USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1045 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 74 TYR OH : rot 15:sc= -0.196 USER MOD Set 1.2: A 108 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 93 THR OG1 : rot -79:sc= 1.25 USER MOD Set 2.2: A 95 MET CE :methyl 163:sc=-0.00744 (180deg=-0.298) USER MOD Set 3.1: A 60 THR OG1 : rot -12:sc= 0.142 USER MOD Set 3.2: A 62 GLN : amide:sc= -1.28 X(o=-1.1,f=-0.81) USER MOD Set 4.1: A 27 SER OG : rot -80:sc= -0.222 USER MOD Set 4.2: A 144 THR OG1 : rot -170:sc= -0.0424 USER MOD Single : A 1 ILE N :NH3+ 140:sc= 0.085 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 HIS : no HD1:sc= -0.0416 X(o=-0.042,f=-0.038) USER MOD Single : A 7 SER OG : rot 180:sc= 0.00364 USER MOD Single : A 16 ASN : amide:sc= -1.12 X(o=-1.1,f=-0.86) USER MOD Single : A 20 THR OG1 : rot 91:sc= 1.27 USER MOD Single : A 21 GLN : amide:sc= -0.361 X(o=-0.36,f=-0.54) USER MOD Single : A 26 THR OG1 : rot -49:sc= 1.78 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= -0.542 K(o=-0.54,f=-4.9!) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0.00719 USER MOD Single : A 48 GLN : amide:sc= -0.274 X(o=-0.27,f=-0.3) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0.235 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -0.226 X(o=-0.23,f=-0.019) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 63:sc= 1.15 USER MOD Single : A 72 ASN : amide:sc= -0.143 X(o=-0.14,f=0) USER MOD Single : A 75 MET CE :methyl 144:sc= -0.0938 (180deg=-3.22!) USER MOD Single : A 77 SER OG : rot 180:sc= 0.00345 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0.0105 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 ASN : amide:sc= 0.858 K(o=0.86,f=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0.00281 USER MOD Single : A 114 HIS : no HD1:sc=-0.00405 X(o=-0.0041,f=0) USER MOD Single : A 118 THR OG1 : rot -6:sc= 0.619 USER MOD Single : A 121 GLN : amide:sc= -1.49! K(o=-1.5!,f=-0.031) USER MOD Single : A 122 MET CE :methyl -125:sc=-0.00595 (180deg=-0.333) USER MOD Single : A 126 GLN : amide:sc= -0.182 K(o=-0.18,f=-1.2) USER MOD Single : A 127 GLN : amide:sc= 0.397 X(o=0.4,f=-0.1) USER MOD Single : A 128 MET CE :methyl -174:sc= -2.36 (180deg=-2.55) USER MOD Single : A 129 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 134 ASN : amide:sc= 0.714 K(o=0.71,f=-0.035) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 SER OG : rot -47:sc= 0.0345 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 1 13.821 -3.942 6.821 1.00 0.00 N ATOM 2 CA ILE A 1 14.320 -3.071 7.892 1.00 0.00 C ATOM 3 C ILE A 1 15.143 -1.940 7.275 1.00 0.00 C ATOM 4 O ILE A 1 15.680 -2.099 6.172 1.00 0.00 O ATOM 5 CB ILE A 1 15.075 -3.826 9.003 1.00 0.00 C ATOM 6 CG1 ILE A 1 16.156 -4.789 8.482 1.00 0.00 C ATOM 7 CG2 ILE A 1 14.059 -4.532 9.916 1.00 0.00 C ATOM 8 CD1 ILE A 1 17.137 -5.170 9.589 1.00 0.00 C ATOM 0 H1 ILE A 1 13.883 -4.935 7.124 1.00 0.00 H new ATOM 0 H2 ILE A 1 12.830 -3.705 6.614 1.00 0.00 H new ATOM 0 H3 ILE A 1 14.396 -3.804 5.965 1.00 0.00 H new ATOM 0 HA ILE A 1 13.460 -2.642 8.407 1.00 0.00 H new ATOM 0 HB ILE A 1 15.631 -3.088 9.581 1.00 0.00 H new ATOM 0 HG12 ILE A 1 15.685 -5.688 8.085 1.00 0.00 H new ATOM 0 HG13 ILE A 1 16.696 -4.322 7.659 1.00 0.00 H new ATOM 0 HG21 ILE A 1 14.589 -5.068 10.704 1.00 0.00 H new ATOM 0 HG22 ILE A 1 13.396 -3.792 10.363 1.00 0.00 H new ATOM 0 HG23 ILE A 1 13.471 -5.238 9.329 1.00 0.00 H new ATOM 0 HD11 ILE A 1 17.889 -5.851 9.190 1.00 0.00 H new ATOM 0 HD12 ILE A 1 17.625 -4.272 9.967 1.00 0.00 H new ATOM 0 HD13 ILE A 1 16.598 -5.659 10.400 1.00 0.00 H new ATOM 20 N PRO A 2 15.235 -0.785 7.955 1.00 0.00 N ATOM 21 CA PRO A 2 16.112 0.313 7.572 1.00 0.00 C ATOM 22 C PRO A 2 17.587 -0.053 7.786 1.00 0.00 C ATOM 23 O PRO A 2 17.928 -1.202 8.092 1.00 0.00 O ATOM 24 CB PRO A 2 15.668 1.496 8.441 1.00 0.00 C ATOM 25 CG PRO A 2 15.181 0.820 9.713 1.00 0.00 C ATOM 26 CD PRO A 2 14.524 -0.451 9.180 1.00 0.00 C ATOM 0 HA PRO A 2 16.036 0.555 6.512 1.00 0.00 H new ATOM 0 HB2 PRO A 2 