USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1050 hydrogens (6 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 NoAdj-H: A 15 TPO H2 : A 15 TPO N : A 14 THR C :(H bumps) USER MOD Set 1.1: A 86 SER OG : rot 126:sc= 1.06 USER MOD Set 1.2: A 89 HIS : no HD1:sc= -1.53 X(o=-2,f=-1.7) USER MOD Set 1.3: A 110 THR OG1 : rot 63:sc= -1.49 USER MOD Single : A 1 MET CE :methyl -160:sc= -0.197 (180deg=-0.784) USER MOD Single : A 1 MET N :NH3+ 133:sc= 0.181 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 5 ASN : amide:sc= 1.24 K(o=1.2,f=0.12) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0545) USER MOD Single : A 26 MET CE :methyl 167:sc= -0.0256 (180deg=-0.266) USER MOD Single : A 28 SER OG : rot 76:sc= 0.625 USER MOD Single : A 29 SER OG : rot -160:sc= 0.486 USER MOD Single : A 30 THR OG1 : rot 33:sc= 0.271 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -0.0853 K(o=-0.085,f=-2.8!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0451) USER MOD Single : A 56 ASN : amide:sc= -0.283 K(o=-0.28,f=-4.1!) USER MOD Single : A 65 GLN : amide:sc= 0.356 K(o=0.36,f=-6.5!) USER MOD Single : A 67 THR OG1 : rot 180:sc=-0.00138 USER MOD Single : A 68 THR OG1 : rot 81:sc= -1.13 USER MOD Single : A 69 THR OG1 : rot 168:sc= -0.353! USER MOD Single : A 73 HIS : no HE2:sc= -1.44! C(o=-1.4!,f=-6.1!) USER MOD Single : A 76 SER OG : rot 113:sc= 1.01 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -1.58! C(o=-1.6!,f=-3.3!) USER MOD Single : A 106 SER OG : rot -5:sc= 0.278 USER MOD Single : A 108 ASN : amide:sc= -6.67! C(o=-6.7!,f=-8.4!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.8 K(o=-0.8,f=0) USER MOD Single : A 118 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 GLN : amide:sc= 0.199 K(o=0.2,f=-1.4) USER MOD Single : A 122 MET CE :methyl 175:sc= -2.88! (180deg=-3.06!) USER MOD Single : A 123 GLN : amide:sc= 0.866 K(o=0.87,f=-0.97) USER MOD Single : A 124 THR OG1 : rot -170:sc= 0.797 USER MOD Single : A 129 GLN : amide:sc= 0.484 K(o=0.48,f=-1.5) USER MOD Single : A 132 LYS NZ :NH3+ 168:sc= 1.08 (180deg=0.936) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.005 -5.449 -7.216 1.00 11.00 N ATOM 2 CA MET A 1 19.087 -5.091 -5.802 1.00 43.05 C ATOM 3 C MET A 1 20.264 -4.175 -5.592 1.00 3.41 C ATOM 4 O MET A 1 21.079 -4.015 -6.500 1.00 14.44 O ATOM 5 CB MET A 1 19.177 -6.337 -4.896 1.00 72.21 C ATOM 6 CG MET A 1 20.386 -7.237 -5.130 1.00 20.33 C ATOM 7 SD MET A 1 20.422 -8.656 -4.001 1.00 52.41 S ATOM 8 CE MET A 1 20.554 -7.818 -2.419 1.00 24.22 C ATOM 0 H1 MET A 1 18.866 -6.476 -7.307 1.00 11.00 H new ATOM 0 H2 MET A 1 18.204 -4.951 -7.654 1.00 11.00 H new ATOM 0 H3 MET A 1 19.887 -5.175 -7.695 1.00 11.00 H new ATOM 0 HA MET A 1 18.171 -4.572 -5.520 1.00 43.05 H new ATOM 0 HB2 MET A 1 19.187 -6.008 -3.857 1.00 72.21 H new ATOM 0 HB3 MET A 1 18.273 -6.930 -5.034 1.00 72.21 H new ATOM 0 HG2 MET A 1 20.375 -7.596 -6.159 1.00 20.33 H new ATOM 0 HG3 MET A 1 21.299 -6.654 -5.006 1.00 20.33 H new ATOM 0 HE1 MET A 1 20.937 -8.512 -1.671 1.00 24.22 H new ATOM 0 HE2 MET A 1 21.234 -6.971 -2.511 1.00 24.22 H new ATOM 0 HE3 MET A 1 19.570 -7.461 -2.113 1.00 24.22 H new ATOM 20 N SER A 2 20.340 -3.569 -4.429 1.00 34.14 N ATOM 21 CA SER A 2 21.369 -2.603 -4.118 1.00 41.33 C ATOM 22 C SER A 2 22.769 -3.229 -4.045 1.00 1.31 C ATOM 23 O SER A 2 23.011 -4.179 -3.294 1.00 55.12 O ATOM 24 CB SER A 2 21.013 -1.918 -2.812 1.00 5.24 C ATOM 25 OG SER A 2 19.687 -1.398 -2.887 1.00 45.11 O ATOM 0 H SER A 2 19.684 -3.734 -3.666 1.00 34.14 H new ATOM 0 HA SER A 2 21.410 -1.874 -4.927 1.00 41.33 H new ATOM 0 HB2 SER A 2 21.090 -2.626 -1.986 1.00 5.24 H new ATOM 0 HB3 SER A 2 21.719 -1.113 -2.609 1.00 5.24 H new ATOM 0 HG SER A 2 19.460 -0.958 -2.041 1.00 45.11 H new ATOM 31 N ASP A 3 23.650 -2.700 -4.844 1.00 43.22 N ATOM 32 CA ASP A 3 25.050 -3.083 -4.887 1.00 61.34 C ATOM 33 C ASP A 3 25.823 -1.914 -4.302 1.00 64.20 C ATOM 34 O ASP A 3 25.261 -0.816 -4.241 1.00 44.11 O ATOM 35 CB ASP A 3 25.460 -3.332 -6.348 1.00 62.34 C ATOM 36 CG ASP A 3 26.901 -3.743 -6.511 1.00 41.35 C ATOM 37 OD1 ASP A 3 27.247 -4.889 -6.157 1.00 52.23 O ATOM 38 OD2 ASP A 3 27.707 -2.940 -7.018 1.00 52.03 O ATOM 0 H ASP A 3 23.415 -1.964 -5.510 1.00 43.22 H new ATOM 0 HA ASP A 3 25.248 -3.996 -4.326 1.00 61.34 H new ATOM 0 HB2 ASP A 3 24.820 -4.108 -6.768 1.00 62.34 H new ATOM 0 HB3 ASP A 3 25.283 -2.425 -6.926 1.00 62.34 H new ATOM 43 N ASN A 4 27.061 -2.118 -3.845 1.00 32.02 N ATOM 44 CA ASN A 4 27.832 -1.021 -3.235 1.00 43.34 C ATOM 45 C ASN A 4 27.962 0.133 -4.196 1.00 52.04 C ATOM 46 O ASN A 4 28.517 -0.002 -5.295 1.00 1.13 O ATOM 47 CB ASN A 4 29.220 -1.450 -2.766 1.00 33.13 C ATOM 48 CG ASN A 4 29.952 -0.322 -2.028 1.00 11.24 C ATOM 49 OD1 ASN A 4 29.331 0.517 -1.370 1.00 44.14 O ATOM 50 ND2 ASN A 4 31.260 -0.283 -2.135 1.00 2.13 N ATOM 0 H ASN A 4 27.548 -3.014 -3.882 1.00 32.02 H new ATOM 0 HA ASN A 4 27.272 -0.712 -2.352 1.00 43.34 H new ATOM 0 HB2 ASN A 4 29.129 -2.314 -2.108 1.00 33.13 H new ATOM 0 HB3 ASN A 4 29.812 -1.765 -3.626 1.00 33.13 H new ATOM 0 HD21 ASN A 4 31.788 0.454 -1.668 1.00 2.13 H new ATOM 0 HD22 ASN A 4 31.748 -0.990 -2.686 1.00 2.13 H new ATOM 57 N ASN A 5 27.440 1.237 -3.794 1.00 74.43 N ATOM 58 CA ASN A 5 27.399 2.417 -4.596 1.00 53.44 C ATOM 59 C ASN A 5 27.606 3.583 -3.680 1.00 75.41 C ATOM 60 O ASN A 5 27.357 3.452 -2.464 1.00 71.42 O ATOM 61 CB ASN A 5 26.028 2.536 -5.307 1.00 3.34 C ATOM 62 CG ASN A 5 24.840 2.744 -4.346 1.00 3.03 C ATOM 63 OD1 ASN A 5 24.470 3.876 -4.033 1.00 44.43 O ATOM 64 ND2 ASN A 5 24.244 1.677 -3.877 1.00 51.04 N ATOM 0 H ASN A 5 27.017 1.352 -2.873 1.00 74.43 H new ATOM 0 HA ASN A 5 28.171 2.386 -5.365 1.00 53.44 H new ATOM 0 HB2 ASN A 5 26.065 3.369 -6.008 1.00 3.34 H new ATOM 0 HB3 ASN A 5 25.854 1.634 -5.893 1.00 3.34 H new ATOM 0 HD21 ASN A 5 23.455 1.773 -3.238 1.00 51.04 H new ATOM 0 HD22 ASN A 5 24.569 0.750 -4.151 1.00 51.04 H new ATOM 71 N GLY A 6 28.089 4.689 -4.215 1.00 14.55 N ATOM 72 CA GLY A 6 28.279 5.889 -3.424 1.00 52.44 C ATOM 73 C GLY A 6 26.976 6.323 -2.815 1.00 51.50 C ATOM 74 O GLY A 6 25.957 6.375 -3.510 1.00 62.23 O ATOM 0 H GLY A 6 28.357 4.781 -5.195 1.00 14.55 H new ATOM 0 HA2 GLY A 6 29.011 5.703 -2.638 1.00 52.44 H new ATOM 0 HA3 GLY A 6 28.679 6.686 -4.050 1.00 52.44 H new ATOM 78 N THR A 7 26.986 6.626 -1.553 1.00 22.54 N ATOM 79 CA THR A 7 25.764 6.923 -0.868 1.00 11.04 C ATOM 80 C THR A 7 25.300 8.359 -1.170 1.00 71.44 C ATOM 81 O THR A 7 26.083 9.318 -1.054 1.00 50.30 O ATOM 82 CB THR A 7 25.895 6.665 0.681 1.00 54.11 C ATOM 83 OG1 THR A 7 24.652 6.906 1.354 1.00 62.43 O ATOM 84 CG2 THR A 7 26.998 7.510 1.316 1.00 45.32 C ATOM 0 H THR A 7 27.826 6.674 -0.976 1.00 22.54 H new ATOM 0 HA THR A 7 24.997 6.244 -1.241 1.00 11.04 H new ATOM 0 HB THR A 7 26.165 5.615 0.797 1.00 54.11 H new ATOM 0 HG1 THR A 7 24.761 6.737 2.313 1.00 62.43 H new ATOM 0 HG21 THR A 7 27.050 7.297 2.384 1.00 45.32 H new ATOM 0 HG22 THR A 7 27.954 7.269 0.851 1.00 45.32 H new ATOM 0 HG23 THR A 7 26.778 8.567 1.167 1.00 45.32 H new ATOM 92 N PRO A 8 24.054 8.513 -1.674 1.00 64.45 N ATOM 93 CA PRO A 8 23.460 9.820 -1.883 1.00 31.55 C ATOM 94 C PRO A 8 23.136 10.439 -0.536 1.00 34.10 C ATOM 95 O PRO A 8 22.757 9.729 0.415 1.00 23.12 O ATOM 96 CB PRO A 8 22.160 9.530 -2.658 1.00 44.10 C ATOM 97 CG PRO A 8 22.269 8.112 -3.097 1.00 42.11 C ATOM 98 CD PRO A 8 23.150 7.436 -2.097 1.00 70.13 C ATOM 0 HA PRO A 8 24.115 10.508 -2.417 1.00 31.55 H new ATOM 0 HB2 PRO A 8 21.284 9.679 -2.026 1.00 44.10 H new ATOM 0 HB3 PRO A 8 22.054 10.199 -3.512 1.00 44.10 H new ATOM 0 HG2 PRO A 8 21.288 7.639 -3.135 1.00 42.11 H new ATOM 0 HG3 PRO A 8 22.694 8.046 -4.099 1.00 42.11 H new ATOM 0 HD2 PRO A 8 22.578 7.037 -1.260 1.00 70.13 H new ATOM 0 HD3 PRO A 8 23.695 6.601 -2.538 1.00 70.13 H new ATOM 106 N GLU A 9 23.303 11.712 -0.430 1.00 24.40 N ATOM 107 CA GLU A 9 23.071 12.384 0.812 1.00 1.43 C ATOM 108 C GLU A 9 21.575 12.625 0.992 1.00 20.05 C ATOM 109 O GLU A 9 20.877 12.974 0.028 1.00 35.13 O ATOM 110 CB GLU A 9 23.868 13.668 0.849 1.00 71.25 C ATOM 111 CG GLU A 9 25.359 13.431 0.657 1.00 73.52 C ATOM 112 CD GLU A 9 26.145 14.700 0.618 1.00 74.21 C ATOM 113 OE1 GLU A 9 25.988 15.477 -0.345 1.00 52.13 O ATOM 114 OE2 GLU A 9 26.911 14.965 1.562 1.00 73.34 O ATOM 0 H GLU A 9 23.602 12.318 -1.194 1.00 24.40 H new ATOM 0 HA GLU A 9 23.405 11.766 1.645 1.00 1.43 H new ATOM 0 HB2 GLU A 9 23.506 14.339 0.070 1.00 71.25 H new ATOM 0 HB3 GLU A 9 23.702 14.168 1.803 1.00 71.25 H new ATOM 0 HG2 GLU A 9 25.730 12.804 1.467 1.00 73.52 H new ATOM 0 HG3 GLU A 9 25.519 12.881 -0.271 1.00 73.52 H new ATOM 121 N PRO A 10 21.056 12.382 2.207 1.00 43.32 N ATOM 122 CA PRO A 10 19.631 12.500 2.496 1.00 42.42 C ATOM 123 C PRO A 10 19.072 13.911 2.288 1.00 64.13 C ATOM 124 O PRO A 10 19.727 14.927 2.599 1.00 61.03 O ATOM 125 CB PRO A 10 19.508 12.083 3.970 1.00 51.40 C ATOM 126 CG PRO A 10 20.882 12.214 4.529 1.00 53.34 C ATOM 127 CD PRO A 10 21.820 11.952 3.394 1.00 45.41 C ATOM 0 HA PRO A 10 19.050 11.879 1.814 1.00 42.42 H new ATOM 0 HB2 PRO A 10 18.804 12.722 4.503 1.00 51.40 H new ATOM 0 HB3 PRO A 10 19.142 11.060 4.061 1.00 51.40 H new ATOM 0 HG2 PRO A 10 21.041 13.210 4.943 1.00 53.34 H new ATOM 0 HG3 PRO A 10 21.042 11.502 5.339 1.00 53.34 H new ATOM 0 HD2 PRO A 10 22.746 12.516 3.501 1.00 45.41 H new ATOM 0 HD3 PRO A 10 22.094 10.899 3.335 1.00 45.41 H new ATOM 135 N GLN A 11 17.870 13.954 1.789 1.00 55.23 N ATOM 136 CA GLN A 11 17.159 15.173 1.528 1.00 1.42 C ATOM 137 C GLN A 11 16.338 15.516 2.748 1.00 54.22 C ATOM 138 O GLN A 11 15.783 14.628 3.403 1.00 41.41 O ATOM 139 CB GLN A 11 16.261 14.977 0.306 1.00 32.20 C ATOM 140 CG GLN A 11 17.053 14.723 -0.962 1.00 74.35 C ATOM 141 CD GLN A 11 16.206 14.317 -2.148 1.00 34.30 C ATOM 142 OE1 GLN A 11 15.043 14.688 -2.276 1.00 71.14 O ATOM 143 NE2 GLN A 11 16.796 13.571 -3.043 1.00 53.52 N ATOM 0 H GLN A 11 17.342 13.116 1.545 1.00 55.23 H new ATOM 0 HA GLN A 11 17.851 15.990 1.321 1.00 1.42 H new ATOM 0 HB2 GLN A 11 15.588 14.138 0.484 1.00 32.20 H new ATOM 0 HB3 GLN A 11 15.639 15.862 0.171 1.00 32.20 H new ATOM 0 HG2 GLN A 11 17.608 15.625 -1.218 1.00 74.35 H new ATOM 0 HG3 GLN A 11 17.787 13.941 -0.769 1.00 74.35 H new ATOM 0 HE21 GLN A 11 17.764 13.280 -2.906 1.00 53.52 H new ATOM 0 HE22 GLN A 11 16.289 13.280 -3.879 1.00 53.52 H new ATOM 152 N VAL A 12 16.298 16.774 3.080 1.00 2.55 N ATOM 153 CA VAL A 12 15.620 17.221 4.267 1.00 62.11 C ATOM 154 C VAL A 12 14.446 18.100 3.902 1.00 75.35 C ATOM 155 O VAL A 12 14.597 19.108 3.206 1.00 24.44 O ATOM 156 CB VAL A 12 16.574 18.010 5.213 1.00 23.34 C ATOM 157 CG1 VAL A 12 15.859 18.444 6.487 1.00 2.30 C ATOM 158 CG2 VAL A 12 17.814 17.196 5.552 1.00 44.41 C ATOM 0 H VAL A 12 16.733 17.520 2.537 1.00 2.55 H new ATOM 0 HA VAL A 12 15.269 16.333 4.792 1.00 62.11 H new ATOM 0 HB VAL A 12 16.890 18.906 4.678 1.00 23.34 H new ATOM 0 HG11 VAL A 12 16.553 18.992 7.125 1.00 2.30 H new ATOM 0 HG12 VAL A 12 15.017 19.087 6.231 1.00 2.30 H new ATOM 0 HG13 VAL A 12 15.495 17.564 7.018 1.00 2.30 H new ATOM 0 HG21 VAL A 12 18.459 17.774 6.213 1.00 44.41 H new ATOM 0 HG22 VAL A 12 17.518 16.273 6.050 1.00 44.41 H new ATOM 0 HG23 VAL A 12 18.354 16.957 4.636 1.00 44.41 H new ATOM 168 N GLU A 13 13.305 17.684 4.337 1.00 24.52 N ATOM 169 CA GLU A 13 12.076 18.392 4.201 1.00 41.45 C ATOM 170 C GLU A 13 11.376 18.315 5.540 1.00 21.51 C ATOM 171 O GLU A 13 11.671 17.423 6.345 1.00 43.42 O ATOM 172 CB GLU A 13 11.190 17.773 3.093 1.00 1.23 C ATOM 173 CG GLU A 13 10.787 16.297 3.299 1.00 63.30 C ATOM 174 CD GLU A 13 11.963 15.351 3.281 1.00 54.21 C ATOM 175 OE1 GLU A 13 12.425 14.999 2.183 1.00 53.43 O ATOM 176 OE2 GLU A 13 12.462 14.989 4.368 1.00 60.12 O ATOM 0 H GLU A 13 13.198 16.794 4.823 1.00 24.52 H new ATOM 0 HA GLU A 13 12.264 19.426 3.912 1.00 41.45 H new ATOM 0 HB2 GLU A 13 10.281 18.369 3.006 1.00 1.23 H new ATOM 0 HB3 GLU A 13 11.718 17.856 2.143 1.00 1.23 H new ATOM 0 HG2 GLU A 13 10.265 16.199 4.251 1.00 63.30 H new ATOM 0 HG3 GLU A 13 10.084 16.007 2.518 1.00 63.30 H new ATOM 183 N THR A 14 10.490 19.201 5.801 1.00 74.43 N ATOM 184 CA THR A 14 9.826 19.193 7.065 1.00 43.25 C ATOM 185 C THR A 14 8.337 18.928 6.845 1.00 35.33 C ATOM 186 O THR A 14 7.721 19.520 5.959 1.00 31.11 O ATOM 187 CB THR A 14 10.066 20.518 7.806 1.00 33.10 C ATOM 188 OG1 THR A 14 11.482 20.836 7.742 1.00 51.31 O ATOM 189 CG2 THR A 14 9.680 20.377 9.265 1.00 73.31 C ATOM 0 H THR A 14 10.202 19.943 5.163 1.00 74.43 H new ATOM 0 HA THR A 14 10.230 18.398 7.692 1.00 43.25 H new ATOM 0 HB THR A 14 9.466 21.301 7.342 1.00 33.10 H new ATOM 0 HG1 THR A 14 11.649 21.681 8.210 1.00 51.31 H new ATOM 0 HG21 THR A 14 9.854 21.322 9.780 1.00 73.31 H new ATOM 0 HG22 THR A 14 8.625 20.113 9.338 1.00 73.31 H new ATOM 0 HG23 THR A 14 10.283 19.595 9.727 1.00 73.31 H new HETATM 197 N TPO A 15 7.756 18.048 7.617 1.00 23.32 N HETATM 198 CA TPO A 15 6.375 17.688 7.363 1.00 64.50 C HETATM 199 CB TPO A 15 6.152 16.170 7.444 1.00 62.45 C HETATM 200 CG2 TPO A 15 4.826 15.788 6.796 1.00 32.51 C HETATM 201 OG1 TPO A 15 7.169 15.480 6.705 1.00 53.41 O HETATM 202 P TPO A 15 8.377 14.653 7.387 1.00 5.32 P HETATM 203 O1P TPO A 15 9.554 15.572 7.700 1.00 14.22 O HETATM 204 O2P TPO A 15 8.883 13.597 6.429 1.00 41.11 O HETATM 205 O3P TPO A 15 7.885 13.982 8.683 1.00 54.00 O HETATM 206 C TPO A 15 5.429 18.345 8.358 1.00 14.44 C HETATM 207 O TPO A 15 5.498 18.125 9.575 1.00 4.50 O HETATM 0 HG23 TPO A 15 4.010 16.293 7.313 1.00 32.51 H new HETATM 0 HG22 TPO A 15 4.833 16.088 5.748 1.00 32.51 H new HETATM 0 HG21 TPO A 15 4.686 14.709 6.863 1.00 32.51 H new HETATM 0 HB TPO A 15 6.168 15.898 8.499 1.00 62.45 H new HETATM 0 HA TPO A 15 6.162 18.041 6.354 1.00 64.50 H new HETATM 0 H TPO A 15 8.443 17.322 7.819 1.00 23.32 H new ATOM 214 N SER A 16 4.573 19.150 7.812 1.00 23.10 N ATOM 215 CA SER A 16 3.532 19.821 8.517 1.00 3.20 C ATOM 216 C SER A 16 2.235 19.063 8.238 1.00 22.05 C ATOM 217 O SER A 16 2.142 18.368 7.215 1.00 31.21 O ATOM 218 CB SER A 16 3.458 21.257 8.008 1.00 31.42 C ATOM 219 OG SER A 16 4.740 21.876 8.124 1.00 34.21 O ATOM 0 H SER A 16 4.583 19.366 6.815 1.00 23.10 H new ATOM 0 HA SER A 16 3.709 19.848 9.592 1.00 3.20 H new ATOM 0 HB2 SER A 16 3.131 21.268 6.968 1.00 31.42 H new ATOM 0 HB3 SER A 16 2.719 21.818 8.580 1.00 31.42 H new ATOM 0 HG SER A 16 4.689 22.798 7.795 1.00 34.21 H new ATOM 225 N VAL A 17 1.276 19.142 9.130 1.00 10.32 N ATOM 226 CA VAL A 17 0.046 18.404 8.964 1.00 61.12 C ATOM 227 C VAL A 17 -0.875 19.181 8.023 1.00 64.43 C ATOM 228 O VAL A 17 -1.340 20.282 8.331 1.00 73.22 O ATOM 229 CB VAL A 17 -0.642 18.157 10.338 1.00 11.35 C ATOM 230 CG1 VAL A 17 -1.935 17.389 10.174 1.00 30.23 C ATOM 231 CG2 VAL A 17 0.295 17.406 11.272 1.00 65.32 C ATOM 0 H VAL A 17 1.323 19.709 9.977 1.00 10.32 H new ATOM 0 HA VAL A 17 0.264 17.428 8.530 1.00 61.12 H new ATOM 0 HB VAL A 17 -0.876 19.129 10.773 1.00 11.35 H new ATOM 0 HG11 VAL A 17 -2.392 17.232 11.151 1.00 30.23 H new ATOM 0 HG12 VAL A 17 -2.618 17.956 9.541 1.00 30.23 H new ATOM 0 HG13 VAL A 17 -1.729 16.424 9.711 1.00 30.23 H new ATOM 0 HG21 VAL A 17 -0.200 17.241 12.229 1.00 65.32 H new ATOM 0 HG22 VAL A 17 0.558 16.445 10.829 1.00 65.32 H new ATOM 0 