USER MOD reduce.3.24.130724 H: found=0, std=0, add=1350, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1347 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 43 SER OG : rot 165:sc= 0.495 USER MOD Set 1.2: A 156 TYR OH : rot 30:sc= 0.477 USER MOD Set 1.3: A 181 THR OG1 : rot -149:sc= 0.0212 USER MOD Set 2.1: A 60 HIS :FLIP no HD1:sc= 0.184 F(o=0.27,f=2) USER MOD Set 2.2: A 80 HIS : no HD1:sc= 0.871 K(o=2,f=-7.8!) USER MOD Set 2.3: A 83 THR OG1 : rot -95:sc= 1.2 USER MOD Set 2.4: A 96 HIS : no HE2:sc= -0.248 K(o=2,f=-11!) USER MOD Set 3.1: A 51 TYR OH : rot -38:sc= 0.479 USER MOD Set 3.2: A 176 THR OG1 : rot 39:sc= 0.355 USER MOD Set 4.1: A 15 ASN : amide:sc=0.000562 X(o=0.0014,f=0.00032) USER MOD Set 4.2: A 150 TYR OH : rot -13:sc=0.000831 USER MOD Single : A 1 MET CE :methyl -166:sc= -0.014 (180deg=-0.255) USER MOD Single : A 1 MET N :NH3+ 175:sc= 0.605 (180deg=0.483) USER MOD Single : A 5 THR OG1 : rot 81:sc= 1.35 USER MOD Single : A 10 THR OG1 : rot 48:sc= 0.209 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 13 GLN :FLIP amide:sc=-0.00126 F(o=-0.96,f=-0.0013) USER MOD Single : A 19 LYS NZ :NH3+ 135:sc= 0.764 (180deg=-0.332) USER MOD Single : A 24 SER OG : rot 86:sc= 0.485 USER MOD Single : A 26 HIS : no HD1:sc= -2.14! C(o=-2.1!,f=-4.7!) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 165:sc= -0.175 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 46:sc= 0.187 USER MOD Single : A 65 SER OG : rot 37:sc= 0.225 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0761 USER MOD Single : A 71 SER OG : rot -75:sc= 0.953 USER MOD Single : A 75 THR OG1 : rot -112:sc= -0.995 USER MOD Single : A 78 TYR OH : rot 35:sc= 0.267 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN :FLIP amide:sc= 0 F(o=-0.56,f=0) USER MOD Single : A 105 SER OG : rot -42:sc= 0.462 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -119:sc= 0.39 (180deg=0.124) USER MOD Single : A 116 THR OG1 : rot -78:sc= 0.422 USER MOD Single : A 117 THR OG1 : rot 54:sc= 0.187 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 120 GLN : amide:sc=-0.00711 K(o=-0.0071,f=-0.97) USER MOD Single : A 121 SER OG : rot 150:sc=-0.00573 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot -26:sc= 0.361 USER MOD Single : A 128 MET CE :methyl -160:sc= -0.0354 (180deg=-0.886) USER MOD Single : A 137 SER OG : rot -12:sc= 0.506 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -1.81 K(o=-1.8,f=-4.5!) USER MOD Single : A 151 SER OG : rot 42:sc= 0.166 USER MOD Single : A 154 CYS SG : rot -107:sc= -0.877 USER MOD Single : A 157 SER OG : rot 64:sc= 0.348 USER MOD Single : A 159 THR OG1 : rot -26:sc= 0.353 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 CYS SG : rot 180:sc= 0.0467 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= -2.07 K(o=-2.1,f=-6.1!) USER MOD Single : A 173 THR OG1 : rot -150:sc= 0 USER MOD Single : A 185 HIS : no HD1:sc= 0.194 K(o=0.19,f=-2.2) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -19.363 2.719 -13.821 1.00 0.41 N ATOM 2 CA MET A 1 -18.180 1.972 -13.333 1.00 33.32 C ATOM 3 C MET A 1 -17.236 1.632 -14.500 1.00 40.41 C ATOM 4 O MET A 1 -16.058 1.989 -14.467 1.00 50.45 O ATOM 5 CB MET A 1 -18.605 0.689 -12.558 1.00 23.20 C ATOM 6 CG MET A 1 -17.433 -0.166 -12.048 1.00 35.43 C ATOM 7 SD MET A 1 -17.945 -1.528 -10.976 1.00 34.33 S ATOM 8 CE MET A 1 -18.500 -0.656 -9.509 1.00 3.41 C ATOM 0 H1 MET A 1 -20.029 2.866 -13.036 1.00 0.41 H new ATOM 0 H2 MET A 1 -19.061 3.641 -14.196 1.00 0.41 H new ATOM 0 H3 MET A 1 -19.831 2.175 -14.574 1.00 0.41 H new ATOM 0 HA MET A 1 -17.639 2.611 -12.635 1.00 33.32 H new ATOM 0 HB2 MET A 1 -19.222 0.981 -11.708 1.00 23.20 H new ATOM 0 HB3 MET A 1 -19.229 0.076 -13.209 1.00 23.20 H new ATOM 0 HG2 MET A 1 -16.891 -0.571 -12.902 1.00 35.43 H new ATOM 0 HG3 MET A 1 -16.738 0.473 -11.503 1.00 35.43 H new ATOM 0 HE1 MET A 1 -18.606 -1.361 -8.685 1.00 3.41 H new ATOM 0 HE2 MET A 1 -17.769 0.107 -9.241 1.00 3.41 H new ATOM 0 HE3 MET A 1 -19.462 -0.184 -9.709 1.00 3.41 H new ATOM 20 N ASP A 2 -17.781 0.999 -15.558 1.00 60.33 N ATOM 21 CA ASP A 2 -16.988 0.467 -16.703 1.00 51.45 C ATOM 22 C ASP A 2 -16.090 1.534 -17.375 1.00 30.12 C ATOM 23 O ASP A 2 -15.066 1.193 -17.978 1.00 34.22 O ATOM 24 CB ASP A 2 -17.929 -0.160 -17.761 1.00 53.31 C ATOM 25 CG ASP A 2 -18.699 -1.386 -17.232 1.00 31.44 C ATOM 26 OD1 ASP A 2 -18.150 -2.511 -17.270 1.00 40.44 O ATOM 27 OD2 ASP A 2 -19.843 -1.221 -16.753 1.00 24.33 O ATOM 0 H ASP A 2 -18.784 0.838 -15.650 1.00 60.33 H new ATOM 0 HA ASP A 2 -16.325 -0.293 -16.289 1.00 51.45 H new ATOM 0 HB2 ASP A 2 -18.642 0.593 -18.096 1.00 53.31 H new ATOM 0 HB3 ASP A 2 -17.343 -0.454 -18.632 1.00 53.31 H new ATOM 32 N GLU A 3 -16.450 2.812 -17.204 1.00 44.34 N ATOM 33 CA GLU A 3 -15.796 3.957 -17.860 1.00 73.50 C ATOM 34 C GLU A 3 -14.418 4.197 -17.218 1.00 3.04 C ATOM 35 O GLU A 3 -13.393 4.297 -17.904 1.00 44.54 O ATOM 36 CB GLU A 3 -16.663 5.261 -17.717 1.00 33.44 C ATOM 37 CG GLU A 3 -18.202 5.093 -17.853 1.00 53.33 C ATOM 38 CD GLU A 3 -18.866 4.475 -16.602 1.00 62.34 C ATOM 39 OE1 GLU A 3 -18.740 5.062 -15.502 1.00 3.24 O ATOM 40 OE2 GLU A 3 -19.481 3.384 -16.699 1.00 54.42 O ATOM 0 H GLU A 3 -17.220 3.087 -16.594 1.00 44.34 H new ATOM 0 HA GLU A 3 -15.685 3.726 -18.919 1.00 73.50 H new ATOM 0 HB2 GLU A 3 -16.454 5.704 -16.743 1.00 33.44 H new ATOM 0 HB3 GLU A 3 -16.331 5.975 -18.470 1.00 33.44 H new ATOM 0 HG2 GLU A 3 -18.650 6.067 -18.049 1.00 53.33 H new ATOM 0 HG3 GLU A 3 -18.416 4.464 -18.717 1.00 53.33 H new ATOM 47 N ASP A 4 -14.426 4.295 -15.880 1.00 44.34 N ATOM 48 CA ASP A 4 -13.215 4.539 -15.070 1.00 13.33 C ATOM 49 C ASP A 4 -12.432 3.240 -14.848 1.00 53.14 C ATOM 50 O ASP A 4 -11.227 3.285 -14.619 1.00 14.33 O ATOM 51 CB ASP A 4 -13.587 5.168 -13.694 1.00 61.31 C ATOM 52 CG ASP A 4 -14.509 4.269 -12.841 1.00 15.44 C ATOM 53 OD1 ASP A 4 -14.005 3.405 -12.076 1.00 35.33 O ATOM 54 OD2 ASP A 4 -15.744 4.418 -12.939 1.00 12.14 O ATOM 0 H ASP A 4 -15.276 4.207 -15.323 1.00 44.34 H new ATOM 0 HA ASP A 4 -12.586 5.238 -15.621 1.00 13.33 H new ATOM 0 HB2 ASP A 4 -12.673 5.372 -13.136 1.00 61.31 H new ATOM 0 HB3 ASP A 4 -14.079 6.126 -13.861 1.00 61.31 H new ATOM 59 N THR A 5 -13.138 2.092 -14.889 1.00 22.30 N ATOM 60 CA THR A 5 -12.561 0.782 -14.546 1.00 34.23 C ATOM 61 C THR A 5 -11.748 0.190 -15.709 1.00 22.04 C ATOM 62 O THR A 5 -10.757 -0.501 -15.473 1.00 60.12 O ATOM 63 CB THR A 5 -13.676 -0.196 -14.066 1.00 21.23 C ATOM 64 OG1 THR A 5 -14.425 0.445 -13.024 1.00 64.40 O ATOM 65 CG2 THR A 5 -13.119 -1.519 -13.512 1.00 73.52 C ATOM 0 H THR A 5 -14.120 2.050 -15.160 1.00 22.30 H new ATOM 0 HA THR A 5 -11.862 0.930 -13.723 1.00 34.23 H new ATOM 0 HB THR A 5 -14.293 -0.434 -14.932 1.00 21.23 H new ATOM 0 HG1 THR A 5 -15.079 1.058 -13.421 1.00 64.40 H new ATOM 0 HG21 THR A 5 -13.944 -2.157 -13.195 1.00 73.52 H new ATOM 0 HG22 THR A 5 -12.546 -2.026 -14.289 1.00 73.52 H new ATOM 0 HG23 THR A 5 -12.471 -1.313 -12.660 1.00 73.52 H new ATOM 73 N GLU A 6 -12.159 0.464 -16.968 1.00 71.51 N ATOM 74 CA GLU A 6 -11.340 0.109 -18.156 1.00 74.41 C ATOM 75 C GLU A 6 -9.994 0.872 -18.135 1.00 63.33 C ATOM 76 O GLU A 6 -8.957 0.342 -18.559 1.00 25.21 O ATOM 77 CB GLU A 6 -12.100 0.385 -19.480 1.00 3.12 C ATOM 78 CG GLU A 6 -12.414 1.873 -19.762 1.00 40.33 C ATOM 79 CD GLU A 6 -13.183 2.149 -21.067 1.00 43.31 C ATOM 80 OE1 GLU A 6 -13.536 1.198 -21.801 1.00 63.13 O ATOM 81 OE2 GLU A 6 -13.432 3.335 -21.366 1.00 63.01 O ATOM 0 H GLU A 6 -13.042 0.924 -17.189 1.00 71.51 H new ATOM 0 HA GLU A 6 -11.139 -0.961 -18.108 1.00 74.41 H new ATOM 0 HB2 GLU A 6 -11.510 -0.008 -20.308 1.00 3.12 H new ATOM 0 HB3 GLU A 6 -13.037 -0.171 -19.465 1.00 3.12 H new ATOM 0 HG2 GLU A 6 -12.993 2.269 -18.928 1.00 40.33 H new ATOM 0 HG3 GLU A 6 -11.475 2.426 -19.789 1.00 40.33 H new ATOM 88 N ASP A 7 -10.032 2.115 -17.611 1.00 22.10 N ATOM 89 CA ASP A 7 -8.836 2.962 -17.428 1.00 41.51 C ATOM 90 C ASP A 7 -8.016 2.482 -16.214 1.00 73.33 C ATOM 91 O ASP A 7 -6.783 2.554 -16.214 1.00 32.12 O ATOM 92 CB ASP A 7 -9.241 4.448 -17.263 1.00 53.52 C ATOM 93 CG ASP A 7 -8.020 5.376 -17.127 1.00 62.34 C ATOM 94 OD1 ASP A 7 -7.399 5.710 -18.160 1.00 44.33 O ATOM 95 OD2 ASP A 7 -7.663 5.754 -15.987 1.00 22.03 O ATOM 0 H ASP A 7 -10.896 2.560 -17.302 1.00 22.10 H new ATOM 0 HA ASP A 7 -8.213 2.876 -18.318 1.00 41.51 H new ATOM 0 HB2 ASP A 7 -9.836 4.758 -18.122 1.00 53.52 H new ATOM 0 HB3 ASP A 7 -9.875 4.554 -16.382 1.00 53.52 H new ATOM 100 N TRP A 8 -8.727 2.027 -15.179 1.00 0.31 N ATOM 101 CA TRP A 8 -8.127 1.349 -14.019 1.00 21.31 C ATOM 102 C TRP A 8 -7.356 0.092 -14.471 1.00 65.33 C ATOM 103 O TRP A 8 -6.332 -0.236 -13.893 1.00 22.45 O ATOM 104 CB TRP A 8 -9.223 1.009 -12.973 1.00 11.15 C ATOM 105 CG TRP A 8 -8.780 0.113 -11.832 1.00 4.23 C ATOM 106 CD1 TRP A 8 -8.018 0.457 -10.745 1.00 14.43 C ATOM 107 CD2 TRP A 8 -9.097 -1.282 -11.668 1.00 2.15 C ATOM 108 NE1 TRP A 8 -7.847 -0.635 -9.935 1.00 22.20 N ATOM 109 CE2 TRP A 8 -8.506 -1.708 -10.472 1.00 12.44 C ATOM 110 CE3 TRP A 8 -9.830 -2.203 -12.425 1.00 20.33 C ATOM 111 CZ2 TRP A 8 -8.624 -3.021 -10.009 1.00 31.32 C ATOM 112 CZ3 TRP A 8 -9.952 -3.499 -11.968 1.00 22.53 C ATOM 113 CH2 TRP A 8 -9.355 -3.898 -10.764 1.00 14.05 C ATOM 0 H TRP A 8 -9.741 2.117 -15.119 1.00 0.31 H new ATOM 0 HA TRP A 8 -7.410 2.018 -13.543 1.00 21.31 H new ATOM 0 HB2 TRP A 8 -9.603 1.941 -12.554 1.00 11.15 H new ATOM 0 HB3 TRP A 8 -10.055 0.528 -13.487 1.00 11.15 H new ATOM 0 HD1 TRP A 8 -7.614 1.440 -10.556 1.00 14.43 H new ATOM 0 HE1 TRP A 8 -7.312 -0.647 -9.067 1.00 22.20 H new ATOM 0 HE3 TRP A 8 -10.293 -1.904 -13.353 1.00 20.33 H new ATOM 0 HZ2 TRP A 8 -8.155 -3.333 -9.088 1.00 31.32 H new ATOM 0 HZ3 TRP A 8 -10.515 -4.216 -12.546 1.00 22.53 H new ATOM 0 HH2 TRP A 8 -9.474 -4.917 -10.426 1.00 14.05 H new ATOM 124 N GLU A 9 -7.850 -0.584 -15.526 1.00 11.40 N ATOM 125 CA GLU A 9 -7.158 -1.739 -16.141 1.00 51.44 C ATOM 126 C GLU A 9 -5.981 -1.284 -17.019 1.00 14.13 C ATOM 127 O GLU A 9 -4.997 -2.022 -17.149 1.00 13.03 O ATOM 128 CB GLU A 9 -8.146 -2.590 -16.967 1.00 42.44 C ATOM 129 CG GLU A 9 -9.267 -3.230 -16.133 1.00 73.32 C ATOM 130 CD GLU A 9 -10.277 -3.985 -16.997 1.00 53.42 C ATOM 131 OE1 GLU A 9 -11.157 -3.340 -17.601 1.00 40.45 O ATOM 132 OE2 GLU A 9 -10.190 -5.227 -17.086 1.00 33.45 O ATOM 0 H GLU A 9 -8.735 -0.349 -15.976 1.00 11.40 H new ATOM 0 HA GLU A 9 -6.758 -2.353 -15.334 1.00 51.44 H new ATOM 0 HB2 GLU A 9 -8.593 -1.963 -17.738 1.00 42.44 H new ATOM 0 HB3 GLU A 9 -7.592 -3.378 -17.478 1.00 42.44 H new ATOM 0 HG2 GLU A 9 -8.830 -3.915 -15.407 1.00 73.32 H new ATOM 0 HG3 GLU A 9 -9.784 -2.454 -15.568 1.00 73.32 H new ATOM 139 N THR A 10 -6.087 -0.072 -17.601 1.00 5.41 N ATOM 140 CA THR A 10 -5.011 0.533 -18.413 1.00 62.24 C ATOM 141 C THR A 10 -3.770 0.787 -17.538 1.00 21.21 C ATOM 142 O THR A 10 -2.656 0.354 -17.871 1.00 62.54 O ATOM 143 CB THR A 10 -5.480 1.882 -19.054 1.00 34.44 C ATOM 144 OG1 THR A 10 -6.707 1.685 -19.772 1.00 61.14 O ATOM 145 CG2 THR A 10 -4.430 2.482 -20.008 1.00 54.32 C ATOM 0 H THR A 10 -6.918 0.514 -17.522 1.00 5.41 H new ATOM 0 HA THR A 10 -4.761 -0.164 -19.213 1.00 62.24 H new ATOM 0 HB THR A 10 -5.626 2.585 -18.234 1.00 34.44 H new ATOM 0 HG1 THR A 10 -7.337 1.185 -19.212 1.00 61.14 H new ATOM 0 HG21 THR A 10 -4.808 3.416 -20.424 1.00 54.32 H new ATOM 0 HG22 THR A 10 -3.508 2.676 -19.459 1.00 54.32 H new ATOM 0 HG23 THR A 10 -4.230 1.780 -20.817 1.00 54.32 H new ATOM 153 N GLN A 11 -3.983 1.495 -16.411 1.00 15.23 N ATOM 154 CA GLN A 11 -2.929 1.738 -15.418 1.00 33.34 C ATOM 155 C GLN A 11 -2.457 0.417 -14.780 1.00 73.30 C ATOM 156 O GLN A 11 -1.301 0.320 -14.409 1.00 35.14 O ATOM 157 CB GLN A 11 -3.400 2.732 -14.315 1.00 73.20 C ATOM 158 CG GLN A 11 -4.395 2.149 -13.289 1.00 40.52 C ATOM 159 CD GLN A 11 -4.903 3.139 -12.237 1.00 21.24 C ATOM 160 OE1 GLN A 11 -4.996 4.340 -12.478 1.00 61.14 O ATOM 161 NE2 GLN A 11 -5.262 2.638 -11.063 1.00 22.41 N ATOM 0 H GLN A 11 -4.883 1.909 -16.169 1.00 15.23 H new ATOM 0 HA GLN A 11 -2.088 2.191 -15.943 1.00 33.34 H new ATOM 0 HB2 GLN A 11 -2.524 3.099 -13.780 1.00 73.20 H new ATOM 0 HB3 GLN A 11 -3.862 3.593 -14.797 1.00 73.20 H new ATOM 0 HG2 GLN A 11 -5.252 1.744 -13.828 1.00 40.52 H new ATOM 0 HG3 GLN A 11 -3.917 1.314 -12.777 1.00 40.52 H new ATOM 0 HE21 GLN A 11 -5.175 1.637 -10.888 1.00 22.41 H new ATOM 0 HE22 GLN A 11 -5.625 3.254 -10.335 1.00 22.41 H new ATOM 170 N LEU A 12 -3.363 -0.595 -14.683 1.00 23.00 N ATOM 171 CA LEU A 12 -3.116 -1.839 -13.912 1.00 24.43 C ATOM 172 C LEU A 12 -2.208 -2.834 -14.650 1.00 24.30 C ATOM 173 O LEU A 12 -1.344 -3.448 -14.019 1.00 1.24 O ATOM 174 CB LEU A 12 -4.451 -2.510 -13.525 1.00 2.13 C ATOM 175 CG LEU A 12 -4.380 -3.851 -12.729 1.00 31.33 C ATOM 176 CD1 LEU A 12 -3.451 -3.756 -11.498 1.00 33.22 C ATOM 177 CD2 LEU A 12 -5.795 -4.304 -12.326 1.00 34.44 C ATOM 0 H LEU A 12 -4.277 -0.569 -15.135 1.00 23.00 H new ATOM 0 HA LEU A 12 -2.584 -1.544 -13.007 1.00 24.43 H new ATOM 0 HB2 LEU A 12 -5.026 -1.798 -12.933 1.00 2.13 H new ATOM 0 HB3 LEU A 12 -5.014 -2.692 -14.441 1.00 2.13 H new ATOM 0 HG LEU A 12 -3.944 -4.602 -13.387 1.00 31.33 H new ATOM 0 HD11 LEU A 12 -3.436 -4.714 -10.979 1.00 33.22 H new ATOM 0 HD12 LEU A 12 -2.442 -3.503 -11.823 1.00 33.22 H new ATOM 0 HD13 LEU A 12 -3.819 -2.983 -10.823 1.00 33.22 H new ATOM 0 HD21 LEU A 12 -5.733 -5.240 -11.771 1.00 34.44 H new ATOM 0 HD22 LEU A 12 -6.257 -3.541 -11.699 1.00 34.44 H new ATOM 0 HD23 LEU A 12 -6.399 -4.452 -13.222 1.00 34.44 H new ATOM 189 N GLN A 13 -2.424 -3.031 -15.956 1.00 23.22 N ATOM 190 CA GLN A 13 -1.541 -3.891 -16.780 1.00 72.10 C ATOM 191 C GLN A 13 -0.086 -3.369 -16.747 1.00 4.33 C ATOM 192 O GLN A 13 0.860 -4.159 -16.774 1.00 54.14 O ATOM 193 CB GLN A 13 -2.083 -3.991 -18.224 1.00 71.25 C ATOM 194 CG GLN A 13 -2.302 -2.633 -18.925 1.00 41.21 C ATOM 195 CD GLN A 13 -3.113 -2.706 -20.222 1.00 5.41 C ATOM 196 OE1 GLN A 13 -4.073 -3.627 -20.297 1.00 21.54 O flip ATOM 197 NE2 GLN A 13 -2.902 -1.913 -21.140 1.00 10.12 N flip ATOM 0 H GLN A 13 -3.198 -2.612 -16.471 1.00 23.22 H new ATOM 0 HA GLN A 13 -1.535 -4.896 -16.359 1.00 72.10 H new ATOM 0 HB2 GLN A 13 -1.388 -4.584 -18.819 1.00 71.25 H new ATOM 0 HB3 GLN A 13 -3.029 -4.532 -18.206 1.00 71.25 H new ATOM 0 HG2 GLN A 13 -2.808 -1.960 -18.233 1.00 41.21 H new ATOM 0 HG3 GLN A 13 -1.330 -2.192 -19.145 1.00 41.21 H new ATOM 0 HE21 GLN A 13 -2.160 -1.219 -21.054 1.00 10.12 H new ATOM 0 HE22 GLN A 13 -3.470 -1.950 -21.987 1.00 10.12 H new ATOM 206 N ALA A 14 0.066 -2.037 -16.648 1.00 61.43 N ATOM 207 CA ALA A 14 1.372 -1.389 -16.440 1.00 72.34 C ATOM 208 C ALA A 14 1.818 -1.514 -14.965 1.00 70.23 C ATOM 209 O ALA A 14 2.992 -1.744 -14.693 1.00 44.14 O ATOM 210 CB ALA A 14 1.292 0.086 -16.849 1.00 43.35 C ATOM 0 H ALA A 14 -0.712 -1.380 -16.710 1.00 61.43 H new ATOM 0 HA ALA A 14 2.113 -1.892 -17.062 1.00 72.34 H new ATOM 0 HB1 ALA A 14 2.261 0.560 -16.693 1.00 43.35 H new ATOM 0 HB2 ALA A 14 1.019 0.157 -17.902 1.00 43.35 H new ATOM 0 HB3 ALA A 14 0.539 0.591 -16.244 1.00 43.35 H new ATOM 216 N ASN A 15 0.841 -1.366 -14.045 1.00 13.44 N ATOM 217 CA ASN A 15 1.044 -1.335 -12.571 1.00 54.13 C ATOM 218 C ASN A 15 1.706 -2.627 -12.085 1.00 44.21 C ATOM 219 O ASN A 15 2.845 -2.618 -11.627 1.00 31.33 O ATOM 220 CB ASN A 15 -0.330 -1.142 -11.855 1.00 72.32 C ATOM 221 CG ASN A 15 -0.260 -0.454 -10.498 1.00 3.21 C ATOM 222 OD1 ASN A 15 -0.006 -1.085 -9.474 1.00 24.35 O ATOM 223 ND2 ASN A 15 -0.525 0.847 -10.484 1.00 11.30 N ATOM 0 H ASN A 15 -0.139 -1.262 -14.309 1.00 13.44 H new ATOM 0 HA ASN A 15 1.702 -0.500 -12.329 1.00 54.13 H new ATOM 0 HB2 ASN A 15 -0.983 -0.561 -12.506 1.00 72.32 H new ATOM 0 HB3 ASN A 15 -0.795 -2.119 -11.726 1.00 72.32 H new ATOM 0 HD21 ASN A 15 -0.522 1.359 -9.602 1.00 11.30 H new ATOM 0 HD22 ASN A 15 -0.731 1.335 -11.356 1.00 11.30 H new ATOM 230 N ARG A 16 0.975 -3.745 -12.236 1.00 13.50 N ATOM 231 CA ARG A 16 1.420 -5.086 -11.807 1.00 22.43 C ATOM 232 C ARG A 16 2.800 -5.444 -12.415 1.00 13.33 C ATOM 233 O ARG A 16 3.617 -6.098 -11.771 1.00 72.32 O ATOM 234 CB ARG A 16 0.351 -6.148 -12.210 1.00 74.41 C ATOM 235 CG ARG A 16 0.176 -6.331 -13.737 1.00 43.14 C ATOM 236 CD ARG A 16 -0.865 -7.392 -14.108 1.00 5.11 C ATOM 237 NE ARG A 16 -2.238 -6.977 -13.767 1.00 22.33 N ATOM 238 CZ ARG A 16 -3.304 -7.795 -13.736 1.00 61.50 C ATOM 239 NH1 ARG A 16 -3.181 -9.093 -14.002 1.00 23.10 N ATOM 240 NH2 ARG A 16 -4.498 -7.302 -13.471 1.00 65.42 N ATOM 0 H ARG A 16 0.049 -3.745 -12.663 1.00 13.50 H new ATOM 0 HA ARG A 16 1.531 -5.082 -10.723 1.00 22.43 H new ATOM 0 HB2 ARG A 16 0.625 -7.107 -11.770 1.00 74.41 H new ATOM 0 HB3 ARG A 16 -0.608 -5.862 -11.778 1.00 74.41 H new ATOM 0 HG2 ARG A 16 -0.115 -5.378 -14.179 1.00 43.14 H new ATOM 0 HG3 ARG A 16 1.136 -6.606 -14.175 1.00 43.14 H new ATOM 0 HD2 ARG A 16 -0.805 -7.597 -15.177 1.00 5.11 H new ATOM 0 HD3 ARG A 16 -0.631 -8.323 -13.591 1.00 5.11 H new ATOM 0 HE ARG A 16 -2.390 -5.995 -13.537 1.00 22.33 H new ATOM 0 HH11 ARG A 16 -2.267 -9.482 -14.234 1.00 23.10 H new ATOM 0 HH12 ARG A 16 -4.001 -9.699 -13.974 1.00 23.10 H new ATOM 0 HH21 ARG A 16 -4.609 -6.304 -13.291 1.00 65.42 H new ATOM 0 HH22 ARG A 16 -5.310 -7.918 -13.446 1.00 65.42 H new ATOM 254 N ASP A 17 3.028 -4.961 -13.650 1.00 23.35 N ATOM 255 CA ASP A 17 4.224 -5.251 -14.450 1.00 43.33 C ATOM 256 C ASP A 17 5.459 -4.481 -13.924 1.00 74.01 C ATOM 257 O ASP A 17 6.546 -5.061 -13.779 1.00 52.21 O ATOM 258 CB ASP A 17 3.908 -4.895 -15.931 1.00 62.54 C ATOM 259 CG ASP A 17 4.941 -5.387 -16.958 1.00 4.30 C ATOM 260 OD1 ASP A 17 5.397 -6.540 -16.845 1.00 22.30 O ATOM 261 OD2 ASP A 17 5.251 -4.644 -17.920 1.00 42.44 O ATOM 0 H ASP A 17 2.369 -4.345 -14.127 1.00 23.35 H new ATOM 0 HA ASP A 17 4.476 -6.309 -14.373 1.00 43.33 H new ATOM 0 HB2 ASP A 17 2.935 -5.314 -16.189 1.00 62.54 H new ATOM 0 HB3 ASP A 17 3.822 -3.812 -16.017 1.00 62.54 H new ATOM 266 N GLU A 18 5.277 -3.177 -13.621 1.00 64.44 N ATOM 267 CA GLU A 18 6.370 -2.306 -13.137 1.00 5.30 C ATOM 268 C GLU A 18 6.694 -2.602 -11.656 1.00 13.22 C ATOM 269 O GLU A 18 7.861 -2.549 -11.258 1.00 3.31 O ATOM 270 CB GLU A 18 6.029 -0.799 -13.358 1.00 51.02 C ATOM 271 CG GLU A 18 4.863 -0.246 -12.510 1.00 2.10 C ATOM 272 CD GLU A 18 4.437 1.182 -12.890 1.00 71.12 C ATOM 273 OE1 GLU A 18 5.099 2.146 -12.457 1.00 20.33 O ATOM 274 OE2 GLU A 18 3.444 1.347 -13.638 1.00 33.12 O ATOM 0 H GLU A 18 4.378 -2.703 -13.704 1.00 64.44 H new ATOM 0 HA GLU A 18 7.263 -2.527 -13.722 1.00 5.30 H new ATOM 0 HB2 GLU A 18 6.920 -0.209 -13.146 1.00 51.02 H new ATOM 0 HB3 GLU A 18 5.791 -0.650 -14.411 1.00 51.02 H new ATOM 0 HG2 GLU A 18 4.005 -0.910 -12.614 1.00 2.10 H new ATOM 0 HG3 GLU A 18 5.152 -0.261 -11.459 1.00 2.10 H new ATOM 281 N LYS A 19 5.653 -2.937 -10.858 1.00 53.12 N ATOM 282 CA LYS A 19 5.811 -3.329 -9.434 1.00 40.23 C ATOM 283 C LYS A 19 6.545 -4.678 -9.322 1.00 62.15 C ATOM 284 O LYS A 19 7.379 -4.865 -8.425 1.00 32.34 O ATOM 285 CB LYS A 19 4.433 -3.388 -8.690 1.00 33.34 C ATOM 286 CG LYS A 19 3.925 -2.044 -8.094 1.00 43.42 C ATOM 287 CD LYS A 19 3.593 -0.973 -9.149 1.00 65.15 C ATOM 288 CE LYS A 19 2.964 0.293 -8.549 1.00 24.53 C ATOM 289 NZ LYS A 19 3.868 0.965 -7.589 1.00 74.44 N ATOM 0 H LYS A 19 4.685 -2.944 -11.179 1.00 53.12 H new ATOM 0 HA LYS A 19 6.413 -2.561 -8.948 1.00 40.23 H new ATOM 0 HB2 LYS A 19 3.682 -3.762 -9.386 1.00 33.34 H new ATOM 0 HB3 LYS A 19 4.509 -4.116 -7.882 1.00 33.34 H new ATOM 0 HG2 LYS A 19 3.034 -2.238 -7.496 1.00 43.42 H new ATOM 0 HG3 LYS A 19 4.683 -1.649 -7.418 1.00 43.42 H new ATOM 0 HD2 LYS A 19 4.505 -0.701 -9.680 1.00 65.15 H new ATOM 0 HD3 LYS A 19 2.910 -1.397 -9.885 1.00 65.15 H new ATOM 0 HE2 LYS A 19 2.709 0.985 -9.351 1.00 24.53 H new ATOM 0 HE3 LYS A 19 2.033 0.031 -8.046 1.00 24.53 H new ATOM 0 HZ1 LYS A 19 3.868 1.989 -7.771 1.00 74.44 H new ATOM 0 HZ2 LYS A 19 3.539 0.786 -6.619 1.00 74.44 H new ATOM 0 HZ3 LYS A 19 4.833 0.593 -7.702 1.00 74.44 H new ATOM 303 N ASP A 20 6.224 -5.602 -10.246 1.00 32.25 N ATOM 304 CA ASP A 20 6.872 -6.927 -10.327 1.00 51.12 C ATOM 305 C ASP A 20 8.386 -6.779 -10.547 1.00 43.34 C ATOM 306 O ASP A 20 9.194 -7.377 -9.825 1.00 22.12 O ATOM 307 CB ASP A 20 6.235 -7.774 -11.460 1.00 72.12 C ATOM 308 CG ASP A 20 6.950 -9.116 -11.703 1.00 51.43 C ATOM 309 OD1 ASP A 20 6.757 -10.057 -10.904 1.00 12.24 O ATOM 310 OD2 ASP A 20 7.725 -9.224 -12.679 1.00 34.13 O ATOM 0 H ASP A 20 5.509 -5.453 -10.958 1.00 32.25 H new ATOM 0 HA ASP A 20 6.715 -7.444 -9.380 1.00 51.12 H new ATOM 0 HB2 ASP A 20 5.191 -7.967 -11.214 