00 C ATOM 2405 CZ PHE C 311 -6.447 13.998 -10.356 1.00 0.00 C ATOM 0 H PHE C 311 -8.103 19.065 -8.587 1.00 0.00 H new ATOM 0 HA PHE C 311 -9.727 16.720 -7.880 1.00 0.00 H new ATOM 0 HB2 PHE C 311 -6.892 17.596 -7.283 1.00 0.00 H new ATOM 0 HB3 PHE C 311 -7.648 16.300 -6.378 1.00 0.00 H new ATOM 0 HD1 PHE C 311 -8.143 16.886 -10.026 1.00 0.00 H new ATOM 0 HD2 PHE C 311 -6.219 14.537 -7.040 1.00 0.00 H new ATOM 0 HE1 PHE C 311 -7.458 15.278 -11.741 1.00 0.00 H new ATOM 0 HE2 PHE C 311 -5.530 12.920 -8.753 1.00 0.00 H new ATOM 0 HZ PHE C 311 -6.140 13.290 -11.112 1.00 0.00 H new ATOM 2415 N ALA C 312 -9.678 19.355 -6.168 1.00 0.00 N ATOM 2416 CA ALA C 312 -10.150 20.098 -4.986 1.00 0.00 C ATOM 2417 C ALA C 312 -9.305 19.827 -3.731 1.00 0.00 C ATOM 2418 O ALA C 312 -9.809 19.885 -2.599 1.00 0.00 O ATOM 2419 CB ALA C 312 -11.623 19.818 -4.721 1.00 0.00 C ATOM 0 H ALA C 312 -9.469 19.959 -6.963 1.00 0.00 H new ATOM 0 HA ALA C 312 -10.031 21.157 -5.217 1.00 0.00 H new ATOM 0 HB1 ALA C 312 -11.948 20.378 -3.844 1.00 0.00 H new ATOM 0 HB2 ALA C 312 -12.213 20.124 -5.585 1.00 0.00 H new ATOM 0 HB3 ALA C 312 -11.765 18.752 -4.544 1.00 0.00 H new ATOM 2425 N ILE C 313 -8.029 19.584 -3.921 1.00 0.00 N ATOM 2426 CA ILE C 313 -7.142 19.352 -2.798 1.00 0.00 C ATOM 2427 C ILE C 313 -6.818 20.709 -2.179 1.00 0.00 C ATOM 2428 O ILE C 313 -6.662 21.695 -2.905 1.00 0.00 O ATOM 2429 CB ILE C 313 -5.807 18.665 -3.224 1.00 0.00 C ATOM 2430 CG1 ILE C 313 -6.052 17.468 -4.166 1.00 0.00 C ATOM 2431 CG2 ILE C 313 -5.026 18.201 -1.988 1.00 0.00 C ATOM 2432 CD1 ILE C 313 -6.885 16.342 -3.586 1.00 0.00 C ATOM 0 H ILE C 313 -7.581 19.541 -4.836 1.00 0.00 H new ATOM 0 HA ILE C 313 -7.641 18.685 -2.095 1.00 0.00 H new ATOM 0 HB ILE C 313 -5.221 19.406 -3.768 1.00 0.00 H new ATOM 0 HG12 ILE C 313 -6.543 17.832 -5.068 1.00 0.00 H new ATOM 0 HG13 ILE C 313 -5.087 17.063 -4.470 1.00 0.00 H new ATOM 0 HG21 ILE C 313 -4.098 17.724 -2.302 1.00 0.00 H new ATOM 0 HG22 ILE C 313 -4.797 19.061 -1.358 1.00 0.00 H new ATOM 0 HG23 ILE C 313 -5.627 17.488 -1.424 1.00 0.00 H new ATOM 0 HD11 ILE C 313 -6.997 15.552 -4.329 1.00 0.00 H new ATOM 0 HD12 ILE C 313 -6.389 15.941 -2.702 1.00 0.00 H new ATOM 0 HD13 ILE C 313 -7.869 16.722 -3.310 1.00 0.00 H new ATOM 2444 N MET C 314 -6.776 20.769 -0.868 1.00 0.00 N ATOM 2445 CA MET C 314 -6.459 21.998 -0.170 1.00 0.00 C ATOM 2446 C MET C 314 -5.002 22.358 -0.249 1.00 0.00 C ATOM 2447 O MET C 