HG23 VAL A 17 1.200 17.993 11.429 1.00 65.32 H new ATOM 241 N PHE A 18 -1.132 18.584 6.891 1.00 42.04 N ATOM 242 CA PHE A 18 -1.849 19.210 5.808 1.00 3.12 C ATOM 243 C PHE A 18 -3.117 18.437 5.494 1.00 35.40 C ATOM 244 O PHE A 18 -3.150 17.213 5.617 1.00 34.55 O ATOM 245 CB PHE A 18 -0.951 19.296 4.546 1.00 41.53 C ATOM 246 CG PHE A 18 -0.598 17.954 3.936 1.00 31.12 C ATOM 247 CD1 PHE A 18 0.381 17.150 4.501 1.00 64.30 C ATOM 248 CD2 PHE A 18 -1.260 17.499 2.803 1.00 65.14 C ATOM 249 CE1 PHE A 18 0.689 15.922 3.952 1.00 4.31 C ATOM 250 CE2 PHE A 18 -0.953 16.276 2.251 1.00 75.53 C ATOM 251 CZ PHE A 18 0.020 15.485 2.826 1.00 10.35 C ATOM 0 H PHE A 18 -0.843 17.627 6.689 1.00 42.04 H new ATOM 0 HA PHE A 18 -2.123 20.220 6.114 1.00 3.12 H new ATOM 0 HB2 PHE A 18 -1.458 19.901 3.794 1.00 41.53 H new ATOM 0 HB3 PHE A 18 -0.029 19.817 4.806 1.00 41.53 H new ATOM 0 HD1 PHE A 18 0.908 17.489 5.381 1.00 64.30 H new ATOM 0 HD2 PHE A 18 -2.025 18.112 2.350 1.00 65.14 H new ATOM 0 HE1 PHE A 18 1.452 15.304 4.402 1.00 4.31 H new ATOM 0 HE2 PHE A 18 -1.474 15.936 1.368 1.00 75.53 H new ATOM 0 HZ PHE A 18 0.259 14.524 2.395 1.00 10.35 H new ATOM 261 N ARG A 19 -4.172 19.133 5.175 1.00 43.21 N ATOM 262 CA ARG A 19 -5.374 18.473 4.755 1.00 52.51 C ATOM 263 C ARG A 19 -5.836 19.008 3.415 1.00 64.44 C ATOM 264 O ARG A 19 -6.562 19.982 3.337 1.00 71.33 O ATOM 265 CB ARG A 19 -6.487 18.516 5.831 1.00 51.41 C ATOM 266 CG ARG A 19 -6.818 19.895 6.382 1.00 35.41 C ATOM 267 CD ARG A 19 -7.873 19.804 7.472 1.00 5.32 C ATOM 268 NE ARG A 19 -8.262 21.123 7.969 1.00 60.21 N ATOM 269 CZ ARG A 19 -8.704 21.384 9.203 1.00 42.34 C ATOM 270 NH1 ARG A 19 -8.746 20.425 10.126 1.00 1.03 N ATOM 271 NH2 ARG A 19 -9.093 22.613 9.516 1.00 5.14 N ATOM 0 H ARG A 19 -4.224 20.151 5.198 1.00 43.21 H new ATOM 0 HA ARG A 19 -5.141 17.416 4.625 1.00 52.51 H new ATOM 0 HB2 ARG A 19 -7.395 18.087 5.406 1.00 51.41 H new ATOM 0 HB3 ARG A 19 -6.190 17.875 6.661 1.00 51.41 H new ATOM 0 HG2 ARG A 19 -5.916 20.358 6.781 1.00 35.41 H new ATOM 0 HG3 ARG A 19 -7.176 20.537 5.577 1.00 35.41 H new ATOM 0 HD2 ARG A 19 -8.752 19.289 7.084 1.00 5.32 H new ATOM 0 HD3 ARG A 19 -7.491 19.204 8.298 1.00 5.32 H new ATOM 0 HE ARG A 19 -8.190 21.908 7.321 1.00 60.21 H new ATOM 0 HH11 ARG A 19 -8.439 19.480 9.894 1.00 1.03 H new ATOM 0 HH12 ARG A 19 -9.085 20.635 11.065 1.00 1.03 H new ATOM 0 HH21 ARG A 19 -9.054 23.354 8.816 1.00 5.14 H new ATOM 0 HH22 ARG A 19 -9.431 22.817 10.456 1.00 5.14 H new ATOM 285 N ALA A 20 -5.373 18.375 2.356 1.00 21.11 N ATOM 286 CA ALA A 20 -5.739 18.784 1.012 1.00 75.52 C ATOM 287 C ALA A 20 -7.040 18.150 0.607 1.00 73.13 C ATOM 288 O ALA A 20 -8.113 18.708 0.812 1.00 15.14 O ATOM 289 CB ALA A 20 -4.612 18.491 0.021 1.00 30.52 C ATOM 0 H ALA A 20 -4.742 17.575 2.399 1.00 21.11 H new ATOM 0 HA ALA A 20 -5.888 19.864 1.002 1.00 75.52 H new ATOM 0 HB1 ALA A 20 -4.914 18.808 -0.977 1.00 30.52 H new ATOM 0 HB2 ALA A 20 -3.715 19.035 0.318 1.00 30.52 H new ATOM 0 HB3 ALA A 20 -4.402 17.421 0.014 1.00 30.52 H new ATOM 295 N ASP A 21 -6.953 16.961 0.126 1.00 20.32 N ATOM 296 CA ASP A 21 -8.141 16.190 -0.263 1.00 72.41 C ATOM 297 C ASP A 21 -8.803 15.623 0.961 1.00 50.13 C ATOM 298 O ASP A 21 -9.944 15.171 0.922 1.00 43.42 O ATOM 299 CB ASP A 21 -7.803 15.071 -1.240 1.00 22.42 C ATOM 300 CG ASP A 21 -7.251 15.587 -2.541 1.00 22.35 C ATOM 301 OD1 ASP A 21 -8.024 15.945 -3.431 1.00 10.14 O ATOM 302 OD2 ASP A 21 -6.016 15.643 -2.699 1.00 52.44 O ATOM 0 H ASP A 21 -6.070 16.472 -0.020 1.00 20.32 H new ATOM 0 HA ASP A 21 -8.825 16.870 -0.771 1.00 72.41 H new ATOM 0 HB2 ASP A 21 -7.076 14.400 -0.782 1.00 22.42 H new ATOM 0 HB3 ASP A 21 -8.699 14.483 -1.437 1.00 22.42 H new ATOM 307 N LEU A 22 -8.087 15.712 2.081 1.00 23.14 N ATOM 308 CA LEU A 22 -8.570 15.234 3.363 1.00 71.24 C ATOM 309 C LEU A 22 -9.791 16.013 3.833 1.00 20.02 C ATOM 310 O LEU A 22 -10.503 15.564 4.718 1.00 54.11 O ATOM 311 CB LEU A 22 -7.465 15.248 4.427 1.00 55.23 C ATOM 312 CG LEU A 22 -6.297 14.274 4.210 1.00 33.34 C ATOM 313 CD1 LEU A 22 -5.260 14.430 5.310 1.00 71.30 C ATOM 314 CD2 LEU A 22 -6.800 12.835 4.170 1.00 14.43 C ATOM 0 H LEU A 22 -7.153 16.120 2.118 1.00 23.14 H new ATOM 0 HA LEU A 22 -8.876 14.198 3.218 1.00 71.24 H new ATOM 0 HB2 LEU A 22 -7.061 16.259 4.487 1.00 55.23 H new ATOM 0 HB3 LEU A 22 -7.918 15.028 5.394 1.00 55.23 H new ATOM 0 HG LEU A 22 -5.832 14.510 3.253 1.00 33.34 H new ATOM 0 HD11 LEU A 22 -4.441 13.732 5.139 1.00 71.30 H new ATOM 0 HD12 LEU A 22 -4.875 15.450 5.305 1.00 71.30 H new ATOM 0 HD13 LEU A 22 -5.720 14.220 6.276 1.00 71.30 H new ATOM 0 HD21 LEU A 22 -5.959 12.160 4.016 1.00 14.43 H new ATOM 0 HD22 LEU A 22 -7.290 12.594 5.114 1.00 14.43 H new ATOM 0 HD23 LEU A 22 -7.512 12.721 3.352 1.00 14.43 H new ATOM 326 N LEU A 23 -10.032 17.174 3.218 1.00 70.44 N ATOM 327 CA LEU A 23 -11.202 17.966 3.517 1.00 42.04 C ATOM 328 C LEU A 23 -12.452 17.179 3.143 1.00 21.11 C ATOM 329 O LEU A 23 -13.373 17.061 3.926 1.00 50.52 O ATOM 330 CB LEU A 23 -11.164 19.277 2.728 1.00 74.34 C ATOM 331 CG LEU A 23 -9.990 20.219 3.015 1.00 50.42 C ATOM 332 CD1 LEU A 23 -10.059 21.441 2.118 1.00 72.34 C ATOM 333 CD2 LEU A 23 -9.983 20.641 4.469 1.00 13.15 C ATOM 0 H LEU A 23 -9.422 17.578 2.508 1.00 70.44 H new ATOM 0 HA LEU A 23 -11.218 18.195 4.582 1.00 42.04 H new ATOM 0 HB2 LEU A 23 -11.154 19.034 1.665 1.00 74.34 H new ATOM 0 HB3 LEU A 23 -12.090 19.818 2.923 1.00 74.34 H new ATOM 0 HG LEU A 23 -9.065 19.681 2.806 1.00 50.42 H new ATOM 0 HD11 LEU A 23 -9.218 22.100 2.335 1.00 72.34 H new ATOM 0 HD12 LEU A 23 -10.016 21.129 1.074 1.00 72.34 H new ATOM 0 HD13 LEU A 23 -10.993 21.973 2.299 1.00 72.34 H new ATOM 0 HD21 LEU A 23 -9.141 21.309 4.650 1.00 13.15 H new ATOM 0 HD22 LEU A 23 -10.914 21.158 4.702 1.00 13.15 H new ATOM 0 HD23 LEU A 23 -9.889 19.760 5.103 1.00 13.15 H new ATOM 345 N LYS A 24 -12.430 16.583 1.969 1.00 73.20 N ATOM 346 CA LYS A 24 -13.549 15.803 1.491 1.00 12.15 C ATOM 347 C LYS A 24 -13.438 14.377 2.009 1.00 20.45 C ATOM 348 O LYS A 24 -14.444 13.730 2.317 1.00 11.55 O ATOM 349 CB LYS A 24 -13.576 15.814 -0.042 1.00 61.22 C ATOM 350 CG LYS A 24 -14.715 15.021 -0.664 1.00 43.15 C ATOM 351 CD LYS A 24 -14.646 15.059 -2.178 1.00 62.11 C ATOM 352 CE LYS A 24 -15.744 14.220 -2.826 1.00 34.14 C ATOM 353 NZ LYS A 24 -17.108 14.685 -2.475 1.00 53.12 N ATOM 0 H LYS A 24 -11.641 16.626 1.324 1.00 73.20 H new ATOM 0 HA LYS A 24 -14.477 16.240 1.859 1.00 12.15 H new ATOM 0 HB2 LYS A 24 -13.642 16.847 -0.383 1.00 61.22 H new ATOM 0 HB3 LYS A 24 -12.631 15.416 -0.411 1.00 61.22 H new ATOM 0 HG2 LYS A 24 -14.672 13.987 -0.321 1.00 43.15 H new ATOM 0 HG3 LYS A 24 -15.670 15.428 -0.330 1.00 43.15 H new ATOM 0 HD2 LYS A 24 -14.731 16.091 -2.518 1.00 62.11 H new ATOM 0 HD3 LYS A 24 -13.672 14.695 -2.505 1.00 62.11 H new ATOM 0 HE2 LYS A 24 -15.624 14.247 -3.909 1.00 34.14 H new ATOM 0 HE3 LYS A 24 -15.629 13.181 -2.518 1.00 34.14 H new ATOM 0 HZ1 LYS A 24 -17.808 14.169 -3.045 1.00 53.12 H new ATOM 0 HZ2 LYS A 24 -17.286 14.508 -1.466 1.00 53.12 H new ATOM 0 HZ3 LYS A 24 -17.188 15.704 -2.667 1.00 53.12 H new ATOM 367 N GLU A 25 -12.199 13.911 2.137 1.00 44.02 N ATOM 368 CA GLU A 25 -11.902 12.555 2.585 1.00 32.23 C ATOM 369 C GLU A 25 -12.487 12.313 3.977 1.00 73.52 C ATOM 370 O GLU A 25 -12.919 11.217 4.283 1.00 51.44 O ATOM 371 CB GLU A 25 -10.392 12.330 2.628 1.00 3.24 C ATOM 372 CG GLU A 25 -9.967 10.870 2.623 1.00 53.11 C ATOM 373 CD GLU A 25 -10.248 10.198 1.299 1.00 31.14 C ATOM 374 OE1 GLU A 25 -11.429 9.932 0.981 1.00 24.35 O ATOM 375 OE2 GLU A 25 -9.310 9.933 0.542 1.00 31.12 O ATOM 0 H GLU A 25 -11.369 14.467 1.932 1.00 44.02 H new ATOM 0 HA GLU A 25 -12.352 11.857 1.879 1.00 32.23 H new ATOM 0 HB2 GLU A 25 -9.939 12.829 1.771 1.00 3.24 H new ATOM 0 HB3 GLU A 25 -9.992 12.808 3.523 1.00 3.24 H new ATOM 0 HG2 GLU A 25 -8.902 10.803 2.844 1.00 53.11 H new ATOM 0 HG3 GLU A 25 -10.491 10.338 3.417 1.00 53.11 H new ATOM 382 N MET A 26 -12.519 13.359 4.798 1.00 2.43 N ATOM 383 CA MET A 26 -13.052 13.272 6.155 1.00 53.22 C ATOM 384 C MET A 26 -14.516 12.833 6.157 1.00 14.54 C ATOM 385 O MET A 26 -14.879 11.870 6.848 1.00 54.23 O ATOM 386 CB MET A 26 -12.883 14.603 6.898 1.00 45.24 C ATOM 387 CG MET A 26 -13.455 14.604 8.316 1.00 23.12 C ATOM 388 SD MET A 26 -12.781 13.288 9.365 1.00 23.25 S ATOM 389 CE MET A 26 -11.032 13.694 9.357 1.00 1.12 C ATOM 0 H MET A 26 -12.178 14.286 4.544 1.00 2.43 H new ATOM 0 HA MET A 26 -12.478 12.510 6.682 1.00 53.22 H new ATOM 0 HB2 MET A 26 -11.822 14.848 6.946 1.00 45.24 H new ATOM 0 HB3 MET A 26 -13.367 15.392 6.322 1.00 45.24 H new ATOM 0 HG2 MET A 26 -13.252 15.569 8.781 1.00 23.12 H new ATOM 0 HG3 MET A 26 -14.538 14.497 8.263 1.00 23.12 H new ATOM 0 HE1 MET A 26 -10.522 13.123 10.133 1.00 1.12 H new ATOM 0 HE2 MET A 26 -10.605 13.446 8.385 1.00 1.12 H new ATOM 0 HE3 MET A 26 -10.905 14.760 9.548 1.00 1.12 H new ATOM 399 N GLU A 27 -15.334 13.484 5.346 1.00 33.30 N ATOM 400 CA GLU A 27 -16.752 13.142 5.259 1.00 4.34 C ATOM 401 C GLU A 27 -16.945 11.781 4.594 1.00 75.54 C ATOM 402 O GLU A 27 -17.904 11.054 4.890 1.00 35.33 O ATOM 403 CB GLU A 27 -17.580 14.221 4.536 1.00 23.42 C ATOM 404 CG GLU A 27 -17.812 15.521 5.325 1.00 72.53 C ATOM 405 CD GLU A 27 -16.564 16.318 5.601 1.00 32.43 C ATOM 406 OE1 GLU A 27 -16.154 17.094 4.731 1.00 2.34 O ATOM 407 OE2 GLU A 27 -15.995 16.201 6.705 1.00 51.23 O ATOM 0 H GLU A 27 -15.045 14.251 4.738 1.00 33.30 H new ATOM 0 HA GLU A 27 -17.123 13.090 6.283 1.00 4.34 H new ATOM 0 HB2 GLU A 27 -17.081 14.470 3.600 1.00 23.42 H new ATOM 0 HB3 GLU A 27 -18.550 13.796 4.277 1.00 23.42 H new ATOM 0 HG2 GLU A 27 -18.512 16.147 4.771 1.00 72.53 H new ATOM 0 HG3 GLU A 27 -18.287 15.274 6.274 1.00 72.53 H new ATOM 414 N SER A 28 -16.031 11.434 3.719 1.00 44.30 N ATOM 415 CA SER A 28 -16.048 10.151 3.046 1.00 41.52 C ATOM 416 C SER A 28 -15.620 9.028 4.010 1.00 72.43 C ATOM 417 O SER A 28 -15.995 7.859 3.851 1.00 73.45 O ATOM 418 CB SER A 28 -15.112 10.207 1.846 1.00 33.34 C ATOM 419 OG SER A 28 -15.448 11.300 0.996 1.00 23.52 O ATOM 0 H SER A 28 -15.251 12.034 3.451 1.00 44.30 H new ATOM 0 HA SER A 28 -17.061 9.934 2.707 1.00 41.52 H new ATOM 0 HB2 SER A 28 -14.082 10.308 2.187 1.00 33.34 H new ATOM 0 HB3 SER A 28 -15.173 9.273 1.287 1.00 33.34 H new ATOM 0 HG SER A 28 -15.133 12.136 1.398 1.00 23.52 H new ATOM 425 N SER A 29 -14.849 9.400 5.001 1.00 71.45 N ATOM 426 CA SER A 29 -14.350 8.482 5.972 1.00 1.45 C ATOM 427 C SER A 29 -15.320 8.361 7.147 1.00 61.02 C ATOM 428 O SER A 29 -15.189 7.454 7.965 1.00 73.11 O ATOM 429 CB SER A 29 -12.938 8.886 6.445 1.00 52.21 C ATOM 430 OG SER A 29 -12.301 7.817 7.142 1.00 2.12 O ATOM 0 H SER A 29 -14.551 10.364 5.151 1.00 71.45 H new ATOM 0 HA SER A 29 -14.268 7.501 5.504 1.00 1.45 H new ATOM 0 HB2 SER A 29 -12.333 9.175 5.586 1.00 52.21 H new ATOM 0 HB3 SER A 29 -13.005 9.758 7.095 1.00 52.21 H new ATOM 0 HG SER A 29 -11.574 8.174 7.693 1.00 2.12 H new ATOM 436 N THR A 30 -16.251 9.307 7.259 1.00 25.02 N ATOM 437 CA THR A 30 -17.217 9.298 8.335 1.00 33.15 C ATOM 438 C THR A 30 -18.112 8.031 8.255 1.00 43.33 C ATOM 439 O THR A 30 -19.019 7.933 7.415 1.00 21.34 O ATOM 440 CB THR A 30 -18.099 10.568 8.309 1.00 60.01 C ATOM 441 OG1 THR A 30 -17.266 11.749 8.232 1.00 54.44 O ATOM 442 CG2 THR A 30 -18.943 10.650 9.571 1.00 53.23 C ATOM 0 H THR A 30 -16.350 10.088 6.611 1.00 25.02 H new ATOM 0 HA THR A 30 -16.664 9.284 9.274 1.00 33.15 H new ATOM 0 HB THR A 30 -18.749 10.514 7.436 1.00 60.01 H new ATOM 0 HG1 THR A 30 -16.457 11.546 7.717 1.00 54.44 H new ATOM 0 HG21 THR A 30 -19.559 11.549 9.539 1.00 53.23 H new ATOM 0 HG22 THR A 30 -19.586 9.772 9.637 1.00 53.23 H new ATOM 0 HG23 THR A 30 -18.290 10.688 10.443 1.00 53.23 H new ATOM 450 N GLY A 31 -17.809 7.067 9.085 1.00 21.22 N ATOM 451 CA GLY A 31 -18.525 5.835 9.124 1.00 71.11 C ATOM 452 C GLY A 31 -17.616 4.737 9.600 1.00 51.13 C ATOM 453 O GLY A 31 -16.733 4.988 10.420 1.00 2.11 O ATOM 0 H GLY A 31 -17.046 7.124 9.759 1.00 21.22 H new ATOM 0 HA2 GLY A 31 -19.384 5.923 9.789 1.00 71.11 H new ATOM 0 HA3 GLY A 31 -18.912 5.596 8.133 1.00 71.11 H new ATOM 457 N THR A 32 -17.808 3.548 9.107 1.00 41.42 N ATOM 458 CA THR A 32 -16.992 2.430 9.498 1.00 54.12 C ATOM 459 C THR A 32 -16.194 1.889 8.292 1.00 52.13 C ATOM 460 O THR A 32 -16.736 1.757 7.190 1.00 53.03 O ATOM 461 CB THR A 32 -17.873 1.310 10.112 1.00 72.45 C ATOM 462 OG1 THR A 32 -18.646 1.851 11.212 1.00 13.32 O ATOM 463 CG2 THR A 32 -17.019 0.157 10.627 1.00 44.45 C ATOM 0 H THR A 32 -18.532 3.324 8.424 1.00 41.42 H new ATOM 0 HA THR A 32 -16.282 2.769 10.253 1.00 54.12 H new ATOM 0 HB THR A 32 -18.534 0.933 9.332 1.00 72.45 H new ATOM 0 HG1 THR A 32 -19.204 1.144 11.599 1.00 13.32 H new ATOM 0 HG21 THR A 32 -17.664 -0.612 11.051 1.00 44.45 H new ATOM 0 HG22 THR A 32 -16.444 -0.266 9.803 1.00 44.45 H new ATOM 0 HG23 THR A 32 -16.338 0.524 11.395 1.00 44.45 H new ATOM 471 N ALA A 33 -14.909 1.633 8.498 1.00 52.33 N ATOM 472 CA ALA A 33 -14.056 1.017 7.488 1.00 54.44 C ATOM 473 C ALA A 33 -13.831 -0.467 7.835 1.00 11.21 C ATOM 474 O ALA A 33 -12.966 -0.790 8.671 1.00 1.45 O ATOM 475 CB ALA A 33 -12.716 1.742 7.412 1.00 61.52 C ATOM 0 H ALA A 33 -14.427 1.847 9.371 1.00 52.33 H new ATOM 0 HA ALA A 33 -14.547 1.090 6.518 1.00 54.44 H new ATOM 0 HB1 ALA A 33 -12.090 1.271 6.654 1.00 61.52 H new ATOM 0 HB2 ALA A 33 -12.882 2.786 7.148 1.00 61.52 H new ATOM 0 HB3 ALA A 33 -12.217 1.687 8.380 1.00 61.52 H new ATOM 481 N PRO A 34 -14.644 -1.382 7.267 1.00 65.03 N ATOM 482 CA PRO A 34 -14.549 -2.821 7.534 1.00 24.35 C ATOM 483 C PRO A 34 -13.372 -3.486 6.804 1.00 43.41 C ATOM 484 O PRO A 34 -12.851 -2.951 5.813 1.00 25.10 O ATOM 485 CB PRO A 34 -15.884 -3.385 7.010 1.00 43.21 C ATOM 486 CG PRO A 34 -16.692 -2.197 6.583 1.00 70.11 C ATOM 487 CD PRO A 34 -15.711 -1.106 6.295 1.00 34.52 C ATOM 0 HA PRO A 34 -14.374 -3.015 8.592 1.00 24.35 H new ATOM 0 HB2 PRO A 34 -15.719 -4.066 6.175 1.00 43.21 H new ATOM 0 HB3 PRO A 34 -16.401 -3.950 7.786 1.00 43.21 H new ATOM 0 HG2 PRO A 34 -17.287 -2.428 5.700 1.00 70.11 H new ATOM 0 HG3 PRO A 34 -17.388 -1.898 7.367 1.00 70.11 H new ATOM 0 HD2 PRO A 34 -15.347 -1.147 5.268 1.00 34.52 H new ATOM 0 HD3 PRO A 34 -16.147 -0.118 6.439 1.00 34.52 H new ATOM 495 N ALA A 35 -12.976 -4.649 7.276 1.00 73.13 N ATOM 496 CA ALA A 35 -11.903 -5.415 6.680 1.00 35.20 C ATOM 497 C ALA A 35 -12.364 -6.862 6.536 1.00 31.22 C ATOM 498 O ALA A 35 -13.413 -7.221 7.061 1.00 13.45 O ATOM 499 CB ALA A 35 -10.638 -5.318 7.523 1.00 71.43 C ATOM 0 H ALA A 35 -13.395 -5.094 8.093 1.00 73.13 H new ATOM 0 HA ALA A 35 -11.662 -5.013 5.696 1.00 35.20 H new ATOM 0 HB1 ALA A 35 -9.844 -5.901 7.056 1.00 71.43 H new ATOM 0 HB2 ALA A 35 -10.328 -4.276 7.595 1.00 71.43 H new ATOM 0 HB3 ALA A 35 -10.835 -5.708 8.522 1.00 71.43 H new ATOM 505 N SER A 36 -11.625 -7.666 5.817 1.00 40.40 N ATOM 506 CA SER A 36 -11.995 -9.049 5.603 1.00 2.45 C ATOM 507 C SER A 36 -10.940 -9.966 6.212 1.00 1.45 C ATOM 508 O SER A 36 -9.812 -9.543 6.446 1.00 53.21 O ATOM 509 CB SER A 36 -12.094 -9.298 4.106 1.00 35.23 C ATOM 510 OG SER A 36 -12.959 -8.345 3.509 1.00 72.42 O ATOM 0 H SER A 36 -10.755 -7.387 5.364 1.00 40.40 H new ATOM 0 HA