1.00 72.12 H new ATOM 0 HB3 ASP A 20 6.243 -7.195 -12.384 1.00 72.12 H new ATOM 315 N ARG A 21 8.765 -5.930 -11.521 1.00 24.35 N ATOM 316 CA ARG A 21 10.184 -5.731 -11.875 1.00 23.24 C ATOM 317 C ARG A 21 10.859 -4.725 -10.927 1.00 72.44 C ATOM 318 O ARG A 21 12.069 -4.566 -10.975 1.00 52.35 O ATOM 319 CB ARG A 21 10.362 -5.304 -13.350 1.00 61.10 C ATOM 320 CG ARG A 21 9.778 -3.932 -13.726 1.00 13.53 C ATOM 321 CD ARG A 21 10.085 -3.545 -15.183 1.00 0.01 C ATOM 322 NE ARG A 21 9.615 -4.572 -16.134 1.00 75.24 N ATOM 323 CZ ARG A 21 8.471 -4.517 -16.827 1.00 34.13 C ATOM 324 NH1 ARG A 21 7.648 -3.480 -16.701 1.00 71.35 N ATOM 325 NH2 ARG A 21 8.151 -5.505 -17.645 1.00 51.44 N ATOM 0 H ARG A 21 8.113 -5.374 -12.074 1.00 24.35 H new ATOM 0 HA ARG A 21 10.678 -6.695 -11.756 1.00 23.24 H new ATOM 0 HB2 ARG A 21 11.427 -5.300 -13.581 1.00 61.10 H new ATOM 0 HB3 ARG A 21 9.901 -6.060 -13.985 1.00 61.10 H new ATOM 0 HG2 ARG A 21 8.698 -3.946 -13.576 1.00 13.53 H new ATOM 0 HG3 ARG A 21 10.183 -3.172 -13.058 1.00 13.53 H new ATOM 0 HD2 ARG A 21 9.610 -2.592 -15.414 1.00 0.01 H new ATOM 0 HD3 ARG A 21 11.159 -3.403 -15.303 1.00 0.01 H new ATOM 0 HE ARG A 21 10.210 -5.389 -16.274 1.00 75.24 H new ATOM 0 HH11 ARG A 21 7.885 -2.714 -16.071 1.00 71.35 H new ATOM 0 HH12 ARG A 21 6.779 -3.450 -17.235 1.00 71.35 H new ATOM 0 HH21 ARG A 21 8.775 -6.306 -17.746 1.00 51.44 H new ATOM 0 HH22 ARG A 21 7.280 -5.467 -18.175 1.00 51.44 H new ATOM 339 N PHE A 22 10.074 -4.029 -10.093 1.00 22.31 N ATOM 340 CA PHE A 22 10.617 -3.245 -8.962 1.00 4.13 C ATOM 341 C PHE A 22 11.249 -4.198 -7.924 1.00 64.54 C ATOM 342 O PHE A 22 12.279 -3.889 -7.319 1.00 13.12 O ATOM 343 CB PHE A 22 9.493 -2.397 -8.324 1.00 21.03 C ATOM 344 CG PHE A 22 9.944 -1.386 -7.260 1.00 60.54 C ATOM 345 CD1 PHE A 22 10.037 -1.747 -5.922 1.00 23.43 C ATOM 346 CD2 PHE A 22 10.251 -0.069 -7.603 1.00 60.02 C ATOM 347 CE1 PHE A 22 10.422 -0.836 -4.966 1.00 13.21 C ATOM 348 CE2 PHE A 22 10.630 0.847 -6.643 1.00 33.20 C ATOM 349 CZ PHE A 22 10.715 0.464 -5.323 1.00 14.21 C ATOM 0 H PHE A 22 9.058 -3.990 -10.176 1.00 22.31 H new ATOM 0 HA PHE A 22 11.391 -2.569 -9.324 1.00 4.13 H new ATOM 0 HB2 PHE A 22 8.977 -1.856 -9.117 1.00 21.03 H new ATOM 0 HB3 PHE A 22 8.766 -3.072 -7.872 1.00 21.03 H new ATOM 0 HD1 PHE A 22 9.803 -2.759 -5.627 1.00 23.43 H new ATOM 0 HD2 PHE A 22 10.191 0.239 -8.637 1.00 60.02 H new ATOM 0 HE1 PHE A 22 10.495 -1.140 -3.932 1.00 13.21 H new ATOM 0 HE2 PHE A 22 10.860 1.863 -6.927 1.00 33.20 H new ATOM 0 HZ PHE A 22 11.010 1.179 -4.569 1.00 14.21 H new ATOM 359 N PHE A 23 10.604 -5.360 -7.742 1.00 54.33 N ATOM 360 CA PHE A 23 11.039 -6.406 -6.790 1.00 74.15 C ATOM 361 C PHE A 23 12.037 -7.399 -7.423 1.00 2.21 C ATOM 362 O PHE A 23 12.591 -8.237 -6.707 1.00 22.15 O ATOM 363 CB PHE A 23 9.797 -7.166 -6.230 1.00 13.32 C ATOM 364 CG PHE A 23 9.037 -6.439 -5.112 1.00 51.01 C ATOM 365 CD1 PHE A 23 8.659 -5.099 -5.237 1.00 4.01 C ATOM 366 CD2 PHE A 23 8.711 -7.102 -3.929 1.00 54.21 C ATOM 367 CE1 PHE A 23 7.978 -4.456 -4.218 1.00 75.25 C ATOM 368 CE2 PHE A 23 8.036 -6.458 -2.914 1.00 10.31 C ATOM 369 CZ PHE A 23 7.669 -5.139 -3.056 1.00 1.11 C ATOM 0 H PHE A 23 9.757 -5.607 -8.254 1.00 54.33 H new ATOM 0 HA PHE A 23 11.561 -5.908 -5.973 1.00 74.15 H new ATOM 0 HB2 PHE A 23 9.107 -7.358 -7.052 1.00 13.32 H new ATOM 0 HB3 PHE A 23 10.123 -8.136 -5.855 1.00 13.32 H new ATOM 0 HD1 PHE A 23 8.901 -4.559 -6.140 1.00 4.01 H new ATOM 0 HD2 PHE A 23 8.992 -8.137 -3.806 1.00 54.21 H new ATOM 0 HE1 PHE A 23 7.688 -3.422 -4.330 1.00 75.25 H new ATOM 0 HE2 PHE A 23 7.795 -6.990 -2.005 1.00 10.31 H new ATOM 0 HZ PHE A 23 7.139 -4.637 -2.260 1.00 1.11 H new ATOM 379 N SER A 24 12.260 -7.320 -8.749 1.00 64.11 N ATOM 380 CA SER A 24 13.101 -8.304 -9.481 1.00 23.30 C ATOM 381 C SER A 24 14.352 -7.655 -10.115 1.00 5.12 C ATOM 382 O SER A 24 15.456 -8.220 -10.058 1.00 35.41 O ATOM 383 CB SER A 24 12.242 -9.000 -10.566 1.00 60.13 C ATOM 384 OG SER A 24 11.119 -9.648 -9.983 1.00 61.23 O ATOM 0 H SER A 24 11.872 -6.586 -9.341 1.00 64.11 H new ATOM 0 HA SER A 24 13.462 -9.039 -8.762 1.00 23.30 H new ATOM 0 HB2 SER A 24 11.904 -8.264 -11.296 1.00 60.13 H new ATOM 0 HB3 SER A 24 12.849 -9.728 -11.104 1.00 60.13 H new ATOM 0 HG SER A 24 10.386 -9.005 -9.883 1.00 61.23 H new ATOM 390 N GLU A 25 14.187 -6.459 -10.707 1.00 51.32 N ATOM 391 CA GLU A 25 15.215 -5.812 -11.560 1.00 22.22 C ATOM 392 C GLU A 25 15.752 -4.533 -10.895 1.00 35.21 C ATOM 393 O GLU A 25 16.967 -4.298 -10.870 1.00 12.54 O ATOM 394 CB GLU A 25 14.606 -5.448 -12.940 1.00 12.13 C ATOM 395 CG GLU A 25 13.969 -6.615 -13.712 1.00 52.23 C ATOM 396 CD GLU A 25 14.966 -7.709 -14.108 1.00 61.04 C ATOM 397 OE1 GLU A 25 15.864 -7.434 -14.937 1.00 35.31 O ATOM 398 OE2 GLU A 25 14.871 -8.844 -13.596 1.00 65.41 O ATOM 0 H GLU A 25 13.335 -5.907 -10.610 1.00 51.32 H new ATOM 0 HA GLU A 25 16.037 -6.516 -11.691 1.00 22.22 H new ATOM 0 HB2 GLU A 25 13.849 -4.678 -12.792 1.00 12.13 H new ATOM 0 HB3 GLU A 25 15.389 -5.010 -13.559 1.00 12.13 H new ATOM 0 HG2 GLU A 25 13.182 -7.057 -13.101 1.00 52.23 H new ATOM 0 HG3 GLU A 25 13.493 -6.227 -14.612 1.00 52.23 H new ATOM 405 N HIS A 26 14.824 -3.694 -10.385 1.00 11.24 N ATOM 406 CA HIS A 26 15.150 -2.424 -9.708 1.00 24.14 C ATOM 407 C HIS A 26 15.891 -2.732 -8.405 1.00 31.55 C ATOM 408 O HIS A 26 17.037 -2.326 -8.196 1.00 41.15 O ATOM 409 CB HIS A 26 13.852 -1.610 -9.439 1.00 32.24 C ATOM 410 CG HIS A 26 14.057 -0.333 -8.661 1.00 25.32 C ATOM 411 ND1 HIS A 26 14.014 -0.325 -7.291 1.00 51.01 N ATOM 412 CD2 HIS A 26 14.317 0.925 -9.096 1.00 22.51 C ATOM 413 CE1 HIS A 26 14.247 0.915 -6.923 1.00 0.52 C ATOM 414 NE2 HIS A 26 14.436 1.712 -7.980 1.00 41.44 N ATOM 0 H HIS A 26 13.823 -3.882 -10.433 1.00 11.24 H new ATOM 0 HA HIS A 26 15.793 -1.817 -10.345 1.00 24.14 H new ATOM 0 HB2 HIS A 26 13.388 -1.366 -10.395 1.00 32.24 H new ATOM 0 HB3 HIS A 26 13.150 -2.242 -8.895 1.00 32.24 H new ATOM 0 HD2 HIS A 26 14.412 1.245 -10.123 1.00 22.51 H new ATOM 0 HE1 HIS A 26 14.281 1.248 -5.896 1.00 0.52 H new ATOM 0 HE2 HIS A 26 14.631 2.713 -7.960 1.00 41.44 H new ATOM 422 N ARG A 27 15.204 -3.476 -7.542 1.00 1.22 N ATOM 423 CA ARG A 27 15.782 -4.063 -6.338 1.00 35.34 C ATOM 424 C ARG A 27 15.791 -5.578 -6.499 1.00 0.40 C ATOM 425 O ARG A 27 14.854 -6.153 -7.057 1.00 12.21 O ATOM 426 CB ARG A 27 14.986 -3.628 -5.075 1.00 64.43 C ATOM 427 CG ARG A 27 15.106 -2.125 -4.747 1.00 21.44 C ATOM 428 CD ARG A 27 16.560 -1.676 -4.545 1.00 43.11 C ATOM 429 NE ARG A 27 16.684 -0.237 -4.262 1.00 2.23 N ATOM 430 CZ ARG A 27 17.814 0.359 -3.844 1.00 64.13 C ATOM 431 NH1 ARG A 27 18.929 -0.344 -3.660 1.00 71.45 N ATOM 432 NH2 ARG A 27 17.824 1.660 -3.616 1.00 45.35 N ATOM 0 H ARG A 27 14.214 -3.691 -7.662 1.00 1.22 H new ATOM 0 HA ARG A 27 16.804 -3.709 -6.203 1.00 35.34 H new ATOM 0 HB2 ARG A 27 13.934 -3.876 -5.217 1.00 64.43 H new ATOM 0 HB3 ARG A 27 15.337 -4.206 -4.220 1.00 64.43 H new ATOM 0 HG2 ARG A 27 14.660 -1.545 -5.555 1.00 21.44 H new ATOM 0 HG3 ARG A 27 14.534 -1.908 -3.845 1.00 21.44 H new ATOM 0 HD2 ARG A 27 16.998 -2.241 -3.722 1.00 43.11 H new ATOM 0 HD3 ARG A 27 17.136 -1.916 -5.439 1.00 43.11 H new ATOM 0 HE ARG A 27 15.858 0.347 -4.392 1.00 2.23 H new ATOM 0 HH11 ARG A 27 18.933 -1.349 -3.837 1.00 71.45 H new ATOM 0 HH12 ARG A 27 19.779 0.122 -3.342 1.00 71.45 H new ATOM 0 HH21 ARG A 27 16.976 2.209 -3.757 1.00 45.35 H new ATOM 0 HH22 ARG A 27 18.680 2.116 -3.299 1.00 45.35 H new ATOM 446 N GLN A 28 16.887 -6.199 -6.051 1.00 62.25 N ATOM 447 CA GLN A 28 17.028 -7.663 -5.997 1.00 13.42 C ATOM 448 C GLN A 28 15.955 -8.264 -5.060 1.00 51.32 C ATOM 449 O GLN A 28 15.548 -7.605 -4.088 1.00 33.32 O ATOM 450 CB GLN A 28 18.469 -8.025 -5.548 1.00 55.02 C ATOM 451 CG GLN A 28 18.892 -7.386 -4.214 1.00 45.13 C ATOM 452 CD GLN A 28 20.376 -7.561 -3.906 1.00 14.31 C ATOM 453 OE1 GLN A 28 20.779 -8.545 -3.279 1.00 34.55 O ATOM 454 NE2 GLN A 28 21.197 -6.610 -4.337 1.00 33.12 N ATOM 0 H GLN A 28 17.709 -5.699 -5.713 1.00 62.25 H new ATOM 0 HA GLN A 28 16.868 -8.092 -6.986 1.00 13.42 H new ATOM 0 HB2 GLN A 28 18.549 -9.109 -5.461 1.00 55.02 H new ATOM 0 HB3 GLN A 28 19.168 -7.715 -6.325 1.00 55.02 H new ATOM 0 HG2 GLN A 28 18.656 -6.322 -4.237 1.00 45.13 H new ATOM 0 HG3 GLN A 28 18.306 -7.825 -3.407 1.00 45.13 H new ATOM 0 HE21 GLN A 28 20.827 -5.811 -4.852 1.00 33.12 H new ATOM 0 HE22 GLN A 28 22.198 -6.678 -4.153 1.00 33.12 H new ATOM 463 N SER A 29 15.525 -9.506 -5.376 1.00 21.54 N ATOM 464 CA SER A 29 14.337 -10.142 -4.768 1.00 40.43 C ATOM 465 C SER A 29 14.378 -10.126 -3.216 1.00 20.11 C ATOM 466 O SER A 29 15.309 -10.683 -2.625 1.00 13.45 O ATOM 467 CB SER A 29 14.209 -11.594 -5.289 1.00 2.43 C ATOM 468 OG SER A 29 14.154 -11.622 -6.706 1.00 35.24 O ATOM 0 H SER A 29 15.995 -10.097 -6.062 1.00 21.54 H new ATOM 0 HA SER A 29 13.463 -9.560 -5.062 1.00 40.43 H new ATOM 0 HB2 SER A 29 15.057 -12.185 -4.943 1.00 2.43 H new ATOM 0 HB3 SER A 29 13.311 -12.054 -4.877 1.00 2.43 H new ATOM 0 HG SER A 29 14.075 -12.550 -7.012 1.00 35.24 H new ATOM 474 N PRO A 30 13.362 -9.480 -2.537 1.00 15.11 N ATOM 475 CA PRO A 30 13.242 -9.473 -1.054 1.00 45.30 C ATOM 476 C PRO A 30 12.588 -10.760 -0.528 1.00 20.12 C ATOM 477 O PRO A 30 12.605 -11.034 0.674 1.00 54.34 O ATOM 478 CB PRO A 30 12.348 -8.242 -0.797 1.00 54.42 C ATOM 479 CG PRO A 30 11.441 -8.187 -1.989 1.00 13.44 C ATOM 480 CD PRO A 30 12.267 -8.668 -3.169 1.00 75.30 C ATOM 0 HA PRO A 30 14.205 -9.427 -0.546 1.00 45.30 H new ATOM 0 HB2 PRO A 30 11.782 -8.348 0.129 1.00 54.42 H new ATOM 0 HB3 PRO A 30 12.941 -7.332 -0.706 1.00 54.42 H new ATOM 0 HG2 PRO A 30 10.566 -8.820 -1.842 1.00 13.44 H new ATOM 0 HG3 PRO A 30 11.077 -7.173 -2.155 1.00 13.44 H new ATOM 0 HD2 PRO A 30 11.670 -9.268 -3.856 1.00 75.30 H new ATOM 0 HD3 PRO A 30 12.669 -7.833 -3.742 1.00 75.30 H new ATOM 488 N ILE A 31 11.973 -11.507 -1.451 1.00 44.13 N ATOM 489 CA ILE A 31 11.430 -12.837 -1.189 1.00 10.34 C ATOM 490 C ILE A 31 12.612 -13.786 -0.839 1.00 2.21 C ATOM 491 O ILE A 31 13.514 -13.926 -1.675 1.00 34.05 O ATOM 492 CB ILE A 31 10.644 -13.367 -2.457 1.00 34.24 C ATOM 493 CG1 ILE A 31 9.644 -12.292 -3.008 1.00 53.41 C ATOM 494 CG2 ILE A 31 9.906 -14.686 -2.151 1.00 31.14 C ATOM 495 CD1 ILE A 31 8.558 -11.836 -2.033 1.00 24.32 C ATOM 0 H ILE A 31 11.838 -11.197 -2.413 1.00 44.13 H new ATOM 0 HA ILE A 31 10.729 -12.799 -0.355 1.00 10.34 H new ATOM 0 HB ILE A 31 11.385 -13.564 -3.232 1.00 34.24 H new ATOM 0 HG12 ILE A 31 10.215 -11.418 -3.322 1.00 53.41 H new ATOM 0 HG13 ILE A 31 9.161 -12.694 -3.899 1.00 53.41 H new ATOM 0 HG21 ILE A 31 9.377 -15.022 -3.043 1.00 31.14 H new ATOM 0 HG22 ILE A 31 10.628 -15.445 -1.850 1.00 31.14 H new ATOM 0 HG23 ILE A 31 9.191 -14.524 -1.344 1.00 31.14 H new ATOM 0 HD11 ILE A 31 7.923 -11.093 -2.517 1.00 24.32 H new ATOM 0 HD12 ILE A 31 7.953 -12.692 -1.736 1.00 24.32 H new ATOM 0 HD13 ILE A 31 9.023 -11.397 -1.150 1.00 24.32 H new ATOM 507 N PRO A 32 12.645 -14.405 0.403 1.00 31.23 N ATOM 508 CA PRO A 32 13.777 -15.252 0.884 1.00 10.53 C ATOM 509 C PRO A 32 14.251 -16.299 -0.138 1.00 12.55 C ATOM 510 O PRO A 32 13.447 -16.762 -0.930 1.00 24.41 O ATOM 511 CB PRO A 32 13.183 -15.974 2.120 1.00 22.44 C ATOM 512 CG PRO A 32 12.144 -15.044 2.641 1.00 4.42 C ATOM 513 CD PRO A 32 11.579 -14.312 1.437 1.00 21.02 C ATOM 0 HA PRO A 32 14.657 -14.640 1.084 1.00 10.53 H new ATOM 0 HB2 PRO A 32 12.751 -16.936 1.846 1.00 22.44 H new ATOM 0 HB3 PRO A 32 13.950 -16.171 2.870 1.00 22.44 H new ATOM 0 HG2 PRO A 32 11.361 -15.592 3.165 1.00 4.42 H new ATOM 0 HG3 PRO A 32 12.574 -14.342 3.355 1.00 4.42 H new ATOM 0 HD2 PRO A 32 10.653 -14.772 1.093 1.00 21.02 H new ATOM 0 HD3 PRO A 32 11.350 -13.274 1.677 1.00 21.02 H new ATOM 521 N PRO A 33 15.564 -16.699 -0.118 1.00 2.22 N ATOM 522 CA PRO A 33 16.065 -17.822 -0.953 1.00 12.02 C ATOM 523 C PRO A 33 15.261 -19.118 -0.708 1.00 51.31 C ATOM 524 O PRO A 33 15.021 -19.902 -1.629 1.00 14.51 O ATOM 525 CB PRO A 33 17.540 -17.977 -0.502 1.00 64.52 C ATOM 526 CG PRO A 33 17.915 -16.629 0.049 1.00 50.54 C ATOM 527 CD PRO A 33 16.660 -16.079 0.685 1.00 52.02 C ATOM 0 HA PRO A 33 15.966 -17.628 -2.021 1.00 12.02 H new ATOM 0 HB2 PRO A 33 17.643 -18.756 0.253 1.00 64.52 H new ATOM 0 HB3 PRO A 33 18.182 -18.256 -1.337 1.00 64.52 H new ATOM 0 HG2 PRO A 33 18.718 -16.716 0.781 1.00 50.54 H new ATOM 0 HG3 PRO A 33 18.274 -15.970 -0.741 1.00 50.54 H new ATOM 0 HD2 PRO A 33 16.590 -16.352 1.738 1.00 52.02 H new ATOM 0 HD3 PRO A 33 16.628 -14.991 0.635 1.00 52.02 H new ATOM 535 N GLU A 34 14.825 -19.275 0.554 1.00 65.21 N ATOM 536 CA GLU A 34 13.994 -20.401 1.011 1.00 44.21 C ATOM 537 C GLU A 34 12.579 -20.323 0.402 1.00 72.14 C ATOM 538 O GLU A 34 12.075 -21.304 -0.148 1.00 61.21 O ATOM 539 CB GLU A 34 13.899 -20.378 2.559 1.00 1.41 C ATOM 540 CG GLU A 34 15.253 -20.361 3.294 1.00 20.31 C ATOM 541 CD GLU A 34 15.104 -20.295 4.823 1.00 43.05 C ATOM 542 OE1 GLU A 34 14.776 -21.330 5.440 1.00 15.23 O ATOM 543 OE2 GLU A 34 15.286 -19.204 5.411 1.00 64.03 O ATOM 0 H GLU A 34 15.044 -18.611 1.297 1.00 65.21 H new ATOM 0 HA GLU A 34 14.458 -21.331 0.683 1.00 44.21 H new ATOM 0 HB2 GLU A 34 13.328 -19.500 2.860 1.00 1.41 H new ATOM 0 HB3 GLU A 34 13.336 -21.252 2.887 1.00 1.41 H new ATOM 0 HG2 GLU A 34 15.816 -21.255 3.027 1.00 20.31 H new ATOM 0 HG3 GLU A 34 15.835 -19.504 2.954 1.00 20.31 H new ATOM 550 N GLU A 35 11.952 -19.141 0.522 1.00 3.10 N ATOM 551 CA GLU A 35 10.582 -18.887 0.036 1.00 72.22 C ATOM 552 C GLU A 35 10.498 -18.995 -1.499 1.00 24.23 C ATOM 553 O GLU A 35 9.672 -19.754 -2.032 1.00 24.33 O ATOM 554 CB GLU A 35 10.115 -17.488 0.515 1.00 12.55 C ATOM 555 CG GLU A 35 8.686 -17.062 0.097 1.00 12.34 C ATOM 556 CD GLU A 35 7.568 -17.878 0.754 1.00 75.21 C ATOM 557 OE1 GLU A 35 7.158 -17.534 1.883 1.00 65.32 O ATOM 558 OE2 GLU A 35 7.095 -18.861 0.149 1.00 32.03 O ATOM 0 H GLU A 35 12.383 -18.328 0.962 1.00 3.10 H new ATOM 0 HA GLU A 35 9.921 -19.649 0.449 1.00 72.22 H new ATOM 0 HB2 GLU A 35 10.176 -17.461 1.603 1.00 12.55 H new ATOM 0 HB3 GLU A 35 10.818 -16.745 0.138 1.00 12.55 H new ATOM 0 HG2 GLU A 35 8.546 -16.010 0.345 1.00 12.34 H new ATOM 0 HG3 GLU A 35 8.595 -17.149 -0.986 1.00 12.34 H new ATOM 565 N ARG A 36 11.394 -18.275 -2.207 1.00 14.22 N ATOM 566 CA ARG A 36 11.380 -18.198 -3.676 1.00 30.50 C ATOM 567 C ARG A 36 12.004 -19.454 -4.315 1.00 5.41 C ATOM 568 O ARG A 36 12.106 -19.537 -5.542 1.00 73.42 O ATOM 569 CB ARG A 36 12.080 -16.909 -4.207 1.00 11.05 C ATOM 570 CG ARG A 36 13.629 -16.906 -4.165 1.00 33.23 C ATOM 571 CD ARG A 36 14.233 -15.710 -4.931 1.00 34.22 C ATOM 572 NE ARG A 36 13.662 -15.597 -6.291 1.00 41.11 N ATOM 573 CZ ARG A 36 14.232 -16.031 -7.435 1.00 14.21 C ATOM 574 NH1 ARG A 36 15.419 -16.624 -7.428 1.00 4.31 N ATOM 575 NH2 ARG A 36 13.587 -15.894 -8.580 1.00 14.10 N ATOM 0 H ARG A 36 12.143 -17.734 -1.775 1.00 14.22 H new ATOM 0 HA ARG A 36 10.332 -18.148 -3.972 1.00 30.50 H new ATOM 0 HB2 ARG A 36 11.765 -16.748 -5.238 1.00 11.05 H new ATOM 0 HB3 ARG A 36 11.720 -16.059 -3.627 1.00 11.05 H new ATOM 0 HG2 ARG A 36 13.962 -16.876 -3.128 1.00 33.23 H new ATOM 0 HG3 ARG A 36 14.004 -17.836 -4.593 1.00 33.23 H new ATOM 0 HD2 ARG A 36 14.045 -14.790 -4.378 1.00 34.22 H new ATOM 0 HD3 ARG A 36 15.315 -15.827 -4.997 1.00 34.22 H new ATOM 0 HE ARG A 36 12.750 -15.148 -6.372 1.00 41.11 H new ATOM 0 HH11 ARG A 36 15.917 -16.759 -6.548 1.00 4.31 H new ATOM 0 HH12 ARG A 36 15.834 -16.945 -8.303 1.00 4.31 H new ATOM 0 HH21 ARG A 36 12.663 -15.462 -8.596 1.00 14.10 H new ATOM 0 HH22 ARG A 36 14.013 -16.220 -9.448 1.00 14.10 H new ATOM 589 N ASP A 37 12.467 -20.405 -3.485 1.00 64.15 N ATOM 590 CA ASP A 37 12.909 -21.729 -3.956 1.00 30.53 C ATOM 591 C ASP A 37 11.748 -22.455 -4.673 1.00 64.03 C ATOM 592 O ASP A 37 11.914 -22.946 -5.800 1.00 70.14 O ATOM 593 CB ASP A 37 13.465 -22.562 -2.768 1.00 44.33 C ATOM 594 CG ASP A 37 13.863 -23.998 -3.144 1.00 42.34 C ATOM 595 OD1 ASP A 37 14.863 -24.171 -3.876 1.00 54.44 O ATOM 596 OD2 ASP A 37 13.157 -24.953 -2.743 1.00 23.03 O ATOM 0 H ASP A 37 12.545 -20.279 -2.476 1.00 64.15 H new ATOM 0 HA ASP A 37 13.716 -21.604 -4.678 1.00 30.53 H new ATOM 0 HB2 ASP A 37 14.335 -22.051 -2.355 1.00 44.33 H new ATOM 0 HB3 ASP A 37 12.713 -22.599 -1.980 1.00 44.33 H new ATOM 601 N ASP A 38 10.569 -22.490 -4.025 1.00 3.30 N ATOM 602 CA ASP A 38 9.347 -23.076 -4.625 1.00 31.34 C ATOM 603 C ASP A 38 8.504 -21.995 -5.347 1.00 72.23 C ATOM 604 O ASP A 38 7.984 -22.234 -6.438 1.00 62.22 O ATOM 605 CB ASP A 38 8.512 -23.749 -3.502 1.00 74.23 C ATOM 606 CG ASP A 38 7.256 -24.476 -4.018 1.00 43.13 C ATOM 607 OD1 ASP A 38 7.343 -25.683 -4.346 1.00 53.53 O ATOM 608 OD2 ASP A 38 6.179 -23.843 -4.117 1.00 61.14 O ATOM 0 H ASP A 38 10.433 -22.120 -3.084 1.00 3.30 H new ATOM 0 HA ASP A 38 9.636 -23.818 -5.369 1.00 31.34 H new ATOM 0 HB2 ASP A 38 9.142 -24.462 -2.971 1.00 74.23 H new ATOM 0 HB3 ASP A 38 8.211 -22.990 -2.780 1.00 74.23 H new ATOM 613 N PHE A 39 8.432 -20.796 -4.750 1.00 41.33 N ATOM 614 CA PHE A 39 7.579 -19.673 -5.239 1.00 10.24 C ATOM 615 C PHE A 39 8.401 -18.735 -6.121 1.00 54.03 C ATOM 616 O PHE A 39 9.618 -18.753 -6.059 1.00 44.23 O ATOM 617 CB PHE A 39 6.983 -18.886 -4.038 1.00 64.42 C ATOM 618 CG PHE A 39 5.954 -19.663 -3.198 1.00 44.21 C ATOM 619 CD1 PHE A 39 6.328 -20.774 -2.444 1.00 21.12 C ATOM 620 CD2 PHE A 39 4.616 -19.269 -3.152 1.00 40.41 C ATOM 621 CE1 PHE A 39 5.405 -21.461 -1.674 1.00 21.32 C ATOM 622 CE2 PHE A 39 3.696 -19.958 -2.386 1.00 63.14 C ATOM 623 CZ PHE A 39 4.091 -21.051 -1.646 1.00 52.53 C ATOM 0 H PHE A 39 8.962 -20.565 -3.910 1.00 41.33 H new ATOM 0 HA PHE A 39 6.761 -20.087 -5.828 1.00 10.24 H new ATOM 0 HB2 PHE A 39 7.799 -18.573 -3.387 1.00 64.42 H new ATOM 0 HB3 PHE A 39 6.511 -17.979 -4.416 1.00 64.42 H new ATOM 0 HD1 PHE A 39 7.356 -21.105 -2.461 1.00 21.12 H new ATOM 0 HD2 PHE A 39 4.295 -18.412 -3.725 1.00 40.41 H new ATOM 0 HE1 PHE A 39 5.716 -22.318 -1.095 1.00 21.32 H new ATOM 0 HE2 PHE A 39 2.664 -19.639 -2.367 1.00 63.14 H new ATOM 0 HZ PHE A 39 3.371 -21.586 -1.045 1.00 52.53 H new ATOM 633 N ASP A 40 7.748 -17.943 -6.976 1.00 1.22 N ATOM 634 CA ASP A 40 8.452 -16.911 -7.760 1.00 31.25 C ATOM 635 C ASP A 40 7.495 -15.767 -8.108 1.00 44.41 C ATOM 636 O ASP A 40 6.625 -15.925 -8.971 1.00 63.33 O ATOM 637 CB ASP A 40 9.084 -17.525 -9.040 1.00 62.54 C ATOM 638 CG ASP A 40 9.957 -16.540 -9.840 1.00 5.24 C ATOM 639 OD1 ASP A 40 10.764 -15.799 -9.227 1.00 52.43 O ATOM 640 OD2 ASP A 40 9.857 -16.514 -11.087 1.00 54.01 O ATOM 0 H ASP A 40 6.743 -17.991 -7.146 1.00 1.22 H new ATOM 0 HA ASP A 40 9.263 -16.505 -7.155 1.00 31.25 H new ATOM 0 HB2 ASP A 40 9.691 -18.385 -8.757 1.00 62.54 H new ATOM 0 HB3 ASP A 40 8.287 -17.895 -9.685 1.00 62.54 H new ATOM 645 N GLY A 41 7.629 -14.646 -7.382 1.00 3.12 N ATOM 646 CA GLY A 41 6.865 -13.435 -7.664 1.00 54.35 C ATOM 647 C GLY A 41 6.681 -12.564 -6.439 1.00 14.24 C ATOM 648 O GLY A 41 6.874 -13.016 -5.300 1.00 14.53 O ATOM 0 H GLY A 41 8.266 -14.560 -6.590 1.00 3.12 H new ATOM 0 HA2 GLY A 41 7.373 -12.862 -8.440 1.00 54.35 H new ATOM 0 HA3 GLY A 41 5.887 -13.710 -8.060 1.00 54.35 H new ATOM 652 N LEU A 42 6.343 -11.291 -6.697 1.00 62.40 N ATOM 653 CA LEU A 42 5.792 -10.367 -5.695 1.00 11.54 C ATOM 654 C LEU A 42 4.425 -10.945 -5.305 1.00 1.31 C ATOM 655 O LEU A 42 3.553 -11.030 -6.182 1.00 73.13 O ATOM 656 CB LEU A 42 5.655 -8.937 -6.353 1.00 1.22 C ATOM 657 CG LEU A 42 5.305 -7.692 -5.445 1.00 4.30 C ATOM 658 CD1 LEU A 42 5.396 -6.383 -6.259 1.00 22.04 C ATOM 659 CD2 LEU A 42 3.917 -7.784 -4.778 1.00 14.04 C ATOM 0 H LEU A 42 6.446 -10.869 -7.620 1.00 62.40 H new ATOM 0 HA LEU A 42 6.423 -10.262 -4.812 1.00 11.54 H new ATOM 0 HB2 LEU A 42 6.596 -8.719 -6.858 1.00 1.22 H new ATOM 0 HB3 LEU A 42 4.888 -9.005 -7.124 1.00 1.22 H new ATOM 0 HG LEU A 42 6.045 -7.692 -4.645 1.00 4.30 H new ATOM 0 HD11 LEU A 42 5.152 -5.537 -5.616 1.00 22.04 H new ATOM 0 HD12 LEU A 42 6.408 -6.264 -6.645 1.00 22.04 H new ATOM 0 HD13 LEU A 42 4.692 -6.422 -7.091 1.00 22.04 H new ATOM 0 HD21 LEU A 42 3.746 -6.895 -4.171 1.00 14.04 H new ATOM 0 HD22 LEU A 42 3.148 -7.852 -5.547 1.00 14.04 H new ATOM 0 HD23 LEU A 42 3.876 -8.670 -4.144 1.00 14.04 H new ATOM 671 N SER A 43 4.255 -11.403 -4.038 1.00 31.21 N ATOM 672 CA SER A 43 2.964 -11.947 -3.574 1.00 50.04 C ATOM 673 C SER A 43 1.856 -10.894 -3.766 1.00 44.44 C ATOM 674 O SER A 43 1.848 -9.829 -3.130 1.00 21.22 O ATOM 675 CB SER A 43 3.055 -12.406 -2.103 1.00 14.24 C ATOM 676 OG SER A 43 4.118 -13.333 -1.929 1.00 61.11 