314 -4.128 21.481 -0.245 1.00 0.00 O ATOM 2448 CB MET C 314 -6.963 22.052 1.301 1.00 0.00 C ATOM 2449 CG MET C 314 -6.922 20.755 2.097 1.00 0.00 C ATOM 2450 SD MET C 314 -8.119 19.546 1.477 1.00 0.00 S ATOM 2451 CE MET C 314 -9.583 20.601 1.369 1.00 0.00 C ATOM 0 H MET C 314 -6.959 19.973 -0.256 1.00 0.00 H new ATOM 0 HA MET C 314 -7.023 22.757 -0.713 1.00 0.00 H new ATOM 0 HB2 MET C 314 -6.370 22.795 1.834 1.00 0.00 H new ATOM 0 HB3 MET C 314 -7.992 22.411 1.293 1.00 0.00 H new ATOM 0 HG2 MET C 314 -5.919 20.331 2.049 1.00 0.00 H new ATOM 0 HG3 MET C 314 -7.129 20.966 3.146 1.00 0.00 H new ATOM 0 HE1 MET C 314 -10.480 19.982 1.388 1.00 0.00 H new ATOM 0 HE2 MET C 314 -9.599 21.289 2.214 1.00 0.00 H new ATOM 0 HE3 MET C 314 -9.554 21.169 0.439 1.00 0.00 H new ATOM 2461 N PRO C 315 -4.734 23.656 -0.333 1.00 0.00 N ATOM 2462 CA PRO C 315 -3.384 24.180 -0.414 1.00 0.00 C ATOM 2463 C PRO C 315 -2.652 24.077 0.930 1.00 0.00 C ATOM 2464 O PRO C 315 -3.284 24.018 2.002 1.00 0.00 O ATOM 2465 CB PRO C 315 -3.584 25.649 -0.803 1.00 0.00 C ATOM 2466 CG PRO C 315 -4.972 25.996 -0.389 1.00 0.00 C ATOM 2467 CD PRO C 315 -5.757 24.720 -0.354 1.00 0.00 C ATOM 0 HA PRO C 315 -2.772 23.625 -1.125 1.00 0.00 H new ATOM 0 HB2 PRO C 315 -2.856 26.288 -0.303 1.00 0.00 H new ATOM 0 HB3 PRO C 315 -3.449 25.791 -1.875 1.00 0.00 H new ATOM 0 HG2 PRO C 315 -4.973 26.475 0.590 1.00 0.00 H new ATOM 0 HG3 PRO C 315 -5.417 26.702 -1.090 1.00 0.00 H new ATOM 0 HD2 PRO C 315 -6.397 24.672 0.527 1.00 0.00 H new ATOM 0 HD3 PRO C 315 -6.406 24.629 -1.225 1.00 0.00 H new ATOM 2475 N GLY C 316 -1.346 24.048 0.862 1.00 0.00 N ATOM 2476 CA GLY C 316 -0.522 23.947 2.034 1.00 0.00 C ATOM 2477 C GLY C 316 -0.235 25.299 2.649 1.00 0.00 C ATOM 2478 O GLY C 316 -0.595 26.352 2.084 1.00 0.00 O ATOM 0 H GLY C 316 -0.824 24.094 -0.013 1.00 0.00 H new ATOM 0 HA2 GLY C 316 -1.016 23.313 2.770 1.00 0.00 H new ATOM 0 HA3 GLY C 316 0.418 23.461 1.774 1.00 0.00 H new ATOM 2482 N SER C 317 0.440 25.293 3.759 1.00 0.00 N ATOM 2483 CA SER C 317 0.719 26.498 4.496 1.00 0.00 C ATOM 2484 C SER C 317 1.927 27.219 3.877 1.00 0.00 C ATOM 2485 O SER C 317 2.030 28.452 3.929 1.00 0.00 O ATOM 2486 CB SER C 317 0.948 26.168 5.987 1.00 0.00 C ATOM 2487 OG SER C 317 0.995 27.338 6.797 1.00 0.00 O ATOM 0 H SER C 317 0.818 24.447 4.186 1.00 0.00 H new ATOM 0 HA SER C 317 -0.137 27.170 4.437 1.00 0.00 H new ATOM 0 HB2 SER C 317 0.149 25.516 6.340 1.00 0.00 