SER A 36 -12.954 -9.256 6.078 1.00 2.45 H new ATOM 0 HB2 SER A 36 -11.104 -9.236 3.653 1.00 35.23 H new ATOM 0 HB3 SER A 36 -12.467 -10.305 3.921 1.00 35.23 H new ATOM 0 HG SER A 36 -13.015 -8.513 2.545 1.00 72.42 H new ATOM 516 N THR A 37 -11.296 -11.184 6.493 1.00 52.45 N ATOM 517 CA THR A 37 -10.346 -12.125 7.007 1.00 10.24 C ATOM 518 C THR A 37 -9.742 -12.896 5.830 1.00 72.41 C ATOM 519 O THR A 37 -10.354 -12.985 4.763 1.00 1.32 O ATOM 520 CB THR A 37 -10.989 -13.103 8.046 1.00 10.51 C ATOM 521 OG1 THR A 37 -9.983 -13.905 8.677 1.00 72.33 O ATOM 522 CG2 THR A 37 -12.015 -14.017 7.397 1.00 52.40 C ATOM 0 H THR A 37 -12.241 -11.550 6.375 1.00 52.45 H new ATOM 0 HA THR A 37 -9.565 -11.583 7.540 1.00 10.24 H new ATOM 0 HB THR A 37 -11.491 -12.488 8.793 1.00 10.51 H new ATOM 0 HG1 THR A 37 -10.404 -14.509 9.324 1.00 72.33 H new ATOM 0 HG21 THR A 37 -12.439 -14.681 8.150 1.00 52.40 H new ATOM 0 HG22 THR A 37 -12.809 -13.416 6.955 1.00 52.40 H new ATOM 0 HG23 THR A 37 -11.534 -14.611 6.620 1.00 52.40 H new ATOM 530 N GLY A 38 -8.553 -13.408 6.005 1.00 62.21 N ATOM 531 CA GLY A 38 -7.912 -14.156 4.952 1.00 65.52 C ATOM 532 C GLY A 38 -6.417 -14.053 5.034 1.00 23.00 C ATOM 533 O GLY A 38 -5.701 -14.982 4.675 1.00 11.41 O ATOM 0 H GLY A 38 -8.008 -13.322 6.863 1.00 62.21 H new ATOM 0 HA2 GLY A 38 -8.209 -15.203 5.015 1.00 65.52 H new ATOM 0 HA3 GLY A 38 -8.250 -13.786 3.984 1.00 65.52 H new ATOM 537 N ALA A 39 -5.935 -12.938 5.556 1.00 22.42 N ATOM 538 CA ALA A 39 -4.503 -12.716 5.683 1.00 73.43 C ATOM 539 C ALA A 39 -3.928 -13.661 6.724 1.00 40.40 C ATOM 540 O ALA A 39 -2.882 -14.251 6.522 1.00 12.52 O ATOM 541 CB ALA A 39 -4.202 -11.262 6.029 1.00 32.31 C ATOM 0 H ALA A 39 -6.514 -12.171 5.899 1.00 22.42 H new ATOM 0 HA ALA A 39 -4.028 -12.924 4.724 1.00 73.43 H new ATOM 0 HB1 ALA A 39 -3.124 -11.125 6.118 1.00 32.31 H new ATOM 0 HB2 ALA A 39 -4.587 -10.614 5.242 1.00 32.31 H new ATOM 0 HB3 ALA A 39 -4.679 -11.007 6.975 1.00 32.31 H new ATOM 547 N GLU A 40 -4.685 -13.864 7.795 1.00 2.41 N ATOM 548 CA GLU A 40 -4.308 -14.764 8.894 1.00 22.14 C ATOM 549 C GLU A 40 -4.399 -16.246 8.479 1.00 12.05 C ATOM 550 O GLU A 40 -4.016 -17.152 9.235 1.00 55.00 O ATOM 551 CB GLU A 40 -5.202 -14.502 10.110 1.00 21.04 C ATOM 552 CG GLU A 40 -6.686 -14.624 9.809 1.00 74.24 C ATOM 553 CD GLU A 40 -7.556 -14.358 11.002 1.00 54.42 C ATOM 554 OE1 GLU A 40 -7.654 -13.198 11.438 1.00 22.44 O ATOM 555 OE2 GLU A 40 -8.214 -15.299 11.496 1.00 31.32 O ATOM 0 H GLU A 40 -5.587 -13.408 7.933 1.00 2.41 H new ATOM 0 HA GLU A 40 -3.269 -14.558 9.152 1.00 22.14 H new ATOM 0 HB2 GLU A 40 -4.941 -15.205 10.901 1.00 21.04 H new ATOM 0 HB3 GLU A 40 -4.998 -13.502 10.492 1.00 21.04 H new ATOM 0 HG2 GLU A 40 -6.947 -13.925 9.014 1.00 74.24 H new ATOM 0 HG3 GLU A 40 -6.893 -15.626 9.433 1.00 74.24 H new ATOM 562 N ASN A 41 -4.912 -16.485 7.290 1.00 11.23 N ATOM 563 CA ASN A 41 -5.030 -17.833 6.755 1.00 24.02 C ATOM 564 C ASN A 41 -3.815 -18.103 5.913 1.00 62.23 C ATOM 565 O ASN A 41 -3.439 -19.255 5.671 1.00 42.21 O ATOM 566 CB ASN A 41 -6.294 -18.002 5.877 1.00 22.41 C ATOM 567 CG ASN A 41 -7.621 -17.818 6.609 1.00 23.50 C ATOM 568 OD1 ASN A 41 -7.735 -17.049 7.567 1.00 51.13 O ATOM 569 ND2 ASN A 41 -8.638 -18.507 6.154 1.00 21.42 N ATOM 0 H ASN A 41 -5.259 -15.756 6.666 1.00 11.23 H new ATOM 0 HA ASN A 41 -5.110 -18.532 7.588 1.00 24.02 H new ATOM 0 HB2 ASN A 41 -6.247 -17.285 5.057 1.00 22.41 H new ATOM 0 HB3 ASN A 41 -6.278 -18.997 5.432 1.00 22.41 H new ATOM 0 HD21 ASN A 41 -9.554 -18.415 6.594 1.00 21.42 H new ATOM 0 HD22 ASN A 41 -8.514 -19.135 5.360 1.00 21.42 H new ATOM 576 N LEU A 42 -3.178 -17.001 5.511 1.00 73.14 N ATOM 577 CA LEU A 42 -2.017 -16.984 4.648 1.00 11.30 C ATOM 578 C LEU A 42 -2.313 -17.649 3.300 1.00 53.01 C ATOM 579 O LEU A 42 -2.125 -18.858 3.135 1.00 20.51 O ATOM 580 CB LEU A 42 -0.797 -17.611 5.333 1.00 31.10 C ATOM 581 CG LEU A 42 -0.295 -16.929 6.615 1.00 0.12 C ATOM 582 CD1 LEU A 42 0.847 -17.722 7.212 1.00 33.33 C ATOM 583 CD2 LEU A 42 0.152 -15.497 6.342 1.00 42.43 C ATOM 0 H LEU A 42 -3.475 -16.067 5.793 1.00 73.14 H new ATOM 0 HA LEU A 42 -1.773 -15.941 4.449 1.00 11.30 H new ATOM 0 HB2 LEU A 42 -1.037 -18.647 5.571 1.00 31.10 H new ATOM 0 HB3 LEU A 42 0.023 -17.630 4.615 1.00 31.10 H new ATOM 0 HG LEU A 42 -1.122 -16.896 7.325 1.00 0.12 H new ATOM 0 HD11 LEU A 42 1.196 -17.230 8.120 1.00 33.33 H new ATOM 0 HD12 LEU A 42 0.504 -18.728 7.453 1.00 33.33 H new ATOM 0 HD13 LEU A 42 1.665 -17.779 6.494 1.00 33.33 H new ATOM 0 HD21 LEU A 42 0.502 -15.042 7.269 1.00 42.43 H new ATOM 0 HD22 LEU A 42 0.962 -15.501 5.612 1.00 42.43 H new ATOM 0 HD23 LEU A 42 -0.687 -14.922 5.950 1.00 42.43 H new ATOM 595 N PRO A 43 -2.818 -16.866 2.325 1.00 70.12 N ATOM 596 CA PRO A 43 -3.141 -17.380 0.990 1.00 74.25 C ATOM 597 C PRO A 43 -1.887 -17.915 0.319 1.00 1.25 C ATOM 598 O PRO A 43 -1.809 -19.084 -0.043 1.00 63.43 O ATOM 599 CB PRO A 43 -3.667 -16.156 0.232 1.00 31.33 C ATOM 600 CG PRO A 43 -3.982 -15.136 1.272 1.00 40.11 C ATOM 601 CD PRO A 43 -3.124 -15.435 2.461 1.00 41.12 C ATOM 0 HA PRO A 43 -3.861 -18.198 1.016 1.00 74.25 H new ATOM 0 HB2 PRO A 43 -2.922 -15.781 -0.470 1.00 31.33 H new ATOM 0 HB3 PRO A 43 -4.554 -16.408 -0.349 1.00 31.33 H new ATOM 0 HG2 PRO A 43 -3.784 -14.132 0.898 1.00 40.11 H new ATOM 0 HG3 PRO A 43 -5.038 -15.174 1.540 1.00 40.11 H new ATOM 0 HD2 PRO A 43 -2.217 -14.831 2.461 1.00 41.12 H new ATOM 0 HD3 PRO A 43 -3.647 -15.225 3.394 1.00 41.12 H new ATOM 609 N ALA A 44 -0.913 -17.050 0.167 1.00 35.25 N ATOM 610 CA ALA A 44 0.381 -17.440 -0.346 1.00 4.22 C ATOM 611 C ALA A 44 1.455 -17.007 0.633 1.00 4.31 C ATOM 612 O ALA A 44 2.655 -17.195 0.401 1.00 41.32 O ATOM 613 CB ALA A 44 0.619 -16.814 -1.708 1.00 43.21 C ATOM 0 H ALA A 44 -0.993 -16.059 0.394 1.00 35.25 H new ATOM 0 HA ALA A 44 0.415 -18.523 -0.461 1.00 4.22 H new ATOM 0 HB1 ALA A 44 1.597 -17.117 -2.082 1.00 43.21 H new ATOM 0 HB2 ALA A 44 -0.153 -17.147 -2.401 1.00 43.21 H new ATOM 0 HB3 ALA A 44 0.584 -15.728 -1.620 1.00 43.21 H new ATOM 619 N GLY A 45 1.007 -16.397 1.732 1.00 62.12 N ATOM 620 CA GLY A 45 1.927 -15.905 2.744 1.00 62.35 C ATOM 621 C GLY A 45 2.498 -14.559 2.363 1.00 64.14 C ATOM 622 O GLY A 45 3.417 -14.046 2.999 1.00 13.10 O ATOM 0 H GLY A 45 0.021 -16.236 1.938 1.00 62.12 H new ATOM 0 HA2 GLY A 45 1.410 -15.825 3.700 1.00 62.35 H new ATOM 0 HA3 GLY A 45 2.738 -16.621 2.879 1.00 62.35 H new ATOM 626 N SER A 46 1.942 -14.004 1.326 1.00 63.24 N ATOM 627 CA SER A 46 2.335 -12.737 0.818 1.00 4.43 C ATOM 628 C SER A 46 1.060 -11.953 0.536 1.00 23.15 C ATOM 629 O SER A 46 -0.038 -12.546 0.503 1.00 65.41 O ATOM 630 CB SER A 46 3.143 -12.926 -0.460 1.00 32.21 C ATOM 631 OG SER A 46 4.208 -13.863 -0.280 1.00 34.31 O ATOM 0 H SER A 46 1.183 -14.438 0.801 1.00 63.24 H new ATOM 0 HA SER A 46 2.960 -12.200 1.532 1.00 4.43 H new ATOM 0 HB2 SER A 46 2.486 -13.271 -1.258 1.00 32.21 H new ATOM 0 HB3 SER A 46 3.552 -11.967 -0.777 1.00 32.21 H new ATOM 0 HG SER A 46 4.704 -13.960 -1.120 1.00 34.31 H new ATOM 637 N ALA A 47 1.184 -10.671 0.339 1.00 61.22 N ATOM 638 CA ALA A 47 0.049 -9.806 0.150 1.00 51.04 C ATOM 639 C ALA A 47 0.461 -8.621 -0.682 1.00 62.03 C ATOM 640 O ALA A 47 1.647 -8.349 -0.801 1.00 3.43 O ATOM 641 CB ALA A 47 -0.492 -9.361 1.486 1.00 15.02 C ATOM 0 H ALA A 47 2.083 -10.190 0.304 1.00 61.22 H new ATOM 0 HA ALA A 47 -0.741 -10.346 -0.371 1.00 51.04 H new ATOM 0 HB1 ALA A 47 -1.350 -8.707 1.331 1.00 15.02 H new ATOM 0 HB2 ALA A 47 -0.800 -10.233 2.063 1.00 15.02 H new ATOM 0 HB3 ALA A 47 0.282 -8.821 2.030 1.00 15.02 H new ATOM 647 N LEU A 48 -0.484 -7.968 -1.302 1.00 35.11 N ATOM 648 CA LEU A 48 -0.204 -6.818 -2.121 1.00 33.15 C ATOM 649 C LEU A 48 -1.040 -5.621 -1.665 1.00 61.01 C ATOM 650 O LEU A 48 -2.054 -5.791 -1.002 1.00 73.31 O ATOM 651 CB LEU A 48 -0.382 -7.124 -3.664 1.00 0.44 C ATOM 652 CG LEU A 48 -1.766 -7.602 -4.245 1.00 4.11 C ATOM 653 CD1 LEU A 48 -2.255 -8.924 -3.668 1.00 21.03 C ATOM 654 CD2 LEU A 48 -2.843 -6.526 -4.165 1.00 42.22 C ATOM 0 H LEU A 48 -1.472 -8.218 -1.254 1.00 35.11 H new ATOM 0 HA LEU A 48 0.847 -6.560 -1.989 1.00 33.15 H new ATOM 0 HB2 LEU A 48 -0.106 -6.217 -4.203 1.00 0.44 H new ATOM 0 HB3 LEU A 48 0.353 -7.885 -3.925 1.00 0.44 H new ATOM 0 HG LEU A 48 -1.569 -7.788 -5.301 1.00 4.11 H new ATOM 0 HD11 LEU A 48 -3.213 -9.185 -4.118 1.00 21.03 H new ATOM 0 HD12 LEU A 48 -1.528 -9.707 -3.884 1.00 21.03 H new ATOM 0 HD13 LEU A 48 -2.375 -8.828 -2.589 1.00 21.03 H new ATOM 0 HD21 LEU A 48 -3.774 -6.912 -4.580 1.00 42.22 H new ATOM 0 HD22 LEU A 48 -2.999 -6.244 -3.124 1.00 42.22 H new ATOM 0 HD23 LEU A 48 -2.527 -5.652 -4.734 1.00 42.22 H new ATOM 666 N LEU A 49 -0.610 -4.431 -1.980 1.00 33.34 N ATOM 667 CA LEU A 49 -1.404 -3.260 -1.682 1.00 30.31 C ATOM 668 C LEU A 49 -1.664 -2.527 -2.972 1.00 2.30 C ATOM 669 O LEU A 49 -0.782 -2.445 -3.829 1.00 13.43 O ATOM 670 CB LEU A 49 -0.763 -2.302 -0.626 1.00 52.41 C ATOM 671 CG LEU A 49 0.446 -1.425 -1.050 1.00 75.01 C ATOM 672 CD1 LEU A 49 0.728 -0.392 0.021 1.00 51.15 C ATOM 673 CD2 LEU A 49 1.697 -2.252 -1.273 1.00 71.42 C ATOM 0 H LEU A 49 0.280 -4.241 -2.441 1.00 33.34 H new ATOM 0 HA LEU A 49 -2.333 -3.602 -1.225 1.00 30.31 H new ATOM 0 HB2 LEU A 49 -1.546 -1.634 -0.268 1.00 52.41 H new ATOM 0 HB3 LEU A 49 -0.449 -2.909 0.223 1.00 52.41 H new ATOM 0 HG LEU A 49 0.183 -0.941 -1.991 1.00 75.01 H new ATOM 0 HD11 LEU A 49 1.577 0.222 -0.280 1.00 51.15 H new ATOM 0 HD12 LEU A 49 -0.149 0.242 0.155 1.00 51.15 H new ATOM 0 HD13 LEU A 49 0.959 -0.895 0.960 1.00 51.15 H new ATOM 0 HD21 LEU A 49 2.518 -1.598 -1.568 1.00 71.42 H new ATOM 0 HD22 LEU A 49 1.960 -2.770 -0.351 1.00 71.42 H new ATOM 0 HD23 LEU A 49 1.514 -2.983 -2.061 1.00 71.42 H new ATOM 685 N VAL A 50 -2.848 -2.044 -3.139 1.00 34.23 N ATOM 686 CA VAL A 50 -3.197 -1.344 -4.341 1.00 12.15 C ATOM 687 C VAL A 50 -3.591 0.088 -4.017 1.00 51.15 C ATOM 688 O VAL A 50 -4.268 0.349 -3.007 1.00 30.32 O ATOM 689 CB VAL A 50 -4.331 -2.087 -5.140 1.00 64.21 C ATOM 690 CG1 VAL A 50 -5.613 -2.225 -4.323 1.00 30.34 C ATOM 691 CG2 VAL A 50 -4.614 -1.412 -6.481 1.00 52.33 C ATOM 0 H VAL A 50 -3.601 -2.119 -2.455 1.00 34.23 H new ATOM 0 HA VAL A 50 -2.320 -1.322 -4.988 1.00 12.15 H new ATOM 0 HB VAL A 50 -3.960 -3.092 -5.342 1.00 64.21 H new ATOM 0 HG11 VAL A 50 -6.367 -2.744 -4.915 1.00 30.34 H new ATOM 0 HG12 VAL A 50 -5.407 -2.795 -3.417 1.00 30.34 H new ATOM 0 HG13 VAL A 50 -5.981 -1.235 -4.053 1.00 30.34 H new ATOM 0 HG21 VAL A 50 -5.403 -1.955 -7.002 1.00 52.33 H new ATOM 0 HG22 VAL A 50 -4.933 -0.384 -6.311 1.00 52.33 H new ATOM 0 HG23 VAL A 50 -3.709 -1.415 -7.088 1.00 52.33 H new ATOM 701 N VAL A 51 -3.124 1.017 -4.819 1.00 0.30 N ATOM 702 CA VAL A 51 -3.505 2.388 -4.650 1.00 54.31 C ATOM 703 C VAL A 51 -4.878 2.525 -5.252 1.00 2.54 C ATOM 704 O VAL A 51 -5.071 2.293 -6.446 1.00 30.41 O ATOM 705 CB VAL A 51 -2.530 3.362 -5.346 1.00 30.31 C ATOM 706 CG1 VAL A 51 -2.859 4.803 -4.979 1.00 42.32 C ATOM 707 CG2 VAL A 51 -1.081 3.032 -5.005 1.00 43.41 C ATOM 0 H VAL A 51 -2.481 0.842 -5.592 1.00 0.30 H new ATOM 0 HA VAL A 51 -3.489 2.645 -3.591 1.00 54.31 H new ATOM 0 HB VAL A 51 -2.651 3.246 -6.423 1.00 30.31 H new ATOM 0 HG11 VAL A 51 -2.161 5.474 -5.479 1.00 42.32 H new ATOM 0 HG12 VAL A 51 -3.876 5.036 -5.295 1.00 42.32 H new ATOM 0 HG13 VAL A 51 -2.776 4.932 -3.900 1.00 42.32 H new ATOM 0 HG21 VAL A 51 -0.419 3.735 -5.510 1.00 43.41 H new ATOM 0 HG22 VAL A 51 -0.935 3.106 -3.927 1.00 43.41 H new ATOM 0 HG23 VAL A 51 -0.852 2.018 -5.333 1.00 43.41 H new ATOM 717 N LYS A 52 -5.810 2.880 -4.440 1.00 64.32 N ATOM 718 CA LYS A 52 -7.182 2.923 -4.838 1.00 50.55 C ATOM 719 C LYS A 52 -7.549 4.328 -5.277 1.00 43.23 C ATOM 720 O LYS A 52 -8.382 4.523 -6.162 1.00 44.20 O ATOM 721 CB LYS A 52 -8.047 2.461 -3.669 1.00 12.31 C ATOM 722 CG LYS A 52 -9.480 2.102 -4.019 1.00 31.04 C ATOM 723 CD LYS A 52 -9.529 0.968 -5.037 1.00 71.25 C ATOM 724 CE LYS A 52 -10.930 0.403 -5.182 1.00 62.13 C ATOM 725 NZ LYS A 52 -11.923 1.432 -5.533 1.00 4.51 N ATOM 0 H LYS A 52 -5.645 3.152 -3.471 1.00 64.32 H new ATOM 0 HA LYS A 52 -7.351 2.258 -5.685 1.00 50.55 H new ATOM 0 HB2 LYS A 52 -7.574 1.592 -3.211 1.00 12.31 H new ATOM 0 HB3 LYS A 52 -8.062 3.249 -2.916 1.00 12.31 H new ATOM 0 HG2 LYS A 52 -10.015 1.808 -3.116 1.00 31.04 H new ATOM 0 HG3 LYS A 52 -9.990 2.978 -4.421 1.00 31.04 H new ATOM 0 HD2 LYS A 52 -9.182 1.332 -6.004 1.00 71.25 H new ATOM 0 HD3 LYS A 52 -8.847 0.175 -4.731 1.00 71.25 H new ATOM 0 HE2 LYS A 52 -10.928 -0.371 -5.949 1.00 62.13 H new ATOM 0 HE3 LYS A 52 -11.223 -0.076 -4.248 1.00 62.13 H new ATOM 0 HZ1 LYS A 52 -12.832 0.977 -5.752 1.00 4.51 H new ATOM 0 HZ2 LYS A 52 -12.046 2.083 -4.732 1.00 4.51 H new ATOM 0 HZ3 LYS A 52 -11.593 1.964 -6.364 1.00 4.51 H new ATOM 739 N ARG A 53 -6.918 5.309 -4.675 1.00 34.20 N ATOM 740 CA ARG A 53 -7.197 6.683 -5.022 1.00 54.03 C ATOM 741 C ARG A 53 -5.920 7.489 -4.903 1.00 2.14 C ATOM 742 O ARG A 53 -5.146 7.286 -3.961 1.00 43.22 O ATOM 743 CB ARG A 53 -8.271 7.269 -4.101 1.00 2.41 C ATOM 744 CG ARG A 53 -8.991 8.481 -4.674 1.00 35.42 C ATOM 745 CD ARG A 53 -9.839 8.071 -5.866 1.00 30.13 C ATOM 746 NE ARG A 53 -10.639 9.167 -6.412 1.00 21.41 N ATOM 747 CZ ARG A 53 -11.753 8.994 -7.150 1.00 32.25 C ATOM 748 NH1 ARG A 53 -12.259 7.766 -7.333 1.00 43.44 N ATOM 749 NH2 ARG A 53 -12.372 10.045 -7.671 1.00 50.51 N ATOM 0 H ARG A 53 -6.213 5.183 -3.948 1.00 34.20 H new ATOM 0 HA ARG A 53 -7.569 6.724 -6.046 1.00 54.03 H new ATOM 0 HB2 ARG A 53 -9.006 6.495 -3.880 1.00 2.41 H new ATOM 0 HB3 ARG A 53 -7.809 7.549 -3.155 1.00 2.41 H new ATOM 0 HG2 ARG A 53 -9.621 8.934 -3.909 1.00 35.42 H new ATOM 0 HG3 ARG A 53 -8.265 9.235 -4.977 1.00 35.42 H new ATOM 0 HD2 ARG A 53 -9.188 7.681 -6.649 1.00 30.13 H new ATOM 0 HD3 ARG A 53 -10.503 7.259 -5.569 1.00 30.13 H new ATOM 0 HE ARG A 53 -10.335 10.122 -6.222 1.00 21.41 H new ATOM 0 HH11 ARG A 53 -11.800 6.958 -6.913 1.00 43.44 H new ATOM 0 HH12 ARG A 53 -13.103 7.640 -7.892 1.00 43.44 H new ATOM 0 HH21 ARG A 53 -12.005 10.983 -7.513 1.00 50.51 H new ATOM 0 HH22 ARG A 53 -13.215 9.915 -8.230 1.00 50.51 H new ATOM 763 N GLY A 54 -5.691 8.359 -5.859 1.00 45.44 N ATOM 764 CA GLY A 54 -4.520 9.190 -5.863 1.00 51.14 C ATOM 765 C GLY A 54 -3.873 9.184 -7.228 1.00 13.51 C ATOM 766 O GLY A 54 -4.372 8.514 -8.123 1.00 3.13 O ATOM 0 H GLY A 54 -6.314 8.507 -6.653 1.00 45.44 H new ATOM 0 HA2 GLY A 54 -4.789 10.209 -5.586 1.00 51.14 H new ATOM 0 HA3 GLY A 54 -3.811 8.833 -5.116 1.00 51.14 H new ATOM 770 N PRO A 55 -2.779 9.924 -7.434 1.00 40.34 N ATOM 771 CA PRO A 55 -2.051 9.929 -8.716 1.00 65.41 C ATOM 772 C PRO A 55 -1.629 8.521 -9.146 1.00 1.50 C ATOM 773 O PRO A 55 -1.747 8.158 -10.314 1.00 31.21 O ATOM 774 CB PRO A 55 -0.808 10.759 -8.402 1.00 55.12 C ATOM 775 CG PRO A 55 -1.253 11.683 -7.337 1.00 73.40 C ATOM 776 CD PRO A 55 -2.208 10.897 -6.487 1.00 54.32 C ATOM 0 HA PRO A 55 -2.662 10.318 -9.531 1.00 65.41 H new ATOM 0 HB2 PRO A 55 0.017 10.131 -8.066 1.00 55.12 H new ATOM 0 HB3 PRO A 55 -0.458 11.301 -9.280 1.00 55.12 H new ATOM 0 HG2 PRO A 55 -0.407 12.038 -6.749 1.00 73.40 H new ATOM 0 HG3 PRO A 55 -1.739 12.562 -7.760 1.00 73.40 H new ATOM 0 HD2 PRO A 55 -1.698 10.403 -5.660 