O ATOM 0 H SER A 43 4.990 -11.404 -3.331 1.00 31.21 H new ATOM 0 HA SER A 43 2.715 -12.824 -4.171 1.00 50.04 H new ATOM 0 HB2 SER A 43 3.210 -11.542 -1.457 1.00 14.24 H new ATOM 0 HB3 SER A 43 2.113 -12.865 -1.801 1.00 14.24 H new ATOM 0 HG SER A 43 4.320 -13.423 -0.974 1.00 61.11 H new ATOM 682 N TYR A 44 0.924 -11.247 -4.648 1.00 72.31 N ATOM 683 CA TYR A 44 -0.028 -10.317 -5.268 1.00 25.44 C ATOM 684 C TYR A 44 -1.445 -10.881 -5.131 1.00 71.43 C ATOM 685 O TYR A 44 -1.660 -12.090 -5.284 1.00 23.51 O ATOM 686 CB TYR A 44 0.380 -10.148 -6.769 1.00 54.11 C ATOM 687 CG TYR A 44 -0.536 -9.279 -7.669 1.00 15.22 C ATOM 688 CD1 TYR A 44 -0.591 -7.886 -7.533 1.00 41.34 C ATOM 689 CD2 TYR A 44 -1.304 -9.859 -8.691 1.00 3.50 C ATOM 690 CE1 TYR A 44 -1.374 -7.115 -8.379 1.00 14.54 C ATOM 691 CE2 TYR A 44 -2.091 -9.089 -9.530 1.00 35.51 C ATOM 692 CZ TYR A 44 -2.121 -7.723 -9.375 1.00 10.22 C ATOM 693 OH TYR A 44 -2.898 -6.960 -10.223 1.00 12.41 O ATOM 0 H TYR A 44 0.804 -12.210 -4.962 1.00 72.31 H new ATOM 0 HA TYR A 44 -0.010 -9.343 -4.780 1.00 25.44 H new ATOM 0 HB2 TYR A 44 1.382 -9.721 -6.799 1.00 54.11 H new ATOM 0 HB3 TYR A 44 0.443 -11.141 -7.214 1.00 54.11 H new ATOM 0 HD1 TYR A 44 -0.014 -7.405 -6.757 1.00 41.34 H new ATOM 0 HD2 TYR A 44 -1.280 -10.930 -8.826 1.00 3.50 H new ATOM 0 HE1 TYR A 44 -1.401 -6.042 -8.262 1.00 14.54 H new ATOM 0 HE2 TYR A 44 -2.679 -9.560 -10.304 1.00 35.51 H new ATOM 0 HH TYR A 44 -3.161 -7.498 -10.999 1.00 12.41 H new ATOM 703 N PHE A 45 -2.391 -10.006 -4.812 1.00 35.33 N ATOM 704 CA PHE A 45 -3.816 -10.337 -4.844 1.00 74.31 C ATOM 705 C PHE A 45 -4.320 -10.039 -6.254 1.00 2.23 C ATOM 706 O PHE A 45 -3.859 -9.081 -6.882 1.00 73.41 O ATOM 707 CB PHE A 45 -4.596 -9.520 -3.789 1.00 65.41 C ATOM 708 CG PHE A 45 -4.130 -9.744 -2.345 1.00 33.21 C ATOM 709 CD1 PHE A 45 -4.090 -11.029 -1.799 1.00 53.43 C ATOM 710 CD2 PHE A 45 -3.745 -8.680 -1.539 1.00 45.33 C ATOM 711 CE1 PHE A 45 -3.683 -11.240 -0.496 1.00 74.51 C ATOM 712 CE2 PHE A 45 -3.337 -8.893 -0.237 1.00 73.40 C ATOM 713 CZ PHE A 45 -3.307 -10.173 0.284 1.00 21.14 C ATOM 0 H PHE A 45 -2.195 -9.047 -4.524 1.00 35.33 H new ATOM 0 HA PHE A 45 -3.970 -11.388 -4.602 1.00 74.31 H new ATOM 0 HB2 PHE A 45 -4.505 -8.460 -4.027 1.00 65.41 H new ATOM 0 HB3 PHE A 45 -5.654 -9.773 -3.860 1.00 65.41 H new ATOM 0 HD1 PHE A 45 -4.383 -11.873 -2.406 1.00 53.43 H new ATOM 0 HD2 PHE A 45 -3.765 -7.675 -1.935 1.00 45.33 H new ATOM 0 HE1 PHE A 45 -3.660 -12.241 -0.091 1.00 74.51 H new ATOM 0 HE2 PHE A 45 -3.040 -8.056 0.377 1.00 73.40 H new ATOM 0 HZ PHE A 45 -2.988 -10.334 1.303 1.00 21.14 H new ATOM 723 N ASP A 46 -5.260 -10.848 -6.758 1.00 31.51 N ATOM 724 CA ASP A 46 -5.780 -10.685 -8.131 1.00 12.13 C ATOM 725 C ASP A 46 -6.808 -9.539 -8.135 1.00 12.13 C ATOM 726 O ASP A 46 -7.552 -9.402 -7.150 1.00 41.44 O ATOM 727 CB ASP A 46 -6.413 -12.001 -8.661 1.00 12.42 C ATOM 728 CG ASP A 46 -5.382 -13.125 -8.820 1.00 33.23 C ATOM 729 OD1 ASP A 46 -5.057 -13.793 -7.820 1.00 65.10 O ATOM 730 OD2 ASP A 46 -4.880 -13.339 -9.945 1.00 33.52 O ATOM 0 H ASP A 46 -5.678 -11.622 -6.241 1.00 31.51 H new ATOM 0 HA ASP A 46 -4.954 -10.442 -8.800 1.00 12.13 H new ATOM 0 HB2 ASP A 46 -7.197 -12.325 -7.976 1.00 12.42 H new ATOM 0 HB3 ASP A 46 -6.889 -11.810 -9.623 1.00 12.42 H new ATOM 735 N PRO A 47 -6.862 -8.706 -9.229 1.00 31.22 N ATOM 736 CA PRO A 47 -7.727 -7.493 -9.303 1.00 32.12 C ATOM 737 C PRO A 47 -9.200 -7.781 -8.947 1.00 61.45 C ATOM 738 O PRO A 47 -9.915 -8.459 -9.693 1.00 61.22 O ATOM 739 CB PRO A 47 -7.575 -7.030 -10.782 1.00 62.24 C ATOM 740 CG PRO A 47 -6.974 -8.199 -11.502 1.00 70.54 C ATOM 741 CD PRO A 47 -6.088 -8.873 -10.488 1.00 22.31 C ATOM 0 HA PRO A 47 -7.427 -6.734 -8.580 1.00 32.12 H new ATOM 0 HB2 PRO A 47 -8.540 -6.758 -11.210 1.00 62.24 H new ATOM 0 HB3 PRO A 47 -6.934 -6.151 -10.855 1.00 62.24 H new ATOM 0 HG2 PRO A 47 -7.746 -8.878 -11.864 1.00 70.54 H new ATOM 0 HG3 PRO A 47 -6.402 -7.875 -12.371 1.00 70.54 H new ATOM 0 HD2 PRO A 47 -5.922 -9.923 -10.727 1.00 22.31 H new ATOM 0 HD3 PRO A 47 -5.107 -8.401 -10.428 1.00 22.31 H new ATOM 749 N ASP A 48 -9.618 -7.301 -7.779 1.00 3.41 N ATOM 750 CA ASP A 48 -10.972 -7.478 -7.256 1.00 1.40 C ATOM 751 C ASP A 48 -11.616 -6.088 -7.015 1.00 4.30 C ATOM 752 O ASP A 48 -11.161 -5.342 -6.137 1.00 62.40 O ATOM 753 CB ASP A 48 -10.910 -8.293 -5.942 1.00 63.24 C ATOM 754 CG ASP A 48 -12.294 -8.581 -5.368 1.00 4.32 C ATOM 755 OD1 ASP A 48 -12.899 -9.605 -5.751 1.00 52.23 O ATOM 756 OD2 ASP A 48 -12.791 -7.776 -4.566 1.00 13.22 O ATOM 0 H ASP A 48 -9.013 -6.767 -7.156 1.00 3.41 H new ATOM 0 HA ASP A 48 -11.584 -8.023 -7.975 1.00 1.40 H new ATOM 0 HB2 ASP A 48 -10.393 -9.235 -6.126 1.00 63.24 H new ATOM 0 HB3 ASP A 48 -10.322 -7.745 -5.206 1.00 63.24 H new ATOM 761 N PRO A 49 -12.688 -5.720 -7.779 1.00 50.32 N ATOM 762 CA PRO A 49 -13.332 -4.383 -7.679 1.00 1.34 C ATOM 763 C PRO A 49 -14.044 -4.125 -6.329 1.00 44.31 C ATOM 764 O PRO A 49 -14.271 -2.964 -5.968 1.00 12.43 O ATOM 765 CB PRO A 49 -14.334 -4.365 -8.870 1.00 22.32 C ATOM 766 CG PRO A 49 -13.936 -5.523 -9.743 1.00 51.14 C ATOM 767 CD PRO A 49 -13.349 -6.554 -8.814 1.00 61.13 C ATOM 0 HA PRO A 49 -12.590 -3.586 -7.723 1.00 1.34 H new ATOM 0 HB2 PRO A 49 -15.361 -4.471 -8.521 1.00 22.32 H new ATOM 0 HB3 PRO A 49 -14.278 -3.423 -9.416 1.00 22.32 H new ATOM 0 HG2 PRO A 49 -14.797 -5.924 -10.278 1.00 51.14 H new ATOM 0 HG3 PRO A 49 -13.209 -5.215 -10.494 1.00 51.14 H new ATOM 0 HD2 PRO A 49 -14.117 -7.198 -8.386 1.00 61.13 H new ATOM 0 HD3 PRO A 49 -12.638 -7.203 -9.326 1.00 61.13 H new ATOM 775 N ASP A 50 -14.392 -5.196 -5.588 1.00 23.11 N ATOM 776 CA ASP A 50 -15.040 -5.069 -4.254 1.00 42.23 C ATOM 777 C ASP A 50 -14.042 -4.593 -3.183 1.00 4.21 C ATOM 778 O ASP A 50 -14.433 -3.980 -2.183 1.00 24.14 O ATOM 779 CB ASP A 50 -15.691 -6.408 -3.823 1.00 34.24 C ATOM 780 CG ASP A 50 -16.730 -6.938 -4.825 1.00 30.41 C ATOM 781 OD1 ASP A 50 -17.563 -6.141 -5.311 1.00 44.42 O ATOM 782 OD2 ASP A 50 -16.746 -8.158 -5.109 1.00 42.03 O ATOM 0 H ASP A 50 -14.238 -6.160 -5.884 1.00 23.11 H new ATOM 0 HA ASP A 50 -15.822 -4.315 -4.345 1.00 42.23 H new ATOM 0 HB2 ASP A 50 -14.910 -7.157 -3.692 1.00 34.24 H new ATOM 0 HB3 ASP A 50 -16.170 -6.274 -2.853 1.00 34.24 H new ATOM 787 N TYR A 51 -12.745 -4.865 -3.413 1.00 54.40 N ATOM 788 CA TYR A 51 -11.645 -4.364 -2.559 1.00 41.34 C ATOM 789 C TYR A 51 -10.948 -3.177 -3.222 1.00 1.30 C ATOM 790 O TYR A 51 -9.861 -2.762 -2.810 1.00 33.22 O ATOM 791 CB TYR A 51 -10.665 -5.510 -2.199 1.00 13.44 C ATOM 792 CG TYR A 51 -11.254 -6.431 -1.127 1.00 72.42 C ATOM 793 CD1 TYR A 51 -11.325 -6.007 0.202 1.00 24.22 C ATOM 794 CD2 TYR A 51 -11.783 -7.682 -1.437 1.00 31.03 C ATOM 795 CE1 TYR A 51 -11.886 -6.800 1.178 1.00 12.41 C ATOM 796 CE2 TYR A 51 -12.353 -8.474 -0.464 1.00 40.22 C ATOM 797 CZ TYR A 51 -12.401 -8.035 0.841 1.00 5.50 C ATOM 798 OH TYR A 51 -12.969 -8.833 1.813 1.00 13.40 O ATOM 0 H TYR A 51 -12.427 -5.438 -4.195 1.00 54.40 H new ATOM 0 HA TYR A 51 -12.061 -4.001 -1.619 1.00 41.34 H new ATOM 0 HB2 TYR A 51 -10.436 -6.090 -3.093 1.00 13.44 H new ATOM 0 HB3 TYR A 51 -9.725 -5.089 -1.843 1.00 13.44 H new ATOM 0 HD1 TYR A 51 -10.932 -5.037 0.470 1.00 24.22 H new ATOM 0 HD2 TYR A 51 -11.746 -8.037 -2.456 1.00 31.03 H new ATOM 0 HE1 TYR A 51 -11.923 -6.457 2.202 1.00 12.41 H new ATOM 0 HE2 TYR A 51 -12.762 -9.439 -0.724 1.00 40.22 H new ATOM 0 HH TYR A 51 -12.457 -8.751 2.644 1.00 13.40 H new ATOM 808 N ARG A 52 -11.591 -2.645 -4.267 1.00 11.42 N ATOM 809 CA ARG A 52 -11.284 -1.339 -4.836 1.00 70.43 C ATOM 810 C ARG A 52 -12.339 -0.356 -4.291 1.00 53.11 C ATOM 811 O ARG A 52 -13.490 -0.367 -4.745 1.00 2.23 O ATOM 812 CB ARG A 52 -11.336 -1.402 -6.388 1.00 23.44 C ATOM 813 CG ARG A 52 -11.005 -0.071 -7.077 1.00 53.22 C ATOM 814 CD ARG A 52 -11.178 -0.102 -8.604 1.00 2.35 C ATOM 815 NE ARG A 52 -12.596 -0.167 -9.000 1.00 54.51 N ATOM 816 CZ ARG A 52 -13.138 0.477 -10.045 1.00 24.12 C ATOM 817 NH1 ARG A 52 -12.394 1.247 -10.839 1.00 61.13 N ATOM 818 NH2 ARG A 52 -14.434 0.363 -10.277 1.00 70.22 N ATOM 0 H ARG A 52 -12.353 -3.124 -4.746 1.00 11.42 H new ATOM 0 HA ARG A 52 -10.280 -1.016 -4.561 1.00 70.43 H new ATOM 0 HB2 ARG A 52 -10.636 -2.163 -6.734 1.00 23.44 H new ATOM 0 HB3 ARG A 52 -12.332 -1.721 -6.696 1.00 23.44 H new ATOM 0 HG2 ARG A 52 -11.644 0.710 -6.664 1.00 53.22 H new ATOM 0 HG3 ARG A 52 -9.976 0.202 -6.843 1.00 53.22 H new ATOM 0 HD2 ARG A 52 -10.721 0.787 -9.038 1.00 2.35 H new ATOM 0 HD3 ARG A 52 -10.649 -0.963 -9.011 1.00 2.35 H new ATOM 0 HE ARG A 52 -13.215 -0.748 -8.435 1.00 54.51 H new ATOM 0 HH11 ARG A 52 -11.396 1.354 -10.657 1.00 61.13 H new ATOM 0 HH12 ARG A 52 -12.823 1.729 -11.629 1.00 61.13 H new ATOM 0 HH21 ARG A 52 -15.013 -0.211 -9.664 1.00 70.22 H new ATOM 0 HH22 ARG A 52 -14.855 0.849 -11.069 1.00 70.22 H new ATOM 832 N VAL A 53 -11.961 0.455 -3.289 1.00 74.21 N ATOM 833 CA VAL A 53 -12.904 1.355 -2.585 1.00 55.21 C ATOM 834 C VAL A 53 -12.543 2.825 -2.881 1.00 44.04 C ATOM 835 O VAL A 53 -11.490 3.104 -3.466 1.00 65.23 O ATOM 836 CB VAL A 53 -12.916 1.086 -1.028 1.00 5.31 C ATOM 837 CG1 VAL A 53 -13.190 -0.410 -0.703 1.00 45.20 C ATOM 838 CG2 VAL A 53 -11.618 1.575 -0.358 1.00 23.11 C ATOM 0 H VAL A 53 -11.003 0.509 -2.943 1.00 74.21 H new ATOM 0 HA VAL A 53 -13.909 1.151 -2.955 1.00 55.21 H new ATOM 0 HB VAL A 53 -13.740 1.665 -0.611 1.00 5.31 H new ATOM 0 HG11 VAL A 53 -13.190 -0.553 0.378 1.00 45.20 H new ATOM 0 HG12 VAL A 53 -14.160 -0.698 -1.108 1.00 45.20 H new ATOM 0 HG13 VAL A 53 -12.412 -1.028 -1.151 1.00 45.20 H new ATOM 0 HG21 VAL A 53 -11.663 1.373 0.712 1.00 23.11 H new ATOM 0 HG22 VAL A 53 -10.766 1.051 -0.791 1.00 23.11 H new ATOM 0 HG23 VAL A 53 -11.506 2.647 -0.521 1.00 23.11 H new ATOM 848 N GLU A 54 -13.420 3.760 -2.474 1.00 24.33 N ATOM 849 CA GLU A 54 -13.226 5.209 -2.702 1.00 41.22 C ATOM 850 C GLU A 54 -13.191 5.949 -1.352 1.00 52.13 C ATOM 851 O GLU A 54 -14.062 5.748 -0.498 1.00 13.14 O ATOM 852 CB GLU A 54 -14.352 5.745 -3.628 1.00 33.11 C ATOM 853 CG GLU A 54 -15.789 5.400 -3.166 1.00 64.12 C ATOM 854 CD GLU A 54 -16.828 5.570 -4.275 1.00 45.31 C ATOM 855 OE1 GLU A 54 -16.819 4.757 -5.226 1.00 71.41 O ATOM 856 OE2 GLU A 54 -17.655 6.509 -4.223 1.00 51.53 O ATOM 0 H GLU A 54 -14.283 3.536 -1.978 1.00 24.33 H new ATOM 0 HA GLU A 54 -12.272 5.385 -3.199 1.00 41.22 H new ATOM 0 HB2 GLU A 54 -14.259 6.829 -3.701 1.00 33.11 H new ATOM 0 HB3 GLU A 54 -14.201 5.344 -4.630 1.00 33.11 H new ATOM 0 HG2 GLU A 54 -15.813 4.371 -2.808 1.00 64.12 H new ATOM 0 HG3 GLU A 54 -16.057 6.037 -2.323 1.00 64.12 H new ATOM 863 N ALA A 55 -12.171 6.804 -1.177 1.00 55.41 N ATOM 864 CA ALA A 55 -11.880 7.480 0.094 1.00 64.41 C ATOM 865 C ALA A 55 -11.748 8.991 -0.099 1.00 21.32 C ATOM 866 O ALA A 55 -11.272 9.448 -1.138 1.00 12.30 O ATOM 867 CB ALA A 55 -10.591 6.912 0.702 1.00 50.33 C ATOM 0 H ALA A 55 -11.519 7.047 -1.923 1.00 55.41 H new ATOM 0 HA ALA A 55 -12.712 7.300 0.774 1.00 64.41 H new ATOM 0 HB1 ALA A 55 -10.380 7.417 1.645 1.00 50.33 H new ATOM 0 HB2 ALA A 55 -10.714 5.844 0.882 1.00 50.33 H new ATOM 0 HB3 ALA A 55 -9.762 7.071 0.012 1.00 50.33 H new ATOM 873 N THR A 56 -12.159 9.748 0.925 1.00 14.14 N ATOM 874 CA THR A 56 -12.025 11.203 0.963 1.00 31.54 C ATOM 875 C THR A 56 -10.716 11.558 1.687 1.00 74.14 C ATOM 876 O THR A 56 -10.490 11.134 2.832 1.00 14.32 O ATOM 877 CB THR A 56 -13.245 11.843 1.692 1.00 60.33 C ATOM 878 OG1 THR A 56 -14.449 11.424 1.035 1.00 10.02 O ATOM 879 CG2 THR A 56 -13.181 13.383 1.715 1.00 2.14 C ATOM 0 H THR A 56 -12.599 9.359 1.759 1.00 14.14 H new ATOM 0 HA THR A 56 -11.999 11.597 -0.053 1.00 31.54 H new ATOM 0 HB THR A 56 -13.228 11.506 2.728 1.00 60.33 H new ATOM 0 HG1 THR A 56 -15.223 11.820 1.487 1.00 10.02 H new ATOM 0 HG21 THR A 56 -14.055 13.776 2.235 1.00 2.14 H new ATOM 0 HG22 THR A 56 -12.277 13.702 2.234 1.00 2.14 H new ATOM 0 HG23 THR A 56 -13.166 13.762 0.693 1.00 2.14 H new ATOM 887 N VAL A 57 -9.863 12.314 0.991 1.00 23.53 N ATOM 888 CA VAL A 57 -8.538 12.709 1.472 1.00 42.23 C ATOM 889 C VAL A 57 -8.660 13.868 2.475 1.00 61.43 C ATOM 890 O VAL A 57 -9.276 14.900 2.179 1.00 1.11 O ATOM 891 CB VAL A 57 -7.604 13.143 0.281 1.00 53.03 C ATOM 892 CG1 VAL A 57 -6.152 13.342 0.763 1.00 31.13 C ATOM 893 CG2 VAL A 57 -7.672 12.127 -0.878 1.00 34.30 C ATOM 0 H VAL A 57 -10.078 12.675 0.061 1.00 23.53 H new ATOM 0 HA VAL A 57 -8.093 11.845 1.964 1.00 42.23 H new ATOM 0 HB VAL A 57 -7.965 14.100 -0.096 1.00 53.03 H new ATOM 0 HG11 VAL A 57 -5.527 13.641 -0.078 1.00 31.13 H new ATOM 0 HG12 VAL A 57 -6.126 14.118 1.529 1.00 31.13 H new ATOM 0 HG13 VAL A 57 -5.776 12.408 1.180 1.00 31.13 H new ATOM 0 HG21 VAL A 57 -7.017 12.453 -1.686 1.00 34.30 H new ATOM 0 HG22 VAL A 57 -7.351 11.148 -0.523 1.00 34.30 H new ATOM 0 HG23 VAL A 57 -8.696 12.062 -1.245 1.00 34.30 H new ATOM 903 N THR A 58 -8.063 13.675 3.652 1.00 14.43 N ATOM 904 CA THR A 58 -8.031 14.665 4.730 1.00 4.34 C ATOM 905 C THR A 58 -6.556 15.006 5.004 1.00 51.02 C ATOM 906 O THR A 58 -5.858 14.266 5.708 1.00 14.23 O ATOM 907 CB THR A 58 -8.734 14.083 5.999 1.00 33.24 C ATOM 908 OG1 THR A 58 -10.059 13.660 5.650 1.00 61.11 O ATOM 909 CG2 THR A 58 -8.812 15.093 7.149 1.00 44.12 C ATOM 0 H THR A 58 -7.578 12.809 3.887 1.00 14.43 H new ATOM 0 HA THR A 58 -8.566 15.573 4.452 1.00 4.34 H new ATOM 0 HB THR A 58 -8.134 13.242 6.347 1.00 33.24 H new ATOM 0 HG1 THR A 58 -10.504 13.292 6.442 1.00 61.11 H new ATOM 0 HG21 THR A 58 -9.310 14.634 8.003 1.00 44.12 H new ATOM 0 HG22 THR A 58 -7.805 15.396 7.436 1.00 44.12 H new ATOM 0 HG23 THR A 58 -9.377 15.968 6.827 1.00 44.12 H new ATOM 917 N VAL A 59 -6.081 16.112 4.408 1.00 53.43 N ATOM 918 CA VAL A 59 -4.647 16.454 4.394 1.00 21.53 C ATOM 919 C VAL A 59 -4.293 17.309 5.614 1.00 22.42 C ATOM 920 O VAL A 59 -4.932 18.325 5.883 1.00 31.34 O ATOM 921 CB VAL A 59 -4.221 17.164 3.048 1.00 2.23 C ATOM 922 CG1 VAL A 59 -2.801 17.788 3.117 1.00 24.53 C ATOM 923 CG2 VAL A 59 -4.297 16.162 1.880 1.00 15.01 C ATOM 0 H VAL A 59 -6.673 16.789 3.926 1.00 53.43 H new ATOM 0 HA VAL A 59 -4.081 15.524 4.449 1.00 21.53 H new ATOM 0 HB VAL A 59 -4.921 17.984 2.886 1.00 2.23 H new ATOM 0 HG11 VAL A 59 -2.565 18.261 2.164 1.00 24.53 H new ATOM 0 HG12 VAL A 59 -2.770 18.535 3.910 1.00 24.53 H new ATOM 0 HG13 VAL A 59 -2.070 17.007 3.326 1.00 24.53 H new ATOM 0 HG21 VAL A 59 -4.002 16.658 0.955 1.00 15.01 H new ATOM 0 HG22 VAL A 59 -3.625 15.326 2.074 1.00 15.01 H new ATOM 0 HG23 VAL A 59 -5.318 15.792 1.784 1.00 15.01 H new ATOM 933 N HIS A 60 -3.270 16.855 6.345 1.00 53.35 N ATOM 934 CA HIS A 60 -2.760 17.518 7.541 1.00 53.24 C ATOM 935 C HIS A 60 -1.625 18.459 7.141 1.00 45.13 C ATOM 936 O HIS A 60 -0.684 18.042 6.469 1.00 31.42 O ATOM 937 CB HIS A 60 -2.305 16.440 8.545 1.00 1.32 C ATOM 938 CG HIS A 60 -3.460 15.572 8.969 1.00 64.10 C ATOM 939 ND1 HIS A 60 -4.510 15.845 9.780 1.00 14.14 N flip ATOM 940 CD2 HIS A 60 -3.694 14.310 8.460 1.00 55.41 C flip ATOM 941 CE1 HIS A 60 -5.348 14.768 9.736 1.00 31.01 C flip ATOM 942 NE2 HIS A 60 -4.839 13.860 8.937 1.00 41.11 N flip ATOM 0 H HIS A 60 -2.766 15.999 6.114 1.00 53.35 H new ATOM 0 HA HIS A 60 -3.531 18.120 8.022 1.00 53.24 H new ATOM 0 HB2 HIS A 60 -1.529 15.822 8.093 1.00 1.32 H new ATOM 0 HB3 HIS A 60 -1.864 16.917 9.420 1.00 1.32 H new ATOM 0 HD2 HIS A 60 -3.045 13.777 7.781 1.00 55.41 H new ATOM 0 HE1 HIS A 60 -6.281 14.678 10.273 1.00 31.01 H new ATOM 0 HE2 HIS A 60 -5.259 12.956 8.721 1.00 41.11 H new ATOM 951 N GLU A 61 -1.745 19.725 7.564 1.00 31.21 N ATOM 952 CA GLU A 61 -0.843 20.818 7.149 1.00 54.05 C ATOM 953 C GLU A 61 0.489 20.786 7.923 1.00 53.43 C ATOM 954 O GLU A 61 1.490 21.359 7.480 1.00 21.23 O ATOM 955 CB GLU A 61 -1.551 22.186 7.317 1.00 1.11 C ATOM 956 CG GLU A 61 -1.980 22.530 8.757 1.00 23.42 C ATOM 957 CD GLU A 61 -2.762 23.846 8.824 1.00 52.32 C ATOM 958 OE1 GLU A 61 -2.136 24.925 8.757 1.00 60.22 O ATOM 959 OE2 GLU A 61 -4.009 23.812 8.895 1.00 10.41 O ATOM 0 H GLU A 61 -2.476 20.026 8.209 1.00 31.21 H new ATOM 0 HA GLU A 61 -0.603 20.674 6.096 1.00 54.05 H new ATOM 0 HB2 GLU A 61 -0.884 22.969 6.957 1.00 1.11 H new ATOM 0 HB3 GLU A 61 -2.434 22.201 6.678 1.00 1.11 H new ATOM 0 HG2 GLU A 61 -2.595 21.722 9.155 1.00 23.42 H new ATOM 0 HG3 GLU A 61 -1.096 22.601 9.391 1.00 23.42 H new ATOM 966 N THR A 62 0.481 20.114 9.087 1.00 50.35 N ATOM 967 CA THR A 62 1.662 19.918 9.933 1.00 3.22 C ATOM 968 C THR A 62 1.884 18.397 10.124 1.00 33.54 C ATOM 969 O THR A 62 1.214 17.769 10.951 1.00 41.24 O ATOM 970 CB THR A 62 1.479 20.655 11.303 1.00 40.24 C ATOM 971 OG1 THR A 62 0.188 20.342 11.858 1.00 1.25 O ATOM 972 CG2 THR A 62 1.614 22.184 11.156 1.00 31.51 C ATOM 0 H THR A 62 -0.362 19.686 9.469 1.00 50.35 H new ATOM 0 HA THR A 62 2.544 20.346 9.457 1.00 3.22 H new ATOM 0 HB THR A 62 2.269 20.309 11.970 1.00 40.24 H new ATOM 0 HG1 THR A 62 0.028 19.378 11.790 1.00 1.25 H new ATOM 0 HG21 THR A 62 1.480 22.656 12.129 1.00 31.51 H new ATOM 0 HG22 THR A 62 2.603 22.426 10.768 1.00 31.51 H new ATOM 0 HG23 THR A 62 0.854 22.552 10.467 1.00 31.51 H new ATOM 980 N PRO A 63 2.787 17.767 9.304 1.00 62.32 N ATOM 981 CA PRO A 63 2.962 16.297 9.277 1.00 51.33 C ATOM 982 C PRO A 63 3.927 15.753 10.369 1.00 73.33 C ATOM 983 O PRO A 63 5.029 16.287 10.564 1.00 5.34 O ATOM 984 CB PRO A 63 3.529 16.078 7.853 1.00 22.54 C ATOM 985 CG PRO A 63 4.361 17.294 7.570 1.00 33.24 C ATOM 986 CD PRO A 63 3.701 18.440 8.324 1.00 12.12 C ATOM 0 HA PRO A 63 2.036 15.762 9.490 1.00 51.33 H new ATOM 0 HB2 PRO A 63 4.130 15.170 7.804 1.00 22.54 H new ATOM 0 HB3 PRO A 63 2.727 15.970 7.122 1.00 22.54 H new ATOM 0 HG2 PRO A 63 5.389 17.149 7.902 1.00 33.24 H new ATOM 0 HG3 PRO A 63 4.398 17.501 6.500 1.00 33.24 H new ATOM 0 HD2 PRO A 63 4.441 19.059 8.832 1.00 12.12 H new ATOM 0 HD3 PRO A 63 3.148 19.093 7.649 1.00 12.12 H new ATOM 994 N GLU A 64 3.495 14.685 11.076 1.00 42.30 N ATOM 995 CA GLU A 64 4.322 13.993 12.098 1.00 71.15 C ATOM 996 C GLU A 64 5.261 12.963 11.432 1.00 41.10 C ATOM 997 O GLU A 64 5.036 12.554 10.289 1.00 62.34 O ATOM 998 CB GLU A 64 3.412 13.284 13.142 1.00 34.52 C ATOM 999 CG GLU A 64 2.462 12.229 12.535 1.00 42.04 C ATOM 1000 CD GLU A 64 1.618 11.474 13.567 1.00 63.50 C ATOM 1001 OE1 GLU A 64 2.084 10.429 14.075 1.00 3.24 O ATOM 1002 OE2 GLU A 64 0.488 11.915 13.875 1.00 54.13 O ATOM 0 H GLU A 64 2.568 14.277 10.957 1.00 42.30 H new ATOM 0 HA GLU A 64 4.930 14.741 12.608 1.00 71.15 H new ATOM 0 HB2 GLU A 64 4.042 12.803 13.890 1.00 34.52 H new ATOM 0 HB3 GLU A 64 2.818 14.036 13.661 1.00 34.52 H new ATOM 0 HG2 GLU A 64 1.795 12.722 11.828 1.00 42.04 H new ATOM 0 HG3 GLU A 64 3.052 11.509 11.968 1.00 42.04 H new ATOM 1009 N SER A 65 6.300 12.548 12.169 1.00 52.33 N ATOM 1010 CA SER A 65 7.319 11.602 11.682 1.00 44.52 C ATOM 1011 C SER A 65 6.934 10.142 12.031 1.00 41.13 C ATOM 1012 O SER A 65 6.846 9.781 13.208 1.00 11.12 O ATOM 1013 CB SER A 65 8.676 11.987 12.303 1.00 12.12 C ATOM 1014 OG SER A 65 8.601 12.063 13.720 1.00 44.44 O ATOM 0 H SER A 65 6.460 12.860 13.127 1.00 52.33 H new ATOM 0 HA SER A 65 7.387 11.659 10.596 1.00 44.52 H new ATOM 0 HB2 SER A 65 9.429 11.253 12.017 1.00 12.12 H new ATOM 0 HB3 SER A 65 9.000 12.948 11.903 1.00 12.12 H new ATOM 0 HG SER A 65 8.009 11.357 14.055 1.00 44.44 H new ATOM 1020 N VAL A 66 6.679 9.316 10.991 1.00 2.02 N ATOM 1021 CA VAL A 66 6.271 7.899 11.141 1.00 52.20 C ATOM 1022 C VAL A 66 7.258 6.990 10.376 1.00 11.13 C ATOM 1023 O VAL A 66 7.317 7.048 9.150 1.00 10.21 O ATOM 1024 CB VAL A 66 4.808 7.673 10.590 1.00 50.13 C ATOM 1025 CG1 VAL A 66 4.294 6.246 10.899 1.00 22.11 C ATOM 1026 CG2 VAL A 66 3.839 8.761 11.122 1.00 64.12 C ATOM 0 H VAL A 66 6.751 9.615 10.018 1.00 2.02 H new ATOM 0 HA VAL A 66 6.284 7.647 12.201 1.00 52.20 H new ATOM 0 HB VAL A 66 4.845 7.767 9.505 1.00 50.13 H new ATOM 0 HG11 VAL A 66 3.285 6.129 10.504 1.00 22.11 H new ATOM 0 HG12 VAL A 66 4.953 5.513 10.433 1.00 22.11 H new ATOM 0 HG13 VAL A 66 4.282 6.089 11.978 1.00 22.11 H new ATOM 0 HG21 VAL A 66 2.839 8.582 10.727 1.00 64.12 H new ATOM 0 HG22 VAL A 66 3.812 8.723 12.211 1.00 64.12 H new ATOM 0 HG23 VAL A 66 4.185 9.744 10.802 1.00 64.12 H new ATOM 1036 N ASP A 67 8.004 6.141 11.106 1.00 63.01 N ATOM 1037 CA ASP A 67 9.038 5.262 10.509 1.00 34.31 C ATOM 1038 C ASP A 67 8.389 4.066 9.807 1.00 32.41 C ATOM 1039 O ASP A 67 7.738 3.239 10.454 1.00 43.13 O ATOM 1040 CB ASP A 67 10.036 4.753 11.583 1.00 15.42 C ATOM 1041 CG ASP A 67 10.936 5.864 12.133 1.00 2.33 C ATOM 1042 OD1 ASP A 67 11.796 6.365 11.379 1.00 