16.491 2.183 8.638 1.00 0.00 H new ATOM 0 HB3 PRO A 2 14.877 2.074 7.963 1.00 0.00 H new ATOM 0 HG2 PRO A 2 16.002 0.597 10.394 1.00 0.00 H new ATOM 0 HG3 PRO A 2 14.474 1.444 10.259 1.00 0.00 H new ATOM 0 HD2 PRO A 2 14.595 -1.261 9.906 1.00 0.00 H new ATOM 0 HD3 PRO A 2 13.464 -0.290 8.985 1.00 0.00 H new ATOM 34 N LYS A 3 18.470 0.930 7.597 1.00 0.00 N ATOM 35 CA LYS A 3 19.913 0.798 7.760 1.00 0.00 C ATOM 36 C LYS A 3 20.315 0.265 9.144 1.00 0.00 C ATOM 37 O LYS A 3 19.517 0.222 10.088 1.00 0.00 O ATOM 38 CB LYS A 3 20.616 2.123 7.383 1.00 0.00 C ATOM 39 CG LYS A 3 20.845 3.156 8.504 1.00 0.00 C ATOM 40 CD LYS A 3 19.607 3.771 9.174 1.00 0.00 C ATOM 41 CE LYS A 3 18.780 4.617 8.201 1.00 0.00 C ATOM 42 NZ LYS A 3 17.743 5.409 8.889 1.00 0.00 N ATOM 0 H LYS A 3 18.187 1.869 7.317 1.00 0.00 H new ATOM 0 HA LYS A 3 20.261 0.033 7.066 1.00 0.00 H new ATOM 0 HB2 LYS A 3 21.586 1.877 6.950 1.00 0.00 H new ATOM 0 HB3 LYS A 3 20.030 2.603 6.599 1.00 0.00 H new ATOM 0 HG2 LYS A 3 21.445 2.681 9.280 1.00 0.00 H new ATOM 0 HG3 LYS A 3 21.443 3.970 8.093 1.00 0.00 H new ATOM 0 HD2 LYS A 3 18.983 2.975 9.581 1.00 0.00 H new ATOM 0 HD3 LYS A 3 19.921 4.390 10.014 1.00 0.00 H new ATOM 0 HE2 LYS A 3 19.442 5.287 7.653 1.00 0.00 H new ATOM 0 HE3 LYS A 3 18.308 3.964 7.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 17.210 5.965 8.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 17.094 4.770 9.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 18.193 6.052 9.572 1.00 0.00 H new ATOM 56 N HIS A 4 21.591 -0.079 9.264 1.00 0.00 N ATOM 57 CA HIS A 4 22.270 -0.555 10.462 1.00 0.00 C ATOM 58 C HIS A 4 23.464 0.367 10.749 1.00 0.00 C ATOM 59 O HIS A 4 23.822 1.172 9.885 1.00 0.00 O ATOM 60 CB HIS A 4 22.695 -2.020 10.257 1.00 0.00 C ATOM 61 CG HIS A 4 23.145 -2.376 8.864 1.00 0.00 C ATOM 62 ND1 HIS A 4 22.512 -3.268 8.035 1.00 0.00 N ATOM 63 CD2 HIS A 4 24.226 -1.878 8.192 1.00 0.00 C ATOM 64 CE1 HIS A 4 23.204 -3.335 6.891 1.00 0.00 C ATOM 65 NE2 HIS A 4 24.270 -2.521 6.951 1.00 0.00 N ATOM 0 H HIS A 4 22.225 -0.029 8.467 1.00 0.00 H new ATOM 0 HA HIS A 4 21.608 -0.527 11.328 1.00 0.00 H new ATOM 0 HB2 HIS A 4 23.505 -2.245 10.950 1.00 0.00 H new ATOM 0 HB3 HIS A 4 21.857 -2.664 10.525 1.00 0.00 H new ATOM 0 HD2 HIS A 4 24.916 -1.129 8.552 1.00 0.00 H new ATOM 0 HE1 HIS A 4 22.943 -3.953 6.044 1.00 0.00 H new ATOM 0 HE2 HIS A 4 24.978 -2.395 6.228 1.00 0.00 H new ATOM 73 N PRO A 5 24.064 0.318 11.949 1.00 0.00 N ATOM 74 CA PRO A 5 25.253 1.096 12.273 1.00 0.00 C ATOM 75 C PRO A 5 26.494 0.439 11.650 1.00 0.00 C ATOM 76 O PRO A 5 27.206 -0.319 12.313 1.00 0.00 O ATOM 77 CB PRO A 5 25.280 1.164 13.803 1.00 0.00 C ATOM 78 CG PRO A 5 24.593 -0.132 14.234 1.00 0.00 C ATOM 79 CD PRO A 5 23.626 -0.460 13.102 1.00 0.00 C ATOM 0 HA PRO A 5 25.242 2.106 11.864 1.00 0.00 H new ATOM 0 HB2 PRO A 5 26.300 1.223 14.184 1.00 0.00 H new ATOM 0 HB3 PRO A 5 24.750 2.041 14.175 1.00 0.00 H new ATOM 0 HG2 PRO A 5 25.317 -0.933 14.379 1.00 0.00 H new ATOM 0 HG3 PRO A 5 24.066 -0.004 15.179 1.00 0.00 H new ATOM 0 HD2 PRO A 5 23.638 -1.527 12.878 1.00 0.00 H new ATOM 0 HD3 PRO A 5 22.603 -0.203 13.378 1.00 0.00 H new ATOM 87 N ASP A 6 26.727 0.717 10.367 1.00 0.00 N ATOM 88 CA ASP A 6 27.911 0.320 9.604 1.00 0.00 C ATOM 89 C ASP A 6 28.308 1.461 8.645 1.00 0.00 C ATOM 90 O ASP A 6 27.845 2.592 8.814 1.00 0.00 O ATOM 91 CB ASP A 6 27.716 -1.073 8.957 1.00 0.00 C ATOM 92 CG ASP A 6 27.549 -1.089 7.434 1.00 0.00 C ATOM 93 OD1 ASP A 6 26.657 -0.402 6.906 1.00 0.00 O ATOM 94 OD2 ASP A 6 28.375 -1.777 6.784 1.00 0.00 O ATOM 0 H ASP A 6 26.064 1.250 9.805 1.00 0.00 H new ATOM 0 HA ASP A 6 28.770 0.179 10.261 1.00 0.00 H new ATOM 0 HB2 ASP A 6 28.573 -1.695 9.215 1.00 0.00 H new ATOM 0 HB3 ASP A 6 26.838 -1.539 9.404 1.00 0.00 H new ATOM 99 N SER A 7 29.231 1.207 7.717 1.00 0.00 N ATOM 100 CA SER A 7 29.813 2.139 6.767 1.00 0.00 C ATOM 101 C SER A 7 28.803 3.062 6.071 1.00 0.00 C ATOM 102 O SER A 7 28.104 2.667 5.138 1.00 0.00 O ATOM 103 CB SER A 7 30.544 1.325 5.705 1.00 