H new ATOM 0 HB3 SER C 317 1.881 25.616 6.096 1.00 0.00 H new ATOM 0 HG SER C 317 1.140 27.083 7.732 1.00 0.00 H new ATOM 2493 N ARG C 318 2.835 26.465 3.256 1.00 0.00 N ATOM 2494 CA ARG C 318 3.981 27.095 2.582 1.00 0.00 C ATOM 2495 C ARG C 318 3.636 27.594 1.177 1.00 0.00 C ATOM 2496 O ARG C 318 4.513 27.966 0.392 1.00 0.00 O ATOM 2497 CB ARG C 318 5.222 26.217 2.551 1.00 0.00 C ATOM 2498 CG ARG C 318 5.773 25.862 3.920 1.00 0.00 C ATOM 2499 CD ARG C 318 7.251 25.510 3.830 1.00 0.00 C ATOM 2500 NE ARG C 318 8.104 26.716 3.620 1.00 0.00 N ATOM 2501 CZ ARG C 318 8.678 27.110 2.459 1.00 0.00 C ATOM 2502 NH1 ARG C 318 8.390 26.487 1.330 1.00 0.00 N1+ ATOM 2503 NH2 ARG C 318 9.500 28.154 2.439 1.00 0.00 N ATOM 0 H ARG C 318 2.807 25.447 3.203 1.00 0.00 H new ATOM 0 HA ARG C 318 4.221 27.963 3.196 1.00 0.00 H new ATOM 0 HB2 ARG C 318 4.987 25.296 2.017 1.00 0.00 H new ATOM 0 HB3 ARG C 318 5.999 26.727 1.981 1.00 0.00 H new ATOM 0 HG2 ARG C 318 5.635 26.701 4.602 1.00 0.00 H new ATOM 0 HG3 ARG C 318 5.218 25.020 4.334 1.00 0.00 H new ATOM 0 HD2 ARG C 318 7.559 25.004 4.745 1.00 0.00 H new ATOM 0 HD3 ARG C 318 7.407 24.809 3.010 1.00 0.00 H new ATOM 0 HE ARG C 318 8.272 27.305 4.436 1.00 0.00 H new ATOM 0 HH11 ARG C 318 7.733 25.707 1.331 1.00 0.00 H new ATOM 0 HH12 ARG C 318 8.824 26.787 0.457 1.00 0.00 H new ATOM 0 HH21 ARG C 318 9.701 28.662 3.301 1.00 0.00 H new ATOM 0 HH22 ARG C 318 9.930 28.448 1.562 1.00 0.00 H new ATOM 2517 N TRP C 319 2.367 27.610 0.875 1.00 0.00 N ATOM 2518 CA TRP C 319 1.874 28.164 -0.350 1.00 0.00 C ATOM 2519 C TRP C 319 1.748 29.662 -0.152 1.00 0.00 C ATOM 2520 O TRP C 319 1.008 30.108 0.725 1.00 0.00 O ATOM 2521 CB TRP C 319 0.519 27.537 -0.679 1.00 0.00 C ATOM 2522 CG TRP C 319 -0.122 28.022 -1.938 1.00 0.00 C ATOM 2523 CD1 TRP C 319 0.396 27.974 -3.192 1.00 0.00 C ATOM 2524 CD2 TRP C 319 -1.427 28.587 -2.067 1.00 0.00 C ATOM 2525 NE1 TRP C 319 -0.506 28.480 -4.089 1.00 0.00 N ATOM 2526 CE2 TRP C 319 -1.632 28.858 -3.426 1.00 0.00 C ATOM 2527 CE3 TRP C 319 -2.445 28.888 -1.162 1.00 0.00 C ATOM 2528 CZ2 TRP C 319 -2.810 29.418 -3.908 1.00 0.00 C ATOM 2529 CZ3 TRP C 319 -3.615 29.441 -1.640 1.00 0.00 C ATOM 2530 CH2 TRP C 319 -3.791 29.698 -3.003 1.00 0.00 C ATOM 0 H TRP C 319 1.639 27.233 1.482 1.00 0.00 H new ATOM 0 HA TRP C 319 2.548 27.958 -1.181 1.00 0.00 H new ATOM 0 HB2 TRP C 319 0.645 26.456 -0.748 1.00 0.00 H new ATOM 0 HB3 TRP C 319 -0.161 27.726 