64.21 O ATOM 1043 OD2 ASP A 67 10.786 6.248 13.315 1.00 3.32 O ATOM 0 H ASP A 67 7.912 6.042 12.117 1.00 63.01 H new ATOM 0 HA ASP A 67 9.587 5.855 9.778 1.00 34.31 H new ATOM 0 HB2 ASP A 67 9.479 4.303 12.405 1.00 15.42 H new ATOM 0 HB3 ASP A 67 10.658 3.969 11.152 1.00 15.42 H new ATOM 1048 N LEU A 68 8.570 3.987 8.475 1.00 62.25 N ATOM 1049 CA LEU A 68 8.067 2.874 7.643 1.00 2.52 C ATOM 1050 C LEU A 68 9.242 2.305 6.813 1.00 32.23 C ATOM 1051 O LEU A 68 10.342 2.874 6.815 1.00 14.42 O ATOM 1052 CB LEU A 68 6.900 3.341 6.724 1.00 23.55 C ATOM 1053 CG LEU A 68 5.743 4.135 7.416 1.00 70.44 C ATOM 1054 CD1 LEU A 68 4.767 4.698 6.376 1.00 50.10 C ATOM 1055 CD2 LEU A 68 4.990 3.289 8.466 1.00 33.34 C ATOM 0 H LEU A 68 9.072 4.697 7.942 1.00 62.25 H new ATOM 0 HA LEU A 68 7.667 2.091 8.287 1.00 2.52 H new ATOM 0 HB2 LEU A 68 7.317 3.965 5.933 1.00 23.55 H new ATOM 0 HB3 LEU A 68 6.471 2.462 6.244 1.00 23.55 H new ATOM 0 HG LEU A 68 6.207 4.966 7.948 1.00 70.44 H new ATOM 0 HD11 LEU A 68 3.972 5.246 6.882 1.00 50.10 H new ATOM 0 HD12 LEU A 68 5.300 5.371 5.704 1.00 50.10 H new ATOM 0 HD13 LEU A 68 4.335 3.879 5.802 1.00 50.10 H new ATOM 0 HD21 LEU A 68 4.198 3.888 8.916 1.00 33.34 H new ATOM 0 HD22 LEU A 68 4.554 2.414 7.984 1.00 33.34 H new ATOM 0 HD23 LEU A 68 5.686 2.967 9.241 1.00 33.34 H new ATOM 1067 N GLU A 69 8.999 1.199 6.095 1.00 40.22 N ATOM 1068 CA GLU A 69 10.057 0.466 5.366 1.00 73.13 C ATOM 1069 C GLU A 69 10.326 1.093 3.983 1.00 31.23 C ATOM 1070 O GLU A 69 9.452 1.753 3.399 1.00 11.14 O ATOM 1071 CB GLU A 69 9.645 -1.024 5.205 1.00 14.55 C ATOM 1072 CG GLU A 69 8.404 -1.249 4.297 1.00 22.12 C ATOM 1073 CD GLU A 69 7.805 -2.658 4.406 1.00 1.21 C ATOM 1074 OE1 GLU A 69 8.508 -3.634 4.094 1.00 73.53 O ATOM 1075 OE2 GLU A 69 6.627 -2.797 4.812 1.00 2.10 O ATOM 0 H GLU A 69 8.071 0.785 6.000 1.00 40.22 H new ATOM 0 HA GLU A 69 10.978 0.531 5.946 1.00 73.13 H new ATOM 0 HB2 GLU A 69 10.488 -1.579 4.793 1.00 14.55 H new ATOM 0 HB3 GLU A 69 9.440 -1.441 6.191 1.00 14.55 H new ATOM 0 HG2 GLU A 69 7.638 -0.518 4.556 1.00 22.12 H new ATOM 0 HG3 GLU A 69 8.685 -1.063 3.260 1.00 22.12 H new ATOM 1082 N THR A 70 11.562 0.909 3.498 1.00 41.12 N ATOM 1083 CA THR A 70 11.938 1.194 2.102 1.00 65.52 C ATOM 1084 C THR A 70 12.550 -0.071 1.466 1.00 33.00 C ATOM 1085 O THR A 70 12.776 -1.077 2.150 1.00 4.52 O ATOM 1086 CB THR A 70 12.925 2.412 2.021 1.00 41.11 C ATOM 1087 OG1 THR A 70 13.149 2.790 0.658 1.00 34.21 O ATOM 1088 CG2 THR A 70 14.277 2.119 2.691 1.00 51.31 C ATOM 0 H THR A 70 12.334 0.557 4.064 1.00 41.12 H new ATOM 0 HA THR A 70 11.045 1.470 1.541 1.00 65.52 H new ATOM 0 HB THR A 70 12.450 3.231 2.562 1.00 41.11 H new ATOM 0 HG1 THR A 70 13.765 3.552 0.627 1.00 34.21 H new ATOM 0 HG21 THR A 70 14.922 2.994 2.607 1.00 51.31 H new ATOM 0 HG22 THR A 70 14.118 1.885 3.744 1.00 51.31 H new ATOM 0 HG23 THR A 70 14.751 1.270 2.198 1.00 51.31 H new ATOM 1096 N SER A 71 12.860 0.011 0.166 1.00 0.01 N ATOM 1097 CA SER A 71 13.292 -1.136 -0.660 1.00 43.33 C ATOM 1098 C SER A 71 14.828 -1.317 -0.628 1.00 55.32 C ATOM 1099 O SER A 71 15.394 -2.063 -1.435 1.00 13.24 O ATOM 1100 CB SER A 71 12.809 -0.876 -2.107 1.00 74.43 C ATOM 1101 OG SER A 71 11.482 -0.365 -2.119 1.00 62.53 O ATOM 0 H SER A 71 12.819 0.887 -0.354 1.00 0.01 H new ATOM 0 HA SER A 71 12.860 -2.055 -0.265 1.00 43.33 H new ATOM 0 HB2 SER A 71 13.479 -0.169 -2.596 1.00 74.43 H new ATOM 0 HB3 SER A 71 12.851 -1.802 -2.680 1.00 74.43 H new ATOM 0 HG SER A 71 10.851 -1.088 -1.919 1.00 62.53 H new ATOM 1107 N ASP A 72 15.483 -0.684 0.354 1.00 1.11 N ATOM 1108 CA ASP A 72 16.943 -0.479 0.364 1.00 62.22 C ATOM 1109 C ASP A 72 17.539 -1.052 1.667 1.00 34.02 C ATOM 1110 O ASP A 72 18.422 -0.455 2.275 1.00 42.23 O ATOM 1111 CB ASP A 72 17.205 1.052 0.185 1.00 42.43 C ATOM 1112 CG ASP A 72 18.692 1.430 0.043 1.00 50.51 C ATOM 1113 OD1 ASP A 72 19.328 1.027 -0.952 1.00 55.22 O ATOM 1114 OD2 ASP A 72 19.231 2.147 0.923 1.00 21.23 O ATOM 0 H ASP A 72 15.013 -0.295 1.172 1.00 1.11 H new ATOM 0 HA ASP A 72 17.435 -1.008 -0.452 1.00 62.22 H new ATOM 0 HB2 ASP A 72 16.668 1.399 -0.698 1.00 42.43 H new ATOM 0 HB3 ASP A 72 16.788 1.582 1.041 1.00 42.43 H new ATOM 1119 N ASP A 73 17.023 -2.239 2.088 1.00 24.34 N ATOM 1120 CA ASP A 73 17.422 -2.965 3.349 1.00 61.34 C ATOM 1121 C ASP A 73 17.396 -2.052 4.598 1.00 40.23 C ATOM 1122 O ASP A 73 18.013 -2.355 5.629 1.00 41.42 O ATOM 1123 CB ASP A 73 18.780 -3.744 3.198 1.00 33.14 C ATOM 1124 CG ASP A 73 20.030 -2.857 3.032 1.00 10.10 C ATOM 1125 OD1 ASP A 73 20.558 -2.349 4.040 1.00 25.12 O ATOM 1126 OD2 ASP A 73 20.494 -2.668 1.887 1.00 2.41 O ATOM 0 H ASP A 73 16.306 -2.735 1.559 1.00 24.34 H new ATOM 0 HA ASP A 73 16.656 -3.723 3.513 1.00 61.34 H new ATOM 0 HB2 ASP A 73 18.917 -4.377 4.075 1.00 33.14 H new ATOM 0 HB3 ASP A 73 18.707 -4.406 2.335 1.00 33.14 H new ATOM 1131 N ARG A 74 16.573 -0.992 4.530 1.00 52.00 N ATOM 1132 CA ARG A 74 16.643 0.152 5.445 1.00 25.02 C ATOM 1133 C ARG A 74 15.226 0.491 5.961 1.00 3.52 C ATOM 1134 O ARG A 74 14.221 -0.066 5.490 1.00 25.24 O ATOM 1135 CB ARG A 74 17.302 1.349 4.665 1.00 51.13 C ATOM 1136 CG ARG A 74 17.691 2.593 5.491 1.00 51.33 C ATOM 1137 CD ARG A 74 18.347 3.697 4.637 1.00 52.45 C ATOM 1138 NE ARG A 74 19.615 3.255 4.025 1.00 22.12 N ATOM 1139 CZ ARG A 74 20.504 4.058 3.405 1.00 32.10 C ATOM 1140 NH1 ARG A 74 20.288 5.370 3.288 1.00 43.44 N ATOM 1141 NH2 ARG A 74 21.608 3.533 2.896 1.00 12.52 N ATOM 0 H ARG A 74 15.835 -0.908 3.831 1.00 52.00 H new ATOM 0 HA ARG A 74 17.252 -0.071 6.321 1.00 25.02 H new ATOM 0 HB2 ARG A 74 18.199 0.978 4.169 1.00 51.13 H new ATOM 0 HB3 ARG A 74 16.612 1.664 3.882 1.00 51.13 H new ATOM 0 HG2 ARG A 74 16.801 2.995 5.975 1.00 51.33 H new ATOM 0 HG3 ARG A 74 18.378 2.297 6.284 1.00 51.33 H new ATOM 0 HD2 ARG A 74 17.656 4.005 3.852 1.00 52.45 H new ATOM 0 HD3 ARG A 74 18.533 4.572 5.260 1.00 52.45 H new ATOM 0 HE ARG A 74 19.837 2.261 4.075 1.00 22.12 H new ATOM 0 HH11 ARG A 74 19.438 5.783 3.671 1.00 43.44 H new ATOM 0 HH12 ARG A 74 20.973 5.960 2.815 1.00 43.44 H new ATOM 0 HH21 ARG A 74 21.779 2.531 2.975 1.00 12.52 H new ATOM 0 HH22 ARG A 74 22.287 4.131 2.425 1.00 12.52 H new ATOM 1155 N THR A 75 15.175 1.440 6.892 1.00 13.22 N ATOM 1156 CA THR A 75 13.952 1.974 7.477 1.00 51.54 C ATOM 1157 C THR A 75 14.098 3.500 7.428 1.00 11.20 C ATOM 1158 O THR A 75 15.155 4.038 7.777 1.00 24.23 O ATOM 1159 CB THR A 75 13.740 1.479 8.945 1.00 25.14 C ATOM 1160 OG1 THR A 75 13.721 0.041 8.961 1.00 32.34 O ATOM 1161 CG2 THR A 75 12.426 2.010 9.553 1.00 64.43 C ATOM 0 H THR A 75 16.016 1.873 7.273 1.00 13.22 H new ATOM 0 HA THR A 75 13.077 1.633 6.924 1.00 51.54 H new ATOM 0 HB THR A 75 14.564 1.862 9.547 1.00 25.14 H new ATOM 0 HG1 THR A 75 12.820 -0.272 9.188 1.00 32.34 H new ATOM 0 HG21 THR A 75 12.322 1.640 10.573 1.00 64.43 H new ATOM 0 HG22 THR A 75 12.444 3.100 9.562 1.00 64.43 H new ATOM 0 HG23 THR A 75 11.583 1.666 8.954 1.00 64.43 H new ATOM 1169 N VAL A 76 13.040 4.184 6.993 1.00 21.21 N ATOM 1170 CA VAL A 76 13.087 5.624 6.684 1.00 75.35 C ATOM 1171 C VAL A 76 11.857 6.319 7.268 1.00 74.13 C ATOM 1172 O VAL A 76 10.763 5.742 7.333 1.00 20.24 O ATOM 1173 CB VAL A 76 13.213 5.924 5.137 1.00 75.22 C ATOM 1174 CG1 VAL A 76 14.628 5.583 4.600 1.00 74.01 C ATOM 1175 CG2 VAL A 76 12.124 5.190 4.330 1.00 12.31 C ATOM 0 H VAL A 76 12.124 3.761 6.843 1.00 21.21 H new ATOM 0 HA VAL A 76 13.991 6.021 7.146 1.00 75.35 H new ATOM 0 HB VAL A 76 13.061 6.995 5.005 1.00 75.22 H new ATOM 0 HG11 VAL A 76 14.675 5.803 3.533 1.00 74.01 H new ATOM 0 HG12 VAL A 76 15.371 6.181 5.127 1.00 74.01 H new ATOM 0 HG13 VAL A 76 14.833 4.525 4.762 1.00 74.01 H new ATOM 0 HG21 VAL A 76 12.240 5.418 3.271 1.00 12.31 H new ATOM 0 HG22 VAL A 76 12.221 4.115 4.482 1.00 12.31 H new ATOM 0 HG23 VAL A 76 11.140 5.517 4.666 1.00 12.31 H new ATOM 1185 N ARG A 77 12.078 7.553 7.719 1.00 3.34 N ATOM 1186 CA ARG A 77 11.047 8.406 8.293 1.00 12.11 C ATOM 1187 C ARG A 77 10.135 8.927 7.174 1.00 74.40 C ATOM 1188 O ARG A 77 10.616 9.461 6.170 1.00 4.31 O ATOM 1189 CB ARG A 77 11.733 9.565 9.080 1.00 14.21 C ATOM 1190 CG ARG A 77 10.794 10.661 9.657 1.00 3.54 C ATOM 1191 CD ARG A 77 10.541 11.844 8.692 1.00 53.23 C ATOM 1192 NE ARG A 77 11.789 12.578 8.375 1.00 1.43 N ATOM 1193 CZ ARG A 77 12.362 12.679 7.156 1.00 14.21 C ATOM 1194 NH1 ARG A 77 11.822 12.088 6.093 1.00 2.50 N ATOM 1195 NH2 ARG A 77 13.473 13.384 7.007 1.00 24.22 N ATOM 0 H ARG A 77 12.998 7.993 7.694 1.00 3.34 H new ATOM 0 HA ARG A 77 10.423 7.846 8.990 1.00 12.11 H new ATOM 0 HB2 ARG A 77 12.297 9.130 9.905 1.00 14.21 H new ATOM 0 HB3 ARG A 77 12.454 10.046 8.419 1.00 14.21 H new ATOM 0 HG2 ARG A 77 9.838 10.206 9.917 1.00 3.54 H new ATOM 0 HG3 ARG A 77 11.226 11.045 10.581 1.00 3.54 H new ATOM 0 HD2 ARG A 77 10.096 11.471 7.770 1.00 53.23 H new ATOM 0 HD3 ARG A 77 9.821 12.529 9.139 1.00 53.23 H new ATOM 0 HE ARG A 77 12.258 13.050 9.148 1.00 1.43 H new ATOM 0 HH11 ARG A 77 10.962 11.548 6.191 1.00 2.50 H new ATOM 0 HH12 ARG A 77 12.268 12.175 5.180 1.00 2.50 H new ATOM 0 HH21 ARG A 77 13.894 13.849 7.812 1.00 24.22 H new ATOM 0 HH22 ARG A 77 13.908 13.462 6.088 1.00 24.22 H new ATOM 1209 N TYR A 78 8.835 8.723 7.363 1.00 11.32 N ATOM 1210 CA TYR A 78 7.771 9.291 6.525 1.00 54.52 C ATOM 1211 C TYR A 78 7.108 10.452 7.269 1.00 24.51 C ATOM 1212 O TYR A 78 7.324 10.642 8.469 1.00 13.03 O ATOM 1213 CB TYR A 78 6.718 8.211 6.169 1.00 73.44 C ATOM 1214 CG TYR A 78 7.161 7.190 5.106 1.00 33.34 C ATOM 1215 CD1 TYR A 78 8.259 6.354 5.311 1.00 43.23 C ATOM 1216 CD2 TYR A 78 6.466 7.053 3.903 1.00 33.31 C ATOM 1217 CE1 TYR A 78 8.637 5.424 4.361 1.00 52.43 C ATOM 1218 CE2 TYR A 78 6.841 6.126 2.956 1.00 71.24 C ATOM 1219 CZ TYR A 78 7.924 5.310 3.188 1.00 1.11 C ATOM 1220 OH TYR A 78 8.299 4.379 2.239 1.00 51.13 O ATOM 0 H TYR A 78 8.477 8.143 8.122 1.00 11.32 H new ATOM 0 HA TYR A 78 8.207 9.656 5.595 1.00 54.52 H new ATOM 0 HB2 TYR A 78 6.452 7.672 7.078 1.00 73.44 H new ATOM 0 HB3 TYR A 78 5.815 8.709 5.817 1.00 73.44 H new ATOM 0 HD1 TYR A 78 8.824 6.435 6.228 1.00 43.23 H new ATOM 0 HD2 TYR A 78 5.614 7.689 3.710 1.00 33.31 H new ATOM 0 HE1 TYR A 78 9.491 4.787 4.538 1.00 52.43 H new ATOM 0 HE2 TYR A 78 6.286 6.040 2.033 1.00 71.24 H new ATOM 0 HH TYR A 78 8.638 3.575 2.685 1.00 51.13 H new ATOM 1230 N LEU A 79 6.316 11.230 6.537 1.00 3.45 N ATOM 1231 CA LEU A 79 5.544 12.350 7.089 1.00 3.40 C ATOM 1232 C LEU A 79 4.051 12.103 6.857 1.00 11.15 C ATOM 1233 O LEU A 79 3.645 11.759 5.737 1.00 1.34 O ATOM 1234 CB LEU A 79 6.008 13.682 6.445 1.00 13.43 C ATOM 1235 CG LEU A 79 7.450 14.152 6.828 1.00 4.21 C ATOM 1236 CD1 LEU A 79 7.816 15.466 6.108 1.00 23.14 C ATOM 1237 CD2 LEU A 79 7.607 14.296 8.365 1.00 11.01 C ATOM 0 H LEU A 79 6.188 11.103 5.533 1.00 3.45 H new ATOM 0 HA LEU A 79 5.715 12.424 8.163 1.00 3.40 H new ATOM 0 HB2 LEU A 79 5.955 13.579 5.361 1.00 13.43 H new ATOM 0 HB3 LEU A 79 5.304 14.465 6.725 1.00 13.43 H new ATOM 0 HG LEU A 79 8.147 13.383 6.495 1.00 4.21 H new ATOM 0 HD11 LEU A 79 8.824 15.769 6.393 1.00 23.14 H new ATOM 0 HD12 LEU A 79 7.774 15.314 5.029 1.00 23.14 H new ATOM 0 HD13 LEU A 79 7.109 16.246 6.392 1.00 23.14 H new ATOM 0 HD21 LEU A 79 8.620 14.624 8.598 1.00 11.01 H new ATOM 0 HD22 LEU A 79 6.893 15.031 8.736 1.00 11.01 H new ATOM 0 HD23 LEU A 79 7.418 13.334 8.842 1.00 11.01 H new ATOM 1249 N HIS A 80 3.243 12.265 7.927 1.00 41.43 N ATOM 1250 CA HIS A 80 1.794 12.049 7.867 1.00 52.22 C ATOM 1251 C HIS A 80 1.122 13.271 7.236 1.00 71.12 C ATOM 1252 O HIS A 80 0.858 14.282 7.901 1.00 11.54 O ATOM 1253 CB HIS A 80 1.242 11.767 9.287 1.00 74.12 C ATOM 1254 CG HIS A 80 -0.254 11.594 9.367 1.00 34.20 C ATOM 1255 ND1 HIS A 80 -0.984 12.136 10.398 1.00 74.01 N ATOM 1256 CD2 HIS A 80 -1.093 10.928 8.541 1.00 41.03 C ATOM 1257 CE1 HIS A 80 -2.233 11.793 10.175 1.00 63.45 C ATOM 1258 NE2 HIS A 80 -2.348 11.061 9.059 1.00 64.11 N ATOM 0 H HIS A 80 3.581 12.547 8.847 1.00 41.43 H new ATOM 0 HA HIS A 80 1.574 11.180 7.247 1.00 52.22 H new ATOM 0 HB2 HIS A 80 1.718 10.866 9.673 1.00 74.12 H new ATOM 0 HB3 HIS A 80 1.533 12.587 9.943 1.00 74.12 H new ATOM 0 HD2 HIS A 80 -0.821 10.393 7.643 1.00 41.03 H new ATOM 0 HE1 HIS A 80 -3.062 12.067 10.811 1.00 63.45 H new ATOM 0 HE2 HIS A 80 -3.209 10.677 8.671 1.00 64.11 H new ATOM 1266 N VAL A 81 0.837 13.144 5.946 1.00 34.11 N ATOM 1267 CA VAL A 81 0.301 14.240 5.130 1.00 40.31 C ATOM 1268 C VAL A 81 -1.198 14.096 4.897 1.00 54.01 C ATOM 1269 O VAL A 81 -1.852 15.080 4.595 1.00 0.22 O ATOM 1270 CB VAL A 81 1.046 14.327 3.754 1.00 2.40 C ATOM 1271 CG1 VAL A 81 2.551 14.630 3.966 1.00 34.42 C ATOM 1272 CG2 VAL A 81 0.829 13.033 2.929 1.00 4.32 C ATOM 0 H VAL A 81 0.970 12.275 5.428 1.00 34.11 H new ATOM 0 HA VAL A 81 0.469 15.162 5.687 1.00 40.31 H new ATOM 0 HB VAL A 81 0.624 15.152 3.181 1.00 2.40 H new ATOM 0 HG11 VAL A 81 3.051 14.686 2.999 1.00 34.42 H new ATOM 0 HG12 VAL A 81 2.661 15.581 4.487 1.00 34.42 H new ATOM 0 HG13 VAL A 81 3.002 13.836 4.561 1.00 34.42 H new ATOM 0 HG21 VAL A 81 1.355 13.115 1.978 1.00 4.32 H new ATOM 0 HG22 VAL A 81 1.215 12.178 3.484 1.00 4.32 H new ATOM 0 HG23 VAL A 81 -0.236 12.894 2.744 1.00 4.32 H new ATOM 1282 N ALA A 82 -1.744 12.873 5.023 1.00 63.24 N ATOM 1283 CA ALA A 82 -3.164 12.624 4.721 1.00 14.51 C ATOM 1284 C ALA A 82 -3.724 11.458 5.537 1.00 55.40 C ATOM 1285 O ALA A 82 -2.977 10.640 6.069 1.00 54.31 O ATOM 1286 CB ALA A 82 -3.347 12.366 3.210 1.00 75.21 C ATOM 0 H ALA A 82 -1.228 12.048 5.329 1.00 63.24 H new ATOM 0 HA ALA A 82 -3.726 13.515 5.002 1.00 14.51 H new ATOM 0 HB1 ALA A 82 -4.400 12.183 2.997 1.00 75.21 H new ATOM 0 HB2 ALA A 82 -3.009 13.237 2.649 1.00 75.21 H new ATOM 0 HB3 ALA A 82 -2.761 11.495 2.916 1.00 75.21 H new ATOM 1292 N THR A 83 -5.056 11.428 5.645 1.00 72.42 N ATOM 1293 CA THR A 83 -5.819 10.284 6.148 1.00 33.51 C ATOM 1294 C THR A 83 -6.995 10.063 5.185 1.00 2.33 C ATOM 1295 O THR A 83 -7.697 11.012 4.819 1.00 73.51 O ATOM 1296 CB THR A 83 -6.326 10.503 7.611 1.00 32.30 C ATOM 1297 OG1 THR A 83 -5.207 10.809 8.456 1.00 21.01 O ATOM 1298 CG2 THR A 83 -7.058 9.262 8.170 1.00 31.42 C ATOM 0 H THR A 83 -5.646 12.217 5.379 1.00 72.42 H new ATOM 0 HA THR A 83 -5.176 9.405 6.188 1.00 33.51 H new ATOM 0 HB THR A 83 -7.038 11.328 7.594 1.00 32.30 H new ATOM 0 HG1 THR A 83 -4.887 9.988 8.885 1.00 21.01 H new ATOM 0 HG21 THR A 83 -7.391 9.464 9.188 1.00 31.42 H new ATOM 0 HG22 THR A 83 -7.921 9.036 7.544 1.00 31.42 H new ATOM 0 HG23 THR A 83 -6.379 8.409 8.173 1.00 31.42 H new ATOM 1306 N LEU A 84 -7.174 8.813 4.766 1.00 5.12 N ATOM 1307 CA LEU A 84 -8.085 8.431 3.683 1.00 31.33 C ATOM 1308 C LEU A 84 -9.265 7.675 4.307 1.00 74.43 C ATOM 1309 O LEU A 84 -9.122 6.508 4.682 1.00 74.41 O ATOM 1310 CB LEU A 84 -7.312 7.548 2.644 1.00 61.42 C ATOM 1311 CG LEU A 84 -5.907 8.080 2.185 1.00 60.44 C ATOM 1312 CD1 LEU A 84 -5.241 7.125 1.167 1.00 54.03 C ATOM 1313 CD2 LEU A 84 -5.983 9.525 1.636 1.00 4.42 C ATOM 0 H LEU A 84 -6.682 8.019 5.176 1.00 5.12 H new ATOM 0 HA LEU A 84 -8.464 9.305 3.153 1.00 31.33 H new ATOM 0 HB2 LEU A 84 -7.178 6.555 3.072 1.00 61.42 H new ATOM 0 HB3 LEU A 84 -7.939 7.432 1.760 1.00 61.42 H new ATOM 0 HG LEU A 84 -5.275 8.108 3.073 1.00 60.44 H new ATOM 0 HD11 LEU A 84 -4.271 7.526 0.873 1.00 54.03 H new ATOM 0 HD12 LEU A 84 -5.105 6.144 1.623 1.00 54.03 H new ATOM 0 HD13 LEU A 84 -5.877 7.031 0.287 1.00 54.03 H new ATOM 0 HD21 LEU A 84 -4.989 9.851 1.331 1.00 4.42 H new ATOM 0 HD22 LEU A 84 -6.654 9.553 0.777 1.00 4.42 H new ATOM 0 HD23 LEU A 84 -6.360 10.190 2.413 1.00 4.42 H new ATOM 1325 N SER A 85 -10.402 8.364 4.473 1.00 71.42 N ATOM 1326 CA SER A 85 -11.604 7.788 5.097 1.00 72.04 C ATOM 1327 C SER A 85 -12.571 7.274 4.024 1.00 61.51 C ATOM 1328 O SER A 85 -12.988 8.030 3.147 1.00 5.02 O ATOM 1329 CB SER A 85 -12.288 8.838 5.990 1.00 25.31 C ATOM 1330 OG SER A 85 -11.453 9.178 7.082 1.00 42.01 O ATOM 0 H SER A 85 -10.516 9.334 4.180 1.00 71.42 H new ATOM 0 HA SER A 85 -11.308 6.943 5.719 1.00 72.04 H new ATOM 0 HB2 SER A 85 -12.514 9.730 5.406 1.00 25.31 H new ATOM 0 HB3 SER A 85 -13.237 8.449 6.358 1.00 25.31 H new ATOM 0 HG SER A 85 -11.901 9.848 7.640 1.00 42.01 H new ATOM 1336 N PHE A 86 -12.937 5.998 4.135 1.00 33.53 N ATOM 1337 CA PHE A 86 -13.769 5.279 3.156 1.00 41.31 C ATOM 1338 C PHE A 86 -14.739 4.358 3.894 1.00 43.51 C ATOM 1339 O PHE A 86 -14.619 4.170 5.105 1.00 42.33 O ATOM 1340 CB PHE A 86 -12.871 4.438 2.199 1.00 3.43 C ATOM 1341 CG PHE A 86 -11.846 3.542 2.907 1.00 40.42 C ATOM 1342 CD1 PHE A 86 -10.590 4.038 3.249 1.00 22.05 C ATOM 1343 CD2 PHE A 86 -12.137 2.217 3.231 1.00 63.22 C ATOM 1344 CE1 PHE A 86 -9.662 3.246 3.891 1.00 63.13 C ATOM 1345 CE2 PHE A 86 -11.206 1.425 3.871 1.00 41.24 C ATOM 1346 CZ PHE A 86 -9.971 1.939 4.203 1.00 20.12 C ATOM 0 H PHE A 86 -12.659 5.416 4.926 1.00 33.53 H new ATOM 0 HA PHE A 86 -14.329 6.003 2.565 1.00 41.31 H new ATOM 0 HB2 PHE A 86 -13.512 3.813 1.577 1.00 3.43 H new ATOM 0 HB3 PHE A 86 -12.341 5.116 1.530 1.00 3.43 H new ATOM 0 HD1 PHE A 86 -10.339 5.060 3.007 1.00 22.05 H new ATOM 0 HD2 PHE A 86 -13.103 1.806 2.978 1.00 63.22 H new ATOM 0 HE1 PHE A 86 -8.694 3.649 4.149 1.00 63.13 H new ATOM 0 HE2 PHE A 86 -11.446 0.400 4.112 1.00 41.24 H new ATOM 0 HZ PHE A 86 -9.245 1.318 4.707 1.00 20.12 H new ATOM 1356 N ASP A 87 -15.685 3.775 3.152 1.00 13.45 N ATOM 1357 CA ASP A 87 -16.536 2.693 3.659 1.00 24.43 C ATOM 1358 C ASP A 87 -15.901 1.346 3.276 1.00 2.41 C ATOM 1359 O ASP A 87 -15.399 1.182 2.156 1.00 64.33 O ATOM 1360 CB ASP A 87 -17.976 2.799 3.096 1.00 70.22 C ATOM 1361 CG ASP A 87 -18.868 1.602 3.495 1.00 41.13 C ATOM 1362 OD1 ASP A 87 -19.115 1.402 4.702 1.00 41.42 O ATOM 1363 OD2 ASP A 87 -19.313 0.851 2.597 1.00 42.24 O ATOM 0 H ASP A 87 -15.883 4.038 2.187 1.00 13.45 H new ATOM 0 HA ASP A 87 -16.608 2.772 4.744 1.00 24.43 H new ATOM 0 HB2 ASP A 87 -18.433 3.721 3.454 1.00 70.22 H new ATOM 0 HB3 ASP A 87 -17.932 2.866 2.009 1.00 70.22 H new ATOM 1368 N LEU A 88 -15.927 0.410 4.232 1.00 13.01 N ATOM 1369 CA LEU A 88 -15.474 -0.974 4.058 1.00 32.52 C ATOM 1370 C LEU A 88 -16.010 -1.797 5.234 1.00 72.12 C ATOM 1371 O LEU A 88 -15.788 -1.435 6.400 1.00 14.44 O ATOM 1372 CB LEU A 88 -13.923 -1.073 3.986 1.00 1.12 C ATOM 1373 CG LEU A 88 -13.327 -2.505 3.773 1.00 4.11 C ATOM 1374 CD1 LEU A 88 -13.703 -3.086 2.386 1.00 33.33 C ATOM 1375 CD2 LEU A 88 -11.794 -2.510 3.998 1.00 22.11 C ATOM 0 H LEU A 88 -16.273 0.600 5.173 1.00 13.01 H new ATOM 0 HA LEU A 88 -15.855 -1.360 3.112 1.00 32.52 H new ATOM 0 HB2 LEU A 88 -13.577 -0.434 3.173 1.00 1.12 H new ATOM 0 HB3 LEU A 88 -13.511 -0.665 4.909 1.00 1.12 H new ATOM 0 HG LEU A 88 -13.774 -3.160 4.521 1.00 4.11 H new ATOM 0 HD11 LEU A 88 -13.270 -4.080 2.279 1.00 33.33 H new ATOM 0 HD12 LEU A 88 -14.788 -3.151 2.301 1.00 33.33 H new ATOM 0 HD13 LEU A 88 -13.316 -2.435 1.602 1.00 33.33 H new ATOM 0 HD21 LEU A 88 -11.407 -3.517 3.843 1.00 22.11 H new ATOM 0 HD22 LEU A 88 -11.321 -1.827 3.293 1.00 22.11 H new ATOM 0 HD23 LEU A 88 -11.575 -2.189 5.016 1.00 22.11 H new ATOM 1387 N ASP A 89 -16.742 -2.874 4.902 1.00 33.44 N ATOM 1388 CA ASP A 89 -17.310 -3.829 5.874 1.00 73.35 C ATOM 1389 C ASP A 89 -18.375 -3.142 6.768 1.00 52.01 C ATOM 1390 O ASP A 89 -18.365 -3.235 8.005 1.00 53.45 O ATOM 1391 CB ASP A 89 -16.178 -4.530 6.682 1.00 75.31 C ATOM 1392 CG ASP A 89 -16.663 -5.710 7.538 1.00 31.21 C ATOM 1393 OD1 ASP A 89 -17.100 -6.729 6.966 1.00 74.45 O ATOM 1394 OD2 ASP A 89 -16.588 -5.632 8.780 1.00 63.03 O ATOM 0 H ASP A 89 -16.960 -3.111 3.934 1.00 33.44 H new ATOM 0 HA ASP A 89 -17.834 -4.618 5.335 1.00 73.35 H new ATOM 0 HB2 ASP A 89 -15.417 -4.886 5.988 1.00 75.31 H new ATOM 0 HB3 ASP A 89 -15.700 -3.796 7.330 1.00 75.31 H new ATOM 1399 N GLY A 90 -19.267 -2.394 6.093 1.00 42.12 N ATOM 1400 CA GLY A 90 -20.472 -1.838 6.706 1.00 52.14 C ATOM 1401 C GLY A 90 -20.248 -0.582 7.540 1.00 71.04 C ATOM 1402 O GLY A 90 -21.208 -0.067 8.129 1.00 3.21 O ATOM 0 H GLY A 90 -19.166 -2.162 5.105 1.00 42.12 H new ATOM 0 HA2 GLY A 90 -21.190 -1.610 5.919 1.00 52.14 H new ATOM 0 HA3 GLY A 90 -20.925 -2.601 7.339 1.00 52.14 H new ATOM 1406 N GLU A 91 -19.002 -0.071 7.588 1.00 64.12 N ATOM 1407 CA GLU A 91 -18.653 1.112 8.404 1.00 50.41 C ATOM 1408 C GLU A 91 -17.476 1.886 7.787 1.00 54.15 C ATOM 1409 O GLU A 91 -16.782 1.383 6.896 1.00 52.42 O ATOM 1410 CB GLU A 91 -18.308 0.687 9.857 1.00 53.32 C ATOM 1411 CG GLU A 91 -17.054 -0.194 9.978 1.00 70.14 C ATOM 1412 CD GLU A 91 -16.717 -0.554 11.428 1.00 1.44 C ATOM 1413 OE1 