1.00 54.32 H new ATOM 0 HD3 PRO A 55 -2.978 11.534 -6.051 1.00 54.32 H new ATOM 784 N ASN A 56 -1.180 7.720 -8.190 1.00 3.11 N ATOM 785 CA ASN A 56 -0.715 6.367 -8.486 1.00 34.44 C ATOM 786 C ASN A 56 -1.854 5.345 -8.389 1.00 51.12 C ATOM 787 O ASN A 56 -1.599 4.141 -8.317 1.00 45.23 O ATOM 788 CB ASN A 56 0.419 5.937 -7.515 1.00 62.21 C ATOM 789 CG ASN A 56 1.621 6.882 -7.463 1.00 62.33 C ATOM 790 OD1 ASN A 56 1.499 8.099 -7.599 1.00 73.02 O ATOM 791 ND2 ASN A 56 2.780 6.337 -7.277 1.00 43.31 N ATOM 0 H ASN A 56 -1.127 7.980 -7.205 1.00 3.11 H new ATOM 0 HA ASN A 56 -0.335 6.387 -9.508 1.00 34.44 H new ATOM 0 HB2 ASN A 56 0.003 5.848 -6.512 1.00 62.21 H new ATOM 0 HB3 ASN A 56 0.768 4.946 -7.805 1.00 62.21 H new ATOM 0 HD21 ASN A 56 3.617 6.919 -7.241 1.00 43.31 H new ATOM 0 HD22 ASN A 56 2.856 5.326 -7.167 1.00 43.31 H new ATOM 798 N ALA A 57 -3.106 5.816 -8.396 1.00 12.21 N ATOM 799 CA ALA A 57 -4.265 4.921 -8.290 1.00 24.24 C ATOM 800 C ALA A 57 -4.309 3.946 -9.442 1.00 34.54 C ATOM 801 O ALA A 57 -4.163 4.331 -10.603 1.00 71.43 O ATOM 802 CB ALA A 57 -5.565 5.698 -8.222 1.00 41.03 C ATOM 0 H ALA A 57 -3.342 6.805 -8.473 1.00 12.21 H new ATOM 0 HA ALA A 57 -4.151 4.361 -7.362 1.00 24.24 H new ATOM 0 HB1 ALA A 57 -6.401 5.003 -8.144 1.00 41.03 H new ATOM 0 HB2 ALA A 57 -5.553 6.351 -7.349 1.00 41.03 H new ATOM 0 HB3 ALA A 57 -5.677 6.300 -9.124 1.00 41.03 H new ATOM 808 N GLY A 58 -4.517 2.702 -9.118 1.00 71.34 N ATOM 809 CA GLY A 58 -4.547 1.672 -10.107 1.00 51.44 C ATOM 810 C GLY A 58 -3.325 0.797 -10.034 1.00 62.54 C ATOM 811 O GLY A 58 -3.337 -0.334 -10.525 1.00 23.20 O ATOM 0 H GLY A 58 -4.670 2.377 -8.163 1.00 71.34 H new ATOM 0 HA2 GLY A 58 -5.440 1.062 -9.971 1.00 51.44 H new ATOM 0 HA3 GLY A 58 -4.615 2.121 -11.098 1.00 51.44 H new ATOM 815 N ALA A 59 -2.281 1.302 -9.415 1.00 71.35 N ATOM 816 CA ALA A 59 -1.059 0.554 -9.285 1.00 4.25 C ATOM 817 C ALA A 59 -1.112 -0.348 -8.068 1.00 53.30 C ATOM 818 O ALA A 59 -1.501 0.083 -6.970 1.00 42.14 O ATOM 819 CB ALA A 59 0.138 1.480 -9.216 1.00 45.22 C ATOM 0 H ALA A 59 -2.258 2.231 -8.994 1.00 71.35 H new ATOM 0 HA ALA A 59 -0.949 -0.072 -10.170 1.00 4.25 H new ATOM 0 HB1 ALA A 59 1.049 0.890 -9.118 1.00 45.22 H new ATOM 0 HB2 ALA A 59 0.189 2.077 -10.126 1.00 45.22 H new ATOM 0 HB3 ALA A 59 0.038 2.140 -8.354 1.00 45.22 H new ATOM 825 N ARG A 60 -0.752 -1.588 -8.264 1.00 40.21 N ATOM 826 CA ARG A 60 -0.724 -2.563 -7.200 1.00 21.13 C ATOM 827 C ARG A 60 0.725 -2.956 -6.957 1.00 31.55 C ATOM 828 O ARG A 60 1.503 -3.065 -7.899 1.00 2.41 O ATOM 829 CB ARG A 60 -1.591 -3.790 -7.574 1.00 21.44 C ATOM 830 CG ARG A 60 -1.067 -4.589 -8.762 1.00 2.25 C ATOM 831 CD ARG A 60 -2.075 -5.607 -9.280 1.00 51.30 C ATOM 832 NE ARG A 60 -2.559 -6.548 -8.250 1.00 40.40 N ATOM 833 CZ ARG A 60 -2.297 -7.868 -8.232 1.00 15.02 C ATOM 834 NH1 ARG A 60 -1.330 -8.378 -8.992 1.00 3.32 N ATOM 835 NH2 ARG A 60 -2.980 -8.663 -7.418 1.00 1.43 N ATOM 0 H ARG A 60 -0.467 -1.956 -9.172 1.00 40.21 H new ATOM 0 HA ARG A 60 -1.141 -2.143 -6.285 1.00 21.13 H new ATOM 0 HB2 ARG A 60 -1.659 -4.450 -6.709 1.00 21.44 H new ATOM 0 HB3 ARG A 60 -2.603 -3.451 -7.797 1.00 21.44 H new ATOM 0 HG2 ARG A 60 -0.804 -3.903 -9.567 1.00 2.25 H new ATOM 0 HG3 ARG A 60 -0.152 -5.106 -8.471 1.00 2.25 H new ATOM 0 HD2 ARG A 60 -2.928 -5.076 -9.703 1.00 51.30 H new ATOM 0 HD3 ARG A 60 -1.619 -6.175 -10.091 1.00 51.30 H new ATOM 0 HE ARG A 60 -3.134 -6.170 -7.497 1.00 40.40 H new ATOM 0 HH11 ARG A 60 -0.780 -7.767 -9.595 1.00 3.32 H new ATOM 0 HH12 ARG A 60 -1.140 -9.380 -8.971 1.00 3.32 H new ATOM 0 HH21 ARG A 60 -3.700 -8.273 -6.810 1.00 1.43 H new ATOM 0 HH22 ARG A 60 -2.785 -9.664 -7.401 1.00 1.43 H new ATOM 849 N PHE A 61 1.103 -3.101 -5.722 1.00 14.34 N ATOM 850 CA PHE A 61 2.462 -3.456 -5.383 1.00 21.22 C ATOM 851 C PHE A 61 2.437 -4.665 -4.488 1.00 70.32 C ATOM 852 O PHE A 61 1.716 -4.681 -3.494 1.00 44.21 O ATOM 853 CB PHE A 61 3.157 -2.300 -4.659 1.00 54.40 C ATOM 854 CG PHE A 61 3.103 -0.994 -5.394 1.00 71.12 C ATOM 855 CD1 PHE A 61 3.995 -0.720 -6.411 1.00 2.14 C ATOM 856 CD2 PHE A 61 2.150 -0.042 -5.065 1.00 63.14 C ATOM 857 CE1 PHE A 61 3.937 0.478 -7.086 1.00 25.32 C ATOM 858 CE2 PHE A 61 2.090 1.154 -5.737 1.00 15.54 C ATOM 859 CZ PHE A 61 2.981 1.415 -6.748 1.00 31.30 C ATOM 0 H PHE A 61 0.486 -2.979 -4.919 1.00 14.34 H new ATOM 0 HA PHE A 61 3.014 -3.672 -6.297 1.00 21.22 H new ATOM 0 HB2 PHE A 61 2.698 -2.172 -3.679 1.00 54.40 H new ATOM 0 HB3 PHE A 61 4.200 -2.566 -4.490 1.00 54.40 H new ATOM 0 HD1 PHE A 61 4.744 -1.451 -6.679 1.00 2.14 H new ATOM 0 HD2 PHE A 61 1.447 -0.244 -4.271 1.00 63.14 H new ATOM 0 HE1 PHE A 61 4.639 0.685 -7.880 1.00 25.32 H new ATOM 0 HE2 PHE A 61 1.343 1.888 -5.471 1.00 15.54 H new ATOM 0 HZ PHE A 61 2.934 2.354 -7.279 1.00 31.30 H new ATOM 869 N LEU A 62 3.183 -5.667 -4.842 1.00 0.11 N ATOM 870 CA LEU A 62 3.226 -6.885 -4.062 1.00 33.22 C ATOM 871 C LEU A 62 4.290 -6.787 -2.977 1.00 61.40 C ATOM 872 O LEU A 62 5.436 -6.398 -3.247 1.00 62.21 O ATOM 873 CB LEU A 62 3.445 -8.152 -4.947 1.00 74.13 C ATOM 874 CG LEU A 62 4.838 -8.380 -5.618 1.00 12.32 C ATOM 875 CD1 LEU A 62 4.890 -9.758 -6.257 1.00 24.43 C ATOM 876 CD2 LEU A 62 5.155 -7.324 -6.676 1.00 51.41 C ATOM 0 H LEU A 62 3.777 -5.673 -5.671 1.00 0.11 H new ATOM 0 HA LEU A 62 2.251 -6.999 -3.588 1.00 33.22 H new ATOM 0 HB2 LEU A 62 3.231 -9.025 -4.330 1.00 74.13 H new ATOM 0 HB3 LEU A 62 2.698 -8.132 -5.740 1.00 74.13 H new ATOM 0 HG LEU A 62 5.587 -8.300 -4.830 1.00 12.32 H new ATOM 0 HD11 LEU A 62 5.865 -9.907 -6.722 1.00 24.43 H new ATOM 0 HD12 LEU A 62 4.732 -10.519 -5.493 1.00 24.43 H new ATOM 0 HD13 LEU A 62 4.111 -9.837 -7.015 1.00 24.43 H new ATOM 0 HD21 LEU A 62 6.133 -7.528 -7.112 1.00 51.41 H new ATOM 0 HD22 LEU A 62 4.396 -7.353 -7.458 1.00 51.41 H new ATOM 0 HD23 LEU A 62 5.162 -6.337 -6.214 1.00 51.41 H new ATOM 888 N LEU A 63 3.918 -7.106 -1.752 1.00 5.40 N ATOM 889 CA LEU A 63 4.864 -7.088 -0.666 1.00 41.03 C ATOM 890 C LEU A 63 5.624 -8.389 -0.686 1.00 13.44 C ATOM 891 O LEU A 63 5.086 -9.445 -0.334 1.00 4.22 O ATOM 892 CB LEU A 63 4.190 -6.910 0.726 1.00 33.32 C ATOM 893 CG LEU A 63 3.466 -5.578 1.052 1.00 31.11 C ATOM 894 CD1 LEU A 63 4.351 -4.381 0.798 1.00 25.33 C ATOM 895 CD2 LEU A 63 2.148 -5.442 0.324 1.00 70.45 C ATOM 0 H LEU A 63 2.971 -7.379 -1.490 1.00 5.40 H new ATOM 0 HA LEU A 63 5.523 -6.231 -0.809 1.00 41.03 H new ATOM 0 HB2 LEU A 63 3.465 -7.715 0.844 1.00 33.32 H new ATOM 0 HB3 LEU A 63 4.959 -7.059 1.484 1.00 33.32 H new ATOM 0 HG LEU A 63 3.241 -5.607 2.118 1.00 31.11 H new ATOM 0 HD11 LEU A 63 3.806 -3.468 1.039 1.00 25.33 H new ATOM 0 HD12 LEU A 63 5.241 -4.448 1.423 1.00 25.33 H new ATOM 0 HD13 LEU A 63 4.645 -4.362 -0.251 1.00 25.33 H new ATOM 0 HD21 LEU A 63 1.683 -4.492 0.588 1.00 70.45 H new ATOM 0 HD22 LEU A 63 2.321 -5.475 -0.752 1.00 70.45 H new ATOM 0 HD23 LEU A 63 1.488 -6.261 0.610 1.00 70.45 H new ATOM 907 N ASP A 64 6.834 -8.325 -1.156 1.00 53.33 N ATOM 908 CA ASP A 64 7.721 -9.482 -1.219 1.00 23.41 C ATOM 909 C ASP A 64 8.977 -9.173 -0.418 1.00 4.14 C ATOM 910 O ASP A 64 9.819 -10.031 -0.156 1.00 14.30 O ATOM 911 CB ASP A 64 8.060 -9.771 -2.698 1.00 11.25 C ATOM 912 CG ASP A 64 9.062 -10.889 -2.908 1.00 72.41 C ATOM 913 OD1 ASP A 64 8.684 -12.067 -2.841 1.00 54.35 O ATOM 914 OD2 ASP A 64 10.249 -10.590 -3.198 1.00 53.22 O ATOM 0 H ASP A 64 7.251 -7.466 -1.514 1.00 53.33 H new ATOM 0 HA ASP A 64 7.243 -10.366 -0.795 1.00 23.41 H new ATOM 0 HB2 ASP A 64 7.140 -10.021 -3.226 1.00 11.25 H new ATOM 0 HB3 ASP A 64 8.451 -8.860 -3.152 1.00 11.25 H new ATOM 919 N GLN A 65 9.036 -7.950 0.030 1.00 30.23 N ATOM 920 CA GLN A 65 10.163 -7.414 0.730 1.00 51.20 C ATOM 921 C GLN A 65 9.839 -7.235 2.197 1.00 31.12 C ATOM 922 O GLN A 65 8.724 -6.852 2.536 1.00 14.03 O ATOM 923 CB GLN A 65 10.680 -6.073 0.099 1.00 61.20 C ATOM 924 CG GLN A 65 9.612 -5.047 -0.340 1.00 65.41 C ATOM 925 CD GLN A 65 9.006 -5.311 -1.736 1.00 40.45 C ATOM 926 OE1 GLN A 65 8.918 -6.445 -2.205 1.00 23.14 O ATOM 927 NE2 GLN A 65 8.589 -4.280 -2.399 1.00 33.10 N ATOM 0 H GLN A 65 8.276 -7.280 -0.087 1.00 30.23 H new ATOM 0 HA GLN A 65 10.974 -8.136 0.635 1.00 51.20 H new ATOM 0 HB2 GLN A 65 11.337 -5.590 0.822 1.00 61.20 H new ATOM 0 HB3 GLN A 65 11.290 -6.320 -0.770 1.00 61.20 H new ATOM 0 HG2 GLN A 65 8.808 -5.041 0.396 1.00 65.41 H new ATOM 0 HG3 GLN A 65 10.058 -4.052 -0.333 1.00 65.41 H new ATOM 0 HE21 GLN A 65 8.670 -3.347 -1.995 1.00 33.10 H new ATOM 0 HE22 GLN A 65 8.180 -4.401 -3.325 1.00 33.10 H new ATOM 936 N PRO A 66 10.821 -7.508 3.091 1.00 54.34 N ATOM 937 CA PRO A 66 10.637 -7.429 4.554 1.00 12.21 C ATOM 938 C PRO A 66 10.186 -6.052 5.022 1.00 45.24 C ATOM 939 O PRO A 66 9.473 -5.912 6.014 1.00 74.23 O ATOM 940 CB PRO A 66 12.041 -7.708 5.098 1.00 44.21 C ATOM 941 CG PRO A 66 12.715 -8.486 4.034 1.00 75.31 C ATOM 942 CD PRO A 66 12.195 -7.940 2.747 1.00 4.34 C ATOM 0 HA PRO A 66 9.866 -8.121 4.893 1.00 12.21 H new ATOM 0 HB2 PRO A 66 12.575 -6.781 5.308 1.00 44.21 H new ATOM 0 HB3 PRO A 66 11.999 -8.270 6.031 1.00 44.21 H new ATOM 0 HG2 PRO A 66 13.798 -8.379 4.096 1.00 75.31 H new ATOM 0 HG3 PRO A 66 12.494 -9.549 4.126 1.00 75.31 H new ATOM 0 HD2 PRO A 66 12.801 -7.107 2.389 1.00 4.34 H new ATOM 0 HD3 PRO A 66 12.194 -8.695 1.961 1.00 4.34 H new ATOM 950 N THR A 67 10.613 -5.039 4.332 1.00 2.21 N ATOM 951 CA THR A 67 10.258 -3.705 4.684 1.00 34.11 C ATOM 952 C THR A 67 10.066 -2.896 3.431 1.00 15.14 C ATOM 953 O THR A 67 10.959 -2.815 2.580 1.00 5.45 O ATOM 954 CB THR A 67 11.325 -3.061 5.603 1.00 21.31 C ATOM 955 OG1 THR A 67 11.457 -3.864 6.793 1.00 60.33 O ATOM 956 CG2 THR A 67 10.928 -1.642 6.005 1.00 14.33 C ATOM 0 H THR A 67 11.215 -5.117 3.512 1.00 2.21 H new ATOM 0 HA THR A 67 9.324 -3.725 5.245 1.00 34.11 H new ATOM 0 HB THR A 67 12.268 -3.013 5.058 1.00 21.31 H new ATOM 0 HG1 THR A 67 12.132 -3.467 7.382 1.00 60.33 H new ATOM 0 HG21 THR A 67 11.698 -1.218 6.650 1.00 14.33 H new ATOM 0 HG22 THR A 67 10.823 -1.027 5.112 1.00 14.33 H new ATOM 0 HG23 THR A 67 9.979 -1.668 6.541 1.00 14.33 H new ATOM 964 N THR A 68 8.902 -2.355 3.304 1.00 2.13 N ATOM 965 CA THR A 68 8.544 -1.561 2.188 1.00 1.41 C ATOM 966 C THR A 68 8.309 -0.135 2.684 1.00 32.15 C ATOM 967 O THR A 68 7.405 0.104 3.467 1.00 5.13 O ATOM 968 CB THR A 68 7.257 -2.136 1.604 1.00 73.11 C ATOM 969 OG1 THR A 68 7.425 -3.550 1.427 1.00 31.34 O ATOM 970 CG2 THR A 68 6.941 -1.513 0.280 1.00 63.50 C ATOM 0 H THR A 68 8.157 -2.458 3.993 1.00 2.13 H new ATOM 0 HA THR A 68 9.322 -1.556 1.425 1.00 1.41 H new ATOM 0 HB THR A 68 6.436 -1.925 2.289 1.00 73.11 H new ATOM 0 HG1 THR A 68 7.281 -4.006 2.282 1.00 31.34 H new ATOM 0 HG21 THR A 68 6.019 -1.941 -0.113 1.00 63.50 H new ATOM 0 HG22 THR A 68 6.817 -0.437 0.404 1.00 63.50 H new ATOM 0 HG23 THR A 68 7.757 -1.706 -0.417 1.00 63.50 H new ATOM 978 N THR A 69 9.131 0.774 2.275 1.00 5.22 N ATOM 979 CA THR A 69 9.045 2.133 2.724 1.00 73.13 C ATOM 980 C THR A 69 8.136 2.968 1.823 1.00 71.24 C ATOM 981 O THR A 69 8.153 2.811 0.607 1.00 21.23 O ATOM 982 CB THR A 69 10.456 2.724 2.752 1.00 44.14 C ATOM 983 OG1 THR A 69 11.167 2.280 1.571 1.00 63.51 O ATOM 984 CG2 THR A 69 11.206 2.277 3.997 1.00 61.02 C ATOM 0 H THR A 69 9.888 0.598 1.615 1.00 5.22 H new ATOM 0 HA THR A 69 8.608 2.150 3.722 1.00 73.13 H new ATOM 0 HB THR A 69 10.388 3.812 2.769 1.00 44.14 H new ATOM 0 HG1 THR A 69 11.994 2.797 1.474 1.00 63.51 H new ATOM 0 HG21 THR A 69 12.206 2.710 3.994 1.00 61.02 H new ATOM 0 HG22 THR A 69 10.669 2.610 4.885 1.00 61.02 H new ATOM 0 HG23 THR A 69 11.281 1.190 4.006 1.00 61.02 H new ATOM 992 N ALA A 70 7.322 3.811 2.409 1.00 51.40 N ATOM 993 CA ALA A 70 6.500 4.692 1.634 1.00 31.54 C ATOM 994 C ALA A 70 6.854 6.121 1.968 1.00 60.44 C ATOM 995 O ALA A 70 6.937 6.502 3.174 1.00 20.13 O ATOM 996 CB ALA A 70 5.028 4.426 1.900 1.00 74.03 C ATOM 0 H ALA A 70 7.215 3.902 3.419 1.00 51.40 H new ATOM 0 HA ALA A 70 6.682 4.515 0.574 1.00 31.54 H new ATOM 0 HB1 ALA A 70 4.421 5.106 1.302 1.00 74.03 H new ATOM 0 HB2 ALA A 70 4.790 3.396 1.633 1.00 74.03 H new ATOM 0 HB3 ALA A 70 4.815 4.585 2.957 1.00 74.03 H new ATOM 1002 N GLY A 71 7.012 6.911 0.931 1.00 3.11 N ATOM 1003 CA GLY A 71 7.405 8.281 1.063 1.00 12.43 C ATOM 1004 C GLY A 71 7.988 8.800 -0.238 1.00 4.52 C ATOM 1005 O GLY A 71 7.560 8.382 -1.321 1.00 25.13 O ATOM 0 H GLY A 71 6.868 6.611 -0.033 1.00 3.11 H new ATOM 0 HA2 GLY A 71 6.544 8.886 1.348 1.00 12.43 H new ATOM 0 HA3 GLY A 71 8.141 8.378 1.861 1.00 12.43 H new ATOM 1009 N ARG A 72 8.966 9.673 -0.137 1.00 4.33 N ATOM 1010 CA ARG A 72 9.597 10.300 -1.298 1.00 25.25 C ATOM 1011 C ARG A 72 10.986 9.730 -1.568 1.00 54.24 C ATOM 1012 O ARG A 72 11.649 9.239 -0.625 1.00 50.12 O ATOM 1013 CB ARG A 72 9.614 11.864 -1.191 1.00 44.52 C ATOM 1014 CG ARG A 72 10.368 12.463 0.008 1.00 51.20 C ATOM 1015 CD ARG A 72 11.873 12.330 -0.135 1.00 35.50 C ATOM 1016 NE ARG A 72 12.589 12.668 1.075 1.00 14.22 N ATOM 1017 CZ ARG A 72 13.428 11.863 1.710 1.00 25.42 C ATOM 1018 NH1 ARG A 72 13.472 10.558 1.404 1.00 42.20 N ATOM 1019 NH2 ARG A 72 14.156 12.348 2.705 1.00 53.43 N ATOM 0 H ARG A 72 9.355 9.976 0.756 1.00 4.33 H new ATOM 0 HA ARG A 72 8.979 10.054 -2.162 1.00 25.25 H new ATOM 0 HB2 ARG A 72 10.054 12.263 -2.105 1.00 44.52 H new ATOM 0 HB3 ARG A 72 8.583 12.214 -1.155 1.00 44.52 H new ATOM 0 HG2 ARG A 72 10.106 13.516 0.110 1.00 51.20 H new ATOM 0 HG3 ARG A 72 10.046 11.965 0.923 1.00 51.20 H new ATOM 0 HD2 ARG A 72 12.116 11.306 -0.420 1.00 35.50 H new ATOM 0 HD3 ARG A 72 12.214 12.976 -0.944 1.00 35.50 H new ATOM 0 HE ARG A 72 12.437 13.596 1.469 1.00 14.22 H new ATOM 0 HH11 ARG A 72 12.858 10.183 0.681 1.00 42.20 H new ATOM 0 HH12 ARG A 72 14.119 9.941 1.895 1.00 42.20 H new ATOM 0 HH21 ARG A 72 14.066 13.328 2.972 1.00 53.43 H new ATOM 0 HH22 ARG A 72 14.807 11.741 3.204 1.00 53.43 H new ATOM 1033 N HIS A 73 11.396 9.766 -2.851 1.00 22.42 N ATOM 1034 CA HIS A 73 12.736 9.350 -3.325 1.00 31.11 C ATOM 1035 C HIS A 73 12.836 7.800 -3.375 1.00 11.11 C ATOM 1036 O HIS A 73 12.238 7.134 -2.556 1.00 43.43 O ATOM 1037 CB HIS A 73 13.844 10.023 -2.427 1.00 64.45 C ATOM 1038 CG HIS A 73 15.261 9.941 -2.916 1.00 3.21 C ATOM 1039 ND1 HIS A 73 16.301 9.393 -2.198 1.00 20.32 N ATOM 1040 CD2 HIS A 73 15.814 10.414 -4.054 1.00 75.32 C ATOM 1041 CE1 HIS A 73 17.417 9.542 -2.902 1.00 5.24 C ATOM 1042 NE2 HIS A 73 17.178 10.157 -4.042 1.00 23.41 N ATOM 0 H HIS A 73 10.793 10.092 -3.606 1.00 22.42 H new ATOM 0 HA HIS A 73 12.900 9.695 -4.346 1.00 31.11 H new ATOM 0 HB2 HIS A 73 13.588 11.076 -2.305 1.00 64.45 H new ATOM 0 HB3 HIS A 73 13.800 9.568 -1.437 1.00 64.45 H new ATOM 0 HD1 HIS A 73 16.227 8.949 -1.283 1.00 20.32 H new ATOM 0 HD2 HIS A 73 15.279 10.914 -4.848 1.00 75.32 H new ATOM 0 HE1 HIS A 73 18.392 9.204 -2.582 1.00 5.24 H new ATOM 1050 N PRO A 74 13.552 7.214 -4.394 1.00 10.51 N ATOM 1051 CA PRO A 74 13.743 5.730 -4.569 1.00 51.02 C ATOM 1052 C PRO A 74 14.185 4.932 -3.315 1.00 74.21 C ATOM 1053 O PRO A 74 14.276 3.709 -3.361 1.00 44.12 O ATOM 1054 CB PRO A 74 14.829 5.648 -5.636 1.00 71.21 C ATOM 1055 CG PRO A 74 14.613 6.851 -6.473 1.00 44.34 C ATOM 1056 CD PRO A 74 14.155 7.942 -5.538 1.00 72.44 C ATOM 0 HA PRO A 74 12.786 5.272 -4.816 1.00 