0.00 C ATOM 104 OG SER A 7 31.555 0.503 6.267 1.00 0.00 O ATOM 0 H SER A 7 29.617 0.269 7.606 1.00 0.00 H new ATOM 0 HA SER A 7 30.474 2.795 7.333 1.00 0.00 H new ATOM 0 HB2 SER A 7 29.828 0.703 5.168 1.00 0.00 H new ATOM 0 HB3 SER A 7 30.990 2.000 4.974 1.00 0.00 H new ATOM 0 HG SER A 7 31.998 -0.003 5.555 1.00 0.00 H new ATOM 110 N GLU A 8 28.857 4.349 6.406 1.00 0.00 N ATOM 111 CA GLU A 8 28.320 5.438 5.605 1.00 0.00 C ATOM 112 C GLU A 8 29.302 5.701 4.458 1.00 0.00 C ATOM 113 O GLU A 8 29.939 6.751 4.375 1.00 0.00 O ATOM 114 CB GLU A 8 28.102 6.686 6.481 1.00 0.00 C ATOM 115 CG GLU A 8 26.983 6.529 7.523 1.00 0.00 C ATOM 116 CD GLU A 8 25.591 6.325 6.912 1.00 0.00 C ATOM 117 OE1 GLU A 8 25.261 6.980 5.895 1.00 0.00 O ATOM 118 OE2 GLU A 8 24.765 5.582 7.496 1.00 0.00 O ATOM 0 H GLU A 8 29.291 4.669 7.272 1.00 0.00 H new ATOM 0 HA GLU A 8 27.347 5.177 5.189 1.00 0.00 H new ATOM 0 HB2 GLU A 8 29.033 6.924 6.995 1.00 0.00 H new ATOM 0 HB3 GLU A 8 27.869 7.534 5.837 1.00 0.00 H new ATOM 0 HG2 GLU A 8 27.215 5.680 8.166 1.00 0.00 H new ATOM 0 HG3 GLU A 8 26.964 7.415 8.158 1.00 0.00 H new ATOM 125 N ALA A 9 29.474 4.690 3.608 1.00 0.00 N ATOM 126 CA ALA A 9 30.309 4.753 2.414 1.00 0.00 C ATOM 127 C ALA A 9 29.632 4.119 1.199 1.00 0.00 C ATOM 128 O ALA A 9 30.293 3.564 0.321 1.00 0.00 O ATOM 129 CB ALA A 9 31.676 4.120 2.717 1.00 0.00 C ATOM 0 H ALA A 9 29.025 3.783 3.735 1.00 0.00 H new ATOM 0 HA ALA A 9 30.460 5.799 2.148 1.00 0.00 H new ATOM 0 HB1 ALA A 9 32.303 4.165 1.827 1.00 0.00 H new ATOM 0 HB2 ALA A 9 32.158 4.666 3.528 1.00 0.00 H new ATOM 0 HB3 ALA A 9 31.538 3.080 3.011 1.00 0.00 H new ATOM 135 N VAL A 10 28.314 4.252 1.117 1.00 0.00 N ATOM 136 CA VAL A 10 27.486 3.693 0.050 1.00 0.00 C ATOM 137 C VAL A 10 26.434 4.718 -0.389 1.00 0.00 C ATOM 138 O VAL A 10 25.860 5.431 0.444 1.00 0.00 O ATOM 139 CB VAL A 10 26.871 2.336 0.475 1.00 0.00 C ATOM 140 CG1 VAL A 10 27.946 1.244 0.592 1.00 0.00 C ATOM 141 CG2 VAL A 10 26.092 2.371 1.799 1.00 0.00 C ATOM 0 H VAL A 10 27.773 4.767 1.811 1.00 0.00 H new ATOM 0 HA VAL A 10 28.111 3.481 -0.818 1.00 0.00 H new ATOM 0 HB VAL A 10 26.163 2.110 -0.322 1.00 0.00 H new ATOM 0 HG11 VAL A 10 27.480 0.305 0.892 1.00 0.00 H new ATOM 0 HG12 VAL A 10 28.438 1.113 -0.372 1.00 0.00 H new ATOM 0 HG13 VAL A 10 28.683 1.538 1.339 1.00 0.00 H new ATOM 0 HG21 VAL A 10 25.698 1.378 2.016 1.00 0.00 H new ATOM 0 HG22 VAL A 10 26.757 2.681 2.605 1.00 0.00 H new ATOM 0 HG23 VAL A 10 25.267 3.079 1.717 1.00 0.00 H new ATOM 151 N ALA A 11 26.182 4.787 -1.700 1.00 0.00 N ATOM 152 CA ALA A 11 25.154 5.623 -2.313 1.00 0.00 C ATOM 153 C ALA A 11 23.787 5.387 -1.644 1.00 0.00 C ATOM 154 O ALA A 11 23.548 4.294 -1.126 1.00 0.00 O ATOM 155 CB ALA A 11 25.109 5.315 -3.815 1.00 0.00 C ATOM 0 H ALA A 11 26.708 4.243 -2.384 1.00 0.00 H new ATOM 0 HA ALA A 11 25.396 6.676 -2.171 1.00 0.00 H new ATOM 0 HB1 ALA A 11 24.346 5.931 -4.290 1.00 0.00 H new ATOM 0 HB2 ALA A 11 26.080 5.533 -4.260 1.00 0.00 H new ATOM 0 HB3 ALA A 11 24.870 4.262 -3.963 1.00 0.00 H new ATOM 161 N PRO A 12 22.907 6.403 -1.614 1.00 0.00 N ATOM 162 CA PRO A 12 21.700 6.367 -0.805 1.00 0.00 C ATOM 163 C PRO A 12 20.665 5.406 -1.379 1.00 0.00 C ATOM 164 O PRO A 12 20.327 5.475 -2.564 1.00 0.00 O ATOM 165 CB PRO A 12 21.189 7.804 -0.762 1.00 0.00 C ATOM 166 CG PRO A 12 21.681 8.377 -2.087 1.00 0.00 C ATOM 167 CD PRO A 12 23.027 7.689 -2.284 1.00 0.00 C ATOM 0 HA PRO A 12 21.903 5.994 0.199 1.00 0.00 H new ATOM 0 HB2 PRO A 12 20.103 7.845 -0.682 1.00 0.00 H new ATOM 0 HB3 PRO A 12 21.592 8.351 0.090 1.00 0.00 H new ATOM 0 HG2 PRO A 12 20.992 8.156 -2.902 1.00 0.00 H new ATOM 0 HG3 PRO A 12 21.785 9.461 -2.043 1.00 0.00 H new ATOM 0 HD2 PRO A 12 23.251 7.561 -3.343 1.00 0.00 H new ATOM 0 HD3 PRO A 12 23.837 8.280 -1.856 1.00 0.00 H new ATOM 175 N ASP A 13 20.125 4.552 -0.516 1.00 0.00 N ATOM 176 CA ASP A 13 18.992 3.709 -0.878 1.00 0.00 C ATOM 177 C ASP A 13 17.753 4.612 -0.988 1.00 0.00 C ATOM 178 O ASP A 13 17.647 5.582 -0.226 1.00 0.00 O ATOM 179 CB ASP