0.151 1.00 0.00 H new ATOM 0 HD1 TRP C 319 1.375 27.593 -3.445 1.00 0.00 H new ATOM 0 HE1 TRP C 319 -0.357 28.561 -5.095 1.00 0.00 H new ATOM 0 HE3 TRP C 319 -2.320 28.692 -0.107 1.00 0.00 H new ATOM 0 HZ2 TRP C 319 -2.943 29.624 -4.960 1.00 0.00 H new ATOM 0 HZ3 TRP C 319 -4.410 29.680 -0.949 1.00 0.00 H new ATOM 0 HH2 TRP C 319 -4.721 30.126 -3.346 1.00 0.00 H new ATOM 2541 N ASP C 320 2.512 30.426 -0.920 1.00 0.00 N ATOM 2542 CA ASP C 320 2.528 31.902 -0.814 1.00 0.00 C ATOM 2543 C ASP C 320 1.155 32.496 -1.056 1.00 0.00 C ATOM 2544 O ASP C 320 0.752 33.456 -0.407 1.00 0.00 O ATOM 2545 CB ASP C 320 3.521 32.521 -1.811 1.00 0.00 C ATOM 2546 CG ASP C 320 3.568 34.047 -1.718 1.00 0.00 C ATOM 2547 OD1 ASP C 320 4.363 34.572 -0.916 1.00 0.00 O ATOM 2548 OD2 ASP C 320 2.809 34.737 -2.435 1.00 0.00 O1- ATOM 0 H ASP C 320 3.139 30.056 -1.634 1.00 0.00 H new ATOM 0 HA ASP C 320 2.841 32.136 0.203 1.00 0.00 H new ATOM 0 HB2 ASP C 320 4.517 32.118 -1.625 1.00 0.00 H new ATOM 0 HB3 ASP C 320 3.243 32.230 -2.824 1.00 0.00 H new ATOM 2553 N GLY C 321 0.432 31.905 -1.958 1.00 0.00 N ATOM 2554 CA GLY C 321 -0.850 32.430 -2.314 1.00 0.00 C ATOM 2555 C GLY C 321 -0.954 32.570 -3.796 1.00 0.00 C ATOM 2556 O GLY C 321 -2.040 32.787 -4.335 1.00 0.00 O ATOM 0 H GLY C 321 0.707 31.061 -2.460 1.00 0.00 H new ATOM 0 HA2 GLY C 321 -1.636 31.770 -1.947 1.00 0.00 H new ATOM 0 HA3 GLY C 321 -1.000 33.399 -1.838 1.00 0.00 H new ATOM 2560 N VAL C 322 0.197 32.477 -4.446 1.00 0.00 N ATOM 2561 CA VAL C 322 0.297 32.491 -5.898 1.00 0.00 C ATOM 2562 C VAL C 322 -0.403 31.266 -6.446 1.00 0.00 C ATOM 2563 O VAL C 322 0.069 30.170 -6.242 1.00 0.00 O ATOM 2564 CB VAL C 322 1.783 32.412 -6.364 1.00 0.00 C ATOM 2565 CG1 VAL C 322 1.903 32.494 -7.886 1.00 0.00 C ATOM 2566 CG2 VAL C 322 2.635 33.472 -5.701 1.00 0.00 C ATOM 0 H VAL C 322 1.097 32.389 -3.975 1.00 0.00 H new ATOM 0 HA VAL C 322 -0.152 33.417 -6.257 1.00 0.00 H new ATOM 0 HB VAL C 322 2.160 31.438 -6.051 1.00 0.00 H new ATOM 0 HG11 VAL C 322 2.953 32.436 -8.172 1.00 0.00 H new ATOM 0 HG12 VAL C 322 1.357 31.667 -8.339 1.00 0.00 H new ATOM 0 HG13 VAL C 322 1.484 33.438 -8.234 1.00 0.00 H new ATOM 0 HG21 VAL C 322 3.663 33.384 -6.052 1.00 0.00 H new ATOM 0 HG22 VAL C 322 2.249 34.460 -5.953 1.00 0.00 H new ATOM 0 HG23 VAL C 322 2.607 33.337 -4.620 1.00 0.00 H new ATOM 2576 N HIS C 323 -1.520 31.454 -7.082 1.00 0.00 N ATOM 2577 CA HIS C 323 -2.230 30.355 -7.699 1.00 