51.02 H new ATOM 0 HB2 PRO A 74 15.824 5.647 -5.191 1.00 71.21 H new ATOM 0 HB3 PRO A 74 14.741 4.734 -6.223 1.00 71.21 H new ATOM 0 HG2 PRO A 74 15.531 7.138 -6.985 1.00 44.34 H new ATOM 0 HG3 PRO A 74 13.865 6.660 -7.243 1.00 44.34 H new ATOM 0 HD2 PRO A 74 14.988 8.567 -5.217 1.00 72.44 H new ATOM 0 HD3 PRO A 74 13.430 8.599 -6.018 1.00 72.44 H new ATOM 1064 N GLU A 75 14.497 5.612 -2.232 1.00 33.40 N ATOM 1065 CA GLU A 75 14.800 4.953 -0.967 1.00 32.40 C ATOM 1066 C GLU A 75 13.493 4.428 -0.362 1.00 74.20 C ATOM 1067 O GLU A 75 13.478 3.467 0.415 1.00 23.51 O ATOM 1068 CB GLU A 75 15.503 5.927 -0.029 1.00 43.22 C ATOM 1069 CG GLU A 75 14.746 7.220 0.185 1.00 30.43 C ATOM 1070 CD GLU A 75 15.546 8.222 0.934 1.00 70.22 C ATOM 1071 OE1 GLU A 75 16.519 8.738 0.373 1.00 64.34 O ATOM 1072 OE2 GLU A 75 15.195 8.552 2.073 1.00 21.15 O ATOM 0 H GLU A 75 14.549 6.630 -2.197 1.00 33.40 H new ATOM 0 HA GLU A 75 15.474 4.111 -1.127 1.00 32.40 H new ATOM 0 HB2 GLU A 75 15.656 5.442 0.935 1.00 43.22 H new ATOM 0 HB3 GLU A 75 16.490 6.156 -0.431 1.00 43.22 H new ATOM 0 HG2 GLU A 75 14.460 7.635 -0.781 1.00 30.43 H new ATOM 0 HG3 GLU A 75 13.824 7.013 0.729 1.00 30.43 H new ATOM 1079 N SER A 76 12.414 5.066 -0.757 1.00 3.04 N ATOM 1080 CA SER A 76 11.105 4.665 -0.413 1.00 1.35 C ATOM 1081 C SER A 76 10.626 3.747 -1.527 1.00 23.30 C ATOM 1082 O SER A 76 10.530 4.167 -2.690 1.00 5.15 O ATOM 1083 CB SER A 76 10.218 5.899 -0.300 1.00 2.13 C ATOM 1084 OG SER A 76 10.798 6.849 0.600 1.00 75.31 O ATOM 0 H SER A 76 12.444 5.900 -1.343 1.00 3.04 H new ATOM 0 HA SER A 76 11.073 4.145 0.544 1.00 1.35 H new ATOM 0 HB2 SER A 76 10.087 6.352 -1.283 1.00 2.13 H new ATOM 0 HB3 SER A 76 9.227 5.612 0.053 1.00 2.13 H new ATOM 0 HG SER A 76 11.069 7.648 0.102 1.00 75.31 H new ATOM 1090 N ASP A 77 10.398 2.498 -1.185 1.00 13.43 N ATOM 1091 CA ASP A 77 9.998 1.464 -2.146 1.00 71.14 C ATOM 1092 C ASP A 77 8.674 1.816 -2.826 1.00 33.21 C ATOM 1093 O ASP A 77 8.481 1.557 -4.029 1.00 15.24 O ATOM 1094 CB ASP A 77 9.916 0.095 -1.462 1.00 73.03 C ATOM 1095 CG ASP A 77 9.634 -1.032 -2.434 1.00 4.14 C ATOM 1096 OD1 ASP A 77 10.570 -1.467 -3.146 1.00 0.42 O ATOM 1097 OD2 ASP A 77 8.501 -1.499 -2.507 1.00 41.15 O ATOM 0 H ASP A 77 10.483 2.157 -0.227 1.00 13.43 H new ATOM 0 HA ASP A 77 10.762 1.415 -2.922 1.00 71.14 H new ATOM 0 HB2 ASP A 77 10.854 -0.104 -0.945 1.00 73.03 H new ATOM 0 HB3 ASP A 77 9.133 0.119 -0.704 1.00 73.03 H new ATOM 1102 N ILE A 78 7.781 2.421 -2.076 1.00 14.33 N ATOM 1103 CA ILE A 78 6.525 2.883 -2.608 1.00 22.44 C ATOM 1104 C ILE A 78 6.585 4.400 -2.706 1.00 31.45 C ATOM 1105 O ILE A 78 6.451 5.115 -1.699 1.00 44.25 O ATOM 1106 CB ILE A 78 5.303 2.462 -1.733 1.00 25.23 C ATOM 1107 CG1 ILE A 78 5.305 0.952 -1.481 1.00 31.23 C ATOM 1108 CG2 ILE A 78 3.990 2.871 -2.400 1.00 72.11 C ATOM 1109 CD1 ILE A 78 5.238 0.094 -2.731 1.00 1.30 C ATOM 0 H ILE A 78 7.908 2.605 -1.081 1.00 14.33 H new ATOM 0 HA ILE A 78 6.380 2.424 -3.586 1.00 22.44 H new ATOM 0 HB ILE A 78 5.389 2.978 -0.777 1.00 25.23 H new ATOM 0 HG12 ILE A 78 6.208 0.692 -0.928 1.00 31.23 H new ATOM 0 HG13 ILE A 78 4.457 0.704 -0.842 1.00 31.23 H new ATOM 0 HG21 ILE A 78 3.153 2.567 -1.772 1.00 72.11 H new ATOM 0 HG22 ILE A 78 3.971 3.953 -2.532 1.00 72.11 H new ATOM 0 HG23 ILE A 78 3.909 2.385 -3.372 1.00 72.11 H new ATOM 0 HD11 ILE A 78 5.245 -0.959 -2.450 1.00 1.30 H new ATOM 0 HD12 ILE A 78 4.322 0.318 -3.277 1.00 1.30 H new ATOM 0 HD13 ILE A 78 6.099 0.306 -3.364 1.00 1.30 H new ATOM 1121 N PHE A 79 6.849 4.880 -3.887 1.00 2.31 N ATOM 1122 CA PHE A 79 6.943 6.289 -4.135 1.00 52.03 C ATOM 1123 C PHE A 79 5.599 6.823 -4.600 1.00 1.10 C ATOM 1124 O PHE A 79 5.137 6.506 -5.693 1.00 2.25 O ATOM 1125 CB PHE A 79 8.052 6.581 -5.165 1.00 42.51 C ATOM 1126 CG PHE A 79 8.167 8.030 -5.562 1.00 51.44 C ATOM 1127 CD1 PHE A 79 8.519 8.989 -4.634 1.00 23.13 C ATOM 1128 CD2 PHE A 79 7.899 8.429 -6.861 1.00 63.33 C ATOM 1129 CE1 PHE A 79 8.609 10.322 -4.991 1.00 53.22 C ATOM 1130 CE2 PHE A 79 7.984 9.757 -7.226 1.00 32.12 C ATOM 1131 CZ PHE A 79 8.339 10.706 -6.290 1.00 41.51 C ATOM 0 H PHE A 79 7.006 4.300 -4.711 1.00 2.31 H new ATOM 0 HA PHE A 79 7.210 6.799 -3.209 1.00 52.03 H new ATOM 0 HB2 PHE A 79 9.007 6.252 -4.755 1.00 42.51 H new ATOM 0 HB3 PHE A 79 7.867 5.986 -6.059 1.00 42.51 H new ATOM 0 HD1 PHE A 79 8.727 8.695 -3.616 1.00 23.13 H new ATOM 0 HD2 PHE A 79 7.620 7.691 -7.598 1.00 63.33 H new ATOM 0 HE1 PHE A 79 8.890 11.061 -4.256 1.00 53.22 H new ATOM 0 HE2 PHE A 79 7.773 10.053 -8.243 1.00 32.12 H new ATOM 0 HZ PHE A 79 8.406 11.746 -6.572 1.00 41.51 H new ATOM 1141 N LEU A 80 4.982 7.596 -3.756 1.00 51.20 N ATOM 1142 CA LEU A 80 3.687 8.199 -4.012 1.00 71.35 C ATOM 1143 C LEU A 80 3.883 9.698 -4.027 1.00 70.30 C ATOM 1144 O LEU A 80 4.407 10.255 -3.063 1.00 43.43 O ATOM 1145 CB LEU A 80 2.730 7.834 -2.861 1.00 13.43 C ATOM 1146 CG LEU A 80 2.496 6.341 -2.599 1.00 52.14 C ATOM 1147 CD1 LEU A 80 1.586 6.149 -1.395 1.00 60.02 C ATOM 1148 CD2 LEU A 80 1.903 5.654 -3.822 1.00 52.31 C ATOM 0 H LEU A 80 5.368 7.837 -2.843 1.00 51.20 H new ATOM 0 HA LEU A 80 3.272 7.848 -4.957 1.00 71.35 H new ATOM 0 HB2 LEU A 80 3.115 8.283 -1.945 1.00 13.43 H new ATOM 0 HB3 LEU A 80 1.765 8.298 -3.063 1.00 13.43 H new ATOM 0 HG LEU A 80 3.462 5.883 -2.388 1.00 52.14 H new ATOM 0 HD11 LEU A 80 1.430 5.084 -1.223 1.00 60.02 H new ATOM 0 HD12 LEU A 80 2.049 6.595 -0.515 1.00 60.02 H new ATOM 0 HD13 LEU A 80 0.626 6.630 -1.584 1.00 60.02 H new ATOM 0 HD21 LEU A 80 1.748 4.597 -3.606 1.00 52.31 H new ATOM 0 HD22 LEU A 80 0.948 6.117 -4.072 1.00 52.31 H new ATOM 0 HD23 LEU A 80 2.587 5.756 -4.664 1.00 52.31 H new ATOM 1160 N ASP A 81 3.529 10.346 -5.108 1.00 23.40 N ATOM 1161 CA ASP A 81 3.671 11.793 -5.159 1.00 61.11 C ATOM 1162 C ASP A 81 2.372 12.456 -4.728 1.00 1.13 C ATOM 1163 O ASP A 81 1.342 12.321 -5.395 1.00 52.42 O ATOM 1164 CB ASP A 81 4.095 12.264 -6.546 1.00 43.12 C ATOM 1165 CG ASP A 81 4.265 13.760 -6.607 1.00 24.04 C ATOM 1166 OD1 ASP A 81 5.141 14.298 -5.915 1.00 1.05 O ATOM 1167 OD2 ASP A 81 3.510 14.429 -7.339 1.00 12.12 O ATOM 0 H ASP A 81 3.148 9.914 -5.950 1.00 23.40 H new ATOM 0 HA ASP A 81 4.460 12.086 -4.467 1.00 61.11 H new ATOM 0 HB2 ASP A 81 5.032 11.781 -6.822 1.00 43.12 H new ATOM 0 HB3 ASP A 81 3.349 11.954 -7.278 1.00 43.12 H new ATOM 1172 N ASP A 82 2.444 13.189 -3.645 1.00 14.53 N ATOM 1173 CA ASP A 82 1.279 13.790 -2.990 1.00 12.22 C ATOM 1174 C ASP A 82 1.472 15.319 -2.962 1.00 61.32 C ATOM 1175 O ASP A 82 2.349 15.845 -3.659 1.00 51.05 O ATOM 1176 CB ASP A 82 1.188 13.226 -1.538 1.00 33.23 C ATOM 1177 CG ASP A 82 -0.165 13.433 -0.861 1.00 44.43 C ATOM 1178 OD1 ASP A 82 -0.429 14.545 -0.362 1.00 14.04 O ATOM 1179 OD2 ASP A 82 -0.963 12.492 -0.831 1.00 3.45 O ATOM 0 H ASP A 82 3.325 13.396 -3.175 1.00 14.53 H new ATOM 0 HA ASP A 82 0.359 13.555 -3.525 1.00 12.22 H new ATOM 0 HB2 ASP A 82 1.408 12.159 -1.562 1.00 33.23 H new ATOM 0 HB3 ASP A 82 1.960 13.697 -0.930 1.00 33.23 H new ATOM 1184 N VAL A 83 0.695 16.008 -2.163 1.00 73.12 N ATOM 1185 CA VAL A 83 0.759 17.448 -2.015 1.00 14.34 C ATOM 1186 C VAL A 83 1.947 17.789 -1.108 1.00 21.44 C ATOM 1187 O VAL A 83 2.628 18.803 -1.281 1.00 3.30 O ATOM 1188 CB VAL A 83 -0.560 17.986 -1.382 1.00 15.32 C ATOM 1189 CG1 VAL A 83 -0.545 19.501 -1.244 1.00 75.43 C ATOM 1190 CG2 VAL A 83 -1.765 17.539 -2.197 1.00 62.42 C ATOM 0 H VAL A 83 -0.021 15.574 -1.580 1.00 73.12 H new ATOM 0 HA VAL A 83 0.885 17.913 -2.993 1.00 14.34 H new ATOM 0 HB VAL A 83 -0.636 17.565 -0.379 1.00 15.32 H new ATOM 0 HG11 VAL A 83 -1.482 19.835 -0.799 1.00 75.43 H new ATOM 0 HG12 VAL A 83 0.287 19.800 -0.606 1.00 75.43 H new ATOM 0 HG13 VAL A 83 -0.429 19.955 -2.228 1.00 75.43 H new ATOM 0 HG21 VAL A 83 -2.677 17.924 -1.740 1.00 62.42 H new ATOM 0 HG22 VAL A 83 -1.679 17.922 -3.214 1.00 62.42 H new ATOM 0 HG23 VAL A 83 -1.804 16.450 -2.222 1.00 62.42 H new ATOM 1200 N THR A 84 2.180 16.942 -0.139 1.00 74.45 N ATOM 1201 CA THR A 84 3.310 17.060 0.749 1.00 50.35 C ATOM 1202 C THR A 84 3.780 15.655 1.114 1.00 52.53 C ATOM 1203 O THR A 84 3.178 14.983 1.935 1.00 13.02 O ATOM 1204 CB THR A 84 2.958 17.877 2.028 1.00 74.21 C ATOM 1205 OG1 THR A 84 2.475 19.184 1.645 1.00 74.34 O ATOM 1206 CG2 THR A 84 4.180 18.046 2.926 1.00 72.11 C ATOM 0 H THR A 84 1.583 16.139 0.059 1.00 74.45 H new ATOM 0 HA THR A 84 4.108 17.604 0.244 1.00 50.35 H new ATOM 0 HB THR A 84 2.191 17.333 2.579 1.00 74.21 H new ATOM 0 HG1 THR A 84 2.252 19.699 2.449 1.00 74.34 H new ATOM 0 HG21 THR A 84 3.905 18.620 3.811 1.00 72.11 H new ATOM 0 HG22 THR A 84 4.547 17.065 3.229 1.00 72.11 H new ATOM 0 HG23 THR A 84 4.962 18.573 2.380 1.00 72.11 H new ATOM 1214 N VAL A 85 4.815 15.199 0.450 1.00 30.22 N ATOM 1215 CA VAL A 85 5.289 13.854 0.661 1.00 12.14 C ATOM 1216 C VAL A 85 6.302 13.841 1.787 1.00 34.23 C ATOM 1217 O VAL A 85 7.216 14.678 1.828 1.00 21.01 O ATOM 1218 CB VAL A 85 5.942 13.261 -0.610 1.00 33.34 C ATOM 1219 CG1 VAL A 85 6.126 11.766 -0.461 1.00 72.40 C ATOM 1220 CG2 VAL A 85 5.131 13.576 -1.841 1.00 53.32 C ATOM 0 H VAL A 85 5.342 15.737 -0.238 1.00 30.22 H new ATOM 0 HA VAL A 85 4.425 13.240 0.916 1.00 12.14 H new ATOM 0 HB VAL A 85 6.922 13.723 -0.731 1.00 33.34 H new ATOM 0 HG11 VAL A 85 6.586 11.364 -1.364 1.00 72.40 H new ATOM 0 HG12 VAL A 85 6.768 11.562 0.396 1.00 72.40 H new ATOM 0 HG13 VAL A 85 5.156 11.294 -0.308 1.00 72.40 H new ATOM 0 HG21 VAL A 85 5.617 13.145 -2.717 1.00 53.32 H new ATOM 0 HG22 VAL A 85 4.132 13.154 -1.736 1.00 53.32 H new ATOM 0 HG23 VAL A 85 5.058 14.657 -1.962 1.00 53.32 H new ATOM 1230 N SER A 86 6.122 12.940 2.694 1.00 31.25 N ATOM 1231 CA SER A 86 7.016 12.775 3.797 1.00 3.32 C ATOM 1232 C SER A 86 8.272 11.996 3.356 1.00 63.14 C ATOM 1233 O SER A 86 8.246 11.277 2.343 1.00 70.51 O ATOM 1234 CB SER A 86 6.278 12.032 4.895 1.00 72.52 C ATOM 1235 OG SER A 86 5.024 12.654 5.143 1.00 61.14 O ATOM 0 H SER A 86 5.339 12.287 2.692 1.00 31.25 H new ATOM 0 HA SER A 86 7.345 13.747 4.166 1.00 3.32 H new ATOM 0 HB2 SER A 86 6.127 10.992 4.604 1.00 72.52 H new ATOM 0 HB3 SER A 86 6.876 12.024 5.806 1.00 72.52 H new ATOM 0 HG SER A 86 4.309 11.987 5.077 1.00 61.14 H new ATOM 1241 N ARG A 87 9.356 12.158 4.106 1.00 12.34 N ATOM 1242 CA ARG A 87 10.620 11.473 3.841 1.00 72.54 C ATOM 1243 C ARG A 87 10.424 9.962 3.971 1.00 1.21 C ATOM 1244 O ARG A 87 10.818 9.186 3.109 1.00 3.11 O ATOM 1245 CB ARG A 87 11.717 11.992 4.811 1.00 50.30 C ATOM 1246 CG ARG A 87 11.398 11.845 6.296 1.00 40.44 C ATOM 1247 CD ARG A 87 12.463 12.454 7.185 1.00 22.21 C ATOM 1248 NE ARG A 87 12.542 13.935 7.109 1.00 72.23 N ATOM 1249 CZ ARG A 87 13.469 14.649 7.748 1.00 65.43 C ATOM 1250 NH1 ARG A 87 14.411 14.032 8.442 1.00 35.24 N ATOM 1251 NH2 ARG A 87 13.477 15.966 7.670 1.00 2.41 N ATOM 0 H ARG A 87 9.385 12.772 4.920 1.00 12.34 H new ATOM 0 HA ARG A 87 10.948 11.685 2.823 1.00 72.54 H new ATOM 0 HB2 ARG A 87 12.645 11.460 4.601 1.00 50.30 H new ATOM 0 HB3 ARG A 87 11.898 13.045 4.598 1.00 50.30 H new ATOM 0 HG2 ARG A 87 10.440 12.320 6.506 1.00 40.44 H new ATOM 0 HG3 ARG A 87 11.290 10.788 6.537 1.00 40.44 H new ATOM 0 HD2 ARG A 87 12.269 12.164 8.218 1.00 22.21 H new ATOM 0 HD3 ARG A 87 13.432 12.035 6.913 1.00 22.21 H new ATOM 0 HE ARG A 87 11.854 14.430 6.541 1.00 72.23 H new ATOM 0 HH11 ARG A 87 14.427 13.013 8.487 1.00 35.24 H new ATOM 0 HH12 ARG A 87 15.122 14.575 8.932 1.00 35.24 H new ATOM 0 HH21 ARG A 87 12.769 16.448 7.116 1.00 2.41 H new ATOM 0 HH22 ARG A 87 14.191 16.502 8.163 1.00 2.41 H new ATOM 1265 N ARG A 88 9.754 9.597 5.032 1.00 62.23 N ATOM 1266 CA ARG A 88 9.352 8.263 5.359 1.00 4.34 C ATOM 1267 C ARG A 88 8.060 8.447 6.072 1.00 3.14 C ATOM 1268 O ARG A 88 8.058 8.856 7.226 1.00 52.11 O ATOM 1269 CB ARG A 88 10.343 7.576 6.323 1.00 45.52 C ATOM 1270 CG ARG A 88 11.715 7.281 5.766 1.00 21.43 C ATOM 1271 CD ARG A 88 12.666 6.808 6.861 1.00 62.41 C ATOM 1272 NE ARG A 88 12.241 5.559 7.533 1.00 52.22 N ATOM 1273 CZ ARG A 88 12.694 5.157 8.741 1.00 51.42 C ATOM 1274 NH1 ARG A 88 13.571 5.909 9.412 1.00 33.10 N ATOM 1275 NH2 ARG A 88 12.277 4.006 9.267 1.00 4.35 N ATOM 0 H ARG A 88 9.457 10.273 5.735 1.00 62.23 H new ATOM 0 HA ARG A 88 9.297 7.640 4.466 1.00 4.34 H new ATOM 0 HB2 ARG A 88 10.459 8.208 7.204 1.00 45.52 H new ATOM 0 HB3 ARG A 88 9.900 6.638 6.659 1.00 45.52 H new ATOM 0 HG2 ARG A 88 11.639 6.517 4.992 1.00 21.43 H new ATOM 0 HG3 ARG A 88 12.118 8.176 5.293 1.00 21.43 H new ATOM 0 HD2 ARG A 88 13.655 6.657 6.428 1.00 62.41 H new ATOM 0 HD3 ARG A 88 12.763 7.595 7.609 1.00 62.41 H new ATOM 0 HE ARG A 88 11.564 4.965 7.054 1.00 52.22 H new ATOM 0 HH11 ARG A 88 13.900 6.788 9.013 1.00 33.10 H new ATOM 0 HH12 ARG A 88 13.912 5.604 10.324 1.00 33.10 H new ATOM 0 HH21 ARG A 88 11.613 3.423 8.757 1.00 4.35 H new ATOM 0 HH22 ARG A 88 12.622 3.707 10.179 1.00 4.35 H new ATOM 1289 N HIS A 89 6.977 8.255 5.385 1.00 64.44 N ATOM 1290 CA HIS A 89 5.686 8.469 5.992 1.00 60.32 C ATOM 1291 C HIS A 89 5.387 7.254 6.823 1.00 4.13 C ATOM 1292 O HIS A 89 5.107 7.335 8.026 1.00 34.42 O ATOM 1293 CB HIS A 89 4.607 8.672 4.908 1.00 61.23 C ATOM 1294 CG HIS A 89 3.318 9.311 5.391 1.00 4.03 C ATOM 1295 ND1 HIS A 89 2.926 10.551 4.926 1.00 34.40 N ATOM 1296 CD2 HIS A 89 2.360 8.836 6.231 1.00 54.11 C ATOM 1297 CE1 HIS A 89 1.745 10.792 5.482 1.00 22.43 C ATOM 1298 NE2 HIS A 89 1.364 9.787 6.277 1.00 70.24 N ATOM 0 H HIS A 89 6.953 7.953 4.411 1.00 64.44 H new ATOM 0 HA HIS A 89 5.690 9.366 6.611 1.00 60.32 H new ATOM 0 HB2 HIS A 89 5.025 9.290 4.113 1.00 61.23 H new ATOM 0 HB3 HIS A 89 4.371 7.703 4.467 1.00 61.23 H new ATOM 0 HD2 HIS A 89 2.377 7.895 6.760 1.00 54.11 H new ATOM 0 HE1 HIS A 89 1.165 11.687 5.313 1.00 22.43 H new ATOM 0 HE2 HIS A 89 0.499 9.734 6.816 1.00 70.24 H new ATOM 1306 N ALA A 90 5.541 6.115 6.194 1.00 31.13 N ATOM 1307 CA ALA A 90 5.275 4.870 6.838 1.00 14.42 C ATOM 1308 C ALA A 90 6.062 3.788 6.177 1.00 5.13 C ATOM 1309 O ALA A 90 6.581 3.971 5.070 1.00 0.53 O ATOM 1310 CB ALA A 90 3.791 4.540 6.764 1.00 2.21 C ATOM 0 H ALA A 90 5.853 6.034 5.226 1.00 31.13 H new ATOM 0 HA ALA A 90 5.565 4.947 7.886 1.00 14.42 H new ATOM 0 HB1 ALA A 90 3.605 3.587 7.260 1.00 2.21 H new ATOM 0 HB2 ALA A 90 3.219 5.325 7.259 1.00 2.21 H new ATOM 0 HB3 ALA A 90 3.485 4.472 5.720 1.00 2.21 H new ATOM 1316 N GLU A 91 6.188 2.699 6.844 1.00 3.44 N ATOM 1317 CA GLU A 91 6.791 1.549 6.287 1.00 0.03 C ATOM 1318 C GLU A 91 5.924 0.356 6.567 1.00 72.42 C ATOM 1319 O GLU A 91 5.326 0.235 7.644 1.00 13.11 O ATOM 1320 CB GLU A 91 8.257 1.355 6.753 1.00 20.21 C ATOM 1321 CG GLU A 91 8.481 1.320 8.261 1.00 41.11 C ATOM 1322 CD GLU A 91 9.956 1.241 8.610 1.00 22.41 C ATOM 1323 OE1 GLU A 91 10.713 2.149 8.221 1.00 53.21 O ATOM 1324 OE2 GLU A 91 10.391 0.288 9.305 1.00 23.33 O ATOM 0 H GLU A 91 5.870 2.582 7.806 1.00 3.44 H new ATOM 0 HA GLU A 91 6.863 1.679 5.207 1.00 0.03 H new ATOM 0 HB2 GLU A 91 8.632 0.424 6.328 1.00 20.21 H new ATOM 0 HB3 GLU A 91 8.860 2.161 6.335 1.00 20.21 H new ATOM 0 HG2 GLU A 91 8.048 2.212 8.714 1.00 41.11 H new ATOM 0 HG3 GLU A 91 7.960 0.462 8.686 1.00 41.11 H new ATOM 1331 N PHE A 92 5.841 -0.498 5.613 1.00 0.12 N ATOM 1332 CA PHE A 92 5.051 -1.673 5.702 1.00 21.44 C ATOM 1333 C PHE A 92 