A 13 18.784 2.589 0.155 1.00 0.00 C ATOM 180 CG ASP A 13 18.035 1.414 -0.480 1.00 0.00 C ATOM 181 OD1 ASP A 13 18.678 0.613 -1.198 1.00 0.00 O ATOM 182 OD2 ASP A 13 16.802 1.267 -0.319 1.00 0.00 O ATOM 0 H ASP A 13 20.455 4.425 0.441 1.00 0.00 H new ATOM 0 HA ASP A 13 19.177 3.217 -1.833 1.00 0.00 H new ATOM 0 HB2 ASP A 13 19.748 2.252 0.535 1.00 0.00 H new ATOM 0 HB3 ASP A 13 18.221 2.970 1.007 1.00 0.00 H new ATOM 187 N PRO A 14 16.825 4.344 -1.919 1.00 0.00 N ATOM 188 CA PRO A 14 15.588 5.101 -2.093 1.00 0.00 C ATOM 189 C PRO A 14 14.604 4.887 -0.927 1.00 0.00 C ATOM 190 O PRO A 14 14.969 4.436 0.159 1.00 0.00 O ATOM 191 CB PRO A 14 15.049 4.675 -3.470 1.00 0.00 C ATOM 192 CG PRO A 14 15.646 3.292 -3.687 1.00 0.00 C ATOM 193 CD PRO A 14 17.001 3.412 -3.017 1.00 0.00 C ATOM 0 HA PRO A 14 15.752 6.178 -2.071 1.00 0.00 H new ATOM 0 HB2 PRO A 14 13.959 4.646 -3.481 1.00 0.00 H new ATOM 0 HB3 PRO A 14 15.357 5.370 -4.252 1.00 0.00 H new ATOM 0 HG2 PRO A 14 15.036 2.511 -3.233 1.00 0.00 H new ATOM 0 HG3 PRO A 14 15.737 3.050 -4.746 1.00 0.00 H new ATOM 0 HD2 PRO A 14 17.344 2.443 -2.655 1.00 0.00 H new ATOM 0 HD3 PRO A 14 17.752 3.774 -3.719 1.00 0.00 H new ATOM 201 N PHE A 15 13.338 5.269 -1.135 1.00 0.00 N ATOM 202 CA PHE A 15 12.250 5.213 -0.159 1.00 0.00 C ATOM 203 C PHE A 15 12.433 6.261 0.954 1.00 0.00 C ATOM 204 O PHE A 15 12.079 6.035 2.112 1.00 0.00 O ATOM 205 CB PHE A 15 11.992 3.778 0.339 1.00 0.00 C ATOM 206 CG PHE A 15 11.708 2.779 -0.765 1.00 0.00 C ATOM 207 CD1 PHE A 15 10.555 2.923 -1.563 1.00 0.00 C ATOM 208 CD2 PHE A 15 12.573 1.688 -0.976 1.00 0.00 C ATOM 209 CE1 PHE A 15 10.257 1.968 -2.549 1.00 0.00 C ATOM 210 CE2 PHE A 15 12.252 0.714 -1.938 1.00 0.00 C ATOM 211 CZ PHE A 15 11.088 0.847 -2.715 1.00 0.00 C ATOM 0 H PHE A 15 13.033 5.643 -2.033 1.00 0.00 H new ATOM 0 HA PHE A 15 11.326 5.495 -0.663 1.00 0.00 H new ATOM 0 HB2 PHE A 15 12.860 3.440 0.905 1.00 0.00 H new ATOM 0 HB3 PHE A 15 11.148 3.791 1.028 1.00 0.00 H new ATOM 0 HD1 PHE A 15 9.900 3.769 -1.416 1.00 0.00 H new ATOM 0 HD2 PHE A 15 13.482 1.599 -0.400 1.00 0.00 H new ATOM 0 HE1 PHE A 15 9.389 2.095 -3.179 1.00 0.00 H new ATOM 0 HE2 PHE A 15 12.901 -0.138 -2.080 1.00 0.00 H new ATOM 0 HZ PHE A 15 10.832 0.088 -3.439 1.00 0.00 H new ATOM 221 N ASN A 16 12.976 7.432 0.595 1.00 0.00 N ATOM 222 CA ASN A 16 13.200 8.571 1.492 1.00 0.00 C ATOM 223 C ASN A 16 11.896 9.004 2.174 1.00 0.00 C ATOM 224 O ASN A 16 10.858 9.027 1.501 1.00 0.00 O ATOM 225 CB ASN A 16 13.738 9.763 0.672 1.00 0.00 C ATOM 226 CG ASN A 16 14.787 10.563 1.418 1.00 0.00 C ATOM 227 OD1 ASN A 16 15.759 10.022 1.939 1.00 0.00 O ATOM 228 ND2 ASN A 16 14.599 11.866 1.493 1.00 0.00 N ATOM 0 H ASN A 16 13.281 7.617 -0.360 1.00 0.00 H new ATOM 0 HA ASN A 16 13.916 8.267 2.256 1.00 0.00 H new ATOM 0 HB2 ASN A 16 14.165 9.394 -0.261 1.00 0.00 H new ATOM 0 HB3 ASN A 16 12.909 10.419 0.406 1.00 0.00 H new ATOM 0 HD21 ASN A 16 15.269 12.450 1.993 1.00 0.00 H new ATOM 0 HD22 ASN A 16 13.783 12.290 1.051 1.00 0.00 H new ATOM 235 N PRO A 17 11.934 9.455 3.440 1.00 0.00 N ATOM 236 CA PRO A 17 10.755 9.904 4.174 1.00 0.00 C ATOM 237 C PRO A 17 10.353 11.325 3.773 1.00 0.00 C ATOM 238 O PRO A 17 9.174 11.675 3.865 1.00 0.00 O ATOM 239 CB PRO A 17 11.165 9.871 5.650 1.00 0.00 C ATOM 240 CG PRO A 17 12.659 10.177 5.585 1.00 0.00 C ATOM 241 CD PRO A 17 13.114 9.535 4.283 1.00 0.00 C ATOM 0 HA PRO A 17 9.894 9.269 3.964 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.624 10.612 6.238 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.969 8.900 6.104 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.846 11.251 5.586 1.00 0.00 H new ATOM 0 HG3 PRO A 17 13.189 9.760 6.441 1.00 0.00 H new ATOM 0 HD2 PRO A 17 13.894 10.130 3.807 1.00 0.00 H new ATOM 0 HD3 PRO A 17 13.533 8.545 4.462 1.00 0.00 H new ATOM 249 N ALA A 18 11.300 12.148 3.298 1.00 0.00 N ATOM 250 CA ALA A 18 11.086 13.540 2.910 1.00 0.00 C ATOM 251 C ALA A 18 10.323 13.671 1.580 1.00 0.00 C ATOM 252 O ALA A 18 10.492 14.640 0.848 1.00 0.00 O