GLU A 91 -16.016 0.237 12.099 1.00 53.02 O ATOM 1414 OE2 GLU A 91 -17.151 -1.625 11.905 1.00 61.21 O ATOM 0 H GLU A 91 -18.215 -0.461 7.069 1.00 64.12 H new ATOM 0 HA GLU A 91 -19.521 1.771 8.424 1.00 50.41 H new ATOM 0 HB2 GLU A 91 -18.168 1.583 10.462 1.00 53.32 H new ATOM 0 HB3 GLU A 91 -19.158 0.149 10.277 1.00 53.32 H new ATOM 0 HG2 GLU A 91 -17.203 -1.110 9.407 1.00 70.14 H new ATOM 0 HG3 GLU A 91 -16.206 0.326 9.531 1.00 70.14 H new ATOM 1421 N SER A 92 -17.254 3.105 8.300 1.00 64.13 N ATOM 1422 CA SER A 92 -16.187 3.984 7.830 1.00 22.23 C ATOM 1423 C SER A 92 -14.841 3.572 8.457 1.00 75.34 C ATOM 1424 O SER A 92 -14.644 3.700 9.665 1.00 21.33 O ATOM 1425 CB SER A 92 -16.513 5.460 8.153 1.00 33.25 C ATOM 1426 OG SER A 92 -15.481 6.327 7.697 1.00 33.52 O ATOM 0 H SER A 92 -17.813 3.505 9.054 1.00 64.13 H new ATOM 0 HA SER A 92 -16.108 3.885 6.747 1.00 22.23 H new ATOM 0 HB2 SER A 92 -17.458 5.737 7.685 1.00 33.25 H new ATOM 0 HB3 SER A 92 -16.643 5.579 9.229 1.00 33.25 H new ATOM 0 HG SER A 92 -15.714 7.254 7.913 1.00 33.52 H new ATOM 1432 N ARG A 93 -13.938 3.054 7.616 1.00 53.51 N ATOM 1433 CA ARG A 93 -12.548 2.727 7.994 1.00 44.43 C ATOM 1434 C ARG A 93 -11.640 3.885 7.527 1.00 73.32 C ATOM 1435 O ARG A 93 -11.982 4.585 6.565 1.00 73.10 O ATOM 1436 CB ARG A 93 -12.109 1.407 7.301 1.00 73.32 C ATOM 1437 CG ARG A 93 -13.073 0.213 7.450 1.00 31.41 C ATOM 1438 CD ARG A 93 -13.179 -0.333 8.880 1.00 24.43 C ATOM 1439 NE ARG A 93 -14.070 -1.506 8.931 1.00 72.14 N ATOM 1440 CZ ARG A 93 -14.140 -2.391 9.935 1.00 20.22 C ATOM 1441 NH1 ARG A 93 -13.368 -2.269 11.010 1.00 21.22 N ATOM 1442 NH2 ARG A 93 -15.009 -3.387 9.873 1.00 53.34 N ATOM 0 H ARG A 93 -14.150 2.846 6.640 1.00 53.51 H new ATOM 0 HA ARG A 93 -12.472 2.596 9.073 1.00 44.43 H new ATOM 0 HB2 ARG A 93 -11.971 1.606 6.238 1.00 73.32 H new ATOM 0 HB3 ARG A 93 -11.137 1.116 7.700 1.00 73.32 H new ATOM 0 HG2 ARG A 93 -14.065 0.517 7.114 1.00 31.41 H new ATOM 0 HG3 ARG A 93 -12.745 -0.590 6.790 1.00 31.41 H new ATOM 0 HD2 ARG A 93 -12.189 -0.608 9.243 1.00 24.43 H new ATOM 0 HD3 ARG A 93 -13.557 0.445 9.543 1.00 24.43 H new ATOM 0 HE ARG A 93 -14.687 -1.657 8.133 1.00 72.14 H new ATOM 0 HH11 ARG A 93 -12.710 -1.493 11.080 1.00 21.22 H new ATOM 0 HH12 ARG A 93 -13.434 -2.951 11.765 1.00 21.22 H new ATOM 0 HH21 ARG A 93 -15.622 -3.479 9.063 1.00 53.34 H new ATOM 0 HH22 ARG A 93 -15.065 -4.063 10.635 1.00 53.34 H new ATOM 1456 N ASP A 94 -10.490 4.089 8.187 1.00 45.03 N ATOM 1457 CA ASP A 94 -9.508 5.111 7.757 1.00 32.31 C ATOM 1458 C ASP A 94 -8.093 4.518 7.691 1.00 50.24 C ATOM 1459 O ASP A 94 -7.700 3.716 8.547 1.00 43.13 O ATOM 1460 CB ASP A 94 -9.540 6.348 8.695 1.00 75.11 C ATOM 1461 CG ASP A 94 -9.033 6.068 10.129 1.00 54.34 C ATOM 1462 OD1 ASP A 94 -9.814 5.537 10.951 1.00 55.23 O ATOM 1463 OD2 ASP A 94 -7.862 6.391 10.439 1.00 51.44 O ATOM 0 H ASP A 94 -10.213 3.565 9.017 1.00 45.03 H new ATOM 0 HA ASP A 94 -9.788 5.440 6.756 1.00 32.31 H new ATOM 0 HB2 ASP A 94 -8.933 7.140 8.255 1.00 75.11 H new ATOM 0 HB3 ASP A 94 -10.562 6.723 8.749 1.00 75.11 H new ATOM 1468 N LEU A 95 -7.350 4.912 6.640 1.00 53.13 N ATOM 1469 CA LEU A 95 -5.934 4.552 6.447 1.00 24.24 C ATOM 1470 C LEU A 95 -5.132 5.823 6.210 1.00 5.11 C ATOM 1471 O LEU A 95 -5.492 6.628 5.356 1.00 2.45 O ATOM 1472 CB LEU A 95 -5.750 3.592 5.244 1.00 41.13 C ATOM 1473 CG LEU A 95 -6.458 2.218 5.359 1.00 23.15 C ATOM 1474 CD1 LEU A 95 -6.147 1.339 4.135 1.00 51.04 C ATOM 1475 CD2 LEU A 95 -6.098 1.510 6.679 1.00 0.14 C ATOM 0 H LEU A 95 -7.722 5.497 5.892 1.00 53.13 H new ATOM 0 HA LEU A 95 -5.582 4.038 7.341 1.00 24.24 H new ATOM 0 HB2 LEU A 95 -6.113 4.092 4.346 1.00 41.13 H new ATOM 0 HB3 LEU A 95 -4.683 3.418 5.103 1.00 41.13 H new ATOM 0 HG LEU A 95 -7.534 2.392 5.374 1.00 23.15 H new ATOM 0 HD11 LEU A 95 -6.654 0.380 4.238 1.00 51.04 H new ATOM 0 HD12 LEU A 95 -6.495 1.838 3.231 1.00 51.04 H new ATOM 0 HD13 LEU A 95 -5.071 1.175 4.069 1.00 51.04 H new ATOM 0 HD21 LEU A 95 -6.611 0.549 6.728 1.00 0.14 H new ATOM 0 HD22 LEU A 95 -5.021 1.349 6.724 1.00 0.14 H new ATOM 0 HD23 LEU A 95 -6.407 2.130 7.520 1.00 0.14 H new ATOM 1487 N HIS A 96 -4.029 5.980 6.927 1.00 4.13 N ATOM 1488 CA HIS A 96 -3.229 7.205 6.882 1.00 22.30 C ATOM 1489 C HIS A 96 -2.198 7.092 5.753 1.00 34.20 C ATOM 1490 O HIS A 96 -1.501 6.080 5.644 1.00 54.53 O ATOM 1491 CB HIS A 96 -2.550 7.431 8.251 1.00 71.33 C ATOM 1492 CG HIS A 96 -3.524 7.580 9.397 1.00 25.02 C ATOM 1493 ND1 HIS A 96 -3.674 8.767 10.062 1.00 32.14 N ATOM 1494 CD2 HIS A 96 -4.381 6.672 9.930 1.00 35.15 C ATOM 1495 CE1 HIS A 96 -4.605 8.563 10.970 1.00 41.52 C ATOM 1496 NE2 HIS A 96 -5.068 7.310 10.926 1.00 21.33 N ATOM 0 H HIS A 96 -3.660 5.267 7.556 1.00 4.13 H new ATOM 0 HA HIS A 96 -3.866 8.066 6.679 1.00 22.30 H new ATOM 0 HB2 HIS A 96 -1.884 6.593 8.459 1.00 71.33 H new ATOM 0 HB3 HIS A 96 -1.929 8.325 8.195 1.00 71.33 H new ATOM 0 HD1 HIS A 96 -3.167 9.635 9.889 1.00 32.14 H new ATOM 0 HD2 HIS A 96 -4.498 5.642 9.626 1.00 35.15 H new ATOM 0 HE1 HIS A 96 -4.952 9.314 11.664 1.00 41.52 H new ATOM 1504 N ALA A 97 -2.124 8.139 4.917 1.00 11.33 N ATOM 1505 CA ALA A 97 -1.240 8.194 3.748 1.00 32.34 C ATOM 1506 C ALA A 97 -0.014 9.033 4.091 1.00 54.31 C ATOM 1507 O ALA A 97 -0.141 10.189 4.532 1.00 32.40 O ATOM 1508 CB ALA A 97 -1.982 8.789 2.540 1.00 50.23 C ATOM 0 H ALA A 97 -2.685 8.982 5.038 1.00 11.33 H new ATOM 0 HA ALA A 97 -0.925 7.185 3.483 1.00 32.34 H new ATOM 0 HB1 ALA A 97 -1.311 8.822 1.681 1.00 50.23 H new ATOM 0 HB2 ALA A 97 -2.846 8.168 2.302 1.00 50.23 H new ATOM 0 HB3 ALA A 97 -2.316 9.799 2.779 1.00 50.23 H new ATOM 1514 N PHE A 98 1.166 8.434 3.912 1.00 2.10 N ATOM 1515 CA PHE A 98 2.445 9.062 4.239 1.00 71.34 C ATOM 1516 C PHE A 98 3.327 9.120 2.985 1.00 40.33 C ATOM 1517 O PHE A 98 3.060 8.446 1.984 1.00 52.45 O ATOM 1518 CB PHE A 98 3.184 8.255 5.344 1.00 21.24 C ATOM 1519 CG PHE A 98 2.332 7.743 6.510 1.00 45.34 C ATOM 1520 CD1 PHE A 98 2.093 8.534 7.622 1.00 25.24 C ATOM 1521 CD2 PHE A 98 1.801 6.453 6.501 1.00 12.42 C ATOM 1522 CE1 PHE A 98 1.356 8.057 8.689 1.00 4.12 C ATOM 1523 CE2 PHE A 98 1.065 5.977 7.567 1.00 1.11 C ATOM 1524 CZ PHE A 98 0.848 6.779 8.664 1.00 22.32 C ATOM 0 H PHE A 98 1.259 7.492 3.533 1.00 2.10 H new ATOM 0 HA PHE A 98 2.251 10.070 4.605 1.00 71.34 H new ATOM 0 HB2 PHE A 98 3.667 7.398 4.874 1.00 21.24 H new ATOM 0 HB3 PHE A 98 3.976 8.883 5.752 1.00 21.24 H new ATOM 0 HD1 PHE A 98 2.489 9.538 7.655 1.00 25.24 H new ATOM 0 HD2 PHE A 98 1.969 5.816 5.645 1.00 12.42 H new ATOM 0 HE1 PHE A 98 1.178 8.690 9.546 1.00 4.12 H new ATOM 0 HE2 PHE A 98 0.660 4.976 7.540 1.00 1.11 H new ATOM 0 HZ PHE A 98 0.280 6.406 9.503 1.00 22.32 H new ATOM 1534 N ARG A 99 4.393 9.917 3.079 1.00 4.21 N ATOM 1535 CA ARG A 99 5.434 10.026 2.043 1.00 2.21 C ATOM 1536 C ARG A 99 6.720 10.502 2.729 1.00 73.24 C ATOM 1537 O ARG A 99 6.646 11.355 3.623 1.00 22.53 O ATOM 1538 CB ARG A 99 4.968 10.982 0.921 1.00 0.22 C ATOM 1539 CG ARG A 99 4.688 12.436 1.373 1.00 15.11 C ATOM 1540 CD ARG A 99 3.527 13.079 0.606 1.00 40.40 C ATOM 1541 NE ARG A 99 3.742 13.140 -0.847 1.00 14.41 N ATOM 1542 CZ ARG A 99 3.050 13.915 -1.694 1.00 13.12 C ATOM 1543 NH1 ARG A 99 2.090 14.730 -1.250 1.00 35.44 N ATOM 1544 NH2 ARG A 99 3.310 13.857 -2.989 1.00 42.21 N ATOM 0 H ARG A 99 4.564 10.516 3.887 1.00 4.21 H new ATOM 0 HA ARG A 99 5.625 9.065 1.565 1.00 2.21 H new ATOM 0 HB2 ARG A 99 5.729 11.000 0.141 1.00 0.22 H new ATOM 0 HB3 ARG A 99 4.061 10.576 0.472 1.00 0.22 H new ATOM 0 HG2 ARG A 99 4.463 12.444 2.439 1.00 15.11 H new ATOM 0 HG3 ARG A 99 5.587 13.036 1.233 1.00 15.11 H new ATOM 0 HD2 ARG A 99 2.615 12.517 0.806 1.00 40.40 H new ATOM 0 HD3 ARG A 99 3.368 14.089 0.984 1.00 40.40 H new ATOM 0 HE ARG A 99 4.473 12.548 -1.241 1.00 14.41 H new ATOM 0 HH11 ARG A 99 1.874 14.769 -0.254 1.00 35.44 H new ATOM 0 HH12 ARG A 99 1.572 15.314 -1.907 1.00 35.44 H new ATOM 0 HH21 ARG A 99 4.032 13.226 -3.336 1.00 42.21 H new ATOM 0 HH22 ARG A 99 2.788 14.443 -3.641 1.00 42.21 H new ATOM 1558 N GLN A 100 7.876 9.929 2.316 1.00 34.25 N ATOM 1559 CA GLN A 100 9.157 9.996 3.066 1.00 74.44 C ATOM 1560 C GLN A 100 9.495 11.406 3.607 1.00 34.23 C ATOM 1561 O GLN A 100 9.346 11.652 4.813 1.00 42.34 O ATOM 1562 CB GLN A 100 10.316 9.418 2.209 1.00 23.25 C ATOM 1563 CG GLN A 100 10.144 7.921 1.860 1.00 45.00 C ATOM 1564 CD GLN A 100 11.340 7.276 1.152 1.00 21.33 C ATOM 1565 OE1 GLN A 100 12.561 7.700 1.482 1.00 24.31 O flip ATOM 1566 NE2 GLN A 100 11.174 6.374 0.332 1.00 61.31 N flip ATOM 0 H GLN A 100 7.948 9.402 1.445 1.00 34.25 H new ATOM 0 HA GLN A 100 9.028 9.376 3.953 1.00 74.44 H new ATOM 0 HB2 GLN A 100 10.394 9.991 1.285 1.00 23.25 H new ATOM 0 HB3 GLN A 100 11.255 9.551 2.746 1.00 23.25 H new ATOM 0 HG2 GLN A 100 9.946 7.370 2.779 1.00 45.00 H new ATOM 0 HG3 GLN A 100 9.264 7.811 1.226 1.00 45.00 H new ATOM 0 HE21 GLN A 100 10.230 6.067 0.096 1.00 61.31 H new ATOM 0 HE22 GLN A 100 11.980 5.933 -0.112 1.00 61.31 H new ATOM 1575 N ALA A 101 9.934 12.327 2.739 1.00 43.51 N ATOM 1576 CA ALA A 101 10.158 13.731 3.140 1.00 52.30 C ATOM 1577 C ALA A 101 9.230 14.676 2.363 1.00 72.51 C ATOM 1578 O ALA A 101 8.201 15.124 2.879 1.00 64.34 O ATOM 1579 CB ALA A 101 11.642 14.099 2.961 1.00 61.52 C ATOM 0 H ALA A 101 10.141 12.132 1.760 1.00 43.51 H new ATOM 0 HA ALA A 101 9.912 13.844 4.196 1.00 52.30 H new ATOM 0 HB1 ALA A 101 11.798 15.136 3.259 1.00 61.52 H new ATOM 0 HB2 ALA A 101 12.256 13.447 3.582 1.00 61.52 H new ATOM 0 HB3 ALA A 101 11.924 13.976 1.915 1.00 61.52 H new ATOM 1585 N ALA A 102 9.575 14.932 1.091 1.00 72.31 N ATOM 1586 CA ALA A 102 8.866 15.895 0.236 1.00 72.12 C ATOM 1587 C ALA A 102 8.559 15.282 -1.135 1.00 40.32 C ATOM 1588 O ALA A 102 8.715 15.949 -2.164 1.00 34.10 O ATOM 1589 CB ALA A 102 9.680 17.200 0.117 1.00 63.21 C ATOM 0 H ALA A 102 10.358 14.474 0.625 1.00 72.31 H new ATOM 0 HA ALA A 102 7.909 16.142 0.697 1.00 72.12 H new ATOM 0 HB1 ALA A 102 9.145 17.906 -0.519 1.00 63.21 H new ATOM 0 HB2 ALA A 102 9.817 17.635 1.107 1.00 63.21 H new ATOM 0 HB3 ALA A 102 10.654 16.983 -0.322 1.00 63.21 H new ATOM 1595 N ASP A 103 8.133 13.998 -1.133 1.00 32.22 N ATOM 1596 CA ASP A 103 7.785 13.239 -2.365 1.00 35.44 C ATOM 1597 C ASP A 103 6.834 14.041 -3.280 1.00 43.25 C ATOM 1598 O ASP A 103 5.928 14.723 -2.795 1.00 34.21 O ATOM 1599 CB ASP A 103 7.112 11.879 -1.980 1.00 23.23 C ATOM 1600 CG ASP A 103 6.280 11.224 -3.119 1.00 11.13 C ATOM 1601 OD1 ASP A 103 6.869 10.569 -3.997 1.00 31.44 O ATOM 1602 OD2 ASP A 103 5.032 11.392 -3.148 1.00 3.33 O ATOM 0 H ASP A 103 8.019 13.455 -0.277 1.00 32.22 H new ATOM 0 HA ASP A 103 8.709 13.056 -2.913 1.00 35.44 H new ATOM 0 HB2 ASP A 103 7.888 11.180 -1.667 1.00 23.23 H new ATOM 0 HB3 ASP A 103 6.462 12.041 -1.120 1.00 23.23 H new ATOM 1607 N GLU A 104 7.073 13.958 -4.592 1.00 10.13 N ATOM 1608 CA GLU A 104 6.156 14.465 -5.625 1.00 24.15 C ATOM 1609 C GLU A 104 6.016 13.441 -6.771 1.00 65.24 C ATOM 1610 O GLU A 104 5.403 13.727 -7.802 1.00 44.44 O ATOM 1611 CB GLU A 104 6.641 15.847 -6.131 1.00 31.44 C ATOM 1612 CG GLU A 104 8.085 15.872 -6.665 1.00 0.52 C ATOM 1613 CD GLU A 104 8.506 17.257 -7.164 1.00 63.23 C ATOM 1614 OE1 GLU A 104 8.860 18.113 -6.323 1.00 71.12 O ATOM 1615 OE2 GLU A 104 8.473 17.499 -8.394 1.00 1.04 O ATOM 0 H GLU A 104 7.918 13.533 -4.974 1.00 10.13 H new ATOM 0 HA GLU A 104 5.164 14.601 -5.194 1.00 24.15 H new ATOM 0 HB2 GLU A 104 5.971 16.184 -6.922 1.00 31.44 H new ATOM 0 HB3 GLU A 104 6.558 16.566 -5.316 1.00 31.44 H new ATOM 0 HG2 GLU A 104 8.766 15.552 -5.876 1.00 0.52 H new ATOM 0 HG3 GLU A 104 8.180 15.153 -7.479 1.00 0.52 H new ATOM 1622 N SER A 105 6.541 12.220 -6.539 1.00 3.43 N ATOM 1623 CA SER A 105 6.439 11.072 -7.467 1.00 40.30 C ATOM 1624 C SER A 105 5.112 10.302 -7.241 1.00 22.54 C ATOM 1625 O SER A 105 4.971 9.143 -7.666 1.00 44.02 O ATOM 1626 CB SER A 105 7.667 10.150 -7.241 1.00 25.12 C ATOM 1627 OG SER A 105 7.736 9.099 -8.192 1.00 71.32 O ATOM 0 H SER A 105 7.057 11.999 -5.687 1.00 3.43 H new ATOM 0 HA SER A 105 6.434 11.425 -8.498 1.00 40.30 H new ATOM 0 HB2 SER A 105 8.579 10.745 -7.294 1.00 25.12 H new ATOM 0 HB3 SER A 105 7.620 9.726 -6.238 1.00 25.12 H new ATOM 0 HG SER A 105 6.840 8.731 -8.339 1.00 71.32 H new ATOM 1633 N ARG A 106 4.159 10.961 -6.532 1.00 42.22 N ATOM 1634 CA ARG A 106 2.797 10.456 -6.264 1.00 13.10 C ATOM 1635 C ARG A 106 2.806 9.284 -5.266 1.00 54.32 C ATOM 1636 O ARG A 106 1.748 8.721 -4.971 1.00 33.25 O ATOM 1637 CB ARG A 106 2.059 10.029 -7.581 1.00 70.43 C ATOM 1638 CG ARG A 106 1.931 11.092 -8.695 1.00 70.31 C ATOM 1639 CD ARG A 106 1.197 12.374 -8.253 1.00 22.52 C ATOM 1640 NE ARG A 106 2.112 13.412 -7.733 1.00 75.13 N ATOM 1641 CZ ARG A 106 2.068 13.956 -6.510 1.00 74.20 C ATOM 1642 NH1 ARG A 106 1.166 13.549 -5.620 1.00 3.13 N ATOM 1643 NH2 ARG A 106 2.898 14.942 -6.203 1.00 14.12 N ATOM 0 H ARG A 106 4.326 11.880 -6.123 1.00 42.22 H new ATOM 0 HA ARG A 106 2.248 11.285 -5.817 1.00 13.10 H new ATOM 0 HB2 ARG A 106 2.580 9.166 -7.996 1.00 70.43 H new ATOM 0 HB3 ARG A 106 1.056 9.697 -7.314 1.00 70.43 H new ATOM 0 HG2 ARG A 106 2.928 11.358 -9.046 1.00 70.31 H new ATOM 0 HG3 ARG A 106 1.401 10.655 -9.542 1.00 70.31 H new ATOM 0 HD2 ARG A 106 0.641 12.778 -9.099 1.00 22.52 H new ATOM 0 HD3 ARG A 106 0.467 12.122 -7.483 1.00 22.52 H new ATOM 0 HE ARG A 106 2.843 13.744 -8.362 1.00 75.13 H new ATOM 0 HH11 ARG A 106 0.500 12.817 -5.867 1.00 3.13 H new ATOM 0 HH12 ARG A 106 1.140 13.969 -4.691 1.00 3.13 H new ATOM 0 HH21 ARG A 106 3.565 15.282 -6.896 1.00 14.12 H new ATOM 0 HH22 ARG A 106 2.870 15.361 -5.274 1.00 14.12 H new ATOM 1657 N THR A 107 3.978 8.965 -4.692 1.00 32.24 N ATOM 1658 CA THR A 107 4.189 7.713 -3.970 1.00 53.15 C ATOM 1659 C THR A 107 3.657 7.825 -2.523 1.00 2.42 C ATOM 1660 O THR A 107 4.363 8.269 -1.606 1.00 74.03 O ATOM 1661 CB THR A 107 5.697 7.317 -3.991 1.00 15.31 C ATOM 1662 OG1 THR A 107 6.203 7.452 -5.332 1.00 70.33 O ATOM 1663 CG2 THR A 107 5.927 5.874 -3.493 1.00 53.42 C ATOM 0 H THR A 107 4.799 9.570 -4.719 1.00 32.24 H new ATOM 0 HA THR A 107 3.629 6.923 -4.471 1.00 53.15 H new ATOM 0 HB THR A 107 6.228 7.985 -3.313 1.00 15.31 H new ATOM 0 HG1 THR A 107 7.151 7.206 -5.350 1.00 70.33 H new ATOM 0 HG21 THR A 107 6.992 5.643 -3.526 1.00 53.42 H new ATOM 0 HG22 THR A 107 5.567 5.781 -2.468 1.00 53.42 H new ATOM 0 HG23 THR A 107 5.385 5.178 -4.133 1.00 53.42 H new ATOM 1671 N LEU A 108 2.369 7.492 -2.374 1.00 63.12 N ATOM 1672 CA LEU A 108 1.678 7.436 -1.083 1.00 24.00 C ATOM 1673 C LEU A 108 1.743 6.006 -0.558 1.00 11.13 C ATOM 1674 O LEU A 108 1.334 5.068 -1.247 1.00 35.50 O ATOM 1675 CB LEU A 108 0.209 7.885 -1.247 1.00 11.03 C ATOM 1676 CG LEU A 108 0.007 9.306 -1.848 1.00 24.14 C ATOM 1677 CD1 LEU A 108 -1.488 9.589 -2.064 1.00 52.33 C ATOM 1678 CD2 LEU A 108 0.675 10.394 -0.968 1.00 52.14 C ATOM 0 H LEU A 108 1.769 7.250 -3.162 1.00 63.12 H new ATOM 0 HA LEU A 108 2.160 8.108 -0.373 1.00 24.00 H new ATOM 0 HB2 LEU A 108 -0.304 7.164 -1.883 1.00 11.03 H new ATOM 0 HB3 LEU A 108 -0.275 7.850 -0.271 1.00 11.03 H new ATOM 0 HG LEU A 108 0.500 9.339 -2.820 1.00 24.14 H new ATOM 0 HD11 LEU A 108 -1.612 10.587 -2.485 1.00 52.33 H new ATOM 0 HD12 LEU A 108 -1.902 8.851 -2.751 1.00 52.33 H new ATOM 0 HD13 LEU A 108 -2.011 9.530 -1.110 1.00 52.33 H new ATOM 0 HD21 LEU A 108 0.515 11.374 -1.417 1.00 52.14 H new ATOM 0 HD22 LEU A 108 0.236 10.375 0.029 1.00 52.14 H new ATOM 0 HD23 LEU A 108 1.745 10.198 -0.897 1.00 52.14 H new ATOM 1690 N PHE A 109 2.257 5.849 0.654 1.00 41.41 N ATOM 1691 CA PHE A 109 2.414 4.543 1.287 1.00 4.12 C ATOM 1692 C PHE A 109 1.411 4.443 2.446 1.00 1.51 C ATOM 1693 O PHE A 109 1.479 5.236 3.395 1.00 34.25 O ATOM 1694 CB PHE A 109 3.875 4.387 1.773 1.00 31.41 C ATOM 1695 CG PHE A 109 4.260 2.962 2.185 1.00 41.20 C ATOM 1696 CD1 PHE A 109 4.656 2.024 1.228 1.00 33.11 C ATOM 1697 CD2 PHE A 109 4.243 2.568 3.520 1.00 54.43 C ATOM 1698 CE1 PHE A 109 5.024 0.741 1.601 1.00 15.52 C ATOM 1699 CE2 PHE A 109 4.606 1.290 3.893 1.00 31.33 C ATOM 1700 CZ PHE A 109 5.001 0.374 2.933 1.00 24.15 C ATOM 0 H PHE A 109 2.579 6.627 1.230 1.00 41.41 H new ATOM 0 HA PHE A 109 2.211 3.736 0.584 1.00 4.12 H new ATOM 0 HB2 PHE A 109 4.546 4.716 0.979 1.00 31.41 H new ATOM 0 HB3 PHE A 109 4.035 5.053 2.621 1.00 31.41 H new ATOM 0 HD1 PHE A 109 4.676 2.302 0.185 1.00 33.11 H new ATOM 0 HD2 PHE A 109 3.940 3.276 4.278 1.00 54.43 H new ATOM 0 HE1 PHE A 109 5.329 0.027 0.850 1.00 15.52 H new ATOM 0 HE2 PHE A 109 4.582 1.004 4.934 1.00 31.33 H new ATOM 0 HZ PHE A 109 5.290 -0.625 3.224 1.00 24.15 H new ATOM 1710 N VAL A 110 0.470 3.488 2.340 1.00 73.25 N ATOM 1711 CA VAL A 110 -0.556 3.238 3.371 1.00 12.22 C ATOM 1712 C VAL A 110 -0.404 1.797 3.921 1.00 13.42 C ATOM 1713 O VAL A 110 -0.438 0.821 3.157 1.00 52.32 O ATOM 1714 CB VAL A 110 -2.039 3.471 2.848 1.00 42.15 C ATOM 1715 CG1 VAL A 110 -2.280 4.952 2.483 1.00 62.45 C ATOM 1716 CG2 VAL A 110 -2.396 2.558 1.655 1.00 45.24 C ATOM 0 H VAL A 110 0.399 2.866 1.535 1.00 73.25 H new ATOM 0 HA VAL A 110 -0.391 3.964 4.167 1.00 12.22 H new ATOM 0 HB VAL A 110 -2.700 3.203 3.672 1.00 42.15 H new ATOM 0 HG11 VAL A 110 -3.303 5.078 2.129 1.00 62.45 H new ATOM 0 HG12 VAL A 110 -2.122 5.574 3.364 1.00 62.45 H new ATOM 0 HG13 VAL A 110 -1.585 5.251 1.698 1.00 62.45 H new ATOM 0 HG21 VAL A 110 -3.419 2.758 1.337 1.00 45.24 H new ATOM 0 HG22 VAL A 110 -1.714 2.756 0.828 1.00 45.24 H new ATOM 0 HG23 VAL A 110 -2.307 1.514 1.956 1.00 45.24 H new ATOM 1726 N PRO A 111 -0.156 1.640 5.248 1.00 23.21 N ATOM 1727 CA PRO A 111 -0.277 0.340 5.913 1.00 62.55 C ATOM 1728 C PRO A 111 -1.738 0.075 6.343 1.00 51.34 C ATOM 1729 O PRO A 111 -2.479 1.015 6.680 1.00 54.42 O ATOM 1730 CB PRO A 111 0.673 0.485 7.130 1.00 41.33 C ATOM 1731 CG PRO A 111 0.712 1.957 7.455 1.00 20.01 C ATOM 1732 CD PRO A 111 0.300 2.702 6.190 1.00 22.22 C ATOM 0 HA PRO A 111 -0.016 -0.506 5.277 1.00 62.55 H new ATOM 0 HB2 PRO A 111 0.309 -0.092 7.980 1.00 41.33 H new ATOM 0 HB3 PRO A 111 1.669 0.111 6.894 1.00 41.33 H new ATOM 0 HG2 PRO A 111 0.035 2.189 8.277 1.00 20.01 H new ATOM 0 HG3 PRO A 111 1.711 2.256 7.771 1.00 20.01 H new ATOM 0 HD2 PRO A 111 -0.497 3.417 6.395 1.00 22.22 H new ATOM 0 HD3 PRO A 111 1.135 3.266 5.775 1.00 22.22 H new ATOM 1740 N PHE A 112 -2.154 -1.196 6.302 1.00 61.23 N ATOM 1741 CA PHE A 112 -3.433 -1.625 6.872 1.00 13.13 C ATOM 1742 C PHE A 112 -3.294 -3.040 7.436 1.00 51.41 C ATOM 1743 O PHE A 112 -2.965 -3.978 6.711 1.00 44.32 O ATOM 1744 CB PHE A 112 -4.609 -1.511 5.862 1.00 22.50 C ATOM 1745 CG PHE A 112 -4.589 -2.405 4.619 1.00 51.43 C ATOM 1746 CD1 PHE A 112 -3.718 -2.149 3.562 1.00 23.02 C ATOM 1747 CD2 PHE A 112 -5.475 -3.476 4.496 1.00 4.14 C ATOM 1748 CE1 PHE A 112 -3.736 -2.937 2.426 1.00 72.20 C ATOM 1749 CE2 PHE A 112 -5.485 -4.263 3.362 1.00 50.23 C ATOM 1750 CZ PHE A 112 -4.619 -3.991 2.327 1.00 33.45 C ATOM 0 H PHE A 112 -1.616 -1.951 5.875 1.00 61.23 H new ATOM 0 HA PHE A 112 -3.685 -0.946 7.686 1.00 13.13 H new ATOM 0 HB2 PHE A 112 -5.533 -1.715 6.403 1.00 22.50 H new ATOM 0 HB3 PHE A 112 -4.659 -0.475 5.526 1.00 22.50 H new ATOM 0 HD1 PHE A 112 -3.022 -1.326 3.631 1.00 23.02 H new ATOM 0 HD2 PHE A 112 -6.163 -3.692 5.300 1.00 4.14 H new ATOM 0 HE1 PHE A 112 -3.056 -2.726 1.614 1.00 72.20 H new ATOM 0 HE2 PHE A 112 -6.173 -5.092 3.287 1.00 50.23 H new ATOM 0 HZ PHE A 112 -4.631 -4.603 1.437 1.00 33.45 H new ATOM 1760 N ARG A 113 -3.526 -3.188 8.746 1.00 55.42 N ATOM 1761 CA ARG A 113 -3.403 -4.484 9.427 1.00 11.21 C ATOM 1762 C ARG A 113 -4.805 -5.041 9.667 1.00 40.31 C ATOM 1763 O ARG A 113 -5.579 -4.458 10.423 1.00 65.41 O ATOM 1764 CB ARG A 113 -2.628 -4.341 10.757 1.00 40.01 C ATOM 1765 CG ARG A 113 -2.346 -5.697 11.434 1.00 33.12 C ATOM 1766 CD ARG A 113 -1.503 -5.579 12.705 1.00 24.04 C ATOM 1767 NE ARG A 113 -1.073 -6.900 13.193 1.00 54.34 N ATOM 1768 CZ ARG A 113 0.199 -7.288 13.383 1.00 63.22 C ATOM 1769 NH1 ARG A 113 1.211 -6.453 13.140 1.00 51.04 N ATOM 1770 NH2 ARG A 113 0.457 -8.515 13.788 1.00 13.05 N ATOM 0 H ARG A 113 -3.802 -2.421 9.359 1.00 55.42 H new ATOM 0 HA ARG A 113 -2.837 -5.174 8.801 1.00 11.21 H new ATOM 0 HB2 ARG A 113 -1.683 -3.831 10.568 1.00 40.01 H new ATOM 0 HB3 ARG A 113 -3.199 -3.712 11.439 1.00 40.01 H new ATOM 0 HG2 ARG A 113 -3.294 -6.176 11.679 1.00 33.12 H new ATOM 0 HG3 ARG A 113 -1.833 -6.348 10.726 1.00 33.12 H new ATOM 0 HD2 ARG A 113 -0.627 -4.961 12.506 1.00 24.04 H new ATOM 0 HD3 ARG A 113 -2.080 -5.074 13.480 1.00 24.04 H new ATOM 0 HE ARG A 113 -1.804 -7.579 13.405 1.00 54.34 H new ATOM 0 HH11 ARG A 113 1.023 -5.508 12.806 1.00 51.04 H new ATOM 0 HH12 ARG A 113 2.172 -6.760 13.288 1.00 51.04 H new ATOM 0 HH21 ARG A 113 -0.308 -9.168 13.957 1.00 13.05 H new ATOM 0 HH22 ARG A 113 1.422 -8.812 13.933 1.00 13.05 H new ATOM 1784 N ASP A 114 -5.112 -6.175 9.050 1.00 1.44 N ATOM 1785 CA ASP A 114 -6.482 -6.685 8.935 1.00 63.03 C ATOM 1786 C ASP A 114 -6.563 -8.064 9.641 1.00 53.15 C ATOM 1787 O ASP A 114 -5.694 -8.385 10.469 1.00 21.21 O ATOM 1788 CB ASP A 114 -6.855 -6.736 7.426 1.00 64.11 C ATOM 1789 CG ASP A 114 -6.227 -7.926 6.692 1.00 64.20 C ATOM 1790 OD1 ASP A 114 -4.988 -8.092 6.725 1.00 73.45 O ATOM 1791 OD2 ASP A 114 -6.976 -8.731 6.130 1.00 31.00 O ATOM 0 H ASP A 114 -4.415 -6.775 8.610 1.00 1.44 H new ATOM 0 HA ASP A 114 -7.207 -6.037 9.428 1.00 63.03 H new ATOM 0 HB2 ASP A 114 -7.939 -6.787 7.327 1.00 64.11 H new ATOM 0 HB3 ASP A 114 -6.534 -5.811 6.947 1.00 64.11 H new ATOM 1796 N LYS A 115 -7.597 -8.874 9.325 1.00 62.54 N ATOM 1797 CA LYS A 115 -7.778 -10.201 9.948 1.00 13.55 C ATOM 1798 C LYS A 115 -6.938 -11.297 9.268 1.00 74.44 C ATOM 1799 O LYS A 115 -6.721 -12.339 9.884 1.00 63.13 O ATOM 1800 CB LYS A 115 -9.281 -10.605 9.980 1.00 61.04 C ATOM 1801 CG LYS A 115 -10.221 -9.701 10.824 1.00 61.53 C ATOM 1802 CD LYS A 115 -9.913 -9.679 12.352 1.00 23.12 C ATOM 1803 CE LYS A 115 -8.863 -8.631 12.763 1.00 51.04 C ATOM 1804 NZ LYS A 115 -8.619 -8.635 14.226 1.00 30.43 N ATOM 0 H LYS A 115 -8.317 -8.632 8.644 1.00 62.54 H new ATOM 0 HA LYS A 115 -7.417 -10.112 10.973 1.00 13.55 H new ATOM 0 HB2 LYS A 115 -9.652 -10.622 8.955 1.00 61.04 H new ATOM 0 HB3 LYS A 115 -9.353 -11.623 10.362 1.00 61.04 H new ATOM 0 HG2 LYS A 115 -10.161 -8.682 10.441 1.00 61.53 H new ATOM 0 HG3 LYS A 115 -11.248 -10.036 10.680 1.00 61.53 H new ATOM 0 HD2 LYS A 115 -10.837 -9.485 12.896 1.00 23.12 H new ATOM 0 HD3 LYS A 115 -9.565 -10.666 12.657 1.00 23.12 H new ATOM 0 HE2 LYS A 115 -7.928 -8.829 12.239 1.00 51.04 H new ATOM 0 HE3 LYS A 115 -9.198 -7.641 12.454 1.00 51.04 H new ATOM 0 HZ1 LYS A 115 -8.865 -7.705 14.622 1.00 30.43 H new ATOM 0 HZ2 LYS A 115 -9.205 -9.368 14.674 1.00 30.43 H new ATOM 0 HZ3 LYS A 115 -7.615 -8.834 14.410 1.00 30.43 H new ATOM 1818 N THR A 116 -6.468 -11.082 8.013 1.00 71.44 N ATOM 1819 CA THR A 116 -5.671 -12.105 7.289 1.00 61.31 C ATOM 1820 C THR A 116 -4.189 -12.033 7.685 1.00 14.00 C ATOM 1821 O THR A 116 -3.444 -12.978 7.434 1.00 22.42 O ATOM 1822 CB THR A 116 -5.797 -12.001 5.723 1.00 55.43 C ATOM 1823 OG1 THR A 116 -5.096 -10.853 5.212 1.00 13.50 O ATOM 1824 CG2 THR A 116 -7.273 -11.956 5.275 1.00 2.41 C ATOM 0 H THR A 116 -6.624 -10.222 7.487 1.00 71.44 H new ATOM 0 HA THR A 116 -6.089 -13.066 7.588 1.00 61.31 H new ATOM 0 HB THR A 116 -5.337 -12.899 5.311 1.00 55.43 H new ATOM 0 HG1 THR A 116 -5.634 -10.048 5.362 1.00 13.50 H new ATOM 0 HG21 THR A 116 -7.321 -11.884 4.188 1.00 2.41 H new ATOM 0 HG22 THR A 116 -7.780 -12.864 5.602 1.00 2.41 H new ATOM 0 HG23 THR A 116 -7.761 -11.088 5.718 1.00 2.41 H new ATOM 1832 N THR A 117 -3.774 -10.903 8.291 1.00 71.13 N ATOM 1833 CA THR A 117 -2.416 -10.702 8.822 1.00 74.20 C ATOM 1834 C THR A 117 -2.019 -11.831 9.814 1.00 34.25 C ATOM 1835 O THR A 117 -2.565 -11.914 10.917 1.00 0.13 O ATOM 1836 CB THR A 117 -2.329 -9.308 9.532 1.00 71.35 C ATOM 1837 OG1 THR A 117 -2.588 -8.252 8.587 1.00 24.55 O ATOM 1838 CG2 THR A 117 -0.961 -9.078 10.204 1.00 15.42 C ATOM 0 H THR A 117 -4.382 -10.095 8.426 1.00 71.13 H new ATOM 0 HA THR A 117 -1.717 -10.733 7.987 1.00 74.20 H new ATOM 0 HB THR A 117 -3.087 -9.299 10.315 1.00 71.35 H new ATOM 0 HG1 THR A 117 -3.439 -8.422 8.132 1.00 24.55 H new ATOM 0 HG21 THR A 117 -0.951 -8.098 10.682 1.00 15.42 H new ATOM 0 HG22 THR A 117 -0.790 -9.850 10.954 1.00 15.42 H new ATOM 0 HG23 THR A 117 -0.174 -9.123 9.451 1.00 15.42 H new ATOM 1846 N GLY A 118 -1.107 -12.721 9.380 1.00 0.20 N ATOM 1847 CA GLY A 118 -0.609 -13.824 10.215 1.00 52.21 C ATOM 1848 C GLY A 118 -1.569 -15.010 10.269 1.00 41.41 C ATOM 1849 O GLY A 118 -1.423 -15.895 11.116 1.00 74.11 O ATOM 0 H GLY A 118 -0.698 -12.694 8.446 1.00 0.20 H new ATOM 0 HA2 GLY A 118 0.353 -14.160 9.828 1.00 52.21 H new ATOM 0 HA3 GLY A 118 -0.436 -13.457 11.227 1.00 52.21 H new ATOM 1853 N GLN A 119 -2.555 -15.021 9.352 1.00 12.42 N ATOM 1854 CA GLN A 119 -3.634 -16.029 9.307 1.00 12.04 C ATOM 1855 C GLN A 119 -3.721 -16.605 7.886 1.00 33.44 C ATOM 1856 O GLN A 119 -3.274 -17.729 7.626 1.00 12.34 O ATOM 1857 CB GLN A 119 -4.995 -15.382 9.730 1.00 31.45 C ATOM 1858 CG GLN A 119 -4.988 -14.699 11.114 1.00 71.40 C ATOM 1859 CD GLN A 119 -4.794 -15.656 12.291 1.00 15.30 C ATOM 1860 OE1 GLN A 119 -5.197 -16.818 12.243 1.00 2.51 O ATOM 1861 NE2 GLN A 119 -4.183 -15.180 13.363 1.00 13.42 N ATOM 0 H GLN A 119 -2.626 -14.322 8.612 1.00 12.42 H new ATOM 0 HA GLN A 119 -3.415 -16.836 10.006 1.00 12.04 H new ATOM 0 HB2 GLN A 119 -5.279 -14.645 8.979 1.00 31.45 H new ATOM 0 HB3 GLN A 119 -5.764 -16.154 9.726 1.00 31.45 H new ATOM 0 HG2 GLN A 119 -4.193 -13.953 11.133 1.00 71.40 H new ATOM 0 HG3 GLN A 119 -5.929 -14.165 11.247 1.00 71.40 H new ATOM 0 HE21 GLN A 119 -3.858 -14.213 13.378 1.00 13.42 H new ATOM 0 HE22 GLN A 119 -4.036 -15.780 14.175 1.00 13.42 H new ATOM 1870 N GLN A 120 -4.277 -15.803 6.953 1.00 52.44 N ATOM 1871 CA GLN A 120 -4.413 -16.178 5.527 1.00 14.13 C ATOM 1872 C GLN A 120 -3.241 -15.582 4.718 1.00 74.33 C ATOM 1873 O GLN A 120 -3.024 -15.926 3.551 1.00 0.25 O ATOM 1874 CB GLN A 120 -5.775 -15.689 4.945 1.00 42.40 C ATOM 1875 CG GLN A 120 -6.983 -15.779 5.909 1.00 1.41 C ATOM 1876 CD GLN A 120 -7.253 -17.169 6.506 1.00 44.13 C ATOM 1877 OE1 GLN A 120 -6.978 -18.202 5.900 1.00 14.31 O ATOM 1878 NE2 GLN A 120 -7.812 -17.199 7.700 1.00 40.55 N ATOM 0 H GLN A 120 -4.645 -14.876 7.166 1.00 52.44 H new ATOM 0 HA GLN A 120 -4.388 -17.265 5.452 1.00 14.13 H new ATOM 0 HB2 GLN A 120 -5.663 -14.653 4.627 1.00 42.40 H new ATOM 0 HB3 GLN A 120 -6.000 -16.274 4.053 1.00 42.40 H new ATOM 0 HG2 GLN A 120 -6.825 -15.076 6.727 1.00 1.41 H new ATOM 0 HG3 GLN A 120 -7.876 -15.452 5.376 1.00 1.41 H new ATOM 0 HE21 GLN A 120 -8.031 -16.328 8.183 1.00 40.55 H new ATOM 0 HE22 GLN A 120 -8.026 -18.094 8.141 1.00 40.55 H new ATOM 1887 N SER A 121 -2.495 -14.697 5.388 1.00 3.50 N ATOM 1888 CA SER A 121 -1.362 -13.954 4.835 1.00 51.44 C ATOM 1889 C SER A 121 -0.258 -13.898 5.906 1.00 34.14 C ATOM 1890 O SER A 121 -0.480 -14.335 7.044 1.00 43.04 O ATOM 1891 CB SER A 121 -1.824 -12.529 4.418 1.00 53.33 C ATOM 1892 OG SER A 121 -0.790 -11.798 3.765 1.00 43.35 O ATOM 0 H SER A 121 -2.672 -14.472 6.367 1.00 3.50 H new ATOM 0 HA SER A 121 -0.971 -14.446 3.945 1.00 51.44 H new ATOM 0 HB2 SER A 121 -2.686 -12.608 3.755 1.00 53.33 H new ATOM 0 HB3 SER A 121 -2.151 -11.982 5.302 1.00 53.33 H new ATOM 0 HG SER A 121 -1.187 -11.172 3.124 1.00 43.35 H new ATOM 1898 N TYR A 122 0.921 -13.369 5.550 1.00 25.13 N ATOM 1899 CA TYR A 122 2.055 -13.263 6.494 1.00 3.04 C ATOM 1900 C TYR A 122 1.791 -12.094 7.484 1.00 24.54 C ATOM 1901 O TYR A 122 1.096 -11.122 7.140 1.00 24.34 O ATOM 1902 CB TYR A 122 3.399 -13.072 5.719 1.00 44.24 C ATOM 1903 CG TYR A 122 4.652 -13.565 6.478 1.00 62.53 C ATOM 1904 CD1 TYR A 122 5.174 -12.861 7.567 1.00 21.31 C ATOM 1905 CD2 TYR A 122 5.306 -14.743 6.104 1.00 14.25 C ATOM 1906 CE1 TYR A 122 6.288 -13.308 8.251 1.00 43.33 C ATOM 1907 CE2 TYR A 122 6.425 -15.191 6.782 1.00 32.43 C ATOM 1908 CZ TYR A 122 6.910 -14.471 7.855 1.00 35.14 C ATOM 1909 OH TYR A 122 8.024 -14.912 8.530 1.00 21.21 O ATOM 0 H TYR A 122 1.119 -13.007 4.617 1.00 25.13 H new ATOM 0 HA TYR A 122 2.143 -14.187 7.066 1.00 3.04 H new ATOM 0 HB2 TYR A 122 3.334 -13.601 4.768 1.00 44.24 H new ATOM 0 HB3 TYR A 122 3.523 -12.014 5.487 1.00 44.24 H new ATOM 0 HD1 TYR A 122 4.695 -11.946 7.881 1.00 21.31 H new ATOM 0 HD2 TYR A 122 4.930 -15.315 5.269 1.00 14.25 H new ATOM 0 HE1 TYR A 122 6.669 -12.748 9.092 1.00 43.33 H new ATOM 0 HE2 TYR A 122 6.918 -16.101 6.473 1.00 32.43 H new ATOM 0 HH TYR A 122 8.342 -15.747 8.127 1.00 21.21 H new ATOM 1919 N ASP A 123 2.348 -12.210 8.707 1.00 2.01 N ATOM 1920 CA ASP A 123 2.143 -11.223 9.794 1.00 74.51 C ATOM 1921 C ASP A 123 2.993 -9.956 9.560 1.00 22.31 C ATOM 1922 O ASP A 123 3.960 -9.975 8.789 1.00 74.53 O ATOM 1923 CB ASP A 123 2.464 -11.863 11.172 1.00 14.53 C ATOM 1924 CG ASP A 123 1.942 -11.038 12.361 1.00 61.44 C ATOM 1925 OD1 ASP A 123 0.725 -11.095 12.630 1.00 11.45 O ATOM 1926 OD2 ASP A 123 2.731 -10.312 13.014 1.00 21.53 O ATOM 0 H ASP A 123 2.952 -12.988 8.971 1.00 2.01 H new ATOM 0 HA ASP A 123 1.095 -10.922 9.791 1.00 74.51 H new ATOM 0 HB2 ASP A 123 2.028 -12.861 11.212 1.00 14.53 H new ATOM 0 HB3 ASP A 123 3.543 -11.982 11.267 1.00 14.53 H new ATOM 1931 N GLY A 124 2.626 -8.862 10.246 1.00 24.33 N ATOM 1932 CA GLY A 124 3.234 -7.543 10.044 1.00 24.52 C ATOM 1933 C GLY A 124 2.211 -6.552 9.520 1.00 63.04 C ATOM 1934 O GLY A 124 2.286 -5.350 9.797 1.00 53.21 O ATOM 0 H GLY A 124 1.896 -8.871 10.958 1.00 24.33 H new ATOM 0 HA2 GLY A 124 3.649 -7.181 10.985 1.00 24.52 H new ATOM 0 HA3 GLY A 124 4.063 -7.623 9.340 1.00 24.52 H new ATOM 1938 N GLY A 125 1.234 -7.082 8.766 1.00 21.15 N ATOM 1939 CA GLY A 125 0.173 -6.294 8.160 1.00 54.12 C ATOM 1940 C GLY A 125 0.072 -6.559 6.675 1.00 3.44 C ATOM 1941 O GLY A 125 0.763 -7.434 6.130 1.00 15.45 O ATOM 0 H GLY A 125 1.167 -8.080 8.564 1.00 21.15 H new ATOM 0 HA2 GLY A 125 -0.777 -6.530 8.639 1.00 54.12 H new ATOM 0 HA3 GLY A 125 0.361 -5.234 8.330 1.00 54.12 H new ATOM 1945 N ARG A 126 -0.800 -5.800 6.024 1.00 51.44 N ATOM 1946 CA ARG A 126 -0.899 -5.734 4.567 1.00 42.31 C ATOM 1947 C ARG A 126 -0.494 -4.318 4.168 1.00 14.53 C ATOM 1948 O ARG A 126 -0.971 -3.352 4.762 1.00 53.52 O ATOM 1949 CB ARG A 126 -2.345 -6.069 4.105 1.00 3.43 C ATOM 1950 CG ARG A 126 -2.793 -7.531 4.347 1.00 73.23 C ATOM 1951 CD ARG A 126 -2.258 -8.524 3.300 1.00 52.22 C ATOM 1952 NE ARG A 126 -0.781 -8.601 3.239 1.00 63.12 N ATOM 1953 CZ ARG A 126 -0.022 -8.262 2.174 1.00 74.11 C ATOM 1954 NH1 ARG A 126 -0.571 -7.812 1.051 1.00 73.23 N ATOM 1955 NH2 ARG A 126 1.286 -8.367 2.249 1.00 20.15 N ATOM 0 H ARG A 126 -1.473 -5.200 6.501 1.00 51.44 H new ATOM 0 HA ARG A 126 -0.246 -6.464 4.088 1.00 42.31 H new ATOM 0 HB2 ARG A 126 -3.037 -5.404 4.621 1.00 3.43 H new ATOM 0 HB3 ARG A 126 -2.428 -5.852 3.040 1.00 3.43 H new ATOM 0 HG2 ARG A 126 -2.459 -7.845 5.336 1.00 73.23 H new ATOM 0 HG3 ARG A 126 -3.882 -7.572 4.350 1.00 73.23 H new ATOM 0 HD2 ARG A 126 -2.654 -9.515 3.520 1.00 52.22 H new ATOM 0 HD3 ARG A 126 -2.637 -8.240 2.318 1.00 52.22 H new ATOM 0 HE ARG A 126 -0.296 -8.938 4.070 1.00 63.12 H new ATOM 0 HH11 ARG A 126 -1.584 -7.717 0.981 1.00 73.23 H new ATOM 0 HH12 ARG A 126 0.021 -7.562 0.259 1.00 73.23 H new ATOM 0 HH21 ARG A 126 1.722 -8.703 3.108 1.00 20.15 H new ATOM 0 HH22 ARG A 126 1.865 -8.113 1.449 1.00 20.15 H new ATOM 1969 N TYR A 127 0.388 -4.187 3.180 1.00 70.44 N ATOM 1970 CA TYR A 127 0.977 -2.890 2.810 1.00 4.22 C ATOM 1971 C TYR A 127 0.616 -2.560 1.372 1.00 12.22 C ATOM 1972 O TYR A 127 0.707 -3.416 0.487 1.00 71.33 O ATOM 1973 CB TYR A 127 2.507 -2.906 3.049 1.00 71.12 C ATOM 1974 CG TYR A 127 2.868 -2.929 4.550 1.00 2.04 C ATOM 1975 CD1 TYR A 127 2.842 -4.113 5.292 1.00 21.13 C ATOM 1976 CD2 TYR A 127 3.199 -1.757 5.228 1.00 51.14 C ATOM 1977 CE1 TYR A 127 3.144 -4.126 6.641 1.00 44.01 C ATOM 1978 CE2 TYR A 127 3.494 -1.766 6.574 1.00 21.04 C ATOM 1979 CZ TYR A 127 3.471 -2.949 7.278 1.00 72.14 C ATOM 1980 OH TYR A 127 3.766 -2.954 8.626 1.00 20.31 O ATOM 0 H TYR A 127 0.717 -4.968 2.613 1.00 70.44 H new ATOM 0 HA TYR A 127 0.568 -2.102 3.442 1.00 4.22 H new ATOM 0 HB2 TYR A 127 2.939 -3.779 2.561 1.00 71.12 H new ATOM 0 HB3 TYR A 127 2.954 -2.027 2.584 1.00 71.12 H new ATOM 0 HD1 TYR A 127 2.580 -5.038 4.801 1.00 21.13 H new ATOM 0 HD2 TYR A 127 3.225 -0.823 4.687 1.00 51.14 H new ATOM 0 HE1 TYR A 127 3.124 -5.054 7.193 1.00 44.01 H new ATOM 0 HE2 TYR A 127 3.744 -0.844 7.077 1.00 21.04 H new ATOM 0 HH TYR A 127 3.313 -3.708 9.057 1.00 20.31 H new ATOM 1990 N MET A 128 0.205 -1.311 1.159 1.00 74.34 N ATOM 1991 CA MET A 128 -0.420 -0.869 -0.087 1.00 74.11 C ATOM 1992 C MET A 128 0.185 0.481 -0.499 1.00 25.25 C ATOM 1993 O MET A 128 0.496 1.310 0.361 1.00 54.12 O ATOM 1994 CB MET A 128 -1.973 -0.781 0.128 1.00 43.32 C ATOM 1995 CG MET A 128 -2.797 -1.324 -1.048 1.00 5.34 C ATOM 1996 SD MET A 128 -2.836 -0.202 -2.459 1.00 31.45 S ATOM 1997 CE MET A 128 -4.029 1.000 -1.883 1.00 5.32 C ATOM 0 H MET A 128 0.297 -0.570 1.854 1.00 74.34 H new ATOM 0 HA MET A 128 -0.232 -1.578 -0.894 1.00 74.11 H new ATOM 0 HB2 MET A 128 -2.237 -1.334 1.029 1.00 43.32 H new ATOM 0 HB3 MET A 128 -2.247 0.260 0.301 1.00 43.32 H new ATOM 0 HG2 MET A 128 -2.382 -2.281 -1.364 1.00 5.34 H new ATOM 0 HG3 MET A 128 -3.817 -1.513 -0.713 1.00 5.34 H new ATOM 0 HE1 MET A 128 -4.434 1.547 -2.734 1.00 5.32 H new ATOM 0 HE2 MET A 128 -4.838 0.489 -1.362 1.00 5.32 H new ATOM 0 HE3 MET A 128 -3.542 1.698 -1.201 1.00 5.32 H new ATOM 2007 N GLU A 129 0.364 0.691 -1.808 1.00 45.22 N ATOM 2008 CA GLU A 129 1.003 1.902 -2.350 1.00 71.22 C ATOM 2009 C GLU A 129 0.154 2.461 -3.504 1.00 64.11 C ATOM 2010 O GLU A 129 -0.158 1.737 -4.458 1.00 34.54 O ATOM 2011 CB GLU A 129 2.434 1.552 -2.838 1.00 70.41 C ATOM 2012 CG GLU A 129 3.222 2.734 -3.438 1.00 24.51 C ATOM 2013 CD GLU A 129 4.606 2.316 -3.958 1.00 71.41 C ATOM 2014 OE1 GLU A 129 4.697 1.845 -5.109 1.00 51.41 O ATOM 2015 OE2 GLU A 129 5.604 2.424 -3.209 1.00 14.15 O ATOM 0 H GLU A 129 0.071 0.027 -2.525 1.00 45.22 H new ATOM 0 HA GLU A 129 1.074 2.664 -1.574 1.00 71.22 H new ATOM 0 HB2 GLU A 129 2.999 1.146 -1.999 1.00 70.41 H new ATOM 0 HB3 GLU A 129 2.364 0.763 -3.587 1.00 70.41 H new ATOM 0 HG2 GLU A 129 2.648 3.172 -4.255 1.00 24.51 H new ATOM 0 HG3 GLU A 129 3.341 3.509 -2.681 1.00 24.51 H new ATOM 2022 N LEU A 130 -0.225 3.745 -3.390 1.00 63.20 N ATOM 2023 CA LEU A 130 -1.007 4.455 -4.409 1.00 40.15 C ATOM 2024 C LEU A 130 -0.109 5.460 -5.113 1.00 23.02 C ATOM 2025 O LEU A 130 0.767 6.062 -4.478 1.00 12.30 O ATOM 2026 CB LEU A 130 -2.220 5.219 -3.785 1.00 24.55 C ATOM 2027 CG LEU A 130 -3.045 4.447 -2.698 1.00 5.43 C ATOM 2028 CD1 LEU A 130 -2.431 4.617 -1.294 1.00 51.11 C ATOM 2029 CD2 LEU A 130 -4.520 4.867 -2.702 1.00 71.23 C ATOM 0 H LEU A 130 0.006 4.321 -2.581 1.00 63.20 H new ATOM 0 HA LEU A 130 -1.393 3.715 -5.110 1.00 40.15 H new ATOM 0 HB2 LEU A 130 -1.850 6.143 -3.341 1.00 24.55 H new ATOM 0 HB3 LEU A 130 -2.897 5.502 -4.591 1.00 24.55 H new ATOM 0 HG LEU A 130 -3.000 3.389 -2.957 1.00 5.43 H new ATOM 0 HD11 LEU A 130 -3.029 4.068 -0.566 1.00 51.11 H new ATOM 0 HD12 LEU A 130 -1.412 4.229 -1.293 1.00 51.11 H new ATOM 0 HD13 LEU A 130 -2.417 5.674 -1.029 1.00 51.11 H new ATOM 0 HD21 LEU A 130 -5.059 4.310 -1.935 1.00 71.23 H new ATOM 0 HD22 LEU A 130 -4.595 5.935 -2.495 1.00 71.23 H new ATOM 0 HD23 LEU A 130 -4.956 4.655 -3.678 1.00 71.23 H new ATOM 2041 N GLU A 131 -0.337 5.639 -6.416 1.00 3.31 N ATOM 2042 CA GLU A 131 0.263 6.720 -7.209 1.00 32.40 C ATOM 2043 C GLU A 131 -0.863 7.408 -8.011 1.00 14.22 C ATOM 2044 O GLU A 131 -1.152 7.017 -9.148 1.00 61.20 O ATOM 2045 CB GLU A 131 1.416 6.184 -8.108 1.00 24.25 C ATOM 2046 CG GLU A 131 2.655 5.732 -7.300 1.00 30.23 C ATOM 2047 CD GLU A 131 3.728 5.056 -8.151 1.00 34.04 C ATOM 2048 OE1 GLU A 131 4.554 5.762 -8.765 1.00 73.42 O ATOM 2049 OE2 GLU A 131 3.736 3.809 -8.225 1.00 54.21 O ATOM 0 H GLU A 131 -0.951 5.031 -6.959 1.00 3.31 H new ATOM 0 HA GLU A 131 0.727 7.461 -6.559 1.00 32.40 H new ATOM 0 HB2 GLU A 131 1.048 5.344 -8.698 1.00 24.25 H new ATOM 0 HB3 GLU A 131 1.712 6.962 -8.811 1.00 24.25 H new ATOM 0 HG2 GLU A 131 3.090 6.599 -6.803 1.00 30.23 H new ATOM 0 HG3 GLU A 131 2.336 5.043 -6.518 1.00 30.23 H new ATOM 2056 N PRO A 132 -1.572 8.412 -7.367 1.00 1.32 N ATOM 2057 CA PRO A 132 -2.737 9.122 -7.965 1.00 3.10 C ATOM 2058 C PRO A 132 -2.406 9.919 -9.244 1.00 52.55 C ATOM 2059 O PRO A 132 -1.239 10.106 -9.609 1.00 62.21 O ATOM 2060 CB PRO A 132 -3.205 10.078 -6.823 1.00 72.55 C ATOM 2061 CG PRO A 132 -2.012 10.234 -5.933 1.00 40.51 C ATOM 2062 CD PRO A 132 -1.305 8.906 -5.982 1.00 33.34 C ATOM 0 HA PRO A 132 -3.495 8.412 -8.296 1.00 3.10 H new ATOM 0 HB2 PRO A 132 -3.528 11.040 -7.221 1.00 72.55 H new ATOM 0 HB3 PRO A 132 -4.051 9.658 -6.279 1.00 72.55 H new ATOM 0 HG2 PRO A 132 -1.364 11.038 -6.281 1.00 40.51 H new ATOM 0 HG3 PRO A 132 -2.311 10.484 -4.915 1.00 40.51 H new ATOM 0 HD2 PRO A 132 -0.237 9.014 -5.795 1.00 33.34 H new ATOM 0 HD3 PRO A 132 -1.692 8.218 -5.230 1.00 33.34 H new ATOM 2070 N ASP A 133 -3.482 10.411 -9.880 1.00 52.11 N ATOM 2071 CA ASP A 133 -3.436 11.232 -11.108 1.00 42.12 C ATOM 2072 C ASP A 133 -2.708 12.576 -10.860 1.00 11.23 C ATOM 2073 O ASP A 133 -2.084 13.136 -11.766 1.00 25.21 O ATOM 2074 CB ASP A 133 -4.900 11.480 -11.582 1.00 10.11 C ATOM 2075 CG ASP A 133 -5.039 12.435 -12.788 1.00 21.44 C ATOM 2076 OD1 ASP A 133 -5.154 13.666 -12.576 1.00 61.21 O ATOM 2077 OD2 ASP A 133 -5.048 11.963 -13.944 1.00 14.22 O ATOM 0 H ASP A 133 -4.433 10.247 -9.549 1.00 52.11 H new ATOM 0 HA ASP A 133 -2.875 10.703 -11.878 1.00 42.12 H new ATOM 0 HB2 ASP A 133 -5.350 10.522 -11.842 1.00 10.11 H new ATOM 0 HB3 ASP A 133 -5.473 11.885 -10.748 1.00 10.11 H new ATOM 2082 N ARG A 134 -2.758 13.040 -9.605 1.00 43.24 N ATOM 2083 CA ARG A 134 -2.288 14.377 -9.203 1.00 4.11 C ATOM 2084 C ARG A 134 -1.901 14.360 -7.711 1.00 10.12 C ATOM 2085 O ARG A 134 -1.941 13.298 -7.074 1.00 43.15 O ATOM 2086 CB ARG A 134 -3.369 15.471 -9.546 1.00 22.42 C ATOM 2087 CG ARG A 134 -4.847 15.150 -9.166 1.00 41.13 C ATOM 2088 CD ARG A 134 -5.106 15.035 -7.651 1.00 70.22 C ATOM 2089 NE ARG A 134 -6.528 14.873 -7.306 1.00 22.22 N ATOM 2090 CZ ARG A 134 -7.224 13.727 -7.354 1.00 13.10 C ATOM 2091 NH1 ARG A 134 -6.645 12.592 -7.740 1.00 1.05 N ATOM 2092 NH2 ARG A 134 -8.486 13.716 -6.964 1.00 60.51 N ATOM 0 H ARG A 134 -3.130 12.493 -8.829 1.00 43.24 H new ATOM 0 HA ARG A 134 -1.395 14.643 -9.768 1.00 4.11 H new ATOM 0 HB2 ARG A 134 -3.084 16.397 -9.046 1.00 22.42 H new ATOM 0 HB3 ARG A 134 -3.329 15.662 -10.618 1.00 22.42 H new ATOM 0 HG2 ARG A 134 -5.491 15.929 -9.574 1.00 41.13 H new ATOM 0 HG3 ARG A 134 -5.137 14.214 -9.644 1.00 41.13 H new ATOM 0 HD2 ARG A 134 -4.547 14.186 -7.259 1.00 70.22 H new ATOM 0 HD3 ARG A 134 -4.720 15.926 -7.156 1.00 70.22 H new ATOM 0 HE ARG A 134 -7.030 15.708 -7.003 1.00 22.22 H new ATOM 0 HH11 ARG A 134 -5.660 12.586 -8.004 1.00 1.05 H new ATOM 0 HH12 ARG A 134 -7.187 11.728 -7.772 1.00 1.05 H new ATOM 0 HH21 ARG A 134 -8.924 14.574 -6.630 1.00 60.51 H new ATOM 0 HH22 ARG A 134 -9.023 12.849 -6.997 1.00 60.51 H new ATOM 2106 N ASP A 135 -1.515 15.523 -7.159 1.00 10.42 N ATOM 2107 CA ASP A 135 -1.237 15.645 -5.715 1.00 2.43 C ATOM 2108 C ASP A 135 -2.545 15.915 -4.970 1.00 11.15 C ATOM 2109 O ASP A 135 -3.373 16.715 -5.420 1.00 21.41 O ATOM 2110 CB ASP A 135 -0.201 16.753 -5.405 1.00 51.42 C ATOM 2111 CG ASP A 135 0.385 16.608 -3.986 1.00 50.21 C ATOM 2112 OD1 ASP A 135 1.381 15.863 -3.835 1.00 14.13 O ATOM 2113 OD2 ASP A 135 -0.162 17.189 -3.024 1.00 72.15 O ATOM 0 H ASP A 135 -1.389 16.387 -7.686 1.00 10.42 H new ATOM 0 HA ASP A 135 -0.802 14.705 -5.377 1.00 2.43 H new ATOM 0 HB2 ASP A 135 0.605 16.712 -6.137 1.00 51.42 H new ATOM 0 HB3 ASP A 135 -0.673 17.730 -5.505 1.00 51.42 H new ATOM 2118 N LEU A 136 -2.709 15.260 -3.817 1.00 51.11 N ATOM 2119 CA LEU A 136 -3.961 15.282 -3.057 1.00 42.15 C ATOM 2120 C LEU A 136 -3.949 16.436 -2.040 1.00 2.03 C ATOM 2121 O LEU A 136 -2.943 16.676 -1.368 1.00 54.24 O ATOM 2122 CB LEU A 136 -4.167 13.917 -2.349 1.00 4.53 C ATOM 2123 CG LEU A 136 -4.270 12.668 -3.283 1.00 60.42 C ATOM 2124 CD1 LEU A 136 -4.453 11.379 -2.456 1.00 3.44 C ATOM 2125 CD2 LEU A 136 -5.404 12.823 -4.323 1.00 4.51 C ATOM 0 H LEU A 136 -1.976 14.699 -3.384 1.00 51.11 H new ATOM 0 HA LEU A 136 -4.794 15.447 -3.740 1.00 42.15 H new ATOM 0 HB2 LEU A 136 -3.339 13.761 -1.657 1.00 4.53 H new ATOM 0 HB3 LEU A 136 -5.076 13.974 -1.751 1.00 4.53 H new ATOM 0 HG LEU A 136 -3.332 12.592 -3.833 1.00 60.42 H new ATOM 0 HD11 LEU A 136 -4.522 10.523 -3.127 1.00 3.44 H new ATOM 0 HD12 LEU A 136 -3.600 11.250 -1.790 1.00 3.44 H new ATOM 0 HD13 LEU A 136 -5.366 11.452 -1.866 1.00 3.44 H new ATOM 0 HD21 LEU A 136 -5.444 11.935 -4.953 1.00 4.51 H new ATOM 0 HD22 LEU A 136 -6.357 12.945 -3.807 1.00 4.51 H new ATOM 0 HD23 LEU A 136 -5.212 13.699 -4.942 1.00 4.51 H new ATOM 2137 N SER A 137 -5.081 17.132 -1.951 1.00 