0.00 C ATOM 2578 C HIS C 323 -1.757 30.212 -9.135 1.00 0.00 C ATOM 2579 O HIS C 323 -1.890 31.145 -9.941 1.00 0.00 O ATOM 2580 CB HIS C 323 -3.757 30.569 -7.614 1.00 0.00 C ATOM 2581 CG HIS C 323 -4.578 29.548 -8.357 1.00 0.00 C ATOM 2582 ND1 HIS C 323 -4.492 28.187 -8.164 1.00 0.00 N ATOM 2583 CD2 HIS C 323 -5.487 29.726 -9.338 1.00 0.00 C ATOM 2584 CE1 HIS C 323 -5.331 27.594 -9.016 1.00 0.00 C ATOM 2585 NE2 HIS C 323 -5.971 28.490 -9.757 1.00 0.00 N ATOM 0 H HIS C 323 -1.969 32.363 -7.192 1.00 0.00 H new ATOM 0 HA HIS C 323 -2.015 29.429 -7.165 1.00 0.00 H new ATOM 0 HB2 HIS C 323 -4.054 30.560 -6.565 1.00 0.00 H new ATOM 0 HB3 HIS C 323 -3.994 31.559 -8.004 1.00 0.00 H new ATOM 0 HD1 HIS C 323 -3.892 27.715 -7.488 1.00 0.00 H new ATOM 0 HD2 HIS C 323 -5.793 30.682 -9.737 1.00 0.00 H new ATOM 0 HE1 HIS C 323 -5.471 26.526 -9.092 1.00 0.00 H new ATOM 2593 N ARG C 324 -1.194 29.082 -9.447 1.00 0.00 N ATOM 2594 CA ARG C 324 -0.642 28.869 -10.770 1.00 0.00 C ATOM 2595 C ARG C 324 -1.646 28.204 -11.669 1.00 0.00 C ATOM 2596 O ARG C 324 -2.453 27.393 -11.229 1.00 0.00 O ATOM 2597 CB ARG C 324 0.664 28.036 -10.775 1.00 0.00 C ATOM 2598 CG ARG C 324 1.855 28.619 -10.010 1.00 0.00 C ATOM 2599 CD ARG C 324 1.596 28.606 -8.539 1.00 0.00 C ATOM 2600 NE ARG C 324 2.740 28.962 -7.727 1.00 0.00 N ATOM 2601 CZ ARG C 324 2.919 28.467 -6.522 1.00 0.00 C ATOM 2602 NH1 ARG C 324 1.966 27.718 -5.969 1.00 0.00 N1+ ATOM 2603 NH2 ARG C 324 3.997 28.770 -5.836 1.00 0.00 N ATOM 0 H ARG C 324 -1.101 28.290 -8.811 1.00 0.00 H new ATOM 0 HA ARG C 324 -0.396 29.864 -11.142 1.00 0.00 H new ATOM 0 HB2 ARG C 324 0.442 27.053 -10.360 1.00 0.00 H new ATOM 0 HB3 ARG C 324 0.967 27.884 -11.811 1.00 0.00 H new ATOM 0 HG2 ARG C 324 2.753 28.042 -10.231 1.00 0.00 H new ATOM 0 HG3 ARG C 324 2.042 29.640 -10.342 1.00 0.00 H new ATOM 0 HD2 ARG C 324 0.781 29.296 -8.320 1.00 0.00 H new ATOM 0 HD3 ARG C 324 1.257 27.611 -8.251 1.00 0.00 H new ATOM 0 HE ARG C 324 3.428 29.616 -8.101 1.00 0.00 H new ATOM 0 HH11 ARG C 324 1.103 27.531 -6.480 1.00 0.00 H new ATOM 0 HH12 ARG C 324 2.099 27.331 -5.035 1.00 0.00 H new ATOM 0 HH21 ARG C 324 4.699 29.391 -6.238 1.00 0.00 H new ATOM 0 HH22 ARG C 324 4.132 28.384 -4.902 1.00 0.00 H new ATOM 2617 N SER C 325 -1.570 28.527 -12.918 1.00 0.00 N ATOM 2618 CA SER C 325 -2.428 27.976 -13.906 1.00 0.00 C ATOM 2619 C SER C 325 -1.516 27.664 -15.099 1.00 0.00 C ATOM 2620 O SER C 325 -1.066 28.566 -15.819 1.00 0.00 O ATOM 2621 CB SER C 325 -3.562 28.989 -14.224 1.00 0.00 C ATOM 2622 OG SER C 325 -4.603 28.418 -15.003 1.00 0.00 O ATOM 0 H SER C 325 -0.894 29.197 -13.285 1.00 0.00 H new ATOM 0 HA SER C 325 -2.939 27.065 -13.594 1.00 0.00 H new ATOM 0 HB2 SER C 325 -3.978 29.368 -13.290 1.00 0.00 H new ATOM 0 HB3 SER C 325 -3.142 29.843 -14.756 1.00 0.00 H new ATOM 0 HG SER C 325 -5.460 28.541 -14.544 1.00 0.00 H new ATOM 2628 N ASN C 326 -1.187 26.385 -15.237 1.00 0.00 N ATOM 2629 CA ASN C 326 -0.126 25.914 -16.152 1.00 0.00 C ATOM 2630 C ASN C 326 -0.698 25.359 -17.476 1.00 0.00 C ATOM 2631 O ASN C 326 0.015 24.791 -18.302 1.00 0.00 O ATOM 2632 CB ASN C 326 0.676 24.818 -15.411 1.00 0.00 C ATOM 2633 CG ASN C 326 1.892 24.301 -16.160 1.00 0.00 C ATOM 2634 OD1 ASN C 326 2.556 25.035 -16.891 1.00 0.00 O ATOM 2635 ND2 ASN C 326 2.170 23.034 -16.006 1.00 0.00 N ATOM 0 H ASN C 326 -1.644 25.634 -14.720 1.00 0.00 H new ATOM 0 HA ASN C 326 0.513 26.754 -16.423 1.00 0.00 H new ATOM 0 HB2 ASN C 326 1.001 25.214 -14.449 1.00 0.00 H new ATOM 0 HB3 ASN C 326 0.011 23.979 -15.203 1.00 0.00 H new ATOM 0 HD21 ASN C 326 2.961 22.622 -16.501 1.00 0.00 H new ATOM 0 HD22 ASN C 326 1.596 22.457 -15.391 1.00 0.00 H new ATOM 2642 N GLY C 327 -1.959 25.546 -17.675 1.00 0.00 N ATOM 2643 CA GLY C 327 -2.621 25.017 -18.842 1.00 0.00 C ATOM 2644 C GLY C 327 -3.684 24.068 -18.401 1.00 0.00 C ATOM 2645 O GLY C 327 -4.812 24.064 -18.922 1.00 0.00 O ATOM 0 H GLY C 327 -2.567 26.066 -17.042 1.00 0.00 H new ATOM 0 HA2 GLY C 327 -3.057 25.826 -19.428 1.00 0.00 H new ATOM 0 HA3 GLY C 327 -1.903 24.508 -19.485 1.00 0.00 H new ATOM 2649 N PHE C 328 -3.352 23.273 -17.413 1.00 0.00 N ATOM 2650 CA PHE C 328 -4.325 22.458 -16.782 1.00 0.00 C ATOM 2651 C PHE C 328 -4.731 23.109 -15.487 1.00 0.00 C ATOM 2652 O PHE C 328 -4.002 23.071 -14.493 1.00 0.00 O ATOM 2653 CB PHE C 328 -3.797 21.025 -16.548 1.00 0.00 C ATOM 2654 CG PHE C 328 -4.611 20.220 -15.554 1.00 0.00 C ATOM 2655 CD1 PHE C 328 -5.977 20.077 -15.692 1.00 0.00 C ATOM 2656 CD2 PHE C 328 -3.996 19.631 -14.469 1.00 0.00 C ATOM 2657 CE1 PHE C 328 -6.706 19.367 -14.771 1.00 0.00 C ATOM 2658 CE2 PHE C 328 -4.721 18.915 -13.547 1.00 0.00 C ATOM 2659 CZ PHE C 328 -6.078 18.786 -13.698 1.00 0.00 C ATOM 0 H PHE C 328 -2.408 23.183 -17.037 1.00 0.00 H new ATOM 0 HA PHE C 328 -5.195 22.366 -17.432 1.00 0.00 H new ATOM 0 HB2 PHE C 328 -3.780 20.496 -17.501 1.00 0.00 H new