ATOM 253 CB ALA A 18 12.425 14.293 2.908 1.00 0.00 C ATOM 0 H ALA A 18 12.266 11.847 3.171 1.00 0.00 H new ATOM 0 HA ALA A 18 10.439 14.007 3.653 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.259 15.330 2.618 1.00 0.00 H new ATOM 0 HB2 ALA A 18 12.862 14.261 3.906 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.106 13.823 2.199 1.00 0.00 H new ATOM 259 N ALA A 19 9.459 12.710 1.283 1.00 0.00 N ATOM 260 CA ALA A 19 8.532 12.650 0.177 1.00 0.00 C ATOM 261 C ALA A 19 7.088 12.533 0.689 1.00 0.00 C ATOM 262 O ALA A 19 6.159 12.709 -0.086 1.00 0.00 O ATOM 263 CB ALA A 19 8.934 11.437 -0.658 1.00 0.00 C ATOM 0 H ALA A 19 9.388 11.878 1.869 1.00 0.00 H new ATOM 0 HA ALA A 19 8.570 13.557 -0.427 1.00 0.00 H new ATOM 0 HB1 ALA A 19 8.262 11.344 -1.512 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.957 11.562 -1.013 1.00 0.00 H new ATOM 0 HB3 ALA A 19 8.870 10.537 -0.046 1.00 0.00 H new ATOM 269 N THR A 20 6.879 12.278 1.985 1.00 0.00 N ATOM 270 CA THR A 20 5.581 11.926 2.551 1.00 0.00 C ATOM 271 C THR A 20 4.525 13.021 2.321 1.00 0.00 C ATOM 272 O THR A 20 3.385 12.702 2.006 1.00 0.00 O ATOM 273 CB THR A 20 5.793 11.578 4.037 1.00 0.00 C ATOM 274 OG1 THR A 20 6.765 10.555 4.160 1.00 0.00 O ATOM 275 CG2 THR A 20 4.546 11.076 4.753 1.00 0.00 C ATOM 0 H THR A 20 7.625 12.312 2.680 1.00 0.00 H new ATOM 0 HA THR A 20 5.173 11.055 2.039 1.00 0.00 H new ATOM 0 HB THR A 20 6.100 12.516 4.500 1.00 0.00 H new ATOM 0 HG1 THR A 20 7.653 10.958 4.262 1.00 0.00 H new ATOM 0 HG21 THR A 20 4.787 10.856 5.793 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.771 11.842 4.715 1.00 0.00 H new ATOM 0 HG23 THR A 20 4.186 10.171 4.264 1.00 0.00 H new ATOM 283 N GLN A 21 4.870 14.310 2.422 1.00 0.00 N ATOM 284 CA GLN A 21 3.893 15.370 2.150 1.00 0.00 C ATOM 285 C GLN A 21 3.400 15.377 0.689 1.00 0.00 C ATOM 286 O GLN A 21 2.255 15.759 0.446 1.00 0.00 O ATOM 287 CB GLN A 21 4.421 16.750 2.576 1.00 0.00 C ATOM 288 CG GLN A 21 5.848 17.073 2.113 1.00 0.00 C ATOM 289 CD GLN A 21 6.892 16.820 3.192 1.00 0.00 C ATOM 290 OE1 GLN A 21 6.741 17.211 4.346 1.00 0.00 O ATOM 291 NE2 GLN A 21 7.951 16.101 2.875 1.00 0.00 N ATOM 0 H GLN A 21 5.799 14.640 2.685 1.00 0.00 H new ATOM 0 HA GLN A 21 3.021 15.143 2.763 1.00 0.00 H new ATOM 0 HB2 GLN A 21 3.748 17.515 2.188 1.00 0.00 H new ATOM 0 HB3 GLN A 21 4.385 16.816 3.663 1.00 0.00 H new ATOM 0 HG2 GLN A 21 6.085 16.470 1.236 1.00 0.00 H new ATOM 0 HG3 GLN A 21 5.897 18.117 1.805 1.00 0.00 H new ATOM 0 HE21 GLN A 21 8.078 15.775 1.917 1.00 0.00 H new ATOM 0 HE22 GLN A 21 8.643 15.871 3.588 1.00 0.00 H new ATOM 300 N LEU A 22 4.214 14.913 -0.270 1.00 0.00 N ATOM 301 CA LEU A 22 3.928 14.897 -1.710 1.00 0.00 C ATOM 302 C LEU A 22 3.056 13.678 -2.063 1.00 0.00 C ATOM 303 O LEU A 22 3.215 13.058 -3.115 1.00 0.00 O ATOM 304 CB LEU A 22 5.240 14.889 -2.530 1.00 0.00 C ATOM 305 CG LEU A 22 6.051 16.184 -2.661 1.00 0.00 C ATOM 306 CD1 LEU A 22 6.469 16.756 -1.323 1.00 0.00 C ATOM 307 CD2 LEU A 22 7.332 15.874 -3.443 1.00 0.00 C ATOM 0 H LEU A 22 5.130 14.521 -0.052 1.00 0.00 H new ATOM 0 HA LEU A 22 3.379 15.803 -1.965 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.895 14.135 -2.093 1.00 0.00 H new ATOM 0 HB3 LEU A 22 4.995 14.553 -3.537 1.00 0.00 H new ATOM 0 HG LEU A 22 5.415 16.914 -3.162 1.00 0.00 H new ATOM 0 HD11 LEU A 22 7.039 17.671 -1.481 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.582 16.979 -0.730 1.00 0.00 H new ATOM 0 HD13 LEU A 22 7.087 16.030 -0.794 1.00 0.00 H new ATOM 0 HD21 LEU A 22 7.924 16.783 -3.547 1.00 0.00 H new ATOM 0 HD22 LEU A 22 7.912 15.123 -2.907 1.00 0.00 H new ATOM 0 HD23 LEU A 22 7.072 15.495 -4.431 1.00 0.00 H new ATOM 319 N LEU A 23 2.155 13.292 -1.159 1.00 0.00 N ATOM 320 CA LEU A 23 1.173 12.236 -1.372 1.00 0.00 C ATOM 321 C LEU A 23 -0.232 12.823 -1.546 1.00 0.00 C ATOM 322 O LEU A 23 -1.148 12.088 -1.896 1.00 0.00 O ATOM 323 CB LEU A 23 1.249 11.217 -0.217 1.00 0.00 C ATOM 324 CG LEU A 23 2.567 10.409 -0.198 1.00 0.00 C ATOM 325 CD1 LEU A 23 2.688 9.582 1.089 