6.006 -2.782 5.934 1.00 41.42 C ATOM 1334 O PHE A 92 6.882 -3.069 5.097 1.00 34.33 O ATOM 1335 CB PHE A 92 4.281 -1.916 4.399 1.00 53.24 C ATOM 1336 CG PHE A 92 3.393 -0.778 3.975 1.00 70.21 C ATOM 1337 CD1 PHE A 92 2.102 -0.683 4.449 1.00 31.54 C ATOM 1338 CD2 PHE A 92 3.852 0.197 3.101 1.00 52.14 C ATOM 1339 CE1 PHE A 92 1.281 0.358 4.068 1.00 60.13 C ATOM 1340 CE2 PHE A 92 3.036 1.239 2.716 1.00 51.50 C ATOM 1341 CZ PHE A 92 1.748 1.321 3.200 1.00 11.25 C ATOM 0 H PHE A 92 6.333 -0.397 4.725 1.00 0.12 H new ATOM 0 HA PHE A 92 4.313 -1.590 6.500 1.00 21.44 H new ATOM 0 HB2 PHE A 92 4.996 -2.118 3.602 1.00 53.24 H new ATOM 0 HB3 PHE A 92 3.671 -2.812 4.514 1.00 53.24 H new ATOM 0 HD1 PHE A 92 1.728 -1.434 5.129 1.00 31.54 H new ATOM 0 HD2 PHE A 92 4.860 0.139 2.718 1.00 52.14 H new ATOM 0 HE1 PHE A 92 0.273 0.418 4.450 1.00 60.13 H new ATOM 0 HE2 PHE A 92 3.406 1.991 2.035 1.00 51.50 H new ATOM 0 HZ PHE A 92 1.107 2.137 2.900 1.00 11.25 H new ATOM 1351 N ARG A 93 5.900 -3.348 7.071 1.00 11.50 N ATOM 1352 CA ARG A 93 6.825 -4.317 7.512 1.00 32.41 C ATOM 1353 C ARG A 93 6.192 -5.666 7.544 1.00 2.44 C ATOM 1354 O ARG A 93 5.094 -5.851 8.092 1.00 42.14 O ATOM 1355 CB ARG A 93 7.349 -3.921 8.880 1.00 44.15 C ATOM 1356 CG ARG A 93 8.080 -2.598 8.871 1.00 55.23 C ATOM 1357 CD ARG A 93 8.430 -2.134 10.261 1.00 2.02 C ATOM 1358 NE ARG A 93 9.278 -3.084 10.978 1.00 13.13 N ATOM 1359 CZ ARG A 93 10.504 -2.810 11.424 1.00 30.04 C ATOM 1360 NH1 ARG A 93 11.137 -1.703 11.015 1.00 74.22 N ATOM 1361 NH2 ARG A 93 11.108 -3.660 12.253 1.00 13.11 N ATOM 0 H ARG A 93 5.153 -3.148 7.737 1.00 11.50 H new ATOM 0 HA ARG A 93 7.663 -4.366 6.817 1.00 32.41 H new ATOM 0 HB2 ARG A 93 6.515 -3.865 9.580 1.00 44.15 H new ATOM 0 HB3 ARG A 93 8.020 -4.698 9.245 1.00 44.15 H new ATOM 0 HG2 ARG A 93 8.991 -2.692 8.281 1.00 55.23 H new ATOM 0 HG3 ARG A 93 7.460 -1.845 8.383 1.00 55.23 H new ATOM 0 HD2 ARG A 93 8.940 -1.172 10.201 1.00 2.02 H new ATOM 0 HD3 ARG A 93 7.513 -1.973 10.827 1.00 2.02 H new ATOM 0 HE ARG A 93 8.907 -4.019 11.149 1.00 13.13 H new ATOM 0 HH11 ARG A 93 10.681 -1.067 10.361 1.00 74.22 H new ATOM 0 HH12 ARG A 93 12.075 -1.496 11.358 1.00 74.22 H new ATOM 0 HH21 ARG A 93 10.632 -4.515 12.543 1.00 13.11 H new ATOM 0 HH22 ARG A 93 12.046 -3.456 12.598 1.00 13.11 H new ATOM 1375 N ILE A 94 6.839 -6.578 6.912 1.00 50.40 N ATOM 1376 CA ILE A 94 6.422 -7.927 6.901 1.00 12.41 C ATOM 1377 C ILE A 94 7.443 -8.633 7.750 1.00 34.44 C ATOM 1378 O ILE A 94 8.620 -8.714 7.380 1.00 42.44 O ATOM 1379 CB ILE A 94 6.421 -8.545 5.447 1.00 3.12 C ATOM 1380 CG1 ILE A 94 5.439 -7.821 4.488 1.00 22.41 C ATOM 1381 CG2 ILE A 94 6.096 -10.036 5.483 1.00 12.13 C ATOM 1382 CD1 ILE A 94 5.845 -6.423 4.043 1.00 41.31 C ATOM 0 H ILE A 94 7.690 -6.400 6.378 1.00 50.40 H new ATOM 0 HA ILE A 94 5.400 -8.026 7.266 1.00 12.41 H new ATOM 0 HB ILE A 94 7.429 -8.403 5.058 1.00 3.12 H new ATOM 0 HG12 ILE A 94 5.309 -8.439 3.600 1.00 22.41 H new ATOM 0 HG13 ILE A 94 4.467 -7.757 4.977 1.00 22.41 H new ATOM 0 HG21 ILE A 94 6.102 -10.434 4.468 1.00 12.13 H new ATOM 0 HG22 ILE A 94 6.843 -10.557 6.082 1.00 12.13 H new ATOM 0 HG23 ILE A 94 5.110 -10.183 5.924 1.00 12.13 H new ATOM 0 HD11 ILE A 94 5.083 -6.018 3.377 1.00 41.31 H new ATOM 0 HD12 ILE A 94 5.944 -5.778 4.916 1.00 41.31 H new ATOM 0 HD13 ILE A 94 6.799 -6.471 3.517 1.00 41.31 H new ATOM 1394 N ASN A 95 7.030 -9.100 8.873 1.00 22.24 N ATOM 1395 CA ASN A 95 7.937 -9.711 9.805 1.00 30.21 C ATOM 1396 C ASN A 95 7.335 -10.951 10.326 1.00 15.34 C ATOM 1397 O ASN A 95 6.235 -10.913 10.868 1.00 23.21 O ATOM 1398 CB ASN A 95 8.256 -8.776 10.996 1.00 34.15 C ATOM 1399 CG ASN A 95 9.072 -7.542 10.639 1.00 45.41 C ATOM 1400 OD1 ASN A 95 8.532 -6.494 10.292 1.00 62.24 O ATOM 1401 ND2 ASN A 95 10.369 -7.647 10.759 1.00 11.23 N ATOM 0 H ASN A 95 6.058 -9.075 9.181 1.00 22.24 H new ATOM 0 HA ASN A 95 8.867 -9.921 9.276 1.00 30.21 H new ATOM 0 HB2 ASN A 95 7.318 -8.455 11.449 1.00 34.15 H new ATOM 0 HB3 ASN A 95 8.797 -9.345 11.752 1.00 34.15 H new ATOM 0 HD21 ASN A 95 10.966 -6.844 10.562 1.00 11.23 H new ATOM 0 HD22 ASN A 95 10.784 -8.532 11.049 1.00 11.23 H new ATOM 1408 N GLU A 96 8.025 -12.058 10.115 1.00 11.01 N ATOM 1409 CA GLU A 96 7.641 -13.359 10.641 1.00 53.15 C ATOM 1410 C GLU A 96 6.213 -13.731 10.187 1.00 35.24 C ATOM 1411 O GLU A 96 5.442 -14.349 10.912 1.00 21.14 O ATOM 1412 CB GLU A 96 7.789 -13.281 12.169 1.00 15.04 C ATOM 1413 CG GLU A 96 7.716 -14.582 12.919 1.00 54.41 C ATOM 1414 CD GLU A 96 8.163 -14.394 14.330 1.00 24.34 C ATOM 1415 OE1 GLU A 96 9.379 -14.460 14.580 1.00 34.44 O ATOM 1416 OE2 GLU A 96 7.315 -14.146 15.217 1.00 44.35 O ATOM 0 H GLU A 96 8.883 -12.080 9.564 1.00 11.01 H new ATOM 0 HA GLU A 96 8.280 -14.155 10.258 1.00 53.15 H new ATOM 0 HB2 GLU A 96 8.746 -12.810 12.395 1.00 15.04 H new ATOM 0 HB3 GLU A 96 7.011 -12.622 12.554 1.00 15.04 H new ATOM 0 HG2 GLU A 96 6.695 -14.962 12.902 1.00 54.41 H new ATOM 0 HG3 GLU A 96 8.342 -15.328 12.429 1.00 54.41 H new ATOM 1423 N GLY A 97 5.899 -13.373 8.948 1.00 73.02 N ATOM 1424 CA GLY A 97 4.604 -13.693 8.378 1.00 60.21 C ATOM 1425 C GLY A 97 3.497 -12.755 8.827 1.00 70.34 C ATOM 1426 O GLY A 97 2.330 -12.967 8.503 1.00 3.42 O ATOM 0 H GLY A 97 6.524 -12.863 8.324 1.00 73.02 H new ATOM 0 HA2 GLY A 97 4.677 -13.663 7.291 1.00 60.21 H new ATOM 0 HA3 GLY A 97 4.338 -14.714 8.651 1.00 60.21 H new ATOM 1430 N GLU A 98 3.847 -11.752 9.598 1.00 33.52 N ATOM 1431 CA GLU A 98 2.892 -10.775 10.049 1.00 41.10 C ATOM 1432 C GLU A 98 3.085 -9.501 9.260 1.00 73.45 C ATOM 1433 O GLU A 98 4.219 -9.118 8.955 1.00 11.21 O ATOM 1434 CB GLU A 98 3.059 -10.497 11.534 1.00 30.34 C ATOM 1435 CG GLU A 98 2.989 -11.734 12.404 1.00 54.14 C ATOM 1436 CD GLU A 98 2.959 -11.392 13.860 1.00 51.34 C ATOM 1437 OE1 GLU A 98 1.855 -11.178 14.397 1.00 20.45 O ATOM 1438 OE2 GLU A 98 4.032 -11.309 14.500 1.00 22.43 O ATOM 0 H GLU A 98 4.799 -11.593 9.928 1.00 33.52 H new ATOM 0 HA GLU A 98 1.885 -11.162 9.891 1.00 41.10 H new ATOM 0 HB2 GLU A 98 4.018 -10.006 11.695 1.00 30.34 H new ATOM 0 HB3 GLU A 98 2.285 -9.798 11.851 1.00 30.34 H new ATOM 0 HG2 GLU A 98 2.099 -12.308 12.148 1.00 54.14 H new ATOM 0 HG3 GLU A 98 3.849 -12.371 12.199 1.00 54.14 H new ATOM 1445 N PHE A 99 2.002 -8.860 8.925 1.00 71.23 N ATOM 1446 CA PHE A 99 2.040 -7.662 8.122 1.00 71.01 C ATOM 1447 C PHE A 99 1.623 -6.465 8.982 1.00 72.02 C ATOM 1448 O PHE A 99 0.486 -6.402 9.456 1.00 71.50 O ATOM 1449 CB PHE A 99 1.049 -7.809 6.948 1.00 74.43 C ATOM 1450 CG PHE A 99 1.307 -8.979 6.024 1.00 43.25 C ATOM 1451 CD1 PHE A 99 0.771 -10.234 6.295 1.00 41.23 C ATOM 1452 CD2 PHE A 99 2.067 -8.820 4.883 1.00 31.03 C ATOM 1453 CE1 PHE A 99 1.001 -11.300 5.448 1.00 61.13 C ATOM 1454 CE2 PHE A 99 2.301 -9.883 4.030 1.00 31.33 C ATOM 1455 CZ PHE A 99 1.766 -11.125 4.313 1.00 33.35 C ATOM 0 H PHE A 99 1.064 -9.151 9.199 1.00 71.23 H new ATOM 0 HA PHE A 99 3.049 -7.507 7.739 1.00 71.01 H new ATOM 0 HB2 PHE A 99 0.042 -7.904 7.354 1.00 74.43 H new ATOM 0 HB3 PHE A 99 1.070 -6.892 6.360 1.00 74.43 H new ATOM 0 HD1 PHE A 99 0.167 -10.376 7.179 1.00 41.23 H new ATOM 0 HD2 PHE A 99 2.485 -7.851 4.653 1.00 31.03 H new ATOM 0 HE1 PHE A 99 0.583 -12.270 5.674 1.00 61.13 H new ATOM 0 HE2 PHE A 99 2.901 -9.742 3.143 1.00 31.33 H new ATOM 0 HZ PHE A 99 1.946 -11.957 3.648 1.00 33.35 H new ATOM 1465 N GLU A 100 2.513 -5.529 9.173 1.00 13.33 N ATOM 1466 CA GLU A 100 2.220 -4.367 9.991 1.00 2.14 C ATOM 1467 C GLU A 100 2.601 -3.075 9.291 1.00 42.21 C ATOM 1468 O GLU A 100 3.560 -3.036 8.514 1.00 41.43 O ATOM 1469 CB GLU A 100 2.907 -4.471 11.370 1.00 53.21 C ATOM 1470 CG GLU A 100 4.415 -4.708 11.315 1.00 63.30 C ATOM 1471 CD GLU A 100 5.056 -4.775 12.686 1.00 4.04 C ATOM 1472 OE1 GLU A 100 4.541 -5.515 13.564 1.00 61.52 O ATOM 1473 OE2 GLU A 100 6.099 -4.133 12.900 1.00 75.23 O ATOM 0 H GLU A 100 3.452 -5.542 8.775 1.00 13.33 H new ATOM 0 HA GLU A 100 1.142 -4.346 10.149 1.00 2.14 H new ATOM 0 HB2 GLU A 100 2.717 -3.553 11.926 1.00 53.21 H new ATOM 0 HB3 GLU A 100 2.445 -5.284 11.931 1.00 53.21 H new ATOM 0 HG2 GLU A 100 4.611 -5.639 10.783 1.00 63.30 H new ATOM 0 HG3 GLU A 100 4.882 -3.908 10.741 1.00 63.30 H new ATOM 1480 N VAL A 101 1.839 -2.042 9.535 1.00 34.12 N ATOM 1481 CA VAL A 101 2.157 -0.734 9.028 1.00 73.10 C ATOM 1482 C VAL A 101 2.704 0.042 10.188 1.00 34.22 C ATOM 1483 O VAL A 101 2.037 0.158 11.226 1.00 62.30 O ATOM 1484 CB VAL A 101 0.898 0.021 8.524 1.00 24.13 C ATOM 1485 CG1 VAL A 101 1.275 1.325 7.833 1.00 74.44 C ATOM 1486 CG2 VAL A 101 0.054 -0.845 7.621 1.00 63.41 C ATOM 0 H VAL A 101 0.983 -2.083 10.089 1.00 34.12 H new ATOM 0 HA VAL A 101 2.852 -0.833 8.194 1.00 73.10 H new ATOM 0 HB VAL A 101 0.297 0.267 9.399 1.00 24.13 H new ATOM 0 HG11 VAL A 101 0.372 1.830 7.491 1.00 74.44 H new ATOM 0 HG12 VAL A 101 1.807 1.968 8.534 1.00 74.44 H new ATOM 0 HG13 VAL A 101 1.917 1.111 6.978 1.00 74.44 H new ATOM 0 HG21 VAL A 101 -0.818 -0.282 7.288 1.00 63.41 H new ATOM 0 HG22 VAL A 101 0.642 -1.149 6.755 1.00 63.41 H new ATOM 0 HG23 VAL A 101 -0.272 -1.730 8.167 1.00 63.41 H new ATOM 1496 N VAL A 102 3.883 0.549 10.048 1.00 1.21 N ATOM 1497 CA VAL A 102 4.483 1.326 11.090 1.00 32.30 C ATOM 1498 C VAL A 102 4.755 2.725 10.572 1.00 43.12 C ATOM 1499 O VAL A 102 5.374 2.895 9.510 1.00 44.43 O ATOM 1500 CB VAL A 102 5.802 0.678 11.625 1.00 23.22 C ATOM 1501 CG1 VAL A 102 6.434 1.529 12.724 1.00 10.31 C ATOM 1502 CG2 VAL A 102 5.538 -0.730 12.148 1.00 45.41 C ATOM 0 H VAL A 102 4.459 0.439 9.213 1.00 1.21 H new ATOM 0 HA VAL A 102 3.787 1.366 11.928 1.00 32.30 H new ATOM 0 HB VAL A 102 6.500 0.622 10.790 1.00 23.22 H new ATOM 0 HG11 VAL A 102 7.349 1.051 13.074 1.00 10.31 H new ATOM 0 HG12 VAL A 102 6.670 2.517 12.329 1.00 10.31 H new ATOM 0 HG13 VAL A 102 5.735 1.628 13.555 1.00 10.31 H new ATOM 0 HG21 VAL A 102 6.469 -1.162 12.515 1.00 45.41 H new ATOM 0 HG22 VAL A 102 4.813 -0.686 12.961 1.00 45.41 H new ATOM 0 HG23 VAL A 102 5.143 -1.349 11.342 1.00 45.41 H new ATOM 1512 N ASP A 103 4.271 3.700 11.282 1.00 12.34 N ATOM 1513 CA ASP A 103 4.486 5.083 10.944 1.00 73.34 C ATOM 1514 C ASP A 103 5.852 5.458 11.452 1.00 60.21 C ATOM 1515 O ASP A 103 6.149 5.296 12.644 1.00 63.51 O ATOM 1516 CB ASP A 103 3.435 5.975 11.616 1.00 1.11 C ATOM 1517 CG ASP A 103 3.489 7.429 11.169 1.00 72.45 C ATOM 1518 OD1 ASP A 103 4.573 8.017 11.087 1.00 51.12 O ATOM 1519 OD2 ASP A 103 2.417 8.003 10.878 1.00 72.32 O ATOM 0 H ASP A 103 3.709 3.560 12.122 1.00 12.34 H new ATOM 0 HA ASP A 103 4.408 5.221 9.866 1.00 73.34 H new ATOM 0 HB2 ASP A 103 2.443 5.576 11.404 1.00 1.11 H new ATOM 0 HB3 ASP A 103 3.572 5.931 12.697 1.00 1.11 H new ATOM 1524 N VAL A 104 6.679 5.928 10.580 1.00 21.14 N ATOM 1525 CA VAL A 104 8.028 6.283 10.941 1.00 43.10 C ATOM 1526 C VAL A 104 8.287 7.754 10.712 1.00 52.51 C ATOM 1527 O VAL A 104 9.440 8.212 10.735 1.00 13.54 O ATOM 1528 CB VAL A 104 9.072 5.413 10.208 1.00 34.24 C ATOM 1529 CG1 VAL A 104 9.050 4.000 10.764 1.00 55.42 C ATOM 1530 CG2 VAL A 104 8.793 5.386 8.710 1.00 11.34 C ATOM 0 H VAL A 104 6.449 6.080 9.598 1.00 21.14 H new ATOM 0 HA VAL A 104 8.136 6.084 12.007 1.00 43.10 H new ATOM 0 HB VAL A 104 10.059 5.847 10.368 1.00 34.24 H new ATOM 0 HG11 VAL A 104 9.789 3.392 10.242 1.00 55.42 H new ATOM 0 HG12 VAL A 104 9.286 4.024 11.828 1.00 55.42 H new ATOM 0 HG13 VAL A 104 8.059 3.568 10.622 1.00 55.42 H new ATOM 0 HG21 VAL A 104 9.540 4.768 8.212 1.00 11.34 H new ATOM 0 HG22 VAL A 104 7.801 4.971 8.532 1.00 11.34 H new ATOM 0 HG23 VAL A 104 8.838 6.400 8.313 1.00 11.34 H new ATOM 1540 N GLY A 105 7.229 8.492 10.529 1.00 62.23 N ATOM 1541 CA GLY A 105 7.341 9.906 10.351 1.00 13.34 C ATOM 1542 C GLY A 105 6.822 10.630 11.563 1.00 63.10 C ATOM 1543 O GLY A 105 7.279 11.725 11.890 1.00 54.23 O ATOM 0 H GLY A 105 6.275 8.132 10.500 1.00 62.23 H new ATOM 0 HA2 GLY A 105 8.383 10.176 10.177 1.00 13.34 H new ATOM 0 HA3 GLY A 105 6.780 10.213 9.468 1.00 13.34 H new ATOM 1547 N SER A 106 5.845 10.009 12.220 1.00 53.35 N ATOM 1548 CA SER A 106 5.164 10.455 13.446 1.00 73.23 C ATOM 1549 C SER A 106 4.304 11.715 13.248 1.00 44.11 C ATOM 1550 O SER A 106 3.114 11.709 13.532 1.00 42.30 O ATOM 1551 CB SER A 106 6.101 10.530 14.694 1.00 51.14 C ATOM 1552 OG SER A 106 7.206 11.430 14.526 1.00 23.14 O ATOM 0 H SER A 106 5.478 9.116 11.891 1.00 53.35 H new ATOM 0 HA SER A 106 4.454 9.660 13.676 1.00 73.23 H new ATOM 0 HB2 SER A 106 5.516 10.842 15.559 1.00 51.14 H new ATOM 0 HB3 SER A 106 6.484 9.533 14.911 1.00 51.14 H new ATOM 0 HG SER A 106 7.208 11.779 13.610 1.00 23.14 H new ATOM 1558 N LEU A 107 4.889 12.762 12.701 1.00 12.25 N ATOM 1559 CA LEU A 107 4.187 14.021 12.470 1.00 73.04 C ATOM 1560 C LEU A 107 3.228 13.904 11.294 1.00 60.12 C ATOM 1561 O LEU A 107 2.283 14.672 11.175 1.00 71.54 O ATOM 1562 CB LEU A 107 5.165 15.202 12.215 1.00 35.21 C ATOM 1563 CG LEU A 107 6.093 15.655 13.369 1.00 23.11 C ATOM 1564 CD1 LEU A 107 5.313 15.915 14.643 1.00 74.51 C ATOM 1565 CD2 LEU A 107 7.247 14.689 13.606 1.00 63.42 C ATOM 0 H LEU A 107 5.864 12.770 12.402 1.00 12.25 H new ATOM 0 HA LEU A 107 3.626 14.231 13.380 1.00 73.04 H new ATOM 0 HB2 LEU A 107 5.796 14.933 11.368 1.00 35.21 H new ATOM 0 HB3 LEU A 107 4.572 16.064 11.909 1.00 35.21 H new ATOM 0 HG LEU A 107 6.538 16.599 13.056 1.00 23.11 H new ATOM 0 HD11 LEU A 107 5.997 16.231 15.430 1.00 74.51 H new ATOM 0 HD12 LEU A 107 4.577 16.699 14.465 1.00 74.51 H new ATOM 0 HD13 LEU A 107 4.803 15.002 14.950 1.00 74.51 H new ATOM 0 HD21 LEU A 107 7.866 15.055 14.425 1.00 63.42 H new ATOM 0 HD22 LEU A 107 6.852 13.706 13.861 1.00 63.42 H new ATOM 0 HD23 LEU A 107 7.850 14.614 12.701 1.00 63.42 H new ATOM 1577 N ASN A 108 3.459 12.929 10.448 1.00 73.12 N ATOM 1578 CA ASN A 108 2.693 12.802 9.218 1.00 61.24 C ATOM 1579 C ASN A 108 1.395 12.005 9.366 1.00 44.31 C ATOM 1580 O ASN A 108 0.482 12.181 8.573 1.00 0.55 O ATOM 1581 CB ASN A 108 3.587 12.278 8.088 1.00 72.50 C ATOM 1582 CG ASN A 108 4.384 11.002 8.404 1.00 23.00 C ATOM 1583 OD1 ASN A 108 5.516 10.881 7.980 1.00 52.54 O ATOM 1584 ND2 ASN A 108 3.803 10.035 9.084 1.00 11.11 N ATOM 0 H ASN A 108 4.169 12.209 10.583 1.00 73.12 H new ATOM 0 HA ASN A 108 2.355 13.804 8.953 1.00 61.24 H new ATOM 0 HB2 ASN A 108 2.963 12.087 7.215 1.00 72.50 H new ATOM 0 HB3 ASN A 108 4.290 13.064 7.812 1.00 72.50 H new ATOM 0 HD21 ASN A 108 4.304 9.165 9.263 1.00 11.11 H new ATOM 0 HD22 ASN A 108 2.852 10.156 9.432 1.00 11.11 H new ATOM 1591 N GLY A 109 1.300 11.193 10.409 1.00 33.14 N ATOM 1592 CA GLY A 109 0.059 10.481 10.712 1.00 64.11 C ATOM 1593 C GLY A 109 -0.412 9.499 9.637 1.00 22.33 C ATOM 1594 O GLY A 109 -1.180 9.858 8.745 1.00 62.44 O ATOM 0 H GLY A 109 2.063 11.009 11.060 1.00 33.14 H new ATOM 0 HA2 GLY A 109 0.192 9.935 11.646 1.00 64.11 H new ATOM 0 HA3 GLY A 109 -0.729 11.215 10.881 1.00 64.11 H new ATOM 1598 N THR A 110 0.066 8.298 9.702 1.00 64.14 N ATOM 1599 CA THR A 110 -0.388 7.248 8.833 1.00 52.13 C ATOM 1600 C THR A 110 -1.721 6.705 9.368 1.00 44.23 C ATOM 1601 O THR A 110 -1.897 6.548 10.592 1.00 62.14 O ATOM 1602 CB THR A 110 0.654 6.121 8.781 1.00 51.05 C ATOM 1603 OG1 THR A 110 1.917 6.683 8.425 1.00 32.43 O ATOM 1604 CG2 THR A 110 0.271 5.060 7.755 1.00 34.34 C