64.52 N ATOM 2138 CA SER A 137 -5.336 18.177 -0.947 1.00 74.33 C ATOM 2139 C SER A 137 -6.638 17.820 -0.220 1.00 33.04 C ATOM 2140 O SER A 137 -7.389 16.939 -0.674 1.00 53.35 O ATOM 2141 CB SER A 137 -5.396 19.578 -1.602 1.00 2.34 C ATOM 2142 OG SER A 137 -6.309 19.612 -2.677 1.00 44.13 O ATOM 0 H SER A 137 -5.866 16.986 -2.586 1.00 64.52 H new ATOM 0 HA SER A 137 -4.520 18.220 -0.226 1.00 74.33 H new ATOM 0 HB2 SER A 137 -5.686 20.317 -0.855 1.00 2.34 H new ATOM 0 HB3 SER A 137 -4.404 19.856 -1.958 1.00 2.34 H new ATOM 0 HG SER A 137 -6.569 18.697 -2.915 1.00 44.13 H new ATOM 2148 N ASP A 138 -6.884 18.479 0.921 1.00 53.20 N ATOM 2149 CA ASP A 138 -8.088 18.240 1.742 1.00 53.22 C ATOM 2150 C ASP A 138 -9.358 18.507 0.909 1.00 62.23 C ATOM 2151 O ASP A 138 -9.585 19.627 0.434 1.00 63.22 O ATOM 2152 CB ASP A 138 -8.051 19.107 3.035 1.00 0.12 C ATOM 2153 CG ASP A 138 -8.051 20.627 2.772 1.00 10.41 C ATOM 2154 OD1 ASP A 138 -7.057 21.137 2.208 1.00 53.25 O ATOM 2155 OD2 ASP A 138 -9.040 21.314 3.113 1.00 51.12 O ATOM 0 H ASP A 138 -6.260 19.190 1.303 1.00 53.20 H new ATOM 0 HA ASP A 138 -8.106 17.196 2.053 1.00 53.22 H new ATOM 0 HB2 ASP A 138 -8.913 18.856 3.653 1.00 0.12 H new ATOM 0 HB3 ASP A 138 -7.161 18.848 3.608 1.00 0.12 H new ATOM 2160 N GLY A 139 -10.116 17.437 0.631 1.00 44.34 N ATOM 2161 CA GLY A 139 -11.356 17.521 -0.153 1.00 10.53 C ATOM 2162 C GLY A 139 -11.338 16.625 -1.388 1.00 74.43 C ATOM 2163 O GLY A 139 -12.403 16.270 -1.896 1.00 1.04 O ATOM 0 H GLY A 139 -9.888 16.493 0.942 1.00 44.34 H new ATOM 0 HA2 GLY A 139 -12.199 17.243 0.479 1.00 10.53 H new ATOM 0 HA3 GLY A 139 -11.516 18.554 -0.462 1.00 10.53 H new ATOM 2167 N ASP A 140 -10.123 16.277 -1.881 1.00 11.53 N ATOM 2168 CA ASP A 140 -9.940 15.327 -3.013 1.00 21.24 C ATOM 2169 C ASP A 140 -10.409 13.919 -2.634 1.00 23.23 C ATOM 2170 O ASP A 140 -10.611 13.620 -1.459 1.00 63.20 O ATOM 2171 CB ASP A 140 -8.447 15.252 -3.480 1.00 64.53 C ATOM 2172 CG ASP A 140 -8.050 16.390 -4.426 1.00 10.45 C ATOM 2173 OD1 ASP A 140 -8.506 16.386 -5.591 1.00 53.52 O ATOM 2174 OD2 ASP A 140 -7.281 17.285 -4.024 1.00 3.44 O ATOM 0 H ASP A 140 -9.246 16.643 -1.510 1.00 11.53 H new ATOM 0 HA ASP A 140 -10.547 15.708 -3.834 1.00 21.24 H new ATOM 0 HB2 ASP A 140 -7.798 15.274 -2.604 1.00 64.53 H new ATOM 0 HB3 ASP A 140 -8.277 14.298 -3.979 1.00 64.53 H new ATOM 2179 N GLU A 141 -10.601 13.063 -3.650 1.00 13.30 N ATOM 2180 CA GLU A 141 -10.892 11.632 -3.454 1.00 24.22 C ATOM 2181 C GLU A 141 -9.768 10.775 -4.057 1.00 63.44 C ATOM 2182 O GLU A 141 -9.027 11.234 -4.940 1.00 52.12 O ATOM 2183 CB GLU A 141 -12.265 11.277 -4.078 1.00 32.03 C ATOM 2184 CG GLU A 141 -13.423 12.142 -3.542 1.00 61.22 C ATOM 2185 CD GLU A 141 -14.803 11.705 -4.045 1.00 22.32 C ATOM 2186 OE1 GLU A 141 -15.099 11.886 -5.248 1.00 71.30 O ATOM 2187 OE2 GLU A 141 -15.601 11.177 -3.243 1.00 52.42 O ATOM 0 H GLU A 141 -10.559 13.342 -4.630 1.00 13.30 H new ATOM 0 HA GLU A 141 -10.941 11.420 -2.386 1.00 24.22 H new ATOM 0 HB2 GLU A 141 -12.205 11.393 -5.160 1.00 32.03 H new ATOM 0 HB3 GLU A 141 -12.484 10.227 -3.882 1.00 32.03 H new ATOM 0 HG2 GLU A 141 -13.416 12.108 -2.453 1.00 61.22 H new ATOM 0 HG3 GLU A 141 -13.253 13.179 -3.830 1.00 61.22 H new ATOM 2194 N ILE A 142 -9.666 9.523 -3.577 1.00 64.44 N ATOM 2195 CA ILE A 142 -8.594 8.590 -3.951 1.00 61.00 C ATOM 2196 C ILE A 142 -9.116 7.139 -3.862 1.00 33.03 C ATOM 2197 O ILE A 142 -9.896 6.803 -2.965 1.00 62.54 O ATOM 2198 CB ILE A 142 -7.329 8.791 -3.028 1.00 43.12 C ATOM 2199 CG1 ILE A 142 -6.140 7.870 -3.455 1.00 11.13 C ATOM 2200 CG2 ILE A 142 -7.683 8.582 -1.535 1.00 42.53 C ATOM 2201 CD1 ILE A 142 -5.613 8.089 -4.868 1.00 44.31 C ATOM 0 H ILE A 142 -10.332 9.129 -2.913 1.00 64.44 H new ATOM 0 HA ILE A 142 -8.289 8.793 -4.978 1.00 61.00 H new ATOM 0 HB ILE A 142 -7.003 9.823 -3.157 1.00 43.12 H new ATOM 0 HG12 ILE A 142 -5.319 8.018 -2.753 1.00 11.13 H new ATOM 0 HG13 ILE A 142 -6.457 6.831 -3.361 1.00 11.13 H new ATOM 0 HG21 ILE A 142 -6.791 8.727 -0.926 1.00 42.53 H new ATOM 0 HG22 ILE A 142 -8.446 9.301 -1.238 1.00 42.53 H new ATOM 0 HG23 ILE A 142 -8.061 7.570 -1.389 1.00 42.53 H new ATOM 0 HD11 ILE A 142 -4.791 7.400 -5.061 1.00 44.31 H new ATOM 0 HD12 ILE A 142 -6.413 7.910 -5.586 1.00 44.31 H new ATOM 0 HD13 ILE A 142 -5.258 9.115 -4.969 1.00 44.31 H new ATOM 2213 N THR A 143 -8.681 6.296 -4.803 1.00 32.13 N ATOM 2214 CA THR A 143 -9.114 4.901 -4.907 1.00 1.15 C ATOM 2215 C THR A 143 -8.113 3.970 -4.178 1.00 1.10 C ATOM 2216 O THR A 143 -6.937 3.910 -4.555 1.00 22.22 O ATOM 2217 CB THR A 143 -9.223 4.525 -6.421 1.00 44.31 C ATOM 2218 OG1 THR A 143 -10.025 5.502 -7.112 1.00 35.13 O ATOM 2219 CG2 THR A 143 -9.837 3.141 -6.629 1.00 32.01 C ATOM 0 H THR A 143 -8.010 6.567 -5.522 1.00 32.13 H new ATOM 0 HA THR A 143 -10.087 4.777 -4.431 1.00 1.15 H new ATOM 0 HB THR A 143 -8.210 4.510 -6.823 1.00 44.31 H new ATOM 0 HG1 THR A 143 -10.088 5.262 -8.060 1.00 35.13 H new ATOM 0 HG21 THR A 143 -9.892 2.924 -7.696 1.00 32.01 H new ATOM 0 HG22 THR A 143 -9.218 2.391 -6.138 1.00 32.01 H new ATOM 0 HG23 THR A 143 -10.840 3.120 -6.202 1.00 32.01 H new ATOM 2227 N LEU A 144 -8.594 3.244 -3.138 1.00 32.43 N ATOM 2228 CA LEU A 144 -7.766 2.349 -2.290 1.00 30.12 C ATOM 2229 C LEU A 144 -7.953 0.891 -2.767 1.00 54.53 C ATOM 2230 O LEU A 144 -8.953 0.237 -2.429 1.00 13.32 O ATOM 2231 CB LEU A 144 -8.175 2.467 -0.777 1.00 41.23 C ATOM 2232 CG LEU A 144 -7.568 3.633 0.076 1.00 55.54 C ATOM 2233 CD1 LEU A 144 -6.070 3.391 0.379 1.00 75.40 C ATOM 2234 CD2 LEU A 144 -7.799 5.005 -0.589 1.00 14.45 C ATOM 0 H LEU A 144 -9.576 3.263 -2.862 1.00 32.43 H new ATOM 0 HA LEU A 144 -6.721 2.645 -2.382 1.00 30.12 H new ATOM 0 HB2 LEU A 144 -9.261 2.556 -0.734 1.00 41.23 H new ATOM 0 HB3 LEU A 144 -7.912 1.528 -0.289 1.00 41.23 H new ATOM 0 HG LEU A 144 -8.095 3.646 1.030 1.00 55.54 H new ATOM 0 HD11 LEU A 144 -5.680 4.218 0.972 1.00 75.40 H new ATOM 0 HD12 LEU A 144 -5.957 2.461 0.936 1.00 75.40 H new ATOM 0 HD13 LEU A 144 -5.516 3.323 -0.557 1.00 75.40 H new ATOM 0 HD21 LEU A 144 -7.364 5.788 0.032 1.00 14.45 H new ATOM 0 HD22 LEU A 144 -7.327 5.017 -1.572 1.00 14.45 H new ATOM 0 HD23 LEU A 144 -8.869 5.181 -0.698 1.00 14.45 H new ATOM 2246 N ASP A 145 -7.005 0.412 -3.573 1.00 45.23 N ATOM 2247 CA ASP A 145 -6.993 -0.973 -4.076 1.00 44.51 C ATOM 2248 C ASP A 145 -6.266 -1.915 -3.107 1.00 34.00 C ATOM 2249 O ASP A 145 -5.047 -2.083 -3.187 1.00 11.03 O ATOM 2250 CB ASP A 145 -6.328 -1.024 -5.470 1.00 23.52 C ATOM 2251 CG ASP A 145 -7.252 -0.540 -6.587 1.00 15.22 C ATOM 2252 OD1 ASP A 145 -7.977 -1.377 -7.150 1.00 22.15 O ATOM 2253 OD2 ASP A 145 -7.271 0.672 -6.896 1.00 40.34 O ATOM 0 H ASP A 145 -6.218 0.972 -3.900 1.00 45.23 H new ATOM 0 HA ASP A 145 -8.026 -1.311 -4.158 1.00 44.51 H new ATOM 0 HB2 ASP A 145 -5.427 -0.411 -5.460 1.00 23.52 H new ATOM 0 HB3 ASP A 145 -6.016 -2.047 -5.681 1.00 23.52 H new ATOM 2258 N PHE A 146 -7.026 -2.545 -2.204 1.00 72.15 N ATOM 2259 CA PHE A 146 -6.493 -3.560 -1.262 1.00 73.24 C ATOM 2260 C PHE A 146 -6.244 -4.884 -1.994 1.00 12.41 C ATOM 2261 O PHE A 146 -5.508 -5.756 -1.520 1.00 71.02 O ATOM 2262 CB PHE A 146 -7.482 -3.790 -0.101 1.00 71.04 C ATOM 2263 CG PHE A 146 -8.029 -2.518 0.511 1.00 11.42 C ATOM 2264 CD1 PHE A 146 -7.167 -1.538 0.992 1.00 53.12 C ATOM 2265 CD2 PHE A 146 -9.400 -2.291 0.587 1.00 72.32 C ATOM 2266 CE1 PHE A 146 -7.660 -0.378 1.530 1.00 62.32 C ATOM 2267 CE2 PHE A 146 -9.889 -1.128 1.128 1.00 51.41 C ATOM 2268 CZ PHE A 146 -9.020 -0.174 1.601 1.00 64.33 C ATOM 0 H PHE A 146 -8.026 -2.373 -2.098 1.00 72.15 H new ATOM 0 HA PHE A 146 -5.551 -3.190 -0.858 1.00 73.24 H new ATOM 0 HB2 PHE A 146 -8.315 -4.393 -0.462 1.00 71.04 H new ATOM 0 HB3 PHE A 146 -6.983 -4.369 0.677 1.00 71.04 H new ATOM 0 HD1 PHE A 146 -6.099 -1.693 0.941 1.00 53.12 H new ATOM 0 HD2 PHE A 146 -10.087 -3.038 0.216 1.00 72.32 H new ATOM 0 HE1 PHE A 146 -6.981 0.377 1.899 1.00 62.32 H new ATOM 0 HE2 PHE A 146 -10.955 -0.963 1.182 1.00 51.41 H new ATOM 0 HZ PHE A 146 -9.405 0.739 2.030 1.00 64.33 H new ATOM 2278 N ASN A 147 -6.886 -5.004 -3.158 1.00 32.33 N ATOM 2279 CA ASN A 147 -6.739 -6.136 -4.072 1.00 10.10 C ATOM 2280 C ASN A 147 -5.413 -6.056 -4.848 1.00 50.15 C ATOM 2281 O ASN A 147 -5.102 -6.952 -5.623 1.00 61.04 O ATOM 2282 CB ASN A 147 -7.932 -6.161 -5.049 1.00 3.24 C ATOM 2283 CG ASN A 147 -7.992 -4.939 -5.982 1.00 1.04 C ATOM 2284 OD1 ASN A 147 -7.496 -4.969 -7.104 1.00 33.03 O ATOM 2285 ND2 ASN A 147 -8.604 -3.865 -5.523 1.00 51.42 N ATOM 0 H ASN A 147 -7.539 -4.298 -3.499 1.00 32.33 H new ATOM 0 HA ASN A 147 -6.725 -7.057 -3.489 1.00 10.10 H new ATOM 0 HB2 ASN A 147 -7.876 -7.066 -5.653 1.00 3.24 H new ATOM 0 HB3 ASN A 147 -8.858 -6.216 -4.477 1.00 3.24 H new ATOM 0 HD21 ASN A 147 -8.674 -3.030 -6.105 1.00 51.42 H new ATOM 0 HD22 ASN A 147 -9.007 -3.869 -4.586 1.00 51.42 H new ATOM 2292 N LEU A 148 -4.662 -4.952 -4.673 1.00 34.44 N ATOM 2293 CA LEU A 148 -3.317 -4.785 -5.239 1.00 45.32 C ATOM 2294 C LEU A 148 -2.289 -4.639 -4.102 1.00 13.15 C ATOM 2295 O LEU A 148 -1.192 -4.135 -4.325 1.00 1.54 O ATOM 2296 CB LEU A 148 -3.283 -3.533 -6.173 1.00 22.44 C ATOM 2297 CG LEU A 148 -4.337 -3.489 -7.330 1.00 43.41 C ATOM 2298 CD1 LEU A 148 -4.147 -2.232 -8.216 1.00 41.33 C ATOM 2299 CD2 LEU A 148 -4.326 -4.786 -8.170 1.00 2.54 C ATOM 0 H LEU A 148 -4.977 -4.148 -4.131 1.00 34.44 H new ATOM 0 HA LEU A 148 -3.063 -5.665 -5.830 1.00 45.32 H new ATOM 0 HB2 LEU A 148 -3.418 -2.645 -5.556 1.00 22.44 H new ATOM 0 HB3 LEU A 148 -2.289 -3.466 -6.616 1.00 22.44 H new ATOM 0 HG LEU A 148 -5.322 -3.420 -6.868 1.00 43.41 H new ATOM 0 HD11 LEU A 148 -4.894 -2.230 -9.010 1.00 41.33 H new ATOM 0 HD12 LEU A 148 -4.264 -1.336 -7.606 1.00 41.33 H new ATOM 0 HD13 LEU A 148 -3.150 -2.244 -8.656 1.00 41.33 H new ATOM 0 HD21 LEU A 148 -5.072 -4.713 -8.961 1.00 2.54 H new ATOM 0 HD22 LEU A 148 -3.340 -4.924 -8.613 1.00 2.54 H new ATOM 0 HD23 LEU A 148 -4.559 -5.636 -7.529 1.00 2.54 H new ATOM 2311 N ALA A 149 -2.642 -5.099 -2.879 1.00 63.20 N ATOM 2312 CA ALA A 149 -1.750 -4.979 -1.708 1.00 5.24 C ATOM 2313 C ALA A 149 -0.531 -5.909 -1.849 1.00 43.14 C ATOM 2314 O ALA A 149 -0.671 -7.127 -2.016 1.00 3.45 O ATOM 2315 CB ALA A 149 -2.502 -5.252 -0.399 1.00 70.14 C ATOM 0 H ALA A 149 -3.533 -5.554 -2.681 1.00 63.20 H new ATOM 0 HA ALA A 149 -1.390 -3.951 -1.671 1.00 5.24 H new ATOM 0 HB1 ALA A 149 -1.815 -5.155 0.442 1.00 70.14 H new ATOM 0 HB2 ALA A 149 -3.314 -4.533 -0.289 1.00 70.14 H new ATOM 0 HB3 ALA A 149 -2.912 -6.262 -0.419 1.00 70.14 H new ATOM 2321 N TYR A 150 0.654 -5.310 -1.722 1.00 43.11 N ATOM 2322 CA TYR A 150 1.934 -5.926 -2.089 1.00 64.44 C ATOM 2323 C TYR A 150 2.549 -6.681 -0.906 1.00 34.31 C ATOM 2324 O TYR A 150 2.223 -6.404 0.259 1.00 53.14 O ATOM 2325 CB TYR A 150 2.897 -4.815 -2.582 1.00 72.23 C ATOM 2326 CG TYR A 150 2.248 -3.844 -3.589 1.00 63.20 C ATOM 2327 CD1 TYR A 150 2.000 -4.230 -4.909 1.00 73.42 C ATOM 2328 CD2 TYR A 150 1.862 -2.551 -3.208 1.00 11.34 C ATOM 2329 CE1 TYR A 150 1.404 -3.361 -5.808 1.00 10.20 C ATOM 2330 CE2 TYR A 150 1.266 -1.688 -4.108 1.00 52.10 C ATOM 2331 CZ TYR A 150 1.043 -2.091 -5.405 1.00 24.01 C ATOM 2332 OH TYR A 150 0.450 -1.223 -6.300 1.00 1.03 O ATOM 0 H TYR A 150 0.755 -4.364 -1.354 1.00 43.11 H new ATOM 0 HA TYR A 150 1.765 -6.652 -2.884 1.00 64.44 H new ATOM 0 HB2 TYR A 150 3.257 -4.249 -1.723 1.00 72.23 H new ATOM 0 HB3 TYR A 150 3.768 -5.279 -3.045 1.00 72.23 H new ATOM 0 HD1 TYR A 150 2.278 -5.222 -5.233 1.00 73.42 H new ATOM 0 HD2 TYR A 150 2.033 -2.224 -2.193 1.00 11.34 H new ATOM 0 HE1 TYR A 150 1.222 -3.677 -6.824 1.00 10.20 H new ATOM 0 HE2 TYR A 150 0.975 -0.697 -3.793 1.00 52.10 H new ATOM 0 HH TYR A 150 0.541 -1.578 -7.209 1.00 1.03 H new ATOM 2342 N SER A 151 3.389 -7.683 -1.219 1.00 42.10 N ATOM 2343 CA SER A 151 4.284 -8.321 -0.250 1.00 4.24 C ATOM 2344 C SER A 151 5.295 -7.293 0.328 1.00 63.22 C ATOM 2345 O SER A 151 6.084 -6.723 -0.435 1.00 53.14 O ATOM 2346 CB SER A 151 5.033 -9.492 -0.934 1.00 74.25 C ATOM 2347 OG SER A 151 5.663 -9.090 -2.143 1.00 3.42 O ATOM 0 H SER A 151 3.463 -8.072 -2.159 1.00 42.10 H new ATOM 0 HA SER A 151 3.691 -8.708 0.578 1.00 4.24 H new ATOM 0 HB2 SER A 151 5.782 -9.891 -0.250 1.00 74.25 H new ATOM 0 HB3 SER A 151 4.330 -10.299 -1.143 1.00 74.25 H new ATOM 0 HG SER A 151 6.081 -8.212 -2.018 1.00 3.42 H new ATOM 2353 N PRO A 152 5.269 -7.018 1.672 1.00 42.42 N ATOM 2354 CA PRO A 152 6.205 -6.071 2.296 1.00 45.45 C ATOM 2355 C PRO A 152 7.575 -6.726 2.560 1.00 0.42 C ATOM 2356 O PRO A 152 7.659 -7.899 2.968 1.00 63.22 O ATOM 2357 CB PRO A 152 5.491 -5.694 3.604 1.00 23.44 C ATOM 2358 CG PRO A 152 4.698 -6.905 3.979 1.00 53.54 C ATOM 2359 CD PRO A 152 4.341 -7.604 2.680 1.00 10.11 C ATOM 0 HA PRO A 152 6.427 -5.207 1.669 1.00 45.45 H new ATOM 0 HB2 PRO A 152 6.207 -5.435 4.384 1.00 23.44 H new ATOM 0 HB3 PRO A 152 4.845 -4.827 3.465 1.00 23.44 H new ATOM 0 HG2 PRO A 152 5.277 -7.563 4.627 1.00 53.54 H new ATOM 0 HG3 PRO A 152 3.799 -6.626 4.529 1.00 53.54 H new ATOM 0 HD2 PRO A 152 4.473 -8.683 2.761 1.00 10.11 H new ATOM 0 HD3 PRO A 152 3.300 -7.430 2.409 1.00 10.11 H new ATOM 2367 N PHE A 153 8.631 -5.948 2.299 1.00 21.24 N ATOM 2368 CA PHE A 153 10.036 -6.353 2.465 1.00 65.23 C ATOM 2369 C PHE A 153 10.344 -6.892 3.883 1.00 50.13 C ATOM 2370 O PHE A 153 11.181 -7.782 4.036 1.00 34.14 O ATOM 2371 CB PHE A 153 10.954 -5.138 2.168 1.00 15.12 C ATOM 2372 CG PHE A 153 10.641 -4.391 0.871 1.00 21.53 C ATOM 2373 CD1 PHE A 153 11.125 -4.843 -0.351 1.00 4.15 C ATOM 2374 CD2 PHE A 153 9.841 -3.243 0.879 1.00 2.32 C ATOM 2375 CE1 PHE A 153 10.826 -4.178 -1.524 1.00 22.14 C ATOM 2376 CE2 PHE A 153 9.540 -2.580 -0.294 1.00 12.33 C ATOM 2377 CZ PHE A 153 10.033 -3.048 -1.495 1.00 74.11 C ATOM 0 H PHE A 153 8.532 -4.992 1.957 1.00 21.24 H new ATOM 0 HA PHE A 153 10.224 -7.166 1.764 1.00 65.23 H new ATOM 0 HB2 PHE A 153 10.883 -4.437 2.999 1.00 15.12 H new ATOM 0 HB3 PHE A 153 11.987 -5.483 2.130 1.00 15.12 H new ATOM 0 HD1 PHE A 153 11.744 -5.727 -0.384 1.00 4.15 H new ATOM 0 HD2 PHE A 153 9.454 -2.870 1.816 1.00 2.32 H new ATOM 0 HE1 PHE A 153 11.213 -4.542 -2.464 1.00 22.14 H new ATOM 0 HE2 PHE A 153 8.920 -1.696 -0.272 1.00 12.33 H new ATOM 0 HZ PHE A 153 9.798 -2.530 -2.413 1.00 74.11 H new ATOM 2387 N CYS A 154 9.665 -6.323 4.896 1.00 40.31 N ATOM 2388 CA CYS A 154 9.854 -6.686 6.314 1.00 34.13 C ATOM 2389 C CYS A 154 9.351 -8.109 6.617 1.00 32.12 C ATOM 2390 O CYS A 154 10.078 -8.917 7.212 1.00 30.11 O ATOM 2391 CB CYS A 154 9.132 -5.657 7.209 1.00 41.52 C ATOM 2392 SG CYS A 154 7.360 -5.489 6.870 1.00 62.13 S ATOM 0 H CYS A 154 8.966 -5.594 4.754 1.00 40.31 H new ATOM 0 HA CYS A 154 10.923 -6.673 6.527 1.00 34.13 H new ATOM 0 HB2 CYS A 154 9.265 -5.943 8.252 1.00 41.52 H new ATOM 0 HB3 CYS A 154 9.608 -4.685 7.082 1.00 41.52 H new ATOM 0 HG CYS A 154 7.140 -4.362 6.260 1.00 62.13 H new ATOM 2398 N ALA A 155 8.107 -8.409 6.189 1.00 60.41 N ATOM 2399 CA ALA A 155 7.451 -9.712 6.448 1.00 42.02 C ATOM 2400 C ALA A 155 8.180 -10.877 5.755 1.00 13.32 C ATOM 2401 O ALA A 155 8.013 -12.033 6.122 1.00 14.14 O ATOM 2402 CB ALA A 155 5.983 -9.658 6.002 1.00 12.11 C ATOM 0 H ALA A 155 7.529 -7.759 5.656 1.00 60.41 H new ATOM 0 HA ALA A 155 7.498 -9.897 7.521 1.00 42.02 H new ATOM 0 HB1 ALA A 155 5.508 -10.620 6.196 1.00 12.11 H new ATOM 0 HB2 ALA A 155 5.462 -8.878 6.557 1.00 12.11 H new ATOM 0 HB3 ALA A 155 5.935 -9.438 4.936 1.00 12.11 H new ATOM 2408 N TYR A 156 8.962 -10.567 4.719 1.00 30.51 N ATOM 2409 CA TYR A 156 9.729 -11.581 3.973 1.00 43.22 C ATOM 2410 C TYR A 156 11.207 -11.606 4.397 1.00 12.02 C ATOM 2411 O TYR A 156 11.806 -12.671 4.478 1.00 51.10 O ATOM 2412 CB TYR A 156 9.517 -11.377 2.448 1.00 12.51 C ATOM 2413 CG TYR A 156 8.111 -11.854 2.007 1.00 63.45 C ATOM 2414 CD1 TYR A 156 6.975 -11.071 2.238 1.00 63.40 C ATOM 2415 CD2 TYR A 156 7.921 -13.119 1.431 1.00 61.23 C ATOM 2416 CE1 TYR A 156 5.713 -11.526 1.916 1.00 1.11 C ATOM 2417 CE2 TYR A 156 6.654 -13.566 1.092 1.00 22.32 C ATOM 2418 CZ TYR A 156 5.556 -12.769 1.340 1.00 32.22 C ATOM 2419 OH TYR A 156 4.293 -13.220 1.029 1.00 72.20 O ATOM 0 H TYR A 156 9.085 -9.616 4.371 1.00 30.51 H new ATOM 0 HA TYR A 156 9.353 -12.574 4.220 1.00 43.22 H new ATOM 0 HB2 TYR A 156 9.640 -10.323 2.199 1.00 12.51 H new ATOM 0 HB3 TYR A 156 10.280 -11.926 1.896 1.00 12.51 H new ATOM 0 HD1 TYR A 156 7.088 -10.091 2.677 1.00 63.40 H new ATOM 0 HD2 TYR A 156 8.775 -13.754 1.249 1.00 61.23 H new ATOM 0 HE1 TYR A 156 4.849 -10.909 2.115 1.00 1.11 H new ATOM 0 HE2 TYR A 156 6.527 -14.536 0.635 1.00 22.32 H new ATOM 0 HH TYR A 156 3.716 -12.457 0.818 1.00 72.20 H new ATOM 2429 N SER A 157 11.785 -10.452 4.727 1.00 0.43 N ATOM 2430 CA SER A 157 13.193 -10.361 5.158 1.00 30.01 C ATOM 2431 C SER A 157 13.273 -9.698 6.540 1.00 13.42 C ATOM 2432 O SER A 157 12.952 -8.509 6.687 1.00 11.02 O ATOM 2433 CB SER A 157 14.025 -9.577 4.131 1.00 23.35 C ATOM 2434 OG SER A 157 14.023 -10.207 2.868 1.00 64.21 O ATOM 0 H SER A 157 11.300 -9.555 4.706 1.00 0.43 H new ATOM 0 HA SER A 157 13.606 -11.368 5.227 1.00 30.01 H new ATOM 0 HB2 SER A 157 13.627 -8.567 4.035 1.00 23.35 H new ATOM 0 HB3 SER A 157 15.050 -9.482 4.489 1.00 23.35 H new ATOM 0 HG SER A 157 13.111 -10.216 2.508 1.00 64.21 H new ATOM 2440 N ASP A 158 13.724 -10.480 7.533 1.00 5.24 N ATOM 2441 CA ASP A 158 13.841 -10.049 8.949 1.00 5.01 C ATOM 2442 C ASP A 158 14.916 -8.967 9.147 1.00 23.12 C ATOM 2443 O ASP A 158 14.960 -8.313 10.196 1.00 23.32 O ATOM 2444 CB ASP A 158 14.137 -11.285 9.848 1.00 33.31 C ATOM 2445 CG ASP A 158 12.983 -12.302 9.846 1.00 63.02 C ATOM 2446 OD1 ASP A 158 12.931 -13.161 8.934 1.00 65.24 O ATOM 2447 OD2 ASP A 158 12.101 -12.225 10.737 1.00 61.02 O ATOM 0 H ASP A 158 14.023 -11.443 7.381 1.00 5.24 H new ATOM 0 HA ASP A 158 12.890 -9.602 9.239 1.00 5.01 H new ATOM 0 HB2 ASP A 158 15.048 -11.773 9.502 1.00 33.31 H new ATOM 0 HB3 ASP A 158 14.322 -10.952 10.869 1.00 33.31 H new ATOM 2452 N THR A 159 15.779 -8.785 8.130 1.00 62.13 N ATOM 2453 CA THR A 159 16.826 -7.747 8.112 1.00 30.23 C ATOM 2454 C THR A 159 16.245 -6.336 7.838 1.00 54.34 C ATOM 2455 O THR A 159 16.978 -5.348 7.850 1.00 40.04 O ATOM 2456 CB THR A 159 17.939 -8.097 7.058 1.00 33.20 C ATOM 2457 OG1 THR A 159 19.043 -7.173 7.145 1.00 13.40 O ATOM 2458 CG2 THR A 159 17.392 -8.101 5.619 1.00 65.14 C ATOM 0 H THR A 159 15.768 -9.361 7.288 1.00 62.13 H new ATOM 0 HA THR A 159 17.275 -7.727 9.105 1.00 30.23 H new ATOM 0 HB THR A 159 18.287 -9.102 7.296 1.00 33.20 H new ATOM 0 HG1 THR A 159 18.727 -6.319 7.508 1.00 13.40 H new ATOM 0 HG21 THR A 159 18.196 -8.348 4.925 1.00 65.14 H new ATOM 0 HG22 THR A 159 16.598 -8.843 5.534 1.00 65.14 H new ATOM 0 HG23 THR A 159 16.994 -7.115 5.378 1.00 65.14 H new ATOM 2466 N PHE A 160 14.926 -6.242 7.596 1.00 54.10 N ATOM 2467 CA PHE A 160 14.218 -4.953 7.491 1.00 2.51 C ATOM 2468 C PHE A 160 13.470 -4.738 8.810 1.00 51.12 C ATOM 2469 O PHE A 160 12.666 -5.597 9.194 1.00 63.41 O ATOM 2470 CB PHE A 160 13.195 -4.946 6.320 1.00 3.24 C ATOM 2471 CG PHE A 160 13.781 -4.966 4.904 1.00 32.12 C ATOM 2472 CD1 PHE A 160 14.400 -6.106 4.401 1.00 2.23 C ATOM 2473 CD2 PHE A 160 13.672 -3.853 4.065 1.00 52.42 C ATOM 2474 CE1 PHE A 160 14.897 -6.139 3.110 1.00 0.02 C ATOM 2475 CE2 PHE A 160 14.160 -3.891 2.770 1.00 53.51 C ATOM 2476 CZ PHE A 160 14.772 -5.036 2.292 1.00 61.32 C ATOM 0 H PHE A 160 14.322 -7.054 7.468 1.00 54.10 H new ATOM 0 HA PHE A 160 14.941 -4.161 7.296 1.00 2.51 H new ATOM 0 HB2 PHE A 160 12.542 -5.811 6.432 1.00 3.24 H new ATOM 0 HB3 PHE A 160 12.569 -4.059 6.418 1.00 3.24 H new ATOM 0 HD1 PHE A 160 14.494 -6.980 5.029 1.00 2.23 H new ATOM 0 HD2 PHE A 160 13.201 -2.953 4.432 1.00 52.42 H new ATOM 0 HE1 PHE A 160 15.384 -7.030 2.742 1.00 0.02 H new ATOM 0 HE2 PHE A 160 14.063 -3.025 2.132 1.00 53.51 H new ATOM 0 HZ PHE A 160 15.151 -5.066 1.281 1.00 61.32 H new ATOM 2486 N SER A 161 13.754 -3.628 9.514 1.00 32.23 N ATOM 2487 CA SER A 161 12.985 -3.235 10.706 1.00 22.12 C ATOM 2488 C SER A 161 11.569 -2.852 10.251 1.00 22.40 C ATOM 2489 O SER A 161 11.412 -1.941 9.423 1.00 1.31 O ATOM 2490 CB SER A 161 13.670 -2.063 11.451 1.00 43.21 C ATOM 2491 OG SER A 161 12.905 -1.636 12.578 1.00 5.14 O ATOM 0 H SER A 161 14.511 -2.987 9.277 1.00 32.23 H new ATOM 0 HA SER A 161 12.937 -4.067 11.409 1.00 22.12 H new ATOM 0 HB2 SER A 161 14.662 -2.371 11.780 1.00 43.21 H new ATOM 0 HB3 SER A 161 13.807 -1.226 10.766 1.00 43.21 H new ATOM 0 HG SER A 161 13.367 -0.897 13.026 1.00 5.14 H new ATOM 