1.00 0.00 C ATOM 326 CD2 LEU A 23 2.659 9.457 -1.396 1.00 0.00 C ATOM 0 H LEU A 23 2.089 13.718 -0.235 1.00 0.00 H new ATOM 0 HA LEU A 23 1.402 11.707 -2.297 1.00 0.00 H new ATOM 0 HB2 LEU A 23 1.141 11.744 0.731 1.00 0.00 H new ATOM 0 HB3 LEU A 23 0.409 10.527 -0.295 1.00 0.00 H new ATOM 0 HG LEU A 23 3.379 11.134 -0.249 1.00 0.00 H new ATOM 0 HD11 LEU A 23 3.624 9.024 1.076 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.675 10.248 1.952 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.851 8.886 1.154 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.598 8.905 -1.351 1.00 0.00 H new ATOM 0 HD22 LEU A 23 1.824 8.756 -1.369 1.00 0.00 H new ATOM 0 HD23 LEU A 23 2.620 10.032 -2.321 1.00 0.00 H new ATOM 338 N ASP A 24 -0.400 14.133 -1.356 1.00 0.00 N ATOM 339 CA ASP A 24 -1.682 14.832 -1.208 1.00 0.00 C ATOM 340 C ASP A 24 -2.622 14.718 -2.413 1.00 0.00 C ATOM 341 O ASP A 24 -3.841 14.796 -2.245 1.00 0.00 O ATOM 342 CB ASP A 24 -1.360 16.307 -0.940 1.00 0.00 C ATOM 343 CG ASP A 24 -2.520 17.059 -0.298 1.00 0.00 C ATOM 344 OD1 ASP A 24 -2.619 17.014 0.951 1.00 0.00 O ATOM 345 OD2 ASP A 24 -3.241 17.794 -1.012 1.00 0.00 O ATOM 0 H ASP A 24 0.395 14.770 -1.298 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.223 14.359 -0.388 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.488 16.371 -0.290 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -1.094 16.792 -1.879 1.00 0.00 H new ATOM 350 N ASP A 25 -2.064 14.542 -3.614 1.00 0.00 N ATOM 351 CA ASP A 25 -2.788 14.465 -4.892 1.00 0.00 C ATOM 352 C ASP A 25 -2.941 13.032 -5.410 1.00 0.00 C ATOM 353 O ASP A 25 -3.652 12.770 -6.383 1.00 0.00 O ATOM 354 CB ASP A 25 -1.965 15.240 -5.935 1.00 0.00 C ATOM 355 CG ASP A 25 -2.715 15.464 -7.248 1.00 0.00 C ATOM 356 OD1 ASP A 25 -3.555 16.388 -7.271 1.00 0.00 O ATOM 357 OD2 ASP A 25 -2.398 14.833 -8.282 1.00 0.00 O ATOM 0 H ASP A 25 -1.055 14.445 -3.730 1.00 0.00 H new ATOM 0 HA ASP A 25 -3.786 14.873 -4.733 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -1.679 16.206 -5.518 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -1.043 14.695 -6.139 1.00 0.00 H new ATOM 362 N THR A 26 -2.173 12.125 -4.817 1.00 0.00 N ATOM 363 CA THR A 26 -1.668 10.944 -5.497 1.00 0.00 C ATOM 364 C THR A 26 -2.653 9.779 -5.365 1.00 0.00 C ATOM 365 O THR A 26 -3.664 9.880 -4.671 1.00 0.00 O ATOM 366 CB THR A 26 -0.254 10.644 -4.974 1.00 0.00 C ATOM 367 OG1 THR A 26 -0.249 10.261 -3.615 1.00 0.00 O ATOM 368 CG2 THR A 26 0.691 11.840 -5.118 1.00 0.00 C ATOM 0 H THR A 26 -1.882 12.192 -3.842 1.00 0.00 H new ATOM 0 HA THR A 26 -1.583 11.116 -6.570 1.00 0.00 H new ATOM 0 HB THR A 26 0.096 9.818 -5.593 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.778 10.900 -3.093 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.676 11.574 -4.734 1.00 0.00 H new ATOM 0 HG22 THR A 26 0.774 12.114 -6.170 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.297 12.685 -4.553 1.00 0.00 H new ATOM 376 N SER A 27 -2.380 8.654 -6.025 1.00 0.00 N ATOM 377 CA SER A 27 -3.348 7.569 -6.104 1.00 0.00 C ATOM 378 C SER A 27 -2.791 6.267 -5.600 1.00 0.00 C ATOM 379 O SER A 27 -3.097 5.853 -4.488 1.00 0.00 O ATOM 380 CB SER A 27 -3.872 7.450 -7.531 1.00 0.00 C ATOM 381 OG SER A 27 -2.826 7.610 -8.462 1.00 0.00 O ATOM 0 H SER A 27 -1.501 8.474 -6.509 1.00 0.00 H new ATOM 0 HA SER A 27 -4.182 7.809 -5.445 1.00 0.00 H new ATOM 0 HB2 SER A 27 -4.344 6.477 -7.670 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.639 8.204 -7.706 1.00 0.00 H new ATOM 0 HG SER A 27 -2.634 8.564 -8.577 1.00 0.00 H new ATOM 387 N TRP A 28 -1.925 5.685 -6.416 1.00 0.00 N ATOM 388 CA TRP A 28 -1.296 4.400 -6.228 1.00 0.00 C ATOM 389 C TRP A 28 -2.308 3.251 -6.382 1.00 0.00 C ATOM 390 O TRP A 28 -3.531 3.437 -6.379 1.00 0.00 O ATOM 391 CB TRP A 28 -0.504 4.377 -4.903 1.00 0.00 C ATOM 392 CG TRP A 28 0.270 5.623 -4.551 1.00 0.00 C ATOM 393 CD1 TRP A 28 -0.212 6.715 -3.906 1.00 0.00 C ATOM 394 CD2 TRP A 28 1.664 5.940 -4.852 1.00 0.00 C ATOM 395 NE1 TRP A 28 0.769 7.670 -3.819 1.00 0.00 N ATOM 