ATOM 0 H THR A 110 0.788 8.011 10.363 1.00 64.14 H new ATOM 0 HA THR A 110 -0.527 7.639 7.825 1.00 52.13 H new ATOM 0 HB THR A 110 0.703 5.645 9.760 1.00 51.05 H new ATOM 0 HG1 THR A 110 2.201 7.315 9.118 1.00 32.43 H new ATOM 0 HG21 THR A 110 1.028 4.276 7.742 1.00 34.34 H new ATOM 0 HG22 THR A 110 -0.694 4.628 8.021 1.00 34.34 H new ATOM 0 HG23 THR A 110 0.204 5.516 6.767 1.00 34.34 H new ATOM 1612 N TYR A 111 -2.660 6.461 8.489 1.00 1.13 N ATOM 1613 CA TYR A 111 -3.951 5.988 8.911 1.00 22.21 C ATOM 1614 C TYR A 111 -4.166 4.565 8.426 1.00 13.03 C ATOM 1615 O TYR A 111 -4.039 4.297 7.239 1.00 32.40 O ATOM 1616 CB TYR A 111 -5.050 6.867 8.324 1.00 11.13 C ATOM 1617 CG TYR A 111 -4.827 8.362 8.471 1.00 63.02 C ATOM 1618 CD1 TYR A 111 -5.126 9.018 9.646 1.00 3.42 C ATOM 1619 CD2 TYR A 111 -4.315 9.113 7.420 1.00 73.31 C ATOM 1620 CE1 TYR A 111 -4.920 10.374 9.775 1.00 33.51 C ATOM 1621 CE2 TYR A 111 -4.109 10.463 7.537 1.00 60.21 C ATOM 1622 CZ TYR A 111 -4.410 11.089 8.716 1.00 21.51 C ATOM 1623 OH TYR A 111 -4.201 12.433 8.841 1.00 44.45 O ATOM 0 H TYR A 111 -2.554 6.582 7.482 1.00 1.13 H new ATOM 0 HA TYR A 111 -3.990 6.023 10.000 1.00 22.21 H new ATOM 0 HB2 TYR A 111 -5.153 6.633 7.264 1.00 11.13 H new ATOM 0 HB3 TYR A 111 -5.995 6.608 8.801 1.00 11.13 H new ATOM 0 HD1 TYR A 111 -5.528 8.460 10.479 1.00 3.42 H new ATOM 0 HD2 TYR A 111 -4.074 8.621 6.489 1.00 73.31 H new ATOM 0 HE1 TYR A 111 -5.158 10.873 10.703 1.00 33.51 H new ATOM 0 HE2 TYR A 111 -3.713 11.028 6.706 1.00 60.21 H new ATOM 0 HH TYR A 111 -3.836 12.787 8.003 1.00 44.45 H new ATOM 1633 N VAL A 112 -4.505 3.681 9.330 1.00 14.11 N ATOM 1634 CA VAL A 112 -4.830 2.293 9.011 1.00 63.33 C ATOM 1635 C VAL A 112 -6.287 2.129 9.408 1.00 55.44 C ATOM 1636 O VAL A 112 -6.673 2.617 10.463 1.00 52.11 O ATOM 1637 CB VAL A 112 -3.933 1.286 9.784 1.00 73.14 C ATOM 1638 CG1 VAL A 112 -4.228 -0.149 9.359 1.00 60.24 C ATOM 1639 CG2 VAL A 112 -2.458 1.611 9.573 1.00 71.13 C ATOM 0 H VAL A 112 -4.567 3.897 10.325 1.00 14.11 H new ATOM 0 HA VAL A 112 -4.658 2.083 7.955 1.00 63.33 H new ATOM 0 HB VAL A 112 -4.161 1.379 10.846 1.00 73.14 H new ATOM 0 HG11 VAL A 112 -3.586 -0.832 9.915 1.00 60.24 H new ATOM 0 HG12 VAL A 112 -5.272 -0.382 9.566 1.00 60.24 H new ATOM 0 HG13 VAL A 112 -4.036 -0.259 8.292 1.00 60.24 H new ATOM 0 HG21 VAL A 112 -1.846 0.895 10.122 1.00 71.13 H new ATOM 0 HG22 VAL A 112 -2.221 1.552 8.511 1.00 71.13 H new ATOM 0 HG23 VAL A 112 -2.252 2.618 9.935 1.00 71.13 H new ATOM 1649 N ASN A 113 -7.088 1.480 8.564 1.00 72.31 N ATOM 1650 CA ASN A 113 -8.578 1.507 8.645 1.00 74.24 C ATOM 1651 C ASN A 113 -9.009 2.957 8.662 1.00 24.31 C ATOM 1652 O ASN A 113 -10.041 3.305 9.229 1.00 20.10 O ATOM 1653 CB ASN A 113 -9.106 0.842 9.953 1.00 44.43 C ATOM 1654 CG ASN A 113 -8.983 -0.661 10.017 1.00 62.15 C ATOM 1655 OD1 ASN A 113 -8.740 -1.228 11.090 1.00 75.41 O ATOM 1656 ND2 ASN A 113 -9.216 -1.333 8.921 1.00 12.14 N ATOM 0 H ASN A 113 -6.735 0.912 7.794 1.00 72.31 H new ATOM 0 HA ASN A 113 -8.979 0.957 7.794 1.00 74.24 H new ATOM 0 HB2 ASN A 113 -8.567 1.269 10.799 1.00 44.43 H new ATOM 0 HB3 ASN A 113 -10.156 1.108 10.076 1.00 44.43 H new ATOM 0 HD21 ASN A 113 -9.201 -2.353 8.935 1.00 12.14 H new ATOM 0 HD22 ASN A 113 -9.413 -0.838 8.051 1.00 12.14 H new ATOM 1663 N ARG A 114 -8.256 3.783 7.926 1.00 64.23 N ATOM 1664 CA ARG A 114 -8.453 5.232 7.885 1.00 72.31 C ATOM 1665 C ARG A 114 -8.353 5.927 9.280 1.00 35.11 C ATOM 1666 O ARG A 114 -8.672 7.109 9.416 1.00 24.53 O ATOM 1667 CB ARG A 114 -9.709 5.618 7.105 1.00 4.04 C ATOM 1668 CG ARG A 114 -9.500 5.595 5.597 1.00 63.42 C ATOM 1669 CD ARG A 114 -10.783 5.881 4.844 1.00 21.33 C ATOM 1670 NE ARG A 114 -11.660 4.702 4.750 1.00 54.30 N ATOM 1671 CZ ARG A 114 -12.925 4.628 5.157 1.00 4.51 C ATOM 1672 NH1 ARG A 114 -13.416 5.502 6.018 1.00 74.20 N ATOM 1673 NH2 ARG A 114 -13.659 3.608 4.764 1.00 12.43 N ATOM 0 H ARG A 114 -7.488 3.459 7.339 1.00 64.23 H new ATOM 0 HA ARG A 114 -7.606 5.630 7.327 1.00 72.31 H new ATOM 0 HB2 ARG A 114 -10.517 4.934 7.365 1.00 4.04 H new ATOM 0 HB3 ARG A 114 -10.026 6.616 7.408 1.00 4.04 H new ATOM 0 HG2 ARG A 114 -8.746 6.334 5.324 1.00 63.42 H new ATOM 0 HG3 ARG A 114 -9.114 4.620 5.299 1.00 63.42 H new ATOM 0 HD2 ARG A 114 -11.319 6.689 5.341 1.00 21.33 H new ATOM 0 HD3 ARG A 114 -10.541 6.230 3.840 1.00 21.33 H new ATOM 0 HE ARG A 114 -11.260 3.862 4.333 1.00 54.30 H new ATOM 0 HH11 ARG A 114 -12.823 6.248 6.381 1.00 74.20 H new ATOM 0 HH12 ARG A 114 -14.388 5.430 6.319 1.00 74.20 H new ATOM 0 HH21 ARG A 114 -13.256 2.893 4.159 1.00 12.43 H new ATOM 0 HH22 ARG A 114 -14.631 3.533 5.065 1.00 12.43 H new ATOM 1687 N GLU A 115 -7.854 5.204 10.277 1.00 12.22 N ATOM 1688 CA GLU A 115 -7.695 5.714 11.633 1.00 33.31 C ATOM 1689 C GLU A 115 -6.215 6.022 11.875 1.00 32.15 C ATOM 1690 O GLU A 115 -5.353 5.213 11.516 1.00 11.34 O ATOM 1691 CB GLU A 115 -8.154 4.647 12.641 1.00 31.31 C ATOM 1692 CG GLU A 115 -9.595 4.180 12.474 1.00 22.43 C ATOM 1693 CD GLU A 115 -10.615 5.226 12.844 1.00 50.35 C ATOM 1694 OE1 GLU A 115 -10.811 6.201 12.090 1.00 72.12 O ATOM 1695 OE2 GLU A 115 -11.287 5.065 13.889 1.00 73.51 O ATOM 0 H GLU A 115 -7.546 4.238 10.165 1.00 12.22 H new ATOM 0 HA GLU A 115 -8.294 6.616 11.758 1.00 33.31 H new ATOM 0 HB2 GLU A 115 -7.496 3.782 12.557 1.00 31.31 H new ATOM 0 HB3 GLU A 115 -8.031 5.044 13.649 1.00 31.31 H new ATOM 0 HG2 GLU A 115 -9.753 3.881 11.438 1.00 22.43 H new ATOM 0 HG3 GLU A 115 -9.755 3.295 13.090 1.00 22.43 H new ATOM 1702 N PRO A 116 -5.886 7.186 12.457 1.00 32.32 N ATOM 1703 CA PRO A 116 -4.493 7.556 12.728 1.00 43.42 C ATOM 1704 C PRO A 116 -3.837 6.595 13.714 1.00 22.21 C ATOM 1705 O PRO A 116 -4.332 6.390 14.832 1.00 14.23 O ATOM 1706 CB PRO A 116 -4.587 8.967 13.328 1.00 73.13 C ATOM 1707 CG PRO A 116 -6.006 9.126 13.764 1.00 25.40 C ATOM 1708 CD PRO A 116 -6.832 8.228 12.887 1.00 51.12 C ATOM 0 HA PRO A 116 -3.879 7.518 11.828 1.00 43.42 H new ATOM 0 HB2 PRO A 116 -3.904 9.081 14.169 1.00 73.13 H new ATOM 0 HB3 PRO A 116 -4.316 9.724 12.592 1.00 73.13 H new ATOM 0 HG2 PRO A 116 -6.121 8.854 14.813 1.00 25.40 H new ATOM 0 HG3 PRO A 116 -6.327 10.163 13.667 1.00 25.40 H new ATOM 0 HD2 PRO A 116 -7.675 7.802 13.432 1.00 51.12 H new ATOM 0 HD3 PRO A 116 -7.244 8.770 12.036 1.00 51.12 H new ATOM 1716 N ARG A 117 -2.741 6.006 13.302 1.00 63.22 N ATOM 1717 CA ARG A 117 -2.023 5.046 14.111 1.00 15.14 C ATOM 1718 C ARG A 117 -0.551 5.230 13.970 1.00 54.14 C ATOM 1719 O ARG A 117 -0.085 5.914 13.065 1.00 32.21 O ATOM 1720 CB ARG A 117 -2.384 3.607 13.721 1.00 12.14 C ATOM 1721 CG ARG A 117 -3.717 3.126 14.235 1.00 64.14 C ATOM 1722 CD ARG A 117 -3.692 2.956 15.742 1.00 40.54 C ATOM 1723 NE ARG A 117 -4.982 2.536 16.274 1.00 11.32 N ATOM 1724 CZ ARG A 117 -5.203 2.147 17.539 1.00 40.33 C ATOM 1725 NH1 ARG A 117 -4.182 1.986 18.383 1.00 21.24 N ATOM 1726 NH2 ARG A 117 -6.442 1.879 17.943 1.00 21.23 N ATOM 0 H ARG A 117 -2.318 6.179 12.390 1.00 63.22 H new ATOM 0 HA ARG A 117 -2.315 5.218 15.147 1.00 15.14 H new ATOM 0 HB2 ARG A 117 -2.380 3.529 12.634 1.00 12.14 H new ATOM 0 HB3 ARG A 117 -1.606 2.940 14.091 1.00 12.14 H new ATOM 0 HG2 ARG A 117 -4.495 3.838 13.959 1.00 64.14 H new ATOM 0 HG3 ARG A 117 -3.971 2.177 13.763 1.00 64.14 H new ATOM 0 HD2 ARG A 117 -2.934 2.220 16.010 1.00 40.54 H new ATOM 0 HD3 ARG A 117 -3.399 3.898 16.207 1.00 40.54 H new ATOM 0 HE ARG A 117 -5.778 2.538 15.636 1.00 11.32 H new ATOM 0 HH11 ARG A 117 -3.228 2.159 18.068 1.00 21.24 H new ATOM 0 HH12 ARG A 117 -4.356 1.690 19.343 1.00 21.24 H new ATOM 0 HH21 ARG A 117 -7.222 1.969 17.292 1.00 21.23 H new ATOM 0 HH22 ARG A 117 -6.612 1.583 18.904 1.00 21.23 H new ATOM 1740 N ASN A 118 0.167 4.629 14.864 1.00 1.51 N ATOM 1741 CA ASN A 118 1.616 4.638 14.817 1.00 11.12 C ATOM 1742 C ASN A 118 2.078 3.302 14.327 1.00 42.13 C ATOM 1743 O ASN A 118 3.041 3.196 13.599 1.00 0.23 O ATOM 1744 CB ASN A 118 2.252 4.954 16.173 1.00 14.35 C ATOM 1745 CG ASN A 118 1.939 6.350 16.667 1.00 43.05 C ATOM 1746 OD1 ASN A 118 0.968 6.561 17.395 1.00 72.14 O ATOM 1747 ND2 ASN A 118 2.741 7.303 16.282 1.00 21.21 N ATOM 0 H ASN A 118 -0.224 4.114 15.653 1.00 1.51 H new ATOM 0 HA ASN A 118 1.931 5.432 14.140 1.00 11.12 H new ATOM 0 HB2 ASN A 118 1.904 4.229 16.908 1.00 14.35 H new ATOM 0 HB3 ASN A 118 3.333 4.836 16.096 1.00 14.35 H new ATOM 0 HD21 ASN A 118 2.574 8.263 16.584 1.00 21.21 H new ATOM 0 HD22 ASN A 118 3.535 7.089 15.679 1.00 21.21 H new ATOM 1754 N ALA A 119 1.380 2.274 14.734 1.00 42.34 N ATOM 1755 CA ALA A 119 1.628 0.948 14.238 1.00 41.44 C ATOM 1756 C ALA A 119 0.332 0.200 14.276 1.00 50.34 C ATOM 1757 O ALA A 119 -0.403 0.289 15.259 1.00 62.44 O ATOM 1758 CB ALA A 119 2.677 0.241 15.083 1.00 44.14 C ATOM 0 H ALA A 119 0.625 2.333 15.417 1.00 42.34 H new ATOM 0 HA ALA A 119 2.012 0.994 13.219 1.00 41.44 H new ATOM 0 HB1 ALA A 119 2.848 -0.761 14.688 1.00 44.14 H new ATOM 0 HB2 ALA A 119 3.609 0.806 15.054 1.00 44.14 H new ATOM 0 HB3 ALA A 119 2.327 0.170 16.113 1.00 44.14 H new ATOM 1764 N GLN A 120 0.028 -0.500 13.227 1.00 71.12 N ATOM 1765 CA GLN A 120 -1.210 -1.254 13.170 1.00 24.50 C ATOM 1766 C GLN A 120 -1.033 -2.430 12.229 1.00 60.02 C ATOM 1767 O GLN A 120 -0.329 -2.316 11.226 1.00 34.14 O ATOM 1768 CB GLN A 120 -2.359 -0.348 12.693 1.00 42.41 C ATOM 1769 CG GLN A 120 -3.682 -0.520 13.450 1.00 41.13 C ATOM 1770 CD GLN A 120 -4.261 -1.916 13.378 1.00 40.31 C ATOM 1771 OE1 GLN A 120 -3.953 -2.780 14.217 1.00 73.35 O ATOM 1772 NE2 GLN A 120 -5.096 -2.151 12.410 1.00 13.21 N ATOM 0 H GLN A 120 0.612 -0.572 12.394 1.00 71.12 H new ATOM 0 HA GLN A 120 -1.459 -1.625 14.164 1.00 24.50 H new ATOM 0 HB2 GLN A 120 -2.041 0.691 12.780 1.00 42.41 H new ATOM 0 HB3 GLN A 120 -2.536 -0.540 11.635 1.00 42.41 H new ATOM 0 HG2 GLN A 120 -3.526 -0.257 14.496 1.00 41.13 H new ATOM 0 HG3 GLN A 120 -4.411 0.185 13.050 1.00 41.13 H new ATOM 0 HE21 GLN A 120 -5.322 -1.414 11.742 1.00 13.21 H new ATOM 0 HE22 GLN A 120 -5.525 -3.072 12.319 1.00 13.21 H new ATOM 1781 N VAL A 121 -1.637 -3.543 12.555 1.00 12.41 N ATOM 1782 CA VAL A 121 -1.575 -4.728 11.720 1.00 73.22 C ATOM 1783 C VAL A 121 -2.479 -4.518 10.509 1.00 24.10 C ATOM 1784 O VAL A 121 -3.661 -4.224 10.668 1.00 1.11 O ATOM 1785 CB VAL A 121 -2.061 -5.980 12.494 1.00 22.44 C ATOM 1786 CG1 VAL A 121 -1.928 -7.239 11.643 1.00 34.02 C ATOM 1787 CG2 VAL A 121 -1.307 -6.133 13.804 1.00 20.14 C ATOM 0 H VAL A 121 -2.187 -3.660 13.406 1.00 12.41 H new ATOM 0 HA VAL A 121 -0.541 -4.888 11.414 1.00 73.22 H new ATOM 0 HB VAL A 121 -3.117 -5.841 12.724 1.00 22.44 H new ATOM 0 HG11 VAL A 121 -2.276 -8.101 12.212 1.00 34.02 H new ATOM 0 HG12 VAL A 121 -2.529 -7.133 10.740 1.00 34.02 H new ATOM 0 HG13 VAL A 121 -0.883 -7.384 11.368 1.00 34.02 H new ATOM 0 HG21 VAL A 121 -1.666 -7.018 14.329 1.00 20.14 H new ATOM 0 HG22 VAL A 121 -0.241 -6.239 13.600 1.00 20.14 H new ATOM 0 HG23 VAL A 121 -1.472 -5.252 14.424 1.00 20.14 H new ATOM 1797 N MET A 122 -1.942 -4.677 9.327 1.00 31.34 N ATOM 1798 CA MET A 122 -2.728 -4.463 8.129 1.00 60.04 C ATOM 1799 C MET A 122 -3.394 -5.750 7.706 1.00 40.13 C ATOM 1800 O MET A 122 -2.756 -6.803 7.624 1.00 62.25 O ATOM 1801 CB MET A 122 -1.901 -3.823 6.993 1.00 2.02 C ATOM 1802 CG MET A 122 -0.617 -4.552 6.619 1.00 45.11 C ATOM 1803 SD MET A 122 0.358 -3.649 5.388 1.00 42.42 S ATOM 1804 CE MET A 122 1.774 -4.729 5.190 1.00 32.24 C ATOM 0 H MET A 122 -0.973 -4.951 9.163 1.00 31.34 H new ATOM 0 HA MET A 122 -3.512 -3.742 8.362 1.00 60.04 H new ATOM 0 HB2 MET A 122 -2.530 -3.754 6.105 1.00 2.02 H new ATOM 0 HB3 MET A 122 -1.647 -2.804 7.283 1.00 2.02 H new ATOM 0 HG2 MET A 122 -0.015 -4.704 7.515 1.00 45.11 H new ATOM 0 HG3 MET A 122 -0.864 -5.540 6.229 1.00 45.11 H new ATOM 0 HE1 MET A 122 2.416 -4.345 4.397 1.00 32.24 H new ATOM 0 HE2 MET A 122 2.335 -4.769 6.124 1.00 32.24 H new ATOM 0 HE3 MET A 122 1.434 -5.731 4.928 1.00 32.24 H new ATOM 1814 N GLN A 123 -4.665 -5.659 7.465 1.00 23.51 N ATOM 1815 CA GLN A 123 -5.491 -6.776 7.176 1.00 52.10 C ATOM 1816 C GLN A 123 -5.997 -6.685 5.733 1.00 74.33 C ATOM 1817 O GLN A 123 -6.005 -5.619 5.153 1.00 65.51 O ATOM 1818 CB GLN A 123 -6.637 -6.747 8.175 1.00 44.14 C ATOM 1819 CG GLN A 123 -7.553 -7.919 8.112 1.00 74.24 C ATOM 1820 CD GLN A 123 -8.577 -7.903 9.218 1.00 64.01 C ATOM 1821 OE1 GLN A 123 -8.325 -7.408 10.313 1.00 14.14 O ATOM 1822 NE2 GLN A 123 -9.723 -8.426 8.949 1.00 30.23 N ATOM 0 H GLN A 123 -5.167 -4.771 7.466 1.00 23.51 H new ATOM 0 HA GLN A 123 -4.946 -7.716 7.264 1.00 52.10 H new ATOM 0 HB2 GLN A 123 -6.222 -6.683 9.181 1.00 44.14 H new ATOM 0 HB3 GLN A 123 -7.219 -5.840 8.012 1.00 44.14 H new ATOM 0 HG2 GLN A 123 -8.062 -7.928 7.148 1.00 74.24 H new ATOM 0 HG3 GLN A 123 -6.969 -8.838 8.173 1.00 74.24 H new ATOM 0 HE21 GLN A 123 -9.896 -8.828 8.028 1.00 30.23 H new ATOM 0 HE22 GLN A 123 -10.457 -8.438 9.657 1.00 30.23 H new ATOM 1831 N THR A 124 -6.359 -7.799 5.141 1.00 23.44 N ATOM 1832 CA THR A 124 -6.863 -7.778 3.790 1.00 75.02 C ATOM 1833 C THR A 124 -8.242 -7.055 3.759 1.00 70.40 C ATOM 1834 O THR A 124 -9.152 -7.370 4.535 1.00 70.03 O ATOM 1835 CB THR A 124 -6.905 -9.221 3.162 1.00 34.42 C ATOM 1836 OG1 THR A 124 -7.238 -9.176 1.771 1.00 34.33 O ATOM 1837 CG2 THR A 124 -7.863 -10.151 3.894 1.00 63.21 C ATOM 0 H THR A 124 -6.314 -8.723 5.570 1.00 23.44 H new ATOM 0 HA THR A 124 -6.179 -7.210 3.160 1.00 75.02 H new ATOM 0 HB THR A 124 -5.900 -9.627 3.273 1.00 34.42 H new ATOM 0 HG1 THR A 124 -7.411 -10.084 1.447 1.00 34.33 H new ATOM 0 HG21 THR A 124 -7.852 -11.132 3.419 1.00 63.21 H new ATOM 0 HG22 THR A 124 -7.552 -10.248 4.934 1.00 63.21 H new ATOM 0 HG23 THR A 124 -8.872 -9.740 3.854 1.00 63.21 H new ATOM 1845 N GLY A 125 -8.342 -6.041 2.932 1.00 3.24 N ATOM 1846 CA GLY A 125 -9.543 -5.243 2.858 1.00 72.45 C ATOM 1847 C GLY A 125 -9.394 -3.963 3.663 1.00 43.12 C ATOM 1848 O GLY A 125 -10.321 -3.146 3.740 1.00 61.43 O ATOM 0 H GLY A 125 -7.600 -5.748 2.297 1.00 3.24 H new ATOM 0 HA2 GLY A 125 -9.759 -5.000 1.818 1.00 72.45 H new ATOM 0 HA3 GLY A 125 -10.390 -5.817 3.234 1.00 72.45 H new ATOM 1852 N ASP A 126 -8.234 -3.800 4.271 1.00 10.30 N ATOM 1853 CA ASP A 126 -7.941 -2.634 5.103 1.00 64.42 C ATOM 1854 C ASP A 126 -7.575 -1.471 4.199 1.00 10.33 C ATOM 1855 O ASP A 126 -7.044 -1.679 3.090 1.00 1.12 O ATOM 1856 CB ASP A 126 -6.750 -2.930 6.016 1.00 72.42 C ATOM 1857 CG ASP A 126 -6.662 -2.055 7.236 1.00 1.55 C ATOM 1858 OD1 ASP A 126 -6.725 -0.814 7.119 1.00 53.02 O ATOM 1859 OD2 ASP A 126 -6.584 -2.625 8.344 1.00 20.54 O ATOM 0 H ASP A 126 -7.465 -4.467 4.206 1.00 10.30 H new ATOM 0 HA ASP A 126 -8.815 -2.394 5.709 1.00 64.42 H new ATOM 0 HB2 ASP A 126 -6.804 -3.971 6.335 1.00 72.42 H new ATOM 0 HB3 ASP A 126 -5.831 -2.820 5.440 1.00 72.42 H new ATOM 1864 N GLU A 127 -7.830 -0.276 4.654 1.00 64.55 N ATOM 1865 CA GLU A 127 -7.520 0.888 3.891 1.00 74.31 C ATOM 1866 C GLU A 127 -6.532 1.723 4.652 1.00 30.11 C ATOM 1867 O GLU A 127 -6.787 2.140 5.791 1.00 15.01 O ATOM 1868 CB GLU A 127 -8.755 1.729 3.630 1.00 62.31 C ATOM 1869 CG GLU A 127 -9.841 1.048 2.839 1.00 41.13 C ATOM 1870 CD GLU A 127 -10.978 1.980 2.605 1.00 2.32 C ATOM 1871 OE1 GLU A 127 -11.851 2.095 3.493 1.00 3.23 O ATOM 1872 OE2 GLU A 127 -10.996 2.654 1.565 1.00 42.12 O ATOM 0 H GLU A 127 -8.257 -0.088 5.561 1.00 64.55 H new ATOM 0 HA GLU A 127 -7.110 0.564 2.935 1.00 74.31 H new ATOM 0 HB2 GLU A 127 -9.169 2.044 4.588 1.00 62.31 H new ATOM 0 HB3 GLU A 127 -8.454 2.633 3.100 1.00 62.31 H new ATOM 0 HG2 GLU A 127 -9.443 0.704 1.884 1.00 41.13 H new ATOM 0 HG3 GLU A 127 -10.191 0.166 3.375 1.00 41.13 H new ATOM 1879 N ILE A 128 -5.466 2.024 4.014 1.00 63.12 N ATOM 1880 CA ILE A 128 -4.432 2.822 4.584 1.00 41.43 C ATOM 1881 C ILE A 128 -4.467 4.161 3.872 1.00 63.45 C ATOM 1882 O ILE A 128 -4.519 4.211 2.650 1.00 3.23 O ATOM 1883 CB ILE A 128 -2.994 2.161 4.448 1.00 34.10 C ATOM 1884 CG1 ILE A 128 -2.863 0.826 5.241 1.00 12.13 C ATOM 1885 CG2 ILE A 128 -1.895 3.120 4.891 1.00 4.13 C ATOM 1886 CD1 ILE A 128 -3.600 -0.368 4.653 1.00 12.32 C ATOM 0 H ILE A 128 -5.276 1.719 3.059 1.00 63.12 H new ATOM 0 HA ILE A 128 -4.608 2.927 5.655 1.00 41.43 H new ATOM 0 HB ILE A 128 -2.874 1.935 3.388 1.00 34.10 H new ATOM 0 HG12 ILE A 128 -1.805 0.574 5.319 1.00 12.13 H new ATOM 0 HG13 ILE A 128 -3.227 0.990 6.255 1.00 12.13 H new ATOM 0 HG21 ILE A 128 -0.925 2.635 4.785 1.00 4.13 H new ATOM 0 HG22 ILE A 128 -1.923 4.016 4.271 1.00 4.13 H new ATOM 0 HG23 ILE A 128 -2.051 3.395 5.934 1.00 4.13 H new ATOM 0 HD11 ILE A 128 -3.440 -1.242 5.285 1.00 12.32 H new ATOM 0 HD12 ILE A 128 -4.666 -0.148 4.601 1.00 12.32 H new ATOM 0 HD13 ILE A 128 -3.223 -0.571 3.651 1.00 12.32 H new ATOM 1898 N GLN A 129 -4.491 5.220 4.612 1.00 0.35 N ATOM 1899 CA GLN A 129 -4.546 6.537 4.030 1.00 3.13 C ATOM 1900 C GLN A 129 -3.211 7.218 4.267 1.00 14.03 C ATOM 1901 O GLN A 129 -2.742 7.304 5.410 1.00 53.43 O ATOM 1902 CB GLN A 129 -5.701 7.350 4.654 1.00 35.41 C ATOM 1903 CG GLN A 129 -5.928 8.743 4.069 1.00 63.12 C ATOM 1904 CD GLN A 129 -6.495 8.719 2.669 1.00 52.40 C ATOM 1905 OE1 GLN A 129 -7.215 7.795 2.293 1.00 14.40 O ATOM 1906 NE2 GLN A 129 -6.197 9.729 1.898 1.00 70.21 N ATOM 0 H GLN A 129 -4.473 5.207 5.632 1.00 0.35 H new ATOM 0 HA GLN A 129 -4.735 6.469 2.959 1.00 3.13 H new ATOM 0 HB2 GLN A 129 -6.622 6.777 4.547 1.00 35.41 H new ATOM 0 HB3 GLN A 129 -5.512 7.452 5.723 1.00 35.41 H new ATOM 0 HG2 GLN A 129 -6.606 9.296 4.719 1.00 63.12 H new ATOM 0 HG3 GLN A 129 -4.982 9.285 4.061 1.00 63.12 H new ATOM 0 HE21 GLN A 129 -5.596 10.476 2.246 1.00 70.21 H new ATOM 0 HE22 GLN A 129 -6.565 9.771 0.947 1.00 70.21 H new ATOM 1915 N ILE A 130 -2.585 7.637 3.203 1.00 54.32 N ATOM 1916 CA ILE A 130 -1.318 8.337 3.261 1.00 63.40 C ATOM 1917 C ILE A 130 -1.452 9.600 2.448 1.00 40.53 C ATOM 1918 O ILE A 130 -1.489 9.549 1.225 1.00 65.12 O ATOM 1919 CB ILE A 130 -0.126 7.464 2.729 1.00 15.54 C ATOM 1920 CG1 ILE A 130 0.108 6.251 3.655 1.00 24.22 C ATOM 1921 CG2 ILE A 130 1.157 8.294 2.584 1.00 13.24 C ATOM 1922 CD1 ILE A 130 1.238 5.332 3.224 1.00 45.23 C ATOM 0 H ILE A 130 -2.939 7.504 2.256 1.00 54.32 H new ATOM 0 HA ILE A 130 -1.086 8.565 4.301 1.00 63.40 H new ATOM 0 HB ILE A 130 -0.394 7.099 1.738 1.00 15.54 H new ATOM 0 HG12 ILE A 130 0.317 6.614 4.661 1.00 24.22 H new ATOM 0 HG13 ILE A 130 -0.813 5.671 3.711 1.00 24.22 H new ATOM 0 HG21 ILE A 130 1.962 7.659 2.214 1.00 13.24 H new ATOM 0 HG22 ILE A 130 0.986 9.109 1.881 1.00 13.24 H new ATOM 0 HG23 ILE A 130 1.436 8.705 3.554 1.00 13.24 H new ATOM 0 HD11 ILE A 130 1.328 4.509 3.933 1.00 45.23 H new ATOM 0 HD12 ILE A 130 1.025 4.934 2.232 1.00 45.23 H new ATOM 0 HD13 ILE A 130 2.173 5.892 3.197 1.00 45.23 H new ATOM 1934 N GLY A 131 -1.583 10.715 3.133 1.00 14.22 N ATOM 1935 CA GLY A 131 -1.796 11.971 2.461 1.00 32.13 C ATOM 1936 C GLY A 131 -3.157 11.971 1.822 1.00 55.31 C ATOM 1937 O GLY A 131 -4.178 11.839 2.514 1.00 40.24 O ATOM 0 H GLY A 131 -1.545 10.774 4.151 1.00 14.22 H new ATOM 0 HA2 GLY A 131 -1.715 12.794 3.171 1.00 32.13 H new ATOM 0 HA3 GLY A 131 -1.027 12.126 1.704 1.00 32.13 H new ATOM 1941 N LYS A 132 -3.197 12.068 0.530 1.00 2.11 N ATOM 1942 CA LYS A 132 -4.435 11.992 -0.178 1.00 41.40 C ATOM 1943 C LYS A 132 -4.566 10.655 -0.904 1.00 50.21 C ATOM 1944 O LYS A 132 -5.532 10.415 -1.640 1.00 3.01 O ATOM 1945 CB LYS A 132 -4.663 13.233 -1.084 1.00 34.35 C ATOM 1946 CG LYS A 132 -3.586 13.560 -2.138 1.00 62.32 C ATOM 1947 CD LYS A 132 -3.585 12.608 -3.333 1.00 50.13 C ATOM 1948 CE LYS A 132 -4.890 12.684 -4.134 1.00 1.24 C ATOM 1949 NZ LYS A 132 -5.174 14.041 -4.653 1.00 72.32 N ATOM 0 H LYS A 132 -2.376 12.201 -0.061 1.00 2.11 H new ATOM 0 HA LYS A 132 -5.250 12.022 0.545 1.00 41.40 H new ATOM 0 HB2 LYS A 132 -5.611 13.098 -1.604 1.00 34.35 H new ATOM 0 HB3 LYS A 132 -4.775 14.104 -0.438 1.00 34.35 H new ATOM 0 HG2 LYS A 132 -3.739 14.578 -2.496 1.00 62.32 H new ATOM 0 HG3 LYS A 132 -2.605 13.533 -1.663 1.00 62.32 H new ATOM 0 HD2 LYS A 132 -2.745 12.847 -3.986 1.00 50.13 H new ATOM 0 HD3 LYS A 132 -3.435 11.587 -2.982 1.00 50.13 H new ATOM 0 HE2 LYS A 132 -4.838 11.985 -4.969 1.00 1.24 H new ATOM 0 HE3 LYS A 132 -5.717 12.363 -3.501 1.00 1.24 H new ATOM 0 HZ1 LYS A 132 -5.947 13.993 -5.347 1.00 72.32 H new ATOM 0 HZ2 LYS A 132 -5.453 14.662 -3.867 1.00 72.32 H new ATOM 0 HZ3 LYS A 132 -4.322 14.423 -5.111 1.00 72.32 H new ATOM 1963 N PHE A 133 -3.610 9.781 -0.667 1.00 31.21 N ATOM 1964 CA PHE A 133 -3.623 8.452 -1.232 1.00 41.13 C ATOM 1965 C PHE A 133 -4.430 7.509 -0.380 1.00 61.15 C ATOM 1966 O PHE A 133 -4.241 7.429 0.838 1.00 24.02 O ATOM 1967 CB PHE A 133 -2.216 7.877 -1.380 1.00 64.21 C ATOM 1968 CG PHE A 133 -1.402 8.465 -2.474 1.00 75.13 C ATOM 1969 CD1 PHE A 133 -0.706 9.639 -2.292 1.00 34.30 C ATOM 1970 CD2 PHE A 133 -1.324 7.826 -3.691 1.00 34.11 C ATOM 1971 CE1 PHE A 133 0.055 10.162 -3.307 1.00 12.12 C ATOM 1972 CE2 PHE A 133 -0.564 8.339 -4.706 1.00 12.42 C ATOM 1973 CZ PHE A 133 0.126 9.508 -4.517 1.00 51.14 C ATOM 0 H PHE A 133 -2.802 9.975 -0.076 1.00 31.21 H new ATOM 0 HA PHE A 133 -4.075 8.547 -2.219 1.00 41.13 H new ATOM 0 HB2 PHE A 133 -1.684 8.015 -0.439 1.00 64.21 H new ATOM 0 HB3 PHE A 133 -2.296 6.803 -1.546 1.00 64.21 H new ATOM 0 HD1 PHE A 133 -0.759 10.152 -1.343 1.00 34.30 H new ATOM 0 HD2 PHE A 133 -1.870 6.907 -3.846 1.00 34.11 H new ATOM 0 HE1 PHE A 133 0.597 11.084 -3.157 1.00 12.12 H new ATOM 0 HE2 PHE A 133 -0.508 7.824 -5.654 1.00 12.42 H new ATOM 0 HZ PHE A 133 0.726 9.916 -5.317 1.00 51.14 H new ATOM 1983 N ARG A 134 -5.270 6.762 -1.030 1.00 42.14 N ATOM 1984 CA ARG A 134 -6.072 5.761 -0.387 1.00 4.52 C ATOM 1985 C ARG A 134 -5.523 4.439 -0.876 1.00 63.23 C ATOM 1986 O ARG A 134 -5.499 4.186 -2.088 1.00 75.22 O ATOM 1987 CB ARG A 134 -7.541 5.899 -0.847 1.00 14.12 C ATOM 1988 CG ARG A 134 -8.509 4.890 -0.225 1.00 73.12 C ATOM 1989 CD ARG A 134 -8.982 5.296 1.168 1.00 12.24 C ATOM 1990 NE ARG A 134 -9.924 6.442 1.125 1.00 54.31 N ATOM 1991 CZ ARG A 134 -11.275 6.324 1.241 1.00 30.32 C ATOM 1992 NH1 ARG A 134 -11.839 5.126 1.377 1.00 11.03 N ATOM 1993 NH2 ARG A 134 -12.055 7.394 1.206 1.00 24.14 N ATOM 0 H ARG A 134 -5.421 6.830 -2.036 1.00 42.14 H new ATOM 0 HA ARG A 134 -6.043 5.849 0.699 1.00 4.52 H new ATOM 0 HB2 ARG A 134 -7.887 6.905 -0.611 1.00 14.12 H new ATOM 0 HB3 ARG A 134 -7.578 5.795 -1.931 1.00 14.12 H new ATOM 0 HG2 ARG A 134 -9.375 4.776 -0.877 1.00 73.12 H new ATOM 0 HG3 ARG A 134 -8.023 3.916 -0.168 1.00 73.12 H new ATOM 0 HD2 ARG A 134 -9.467 4.446 1.648 1.00 12.24 H new ATOM 0 HD3 ARG A 134 -8.120 5.559 1.781 1.00 12.24 H new ATOM 0 HE ARG A 134 -9.535 7.377 1.001 1.00 54.31 H new ATOM 0 HH11 ARG A 134 -11.258 4.288 1.395 1.00 11.03 H new ATOM 0 HH12 ARG A 134 -12.852 5.046 1.463 1.00 11.03 H new ATOM 0 HH21 ARG A 134 -11.645 8.321 1.091 1.00 24.14 H new ATOM 0 HH22 ARG A 134 -13.066 7.291 1.294 1.00 24.14 H new ATOM 2007 N LEU A 135 -5.049 3.638 0.025 1.00 63.44 N ATOM 2008 CA LEU A 135 -4.448 2.373 -0.310 1.00 20.30 C ATOM 2009 C LEU A 135 -5.292 1.267 0.251 1.00 44.23 C ATOM 2010 O LEU A 135 -5.803 1.385 1.352 1.00 0.24 O ATOM 2011 CB LEU A 135 -3.050 2.280 0.309 1.00 55.45 C ATOM 2012 CG LEU A 135 -2.088 3.425 0.001 1.00 2.14 C ATOM 2013 CD1 LEU A 135 -0.797 3.262 0.776 1.00 32.54 C ATOM 2014 CD2 LEU A 135 -1.798 3.509 -1.481 1.00 64.44 C ATOM 0 H LEU A 135 -5.065 3.840 1.025 1.00 63.44 H new ATOM 0 HA LEU A 135 -4.376 2.287 -1.394 1.00 20.30 H new ATOM 0 HB2 LEU A 135 -3.161 2.210 1.391 1.00 55.45 H new ATOM 0 HB3 LEU A 135 -2.591 1.350 -0.025 1.00 55.45 H new ATOM 0 HG LEU A 135 -2.568 4.354 0.310 1.00 2.14 H new ATOM 0 HD11 LEU A 135 -0.125 4.088 0.542 1.00 32.54 H new ATOM 0 HD12 LEU A 135 -1.012 3.260 1.845 1.00 32.54 H new ATOM 0 HD13 LEU A 135 -0.323 2.320 0.500 1.00 32.54 H new ATOM 0 HD21 LEU A 135 -1.110 4.333 -1.671 1.00 64.44 H new ATOM 0 HD22 LEU A 135 -1.347 2.575 -1.817 1.00 64.44 H new ATOM 0 HD23 LEU A 135 -2.727 3.679 -2.025 1.00 64.44 H new ATOM 2026 N VAL A 136 -5.451 0.227 -0.492 1.00 31.23 N ATOM 2027 CA VAL A 136 -6.188 -0.925 -0.030 1.00 43.40 C ATOM 2028 C VAL A 136 -5.241 -2.108 0.019 1.00 21.22 C ATOM 2029 O VAL A 136 -4.577 -2.424 -0.975 1.00 62.34 O ATOM 2030 CB VAL A 136 -7.418 -1.250 -0.936 1.00 54.53 C ATOM 2031 CG1 VAL A 136 -8.156 -2.489 -0.435 1.00 5.21 C ATOM 2032 CG2 VAL A 136 -8.374 -0.067 -0.980 1.00 61.22 C ATOM 0 H VAL A 136 -5.079 0.139 -1.438 1.00 31.23 H new ATOM 0 HA VAL A 136 -6.585 -0.708 0.961 1.00 43.40 H new ATOM 0 HB VAL A 136 -7.047 -1.449 -1.942 1.00 54.53 H new ATOM 0 HG11 VAL A 136 -9.008 -2.692 -1.084 1.00 5.21 H new ATOM 0 HG12 VAL A 136 -7.480 -3.344 -0.445 1.00 5.21 H new ATOM 0 HG13 VAL A 136 -8.508 -2.316 0.582 1.00 5.21 H new ATOM 0 HG21 VAL A 136 -9.225 -0.311 -1.616 1.00 61.22 H new ATOM 0 HG22 VAL A 136 -8.725 0.155 0.028 1.00 61.22 H new ATOM 0 HG23 VAL A 136 -7.857 0.804 -1.384 1.00 61.22 H new ATOM 2042 N PHE A 137 -5.141 -2.716 1.163 1.00 1.14 N ATOM 2043 CA PHE A 137 -4.259 -3.843 1.354 1.00 23.23 C ATOM 2044 C PHE A 137 -5.028 -5.130 1.105 1.00 42.50 C ATOM 2045 O PHE A 137 -6.090 -5.332 1.680 1.00 52.55 O ATOM 2046 CB PHE A 137 -3.686 -3.808 2.773 1.00 12.30 C ATOM 2047 CG PHE A 137 -2.731 -4.919 3.089 1.00 60.14 C ATOM 2048 CD1 PHE A 137 -1.466 -4.929 2.546 1.00 43.51 C ATOM 2049 CD2 PHE A 137 -3.101 -5.947 3.933 1.00 33.34 C ATOM 2050 CE1 PHE A 137 -0.587 -5.942 2.840 1.00 21.55 C ATOM 2051 CE2 PHE A 137 -2.228 -6.964 4.234 1.00 64.30 C ATOM 2052 CZ PHE A 137 -0.969 -6.959 3.688 1.00 12.33 C ATOM 0 H PHE A 137 -5.667 -2.449 1.995 1.00 1.14 H new ATOM 0 HA PHE A 137 -3.429 -3.795 0.649 1.00 23.23 H new ATOM 0 HB2 PHE A 137 -3.177 -2.856 2.921 1.00 12.30 H new ATOM 0 HB3 PHE A 137 -4.511 -3.843 3.485 1.00 12.30 H new ATOM 0 HD1 PHE A 137 -1.162 -4.133 1.883 1.00 43.51 H new ATOM 0 HD2 PHE A 137 -4.092 -5.952 4.363 1.00 33.34 H new ATOM 0 HE1 PHE A 137 0.403 -5.942 2.407 1.00 21.55 H new ATOM 0 HE2 PHE A 137 -2.530 -7.762 4.896 1.00 64.30 H new ATOM 0 HZ PHE A 137 -0.276 -7.753 3.923 1.00 12.33 H new ATOM 2062 N LEU A 138 -4.508 -5.983 0.256 1.00 74.40 N ATOM 2063 CA LEU A 138 -5.183 -7.212 -0.104 1.00 22.10 C ATOM 2064 C LEU A 138 -4.229 -8.394 -0.009 1.00 51.41 C ATOM 2065 O LEU A 138 -3.121 -8.360 -0.532 1.00 42.52 O ATOM 2066 CB LEU A 138 -5.740 -7.100 -1.534 1.00 52.10 C ATOM 2067 CG LEU A 138 -6.791 -6.002 -1.768 1.00 71.34 C ATOM 2068 CD1 LEU A 138 -7.092 -5.857 -3.248 1.00 42.14 C ATOM 2069 CD2 LEU A 138 -8.072 -6.312 -1.000 1.00 72.44 C ATOM 0 H LEU A 138 -3.608 -5.848 -0.205 1.00 74.40 H new ATOM 0 HA LEU A 138 -6.006 -7.375 0.592 1.00 22.10 H new ATOM 0 HB2 LEU A 138 -4.906 -6.927 -2.214 1.00 52.10 H new ATOM 0 HB3 LEU A 138 -6.180 -8.059 -1.807 1.00 52.10 H new ATOM 0 HG LEU A 138 -6.384 -5.060 -1.401 1.00 71.34 H new ATOM 0 HD11 LEU A 138 -7.838 -5.075 -3.393 1.00 42.14 H new ATOM 0 HD12 LEU A 138 -6.179 -5.591 -3.781 1.00 42.14 H new ATOM 0 HD13 LEU A 138 -7.476 -6.801 -3.635 1.00 42.14 H new ATOM 0 HD21 LEU A 138 -8.803 -5.524 -1.179 1.00 72.44 H new ATOM 0 HD22 LEU A 138 -8.477 -7.266 -1.338 1.00 72.44 H new ATOM 0 HD23 LEU A 138 -7.852 -6.369 0.066 1.00 72.44 H new ATOM 2081 N ALA A 139 -4.654 -9.427 0.647 1.00 13.55 N ATOM 2082 CA ALA A 139 -3.857 -10.621 0.770 1.00 14.24 C ATOM 2083 C ALA A 139 -4.366 -11.641 -0.214 1.00 31.44 C ATOM 2084 O ALA A 139 -5.542 -11.998 -0.183 1.00 3.24 O ATOM 2085 CB ALA A 139 -3.916 -11.168 2.188 1.00 13.34 C ATOM 0 H ALA A 139 -5.560 -9.474 1.114 1.00 13.55 H new ATOM 0 HA ALA A 139 -2.815 -10.388 0.553 1.00 14.24 H new ATOM 0 HB1 ALA A 139 -3.307 -12.069 2.256 1.00 13.34 H new ATOM 0 HB2 ALA A 139 -3.535 -10.419 2.883 1.00 13.34 H new ATOM 0 HB3 ALA A 139 -4.948 -11.408 2.443 1.00 13.34 H new ATOM 2091 N GLY A 140 -3.511 -12.106 -1.080 1.00 11.44 N ATOM 2092 CA GLY A 140 -3.959 -13.020 -2.083 1.00 62.43 C ATOM 2093 C GLY A 140 -2.845 -13.863 -2.656 1.00 54.02 C ATOM 2094 O GLY A 140 -1.911 -14.242 -1.928 1.00 40.21 O ATOM 0 H GLY A 140 -2.519 -11.871 -1.110 1.00 11.44 H new ATOM 0 HA2 GLY A 140 -4.719 -13.674 -1.656 1.00 62.43 H new ATOM 0 HA3 GLY A 140 -4.435 -12.461 -2.889 1.00 62.43 H new ATOM 2098 N PRO A 141 -2.916 -14.162 -3.959 1.00 1.21 N ATOM 2099 CA PRO A 141 -1.944 -15.013 -4.652 1.00 22.52 C ATOM 2100 C PRO A 141 -0.569 -14.355 -4.806 1.00 54.22 C ATOM 2101 O PRO A 141 -0.463 -13.126 -4.968 1.00 2.54 O ATOM 2102 CB PRO A 141 -2.583 -15.239 -6.034 1.00 42.04 C ATOM 2103 CG PRO A 141 -3.994 -14.787 -5.893 1.00 70.21 C ATOM 2104 CD PRO A 141 -3.964 -13.697 -4.883 1.00 51.23 C ATOM 0 HA PRO A 141 -1.752 -15.929 -4.094 1.00 22.52 H new ATOM 0 HB2 PRO A 141 -2.063 -14.671 -6.805 1.00 42.04 H new ATOM 0 HB3 PRO A 141 -2.533 -16.289 -6.323 1.00 42.04 H new ATOM 0 HG2 PRO A 141 -4.388 -14.430 -6.844 1.00 70.21 H new ATOM 0 HG3 PRO A 141 -4.637 -15.605 -5.568 1.00 70.21 H new ATOM 0 HD2 PRO A 141 -3.716 -12.734 -5.330 1.00 51.23 H new ATOM 0 HD3 PRO A 141 -4.925 -13.578 -4.383 1.00 51.23 H new ATOM 2112 N ALA A 142 0.464 -15.194 -4.757 1.00 25.41 N ATOM 2113 CA ALA A 142 1.882 -14.798 -4.864 1.00 4.24 C ATOM 2114 C ALA A 142 2.747 -16.054 -4.752 1.00 2.13 C ATOM 2115 O ALA A 142 3.890 -16.012 -4.287 1.00 31.42 O ATOM 2116 CB ALA A 142 2.246 -13.839 -3.741 1.00 33.22 C ATOM 0 H ALA A 142 0.342 -16.200 -4.638 1.00 25.41 H new ATOM 0 HA ALA A 142 2.050 -14.302 -5.820 1.00 4.24 H new ATOM 0 HB1 ALA A 142 3.294 -13.554 -3.831 1.00 33.22 H new ATOM 0 HB2 ALA A 142 1.621 -12.948 -3.806 1.00 33.22 H new ATOM 0 HB3 ALA A 142 2.084 -14.326 -2.780 1.00 33.22 H new ATOM 2122 N GLU A 143 2.198 -17.152 -5.201 1.00 43.01 N ATOM 2123 CA GLU A 143 2.824 -18.442 -5.105 1.00 43.23 C ATOM 2124 C GLU A 143 3.005 -18.969 -6.523 1.00 13.05 C ATOM 2125 O GLU A 143 2.080 -19.630 -7.048 1.00 38.23 O ATOM 2126 CB GLU A 143 1.907 -19.378 -4.295 1.00 4.55 C ATOM 2127 CG GLU A 143 2.450 -20.768 -4.016 1.00 44.24 C ATOM 2128 CD GLU A 143 3.541 -20.774 -2.998 1.00 33.15 C ATOM 2129 OE1 GLU A 143 3.227 -20.722 -1.782 1.00 61.51 O ATOM 2130 OE2 GLU A 143 4.716 -20.828 -3.373 1.00 25.24 O ATOM 2131 OXT GLU A 143 4.042 -18.670 -7.152 1.00 38.23 O ATOM 0 H GLU A 143 1.284 -17.174 -5.653 1.00 43.01 H new ATOM 0 HA GLU A 143 3.791 -18.383 -4.605 1.00 43.23 H new ATOM 0 HB2 GLU A 143 1.684 -18.899 -3.342 1.00 4.55 H new ATOM 0 HB3 GLU A 143 0.962 -19.480 -4.829 1.00 4.55 H new ATOM 0 HG2 GLU A 143 1.637 -21.408 -3.673 1.00 44.24 H new ATOM 0 HG3 GLU A 143 2.825 -21.199 -4.945 1.00 44.24 H new TER 2138 GLU A 143