ATOM 0 HB3 PHE C 328 -2.767 21.082 -16.196 1.00 0.00 H new ATOM 0 HD1 PHE C 328 -6.478 20.529 -16.535 1.00 0.00 H new ATOM 0 HD2 PHE C 328 -2.928 19.734 -14.342 1.00 0.00 H new ATOM 0 HE1 PHE C 328 -7.775 19.265 -14.891 1.00 0.00 H new ATOM 0 HE2 PHE C 328 -4.224 18.455 -12.706 1.00 0.00 H new ATOM 0 HZ PHE C 328 -6.652 18.228 -12.973 1.00 0.00 H new ATOM 2669 N GLU C 329 -5.795 23.830 -15.559 1.00 0.00 N ATOM 2670 CA GLU C 329 -6.463 24.333 -14.408 1.00 0.00 C ATOM 2671 C GLU C 329 -7.601 23.387 -14.050 1.00 0.00 C ATOM 2672 O GLU C 329 -7.604 22.690 -13.030 1.00 0.00 O ATOM 2673 CB GLU C 329 -6.971 25.737 -14.691 1.00 0.00 C ATOM 2674 CG GLU C 329 -7.631 26.411 -13.520 1.00 0.00 C ATOM 2675 CD GLU C 329 -8.001 27.808 -13.853 1.00 0.00 C ATOM 2676 OE1 GLU C 329 -7.102 28.670 -13.873 1.00 0.00 O ATOM 2677 OE2 GLU C 329 -9.189 28.093 -14.092 1.00 0.00 O1- ATOM 0 H GLU C 329 -6.236 24.093 -16.440 1.00 0.00 H new ATOM 0 HA GLU C 329 -5.780 24.390 -13.560 1.00 0.00 H new ATOM 0 HB2 GLU C 329 -6.135 26.352 -15.023 1.00 0.00 H new ATOM 0 HB3 GLU C 329 -7.682 25.693 -15.516 1.00 0.00 H new ATOM 0 HG2 GLU C 329 -8.522 25.854 -13.229 1.00 0.00 H new ATOM 0 HG3 GLU C 329 -6.957 26.403 -12.664 1.00 0.00 H new ATOM 2684 N GLU C 330 -8.548 23.369 -14.963 1.00 0.00 N ATOM 2685 CA GLU C 330 -9.785 22.640 -14.860 1.00 0.00 C ATOM 2686 C GLU C 330 -9.724 21.343 -15.667 1.00 0.00 C ATOM 2687 O GLU C 330 -10.364 20.342 -15.317 1.00 0.00 O ATOM 2688 CB GLU C 330 -10.906 23.538 -15.404 1.00 0.00 C ATOM 2689 CG GLU C 330 -10.642 24.027 -16.828 1.00 0.00 C ATOM 2690 CD GLU C 330 -11.700 24.939 -17.367 1.00 0.00 C ATOM 2691 OE1 GLU C 330 -12.801 24.466 -17.675 1.00 0.00 O ATOM 2692 OE2 GLU C 330 -11.432 26.138 -17.547 1.00 0.00 O1- ATOM 0 H GLU C 330 -8.468 23.888 -15.837 1.00 0.00 H new ATOM 0 HA GLU C 330 -9.970 22.375 -13.819 1.00 0.00 H new ATOM 0 HB2 GLU C 330 -11.847 22.988 -15.383 1.00 0.00 H new ATOM 0 HB3 GLU C 330 -11.026 24.399 -14.746 1.00 0.00 H new ATOM 0 HG2 GLU C 330 -9.684 24.546 -16.851 1.00 0.00 H new ATOM 0 HG3 GLU C 330 -10.552 23.163 -17.487 1.00 0.00 H new ATOM 2699 N LYS C 331 -8.963 21.375 -16.741 1.00 0.00 N ATOM 2700 CA LYS C 331 -8.858 20.281 -17.662 1.00 0.00 C ATOM 2701 C LYS C 331 -7.622 20.531 -18.503 1.00 0.00 C ATOM 2702 O LYS C 331 -7.207 21.691 -18.651 1.00 0.00 O ATOM 2703 CB LYS C 331 -10.125 20.238 -18.533 1.00 0.00 C ATOM 2704 CG LYS C 331 -10.241 19.049 -19.462 1.00 