396 CE2 TRP A 28 1.954 7.252 -4.377 1.00 0.00 C ATOM 397 CE3 TRP A 28 2.709 5.256 -5.505 1.00 0.00 C ATOM 398 CZ2 TRP A 28 3.214 7.853 -4.538 1.00 0.00 C ATOM 399 CZ3 TRP A 28 3.975 5.848 -5.677 1.00 0.00 C ATOM 400 CH2 TRP A 28 4.234 7.140 -5.187 1.00 0.00 C ATOM 0 H TRP A 28 -1.628 6.133 -7.283 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.564 4.237 -7.019 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.204 4.171 -4.093 1.00 0.00 H new ATOM 0 HB3 TRP A 28 0.195 3.542 -4.940 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -1.215 6.817 -3.520 1.00 0.00 H new ATOM 0 HE1 TRP A 28 0.635 8.585 -3.390 1.00 0.00 H new ATOM 0 HE3 TRP A 28 2.535 4.258 -5.881 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 3.395 8.851 -4.167 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 4.754 5.304 -6.190 1.00 0.00 H new ATOM 0 HH2 TRP A 28 5.212 7.581 -5.309 1.00 0.00 H new ATOM 411 N VAL A 29 -1.787 2.044 -6.584 1.00 0.00 N ATOM 412 CA VAL A 29 -2.523 0.791 -6.713 1.00 0.00 C ATOM 413 C VAL A 29 -1.640 -0.257 -6.047 1.00 0.00 C ATOM 414 O VAL A 29 -0.425 -0.245 -6.237 1.00 0.00 O ATOM 415 CB VAL A 29 -2.777 0.448 -8.200 1.00 0.00 C ATOM 416 CG1 VAL A 29 -3.639 -0.809 -8.385 1.00 0.00 C ATOM 417 CG2 VAL A 29 -3.462 1.588 -8.961 1.00 0.00 C ATOM 0 H VAL A 29 -0.780 1.907 -6.667 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.507 0.845 -6.247 1.00 0.00 H new ATOM 0 HB VAL A 29 -1.780 0.275 -8.606 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.782 -0.998 -9.449 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -3.139 -1.663 -7.928 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -4.608 -0.659 -7.909 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.615 1.292 -9.999 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -4.425 1.806 -8.500 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.833 2.478 -8.927 1.00 0.00 H new ATOM 427 N LEU A 30 -2.216 -1.130 -5.226 1.00 0.00 N ATOM 428 CA LEU A 30 -1.478 -2.225 -4.617 1.00 0.00 C ATOM 429 C LEU A 30 -1.251 -3.280 -5.686 1.00 0.00 C ATOM 430 O LEU A 30 -2.216 -3.699 -6.341 1.00 0.00 O ATOM 431 CB LEU A 30 -2.294 -2.821 -3.465 1.00 0.00 C ATOM 432 CG LEU A 30 -1.650 -3.961 -2.655 1.00 0.00 C ATOM 433 CD1 LEU A 30 -1.904 -5.346 -3.249 1.00 0.00 C ATOM 434 CD2 LEU A 30 -0.163 -3.757 -2.412 1.00 0.00 C ATOM 0 H LEU A 30 -3.202 -1.097 -4.967 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.526 -1.872 -4.221 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.540 -2.015 -2.774 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.235 -3.189 -3.874 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.153 -3.921 -1.689 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -1.422 -6.102 -2.629 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -2.977 -5.536 -3.284 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.494 -5.390 -4.258 1.00 0.00 H new ATOM 0 HD21 LEU A 30 0.230 -4.595 -1.836 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.357 -3.698 -3.368 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.009 -2.831 -1.857 1.00 0.00 H new ATOM 446 N SER A 31 -0.013 -3.763 -5.810 1.00 0.00 N ATOM 447 CA SER A 31 0.288 -4.876 -6.689 1.00 0.00 C ATOM 448 C SER A 31 0.811 -6.117 -5.953 1.00 0.00 C ATOM 449 O SER A 31 0.576 -7.216 -6.455 1.00 0.00 O ATOM 450 CB SER A 31 1.264 -4.383 -7.773 1.00 0.00 C ATOM 451 OG SER A 31 1.481 -5.334 -8.798 1.00 0.00 O ATOM 0 H SER A 31 0.794 -3.394 -5.308 1.00 0.00 H new ATOM 0 HA SER A 31 -0.640 -5.214 -7.151 1.00 0.00 H new ATOM 0 HB2 SER A 31 0.875 -3.465 -8.214 1.00 0.00 H new ATOM 0 HB3 SER A 31 2.218 -4.134 -7.308 1.00 0.00 H new ATOM 0 HG SER A 31 2.106 -4.967 -9.458 1.00 0.00 H new ATOM 457 N ALA A 32 1.443 -6.014 -4.773 1.00 0.00 N ATOM 458 CA ALA A 32 1.993 -7.201 -4.104 1.00 0.00 C ATOM 459 C ALA A 32 2.082 -7.029 -2.598 1.00 0.00 C ATOM 460 O ALA A 32 2.435 -5.955 -2.108 1.00 0.00 O ATOM 461 CB ALA A 32 3.405 -7.492 -4.610 1.00 0.00 C ATOM 0 H ALA A 32 1.584 -5.137 -4.271 1.00 0.00 H new ATOM 0 HA ALA A 32 