2497 N CYS A 162 10.552 -3.562 10.779 1.00 54.43 N ATOM 2498 CA CYS A 162 9.176 -3.478 10.282 1.00 45.35 C ATOM 2499 C CYS A 162 8.570 -2.101 10.595 1.00 3.32 C ATOM 2500 O CYS A 162 8.858 -1.547 11.659 1.00 32.21 O ATOM 2501 CB CYS A 162 8.321 -4.609 10.909 1.00 32.10 C ATOM 2502 SG CYS A 162 8.303 -4.611 12.716 1.00 53.30 S ATOM 0 H CYS A 162 10.668 -4.207 11.561 1.00 54.43 H new ATOM 0 HA CYS A 162 9.184 -3.603 9.199 1.00 45.35 H new ATOM 0 HB2 CYS A 162 7.297 -4.518 10.547 1.00 32.10 H new ATOM 0 HB3 CYS A 162 8.698 -5.570 10.560 1.00 32.10 H new ATOM 0 HG CYS A 162 7.561 -5.590 13.141 1.00 53.30 H new ATOM 2508 N PRO A 163 7.744 -1.525 9.666 1.00 43.33 N ATOM 2509 CA PRO A 163 7.081 -0.210 9.872 1.00 44.02 C ATOM 2510 C PRO A 163 6.302 -0.118 11.189 1.00 10.04 C ATOM 2511 O PRO A 163 5.905 -1.143 11.756 1.00 43.54 O ATOM 2512 CB PRO A 163 6.113 -0.119 8.672 1.00 64.31 C ATOM 2513 CG PRO A 163 6.771 -0.926 7.611 1.00 42.00 C ATOM 2514 CD PRO A 163 7.390 -2.096 8.332 1.00 54.41 C ATOM 0 HA PRO A 163 7.809 0.599 9.932 1.00 44.02 H new ATOM 0 HB2 PRO A 163 5.130 -0.517 8.923 1.00 64.31 H new ATOM 0 HB3 PRO A 163 5.968 0.914 8.355 1.00 64.31 H new ATOM 0 HG2 PRO A 163 6.049 -1.260 6.865 1.00 42.00 H new ATOM 0 HG3 PRO A 163 7.527 -0.343 7.084 1.00 42.00 H new ATOM 0 HD2 PRO A 163 6.692 -2.928 8.422 1.00 54.41 H new ATOM 0 HD3 PRO A 163 8.269 -2.472 7.809 1.00 54.41 H new ATOM 2522 N LEU A 164 6.058 1.113 11.646 1.00 55.52 N ATOM 2523 CA LEU A 164 5.315 1.377 12.877 1.00 1.21 C ATOM 2524 C LEU A 164 3.974 2.030 12.486 1.00 11.01 C ATOM 2525 O LEU A 164 3.899 3.257 12.334 1.00 70.23 O ATOM 2526 CB LEU A 164 6.153 2.281 13.832 1.00 42.53 C ATOM 2527 CG LEU A 164 5.506 2.592 15.222 1.00 43.42 C ATOM 2528 CD1 LEU A 164 5.183 1.296 16.007 1.00 12.21 C ATOM 2529 CD2 LEU A 164 6.399 3.548 16.049 1.00 63.23 C ATOM 0 H LEU A 164 6.373 1.958 11.169 1.00 55.52 H new ATOM 0 HA LEU A 164 5.117 0.453 13.420 1.00 1.21 H new ATOM 0 HB2 LEU A 164 7.117 1.802 14.001 1.00 42.53 H new ATOM 0 HB3 LEU A 164 6.351 3.226 13.326 1.00 42.53 H new ATOM 0 HG LEU A 164 4.558 3.098 15.037 1.00 43.42 H new ATOM 0 HD11 LEU A 164 4.735 1.554 16.967 1.00 12.21 H new ATOM 0 HD12 LEU A 164 4.485 0.687 15.433 1.00 12.21 H new ATOM 0 HD13 LEU A 164 6.102 0.734 16.175 1.00 12.21 H new ATOM 0 HD21 LEU A 164 5.926 3.748 17.010 1.00 63.23 H new ATOM 0 HD22 LEU A 164 7.373 3.086 16.213 1.00 63.23 H new ATOM 0 HD23 LEU A 164 6.529 4.485 15.507 1.00 63.23 H new ATOM 2541 N PRO A 165 2.903 1.208 12.243 1.00 64.21 N ATOM 2542 CA PRO A 165 1.594 1.725 11.821 1.00 71.02 C ATOM 2543 C PRO A 165 0.765 2.218 13.034 1.00 20.54 C ATOM 2544 O PRO A 165 0.714 1.525 14.067 1.00 61.24 O ATOM 2545 CB PRO A 165 0.954 0.491 11.137 1.00 22.10 C ATOM 2546 CG PRO A 165 1.496 -0.689 11.881 1.00 13.54 C ATOM 2547 CD PRO A 165 2.877 -0.283 12.379 1.00 73.31 C ATOM 0 HA PRO A 165 1.654 2.593 11.164 1.00 71.02 H new ATOM 0 HB2 PRO A 165 -0.134 0.528 11.194 1.00 22.10 H new ATOM 0 HB3 PRO A 165 1.216 0.445 10.080 1.00 22.10 H new ATOM 0 HG2 PRO A 165 0.845 -0.956 12.714 1.00 13.54 H new ATOM 0 HG3 PRO A 165 1.558 -1.563 11.232 1.00 13.54 H new ATOM 0 HD2 PRO A 165 3.032 -0.590 13.413 1.00 73.31 H new ATOM 0 HD3 PRO A 165 3.665 -0.749 11.787 1.00 73.31 H new ATOM 2555 N PRO A 166 0.144 3.441 12.950 1.00 43.44 N ATOM 2556 CA PRO A 166 -0.785 3.939 13.989 1.00 70.11 C ATOM 2557 C PRO A 166 -1.945 2.950 14.257 1.00 73.35 C ATOM 2558 O PRO A 166 -2.347 2.181 13.378 1.00 22.33 O ATOM 2559 CB PRO A 166 -1.305 5.293 13.411 1.00 62.24 C ATOM 2560 CG PRO A 166 -0.931 5.277 11.958 1.00 14.14 C ATOM 2561 CD PRO A 166 0.334 4.451 11.873 1.00 44.21 C ATOM 0 HA PRO A 166 -0.296 4.055 14.956 1.00 70.11 H new ATOM 0 HB2 PRO A 166 -2.384 5.386 13.538 1.00 62.24 H new ATOM 0 HB3 PRO A 166 -0.850 6.140 13.924 1.00 62.24 H new ATOM 0 HG2 PRO A 166 -1.726 4.840 11.353 1.00 14.14 H new ATOM 0 HG3 PRO A 166 -0.765 6.288 11.585 1.00 14.14 H new ATOM 0 HD2 PRO A 166 0.446 3.983 10.895 1.00 44.21 H new ATOM 0 HD3 PRO A 166 1.224 5.057 12.040 1.00 44.21 H new ATOM 2569 N GLU A 167 -2.476 3.002 15.484 1.00 33.43 N ATOM 2570 CA GLU A 167 -3.610 2.162 15.928 1.00 53.45 C ATOM 2571 C GLU A 167 -4.864 2.373 15.042 1.00 0.01 C ATOM 2572 O GLU A 167 -5.711 1.483 14.920 1.00 11.35 O ATOM 2573 CB GLU A 167 -3.926 2.464 17.421 1.00 5.24 C ATOM 2574 CG GLU A 167 -2.729 2.241 18.370 1.00 60.23 C ATOM 2575 CD GLU A 167 -3.030 2.603 19.834 1.00 45.44 C ATOM 2576 OE1 GLU A 167 -3.491 1.724 20.596 1.00 3.20 O ATOM 2577 OE2 GLU A 167 -2.806 3.768 20.232 1.00 72.25 O ATOM 0 H GLU A 167 -2.132 3.632 16.208 1.00 33.43 H new ATOM 0 HA GLU A 167 -3.324 1.115 15.826 1.00 53.45 H new ATOM 0 HB2 GLU A 167 -4.260 3.498 17.510 1.00 5.24 H new ATOM 0 HB3 GLU A 167 -4.754 1.833 17.742 1.00 5.24 H new ATOM 0 HG2 GLU A 167 -2.424 1.196 18.318 1.00 60.23 H new ATOM 0 HG3 GLU A 167 -1.885 2.837 18.023 1.00 60.23 H new ATOM 2584 N SER A 168 -4.926 3.543 14.395 1.00 14.44 N ATOM 2585 CA SER A 168 -6.081 3.988 13.603 1.00 42.10 C ATOM 2586 C SER A 168 -6.186 3.298 12.218 1.00 43.32 C ATOM 2587 O SER A 168 -7.271 3.288 11.630 1.00 12.42 O ATOM 2588 CB SER A 168 -5.990 5.516 13.437 1.00 12.01 C ATOM 2589 OG SER A 168 -5.780 6.153 14.690 1.00 73.03 O ATOM 0 H SER A 168 -4.162 4.219 14.407 1.00 14.44 H new ATOM 0 HA SER A 168 -6.986 3.703 14.140 1.00 42.10 H new ATOM 0 HB2 SER A 168 -5.174 5.764 12.758 1.00 12.01 H new ATOM 0 HB3 SER A 168 -6.907 5.891 12.983 1.00 12.01 H new ATOM 0 HG SER A 168 -5.724 7.123 14.559 1.00 73.03 H new ATOM 2595 N ASN A 169 -5.080 2.702 11.701 1.00 42.40 N ATOM 2596 CA ASN A 169 -5.097 2.045 10.358 1.00 55.23 C ATOM 2597 C ASN A 169 -5.261 0.513 10.491 1.00 31.34 C ATOM 2598 O ASN A 169 -5.157 -0.231 9.500 1.00 44.40 O ATOM 2599 CB ASN A 169 -3.829 2.396 9.516 1.00 53.52 C ATOM 2600 CG ASN A 169 -2.539 1.738 10.011 1.00 54.05 C ATOM 2601 OD1 ASN A 169 -1.788 2.322 10.768 1.00 4.02 O ATOM 2602 ND2 ASN A 169 -2.278 0.509 9.582 1.00 75.12 N ATOM 0 H ASN A 169 -4.180 2.660 12.179 1.00 42.40 H new ATOM 0 HA ASN A 169 -5.961 2.438 9.822 1.00 55.23 H new ATOM 0 HB2 ASN A 169 -4.001 2.098 8.482 1.00 53.52 H new ATOM 0 HB3 ASN A 169 -3.695 3.478 9.518 1.00 53.52 H new ATOM 0 HD21 ASN A 169 -1.430 0.032 9.887 1.00 75.12 H new ATOM 0 HD22 ASN A 169 -2.926 0.042 8.947 1.00 75.12 H new ATOM 2609 N TRP A 170 -5.525 0.046 11.722 1.00 50.32 N ATOM 2610 CA TRP A 170 -5.744 -1.379 11.997 1.00 70.42 C ATOM 2611 C TRP A 170 -7.225 -1.699 11.716 1.00 13.02 C ATOM 2612 O TRP A 170 -8.110 -1.265 12.462 1.00 55.31 O ATOM 2613 CB TRP A 170 -5.364 -1.730 13.465 1.00 72.51 C ATOM 2614 CG TRP A 170 -3.925 -1.431 13.859 1.00 60.11 C ATOM 2615 CD1 TRP A 170 -2.872 -1.073 13.048 1.00 13.22 C ATOM 2616 CD2 TRP A 170 -3.391 -1.482 15.192 1.00 33.43 C ATOM 2617 NE1 TRP A 170 -1.740 -0.880 13.803 1.00 31.32 N ATOM 2618 CE2 TRP A 170 -2.030 -1.134 15.119 1.00 23.51 C ATOM 2619 CE3 TRP A 170 -3.945 -1.787 16.443 1.00 33.32 C ATOM 2620 CZ2 TRP A 170 -1.214 -1.081 16.248 1.00 42.34 C ATOM 2621 CZ3 TRP A 170 -3.137 -1.735 17.561 1.00 24.32 C ATOM 2622 CH2 TRP A 170 -1.785 -1.385 17.459 1.00 11.32 C ATOM 0 H TRP A 170 -5.592 0.642 12.547 1.00 50.32 H new ATOM 0 HA TRP A 170 -5.106 -1.983 11.352 1.00 70.42 H new ATOM 0 HB2 TRP A 170 -6.027 -1.182 14.134 1.00 72.51 H new ATOM 0 HB3 TRP A 170 -5.554 -2.791 13.627 1.00 72.51 H new ATOM 0 HD1 TRP A 170 -2.927 -0.960 11.975 1.00 13.22 H new ATOM 0 HE1 TRP A 170 -0.830 -0.594 13.442 1.00 31.32 H new ATOM 0 HE3 TRP A 170 -4.987 -2.058 16.531 1.00 33.32 H new ATOM 0 HZ2 TRP A 170 -0.171 -0.811 16.173 1.00 42.34 H new ATOM 0 HZ3 TRP A 170 -3.554 -1.968 18.530 1.00 24.32 H new ATOM 0 HH2 TRP A 170 -1.178 -1.354 18.352 1.00 11.32 H new ATOM 2633 N LEU A 171 -7.481 -2.447 10.631 1.00 70.30 N ATOM 2634 CA LEU A 171 -8.841 -2.732 10.153 1.00 42.22 C ATOM 2635 C LEU A 171 -9.357 -4.022 10.800 1.00 62.21 C ATOM 2636 O LEU A 171 -8.688 -5.059 10.755 1.00 23.12 O ATOM 2637 CB LEU A 171 -8.852 -2.853 8.605 1.00 22.42 C ATOM 2638 CG LEU A 171 -8.309 -1.615 7.822 1.00 62.41 C ATOM 2639 CD1 LEU A 171 -8.465 -1.802 6.292 1.00 75.02 C ATOM 2640 CD2 LEU A 171 -8.973 -0.303 8.305 1.00 75.25 C ATOM 0 H LEU A 171 -6.749 -2.871 10.061 1.00 70.30 H new ATOM 0 HA LEU A 171 -9.500 -1.911 10.435 1.00 42.22 H new ATOM 0 HB2 LEU A 171 -8.261 -3.725 8.323 1.00 22.42 H new ATOM 0 HB3 LEU A 171 -9.875 -3.043 8.282 1.00 22.42 H new ATOM 0 HG LEU A 171 -7.243 -1.535 8.034 1.00 62.41 H new ATOM 0 HD11 LEU A 171 -8.078 -0.923 5.777 1.00 75.02 H new ATOM 0 HD12 LEU A 171 -7.908 -2.684 5.975 1.00 75.02 H new ATOM 0 HD13 LEU A 171 -9.519 -1.931 6.047 1.00 75.02 H new ATOM 0 HD21 LEU A 171 -8.572 0.538 7.739 1.00 75.25 H new ATOM 0 HD22 LEU A 171 -10.050 -0.363 8.152 1.00 75.25 H new ATOM 0 HD23 LEU A 171 -8.765 -0.159 9.365 1.00 75.25 H new ATOM 2652 N GLU A 172 -10.549 -3.955 11.410 1.00 71.13 N ATOM 2653 CA GLU A 172 -11.178 -5.115 12.061 1.00 51.23 C ATOM 2654 C GLU A 172 -12.101 -5.838 11.052 1.00 73.14 C ATOM 2655 O GLU A 172 -13.311 -5.965 11.250 1.00 20.34 O ATOM 2656 CB GLU A 172 -11.931 -4.642 13.338 1.00 44.55 C ATOM 2657 CG GLU A 172 -12.395 -5.774 14.289 1.00 52.51 C ATOM 2658 CD GLU A 172 -11.259 -6.675 14.810 1.00 54.43 C ATOM 2659 OE1 GLU A 172 -10.146 -6.165 15.094 1.00 11.01 O ATOM 2660 OE2 GLU A 172 -11.466 -7.901 14.949 1.00 72.55 O ATOM 0 H GLU A 172 -11.103 -3.100 11.466 1.00 71.13 H new ATOM 0 HA GLU A 172 -10.424 -5.836 12.377 1.00 51.23 H new ATOM 0 HB2 GLU A 172 -11.281 -3.966 13.894 1.00 44.55 H new ATOM 0 HB3 GLU A 172 -12.804 -4.065 13.033 1.00 44.55 H new ATOM 0 HG2 GLU A 172 -12.908 -5.328 15.141 1.00 52.51 H new ATOM 0 HG3 GLU A 172 -13.124 -6.394 13.767 1.00 52.51 H new ATOM 2667 N THR A 173 -11.491 -6.253 9.935 1.00 63.11 N ATOM 2668 CA THR A 173 -12.154 -6.983 8.849 1.00 14.52 C ATOM 2669 C THR A 173 -11.094 -7.737 8.033 1.00 74.42 C ATOM 2670 O THR A 173 -9.921 -7.356 8.045 1.00 21.44 O ATOM 2671 CB THR A 173 -12.972 -6.024 7.919 1.00 30.14 C ATOM 2672 OG1 THR A 173 -13.587 -6.768 6.855 1.00 51.44 O ATOM 2673 CG2 THR A 173 -12.110 -4.888 7.328 1.00 24.04 C ATOM 0 H THR A 173 -10.500 -6.087 9.758 1.00 63.11 H new ATOM 0 HA THR A 173 -12.860 -7.688 9.287 1.00 14.52 H new ATOM 0 HB THR A 173 -13.738 -5.561 8.541 1.00 30.14 H new ATOM 0 HG1 THR A 173 -13.673 -6.197 6.063 1.00 51.44 H new ATOM 0 HG21 THR A 173 -12.729 -4.255 6.692 1.00 24.04 H new ATOM 0 HG22 THR A 173 -11.691 -4.290 8.138 1.00 24.04 H new ATOM 0 HG23 THR A 173 -11.300 -5.316 6.736 1.00 24.04 H new ATOM 2681 N ALA A 174 -11.505 -8.818 7.353 1.00 44.05 N ATOM 2682 CA ALA A 174 -10.604 -9.624 6.512 1.00 53.01 C ATOM 2683 C ALA A 174 -10.607 -9.088 5.077 1.00 41.23 C ATOM 2684 O ALA A 174 -11.670 -8.836 4.501 1.00 73.13 O ATOM 2685 CB ALA A 174 -11.019 -11.104 6.538 1.00 11.14 C ATOM 0 H ALA A 174 -12.467 -9.158 7.370 1.00 44.05 H new ATOM 0 HA ALA A 174 -9.593 -9.549 6.911 1.00 53.01 H new ATOM 0 HB1 ALA A 174 -10.341 -11.683 5.911 1.00 11.14 H new ATOM 0 HB2 ALA A 174 -10.974 -11.477 7.561 1.00 11.14 H new ATOM 0 HB3 ALA A 174 -12.037 -11.203 6.160 1.00 11.14 H new ATOM 2691 N VAL A 175 -9.411 -8.912 4.519 1.00 63.13 N ATOM 2692 CA VAL A 175 -9.210 -8.517 3.129 1.00 23.32 C ATOM 2693 C VAL A 175 -8.747 -9.761 2.358 1.00 3.13 C ATOM 2694 O VAL A 175 -7.553 -10.079 2.299 1.00 64.22 O ATOM 2695 CB VAL A 175 -8.173 -7.334 3.016 1.00 60.31 C ATOM 2696 CG1 VAL A 175 -7.903 -6.959 1.539 1.00 14.34 C ATOM 2697 CG2 VAL A 175 -8.658 -6.107 3.837 1.00 13.14 C ATOM 0 H VAL A 175 -8.539 -9.043 5.031 1.00 63.13 H new ATOM 0 HA VAL A 175 -10.139 -8.142 2.700 1.00 23.32 H new ATOM 0 HB VAL A 175 -7.226 -7.670 3.438 1.00 60.31 H new ATOM 0 HG11 VAL A 175 -7.184 -6.141 1.497 1.00 14.34 H new ATOM 0 HG12 VAL A 175 -7.500 -7.824 1.012 1.00 14.34 H new ATOM 0 HG13 VAL A 175 -8.835 -6.648 1.066 1.00 14.34 H new ATOM 0 HG21 VAL A 175 -7.931 -5.300 3.748 1.00 13.14 H new ATOM 0 HG22 VAL A 175 -9.622 -5.771 3.454 1.00 13.14 H new ATOM 0 HG23 VAL A 175 -8.762 -6.388 4.885 1.00 13.14 H new ATOM 2707 N THR A 176 -9.733 -10.498 1.832 1.00 24.42 N ATOM 2708 CA THR A 176 -9.513 -11.710 1.041 1.00 12.03 C ATOM 2709 C THR A 176 -9.858 -11.410 -0.424 1.00 74.33 C ATOM 2710 O THR A 176 -11.026 -11.231 -0.768 1.00 11.01 O ATOM 2711 CB THR A 176 -10.387 -12.895 1.594 1.00 1.54 C ATOM 2712 OG1 THR A 176 -11.767 -12.490 1.677 1.00 74.23 O ATOM 2713 CG2 THR A 176 -9.918 -13.357 2.989 1.00 55.13 C ATOM 0 H THR A 176 -10.719 -10.264 1.947 1.00 24.42 H new ATOM 0 HA THR A 176 -8.468 -12.013 1.111 1.00 12.03 H new ATOM 0 HB THR A 176 -10.276 -13.729 0.901 1.00 1.54 H new ATOM 0 HG1 THR A 176 -11.993 -11.936 0.901 1.00 74.23 H new ATOM 0 HG21 THR A 176 -10.549 -14.177 3.332 1.00 55.13 H new ATOM 0 HG22 THR A 176 -8.884 -13.696 2.931 1.00 55.13 H new ATOM 0 HG23 THR A 176 -9.989 -12.526 3.691 1.00 55.13 H new ATOM 2721 N ALA A 177 -8.823 -11.323 -1.264 1.00 1.45 N ATOM 2722 CA ALA A 177 -8.952 -11.003 -2.696 1.00 62.12 C ATOM 2723 C ALA A 177 -7.890 -11.788 -3.461 1.00 41.13 C ATOM 2724 O ALA A 177 -6.755 -11.869 -2.999 1.00 31.11 O ATOM 2725 CB ALA A 177 -8.794 -9.489 -2.927 1.00 24.40 C ATOM 0 H ALA A 177 -7.858 -11.474 -0.969 1.00 1.45 H new ATOM 0 HA ALA A 177 -9.942 -11.284 -3.055 1.00 62.12 H new ATOM 0 HB1 ALA A 177 -8.892 -9.271 -3.990 1.00 24.40 H new ATOM 0 HB2 ALA A 177 -9.566 -8.954 -2.374 1.00 24.40 H new ATOM 0 HB3 ALA A 177 -7.812 -9.169 -2.580 1.00 24.40 H new ATOM 2731 N GLY A 178 -8.267 -12.352 -4.624 1.00 31.14 N ATOM 2732 CA GLY A 178 -7.375 -13.216 -5.401 1.00 64.34 C ATOM 2733 C GLY A 178 -6.775 -14.372 -4.607 1.00 30.55 C ATOM 2734 O GLY A 178 -7.437 -14.926 -3.726 1.00 51.14 O ATOM 0 H GLY A 178 -9.188 -12.221 -5.043 1.00 31.14 H new ATOM 0 HA2 GLY A 178 -7.928 -13.621 -6.249 1.00 64.34 H new ATOM 0 HA3 GLY A 178 -6.565 -12.611 -5.808 1.00 64.34 H new ATOM 2738 N GLU A 179 -5.528 -14.747 -4.955 1.00 14.34 N ATOM 2739 CA GLU A 179 -4.748 -15.759 -4.219 1.00 44.30 C ATOM 2740 C GLU A 179 -4.274 -15.216 -2.861 1.00 32.41 C ATOM 2741 O GLU A 179 -4.073 -14.012 -2.696 1.00 21.11 O ATOM 2742 CB GLU A 179 -3.520 -16.210 -5.058 1.00 61.05 C ATOM 2743 CG GLU A 179 -3.870 -16.880 -6.396 1.00 13.04 C ATOM 2744 CD GLU A 179 -4.737 -18.141 -6.236 1.00 11.23 C ATOM 2745 OE1 GLU A 179 -4.213 -19.181 -5.780 1.00 1.25 O ATOM 2746 OE2 GLU A 179 -5.947 -18.096 -6.560 1.00 22.32 O ATOM 0 H GLU A 179 -5.033 -14.355 -5.756 1.00 14.34 H new ATOM 0 HA GLU A 179 -5.399 -16.615 -4.041 1.00 44.30 H new ATOM 0 HB2 GLU A 179 -2.892 -15.341 -5.255 1.00 61.05 H new ATOM 0 HB3 GLU A 179 -2.926 -16.904 -4.464 1.00 61.05 H new ATOM 0 HG2 GLU A 179 -4.396 -16.163 -7.027 1.00 13.04 H new ATOM 0 HG3 GLU A 179 -2.948 -17.144 -6.914 1.00 13.04 H new ATOM 2753 N ARG A 180 -4.084 -16.134 -1.906 1.00 22.51 N ATOM 2754 CA ARG A 180 -3.538 -15.823 -0.566 1.00 70.23 C ATOM 2755 C ARG A 180 -2.009 -16.064 -0.566 1.00 4.24 C ATOM 2756 O ARG A 180 -1.388 -16.146 -1.631 1.00 40.01 O ATOM 2757 CB ARG A 180 -4.248 -16.702 0.507 1.00 44.12 C ATOM 2758 CG ARG A 180 -4.149 -18.225 0.260 1.00 31.40 C ATOM 2759 CD ARG A 180 -4.691 -19.064 1.428 1.00 53.52 C ATOM 2760 NE ARG A 180 -3.824 -18.998 2.627 1.00 72.22 N ATOM 2761 CZ ARG A 180 -4.181 -19.390 3.866 1.00 11.40 C ATOM 2762 NH1 ARG A 180 -5.393 -19.884 4.106 1.00 14.31 N ATOM 2763 NH2 ARG A 180 -3.310 -19.297 4.862 1.00 13.41 N ATOM 0 H ARG A 180 -4.304 -17.122 -2.035 1.00 22.51 H new ATOM 0 HA ARG A 180 -3.722 -14.777 -0.322 1.00 70.23 H new ATOM 0 HB2 ARG A 180 -3.819 -16.477 1.484 1.00 44.12 H new ATOM 0 HB3 ARG A 180 -5.301 -16.422 0.549 1.00 44.12 H new ATOM 0 HG2 ARG A 180 -4.700 -18.476 -0.646 1.00 31.40 H new ATOM 0 HG3 ARG A 180 -3.107 -18.491 0.083 1.00 31.40 H new ATOM 0 HD2 ARG A 180 -5.691 -18.716 1.687 1.00 53.52 H new ATOM 0 HD3 ARG A 180 -4.788 -20.102 1.111 1.00 53.52 H new ATOM 0 HE ARG A 180 -2.882 -18.626 2.505 1.00 72.22 H new ATOM 0 HH11 ARG A 180 -6.068 -19.971 3.346 1.00 14.31 H new ATOM 0 HH12 ARG A 180 -5.647 -20.176 5.050 1.00 14.31 H new ATOM 0 HH21 ARG A 180 -2.374 -18.930 4.689 1.00 13.41 H new ATOM 0 HH22 ARG A 180 -3.576 -19.593 5.801 1.00 13.41 H new ATOM 2777 N THR A 181 -1.417 -16.193 0.637 1.00 12.33 N ATOM 2778 CA THR A 181 0.001 -16.545 0.800 1.00 34.14 C ATOM 2779 C THR A 181 0.143 -17.355 2.102 1.00 21.01 C ATOM 2780 O THR A 181 -0.148 -16.864 3.204 1.00 70.51 O ATOM 2781 CB THR A 181 0.968 -15.297 0.755 1.00 12.31 C ATOM 2782 OG1 THR A 181 2.337 -15.701 0.974 1.00 41.11 O ATOM 2783 CG2 THR A 181 0.591 -14.195 1.754 1.00 12.10 C ATOM 0 H THR A 181 -1.910 -16.056 1.519 1.00 12.33 H new ATOM 0 HA THR A 181 0.314 -17.151 -0.050 1.00 34.14 H new ATOM 0 HB THR A 181 0.860 -14.874 -0.244 1.00 12.31 H new ATOM 0 HG1 THR A 181 2.824 -14.977 1.421 1.00 41.11 H new ATOM 0 HG21 THR A 181 1.297 -13.369 1.668 1.00 12.10 H new ATOM 0 HG22 THR A 181 -0.415 -13.836 1.537 1.00 12.10 H new ATOM 0 HG23 THR A 181 0.623 -14.596 2.767 1.00 12.10 H new ATOM 2791 N ASP A 182 0.553 -18.619 1.949 1.00 14.03 N ATOM 2792 CA ASP A 182 0.611 -19.592 3.046 1.00 13.12 C ATOM 2793 C ASP A 182 1.948 -19.461 3.794 1.00 20.14 C ATOM 2794 O ASP A 182 2.955 -20.047 3.408 1.00 3.31 O ATOM 2795 CB ASP A 182 0.354 -21.051 2.535 1.00 64.32 C ATOM 2796 CG ASP A 182 1.321 -21.533 1.429 1.00 65.34 C ATOM 2797 OD1 ASP A 182 1.300 -20.951 0.326 1.00 64.21 O ATOM 2798 OD2 ASP A 182 2.084 -22.497 1.656 1.00 34.10 O ATOM 0 H ASP A 182 0.857 -18.999 1.052 1.00 14.03 H new ATOM 0 HA ASP A 182 -0.190 -19.372 3.752 1.00 13.12 H new ATOM 0 HB2 ASP A 182 0.424 -21.734 3.381 1.00 64.32 H new ATOM 0 HB3 ASP A 182 -0.667 -21.114 2.158 1.00 64.32 H new ATOM 2803 N LEU A 183 1.947 -18.613 4.831 1.00 63.03 N ATOM 2804 CA LEU A 183 3.093 -18.446 5.753 1.00 13.43 C ATOM 2805 C LEU A 183 3.438 -19.790 6.441 1.00 23.14 C ATOM 2806 O LEU A 183 4.610 -20.089 6.701 1.00 2.42 O ATOM 2807 CB LEU A 183 2.796 -17.339 6.815 1.00 24.43 C ATOM 2808 CG LEU A 183 1.659 -17.627 7.861 1.00 73.13 C ATOM 2809 CD1 LEU A 183 1.716 -16.637 9.032 1.00 23.20 C ATOM 2810 CD2 LEU A 183 0.245 -17.628 7.233 1.00 41.43 C ATOM 0 H LEU A 183 1.151 -18.018 5.060 1.00 63.03 H new ATOM 0 HA LEU A 183 3.957 -18.129 5.169 1.00 13.43 H new ATOM 0 HB2 LEU A 183 3.717 -17.143 7.364 1.00 24.43 H new ATOM 0 HB3 LEU A 183 2.541 -16.422 6.284 1.00 24.43 H new ATOM 0 HG LEU A 183 1.845 -18.633 8.236 1.00 73.13 H new ATOM 0 HD11 LEU A 183 0.917 -16.862 9.738 1.00 23.20 H new ATOM 0 HD12 LEU A 183 2.679 -16.723 9.535 1.00 23.20 H new ATOM 0 HD13 LEU A 183 1.592 -15.621 8.656 1.00 23.20 H new ATOM 0 HD21 LEU A 183 -0.496 -17.833 8.006 1.00 41.43 H new ATOM 0 HD22 LEU A 183 0.044 -16.654 6.787 1.00 41.43 H new ATOM 0 HD23 LEU A 183 0.189 -18.398 6.464 1.00 41.43 H new ATOM 2822 N GLU A 184 2.395 -20.607 6.697 1.00 34.41 N ATOM 2823 CA GLU A 184 2.528 -21.944 7.283 1.00 31.32 C ATOM 2824 C GLU A 184 2.575 -22.986 6.148 1.00 54.42 C ATOM 2825 O GLU A 184 1.594 -23.701 5.903 1.00 51.31 O ATOM 2826 CB GLU A 184 1.340 -22.218 8.252 1.00 51.34 C ATOM 2827 CG GLU A 184 1.136 -21.155 9.341 1.00 41.31 C ATOM 2828 CD GLU A 184 2.351 -20.968 10.261 1.00 63.14 C ATOM 2829 OE1 GLU A 184 2.573 -21.816 11.150 1.00 64.00 O ATOM 2830 OE2 GLU A 184 3.083 -19.964 10.112 1.00 33.22 O ATOM 0 H GLU A 184 1.429 -20.348 6.498 1.00 34.41 H new ATOM 0 HA GLU A 184 3.451 -22.012 7.859 1.00 31.32 H new ATOM 0 HB2 GLU A 184 0.424 -22.298 7.667 1.00 51.34 H new ATOM 0 HB3 GLU A 184 1.497 -23.184 8.732 1.00 51.34 H new ATOM 0 HG2 GLU A 184 0.902 -20.202 8.866 1.00 41.31 H new ATOM 0 HG3 GLU A 184 0.273 -21.430 9.947 1.00 41.31 H new ATOM 2837 N HIS A 185 3.716 -23.017 5.441 1.00 43.32 N ATOM 2838 CA HIS A 185 3.929 -23.873 4.251 1.00 51.13 C ATOM 2839 C HIS A 185 3.800 -25.373 4.617 1.00 4.03 C ATOM 2840 O HIS A 185 2.830 -26.025 4.179 1.00 74.33 O ATOM 2841 CB HIS A 185 5.323 -23.594 3.621 1.00 40.13 C ATOM 2842 CG HIS A 185 5.566 -22.149 3.287 1.00 30.32 C ATOM 2843 ND1 HIS A 185 6.013 -21.231 4.217 1.00 22.03 N ATOM 2844 CD2 HIS A 185 5.424 -21.458 2.133 1.00 3.10 C ATOM 2845 CE1 HIS A 185 6.126 -20.054 3.653 1.00 22.31 C ATOM 2846 NE2 HIS A 185 5.777 -20.165 2.393 1.00 53.05 N ATOM 0 H HIS A 185 4.527 -22.445 5.677 1.00 43.32 H new ATOM 0 HA HIS A 185 3.158 -23.630 3.520 1.00 51.13 H new ATOM 0 HB2 HIS A 185 6.096 -23.931 4.311 1.00 40.13 H new ATOM 0 HB3 HIS A 185 5.425 -24.188 2.713 1.00 40.13 H new ATOM 0 HD2 HIS A 185 5.094 -21.854 1.184 1.00 3.10 H new ATOM 0 HE1 HIS A 185 6.451 -19.147 4.142 1.00 22.31 H new ATOM 0 HE2 HIS A 185 5.770 -19.404 1.714 1.00 53.05 H new TER 2855 HIS A 185