0.00 C ATOM 2705 CD LYS C 331 -11.561 19.092 -20.199 1.00 0.00 C ATOM 2706 CE LYS C 331 -11.729 17.917 -21.134 1.00 0.00 C ATOM 2707 NZ LYS C 331 -13.048 17.935 -21.788 1.00 0.00 N1+ ATOM 0 H LYS C 331 -8.392 22.181 -16.996 1.00 0.00 H new ATOM 0 HA LYS C 331 -8.771 19.322 -17.152 1.00 0.00 H new ATOM 0 HB2 LYS C 331 -10.995 20.250 -17.877 1.00 0.00 H new ATOM 0 HB3 LYS C 331 -10.164 21.149 -19.131 1.00 0.00 H new ATOM 0 HG2 LYS C 331 -9.417 19.053 -20.175 1.00 0.00 H new ATOM 0 HG3 LYS C 331 -10.164 18.123 -18.892 1.00 0.00 H new ATOM 0 HD2 LYS C 331 -12.378 19.100 -19.478 1.00 0.00 H new ATOM 0 HD3 LYS C 331 -11.628 20.020 -20.768 1.00 0.00 H new ATOM 0 HE2 LYS C 331 -10.945 17.938 -21.891 1.00 0.00 H new ATOM 0 HE3 LYS C 331 -11.610 16.987 -20.578 1.00 0.00 H new ATOM 0 HZ1 LYS C 331 -13.132 17.116 -22.423 1.00 0.00 H new ATOM 0 HZ2 LYS C 331 -13.794 17.891 -21.065 1.00 0.00 H new ATOM 0 HZ3 LYS C 331 -13.151 18.811 -22.338 1.00 0.00 H new ATOM 2721 N TRP C 332 -7.025 19.493 -19.011 1.00 0.00 N ATOM 2722 CA TRP C 332 -5.813 19.617 -19.778 1.00 0.00 C ATOM 2723 C TRP C 332 -6.121 19.614 -21.247 1.00 0.00 C ATOM 2724 O TRP C 332 -5.643 20.508 -21.958 1.00 0.00 O ATOM 2725 CB TRP C 332 -4.782 18.539 -19.400 1.00 0.00 C ATOM 2726 CG TRP C 332 -5.183 17.111 -19.672 1.00 0.00 C ATOM 2727 CD1 TRP C 332 -6.134 16.384 -19.023 1.00 0.00 C ATOM 2728 CD2 TRP C 332 -4.601 16.232 -20.642 1.00 0.00 C ATOM 2729 NE1 TRP C 332 -6.194 15.118 -19.539 1.00 0.00 N ATOM 2730 CE2 TRP C 332 -5.265 14.999 -20.536 1.00 0.00 C ATOM 2731 CE3 TRP C 332 -3.590 16.374 -21.596 1.00 0.00 C ATOM 2732 CZ2 TRP C 332 -4.950 13.911 -21.345 1.00 0.00 C ATOM 2733 CZ3 TRP C 332 -3.278 15.296 -22.398 1.00 0.00 C ATOM 2734 CH2 TRP C 332 -3.956 14.079 -22.269 1.00 0.00 C ATOM 2735 OXT TRP C 332 -6.930 18.771 -21.690 1.00 0.00 O1- ATOM 0 H TRP C 332 -7.361 18.536 -18.907 1.00 0.00 H new ATOM 0 HA TRP C 332 -5.355 20.576 -19.535 1.00 0.00 H new ATOM 0 HB2 TRP C 332 -3.858 18.744 -19.940 1.00 0.00 H new ATOM 0 HB3 TRP C 332 -4.559 18.636 -18.338 1.00 0.00 H new ATOM 0 HD1 TRP C 332 -6.752 16.753 -18.218 1.00 0.00 H new ATOM 0 HE1 TRP C 332 -6.829 14.382 -19.230 1.00 0.00 H new ATOM 0 HE3 TRP C 332 -3.063 17.310 -21.703 1.00 0.00 H new ATOM 0 HZ2 TRP C 332 -5.471 12.970 -21.247 1.00 0.00 H new ATOM 0 HZ3 TRP C 332 -2.497 15.393 -23.138 1.00 0.00 H new ATOM 0 HH2 TRP C 332 -3.689 13.254 -22.913 1.00 0.00 H new TER 2746 TRP C 332