1.311 -8.020 -4.334 1.00 0.00 H new ATOM 0 HB1 ALA A 32 3.798 -8.374 -4.105 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.376 -7.672 -5.685 1.00 0.00 H new ATOM 0 HB3 ALA A 32 4.049 -6.638 -4.402 1.00 0.00 H new ATOM 467 N TRP A 33 1.883 -8.132 -1.882 1.00 0.00 N ATOM 468 CA TRP A 33 1.842 -8.260 -0.429 1.00 0.00 C ATOM 469 C TRP A 33 2.606 -9.523 -0.063 1.00 0.00 C ATOM 470 O TRP A 33 2.100 -10.637 -0.211 1.00 0.00 O ATOM 471 CB TRP A 33 0.377 -8.298 0.045 1.00 0.00 C ATOM 472 CG TRP A 33 -0.005 -8.509 1.471 1.00 0.00 C ATOM 473 CD1 TRP A 33 0.745 -8.998 2.486 1.00 0.00 C ATOM 474 CD2 TRP A 33 -1.314 -8.235 2.039 1.00 0.00 C ATOM 475 NE1 TRP A 33 0.031 -8.911 3.661 1.00 0.00 N ATOM 476 CE2 TRP A 33 -1.230 -8.396 3.449 1.00 0.00 C ATOM 477 CE3 TRP A 33 -2.552 -7.826 1.496 1.00 0.00 C ATOM 478 CZ2 TRP A 33 -2.296 -8.044 4.284 1.00 0.00 C ATOM 479 CZ3 TRP A 33 -3.652 -7.550 2.325 1.00 0.00 C ATOM 480 CH2 TRP A 33 -3.508 -7.633 3.718 1.00 0.00 C ATOM 0 H TRP A 33 1.734 -9.031 -2.340 1.00 0.00 H new ATOM 0 HA TRP A 33 2.309 -7.409 0.067 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -0.073 -7.353 -0.260 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -0.114 -9.085 -0.528 1.00 0.00 H new ATOM 0 HD1 TRP A 33 1.745 -9.394 2.390 1.00 0.00 H new ATOM 0 HE1 TRP A 33 0.390 -9.192 4.573 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -2.655 -7.724 0.426 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -2.184 -8.089 5.357 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -4.603 -7.276 1.893 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -4.339 -7.378 4.359 1.00 0.00 H new ATOM 491 N LYS A 34 3.844 -9.365 0.395 1.00 0.00 N ATOM 492 CA LYS A 34 4.608 -10.447 0.978 1.00 0.00 C ATOM 493 C LYS A 34 4.226 -10.540 2.443 1.00 0.00 C ATOM 494 O LYS A 34 4.193 -9.518 3.127 1.00 0.00 O ATOM 495 CB LYS A 34 6.108 -10.158 0.835 1.00 0.00 C ATOM 496 CG LYS A 34 6.849 -11.467 0.573 1.00 0.00 C ATOM 497 CD LYS A 34 6.860 -11.782 -0.931 1.00 0.00 C ATOM 498 CE LYS A 34 8.087 -11.126 -1.557 1.00 0.00 C ATOM 499 NZ LYS A 34 8.342 -11.529 -2.948 1.00 0.00 N ATOM 0 H LYS A 34 4.342 -8.475 0.369 1.00 0.00 H new ATOM 0 HA LYS A 34 4.395 -11.389 0.472 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.279 -9.459 0.016 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.488 -9.686 1.741 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.871 -11.394 0.944 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.369 -12.280 1.118 1.00 0.00 H new ATOM 0 HD2 LYS A 34 6.884 -12.860 -1.092 1.00 0.00 H new ATOM 0 HD3 LYS A 34 5.950 -11.410 -1.402 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.965 -10.043 -1.521 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.962 -11.368 -0.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 9.190 -11.041 -3.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.491 -12.557 -2.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.525 -11.274 -3.539 1.00 0.00 H new ATOM 513 N GLN A 35 3.927 -11.737 2.930 1.00 0.00 N ATOM 514 CA GLN A 35 3.899 -11.967 4.361 1.00 0.00 C ATOM 515 C GLN A 35 5.313 -11.912 4.908 1.00 0.00 C ATOM 516 O GLN A 35 6.280 -12.021 4.150 1.00 0.00 O ATOM 517 CB GLN A 35 3.278 -13.308 4.715 1.00 0.00 C ATOM 518 CG GLN A 35 1.804 -13.357 4.309 1.00 0.00 C ATOM 519 CD GLN A 35 1.121 -14.652 4.712 1.00 0.00 C ATOM 520 OE1 GLN A 35 0.198 -15.094 4.037 1.00 0.00 O ATOM 521 NE2 GLN A 35 1.542 -15.269 5.801 1.00 0.00 N ATOM 0 H GLN A 35 3.703 -12.553 2.360 1.00 0.00 H new ATOM 0 HA GLN A 35 3.283 -11.187 4.808 1.00 0.00 H new ATOM 0 HB2 GLN A 35 3.823 -14.108 4.214 1.00 0.00 H new ATOM 0 HB3 GLN A 35 3.369 -13.483 5.787 1.00 0.00 H new ATOM 0 HG2 GLN A 35 1.279 -12.518 4.766 1.00 0.00 H new ATOM 0 HG3 GLN A 35 1.726 -13.232 3.229 1.00 0.00 H new ATOM 0 HE21 GLN A 35 2.312 -14.878 6.343 1.00 0.00 H new ATOM 0 HE22 GLN A 35 1.097 -16.137 6.100 1.00 0.00 H new ATOM 530 N ALA A 36 5.408 -11.840 6.233 1.00 0.00 N ATOM 531 CA ALA A 36 6.654 -11.603 6.936 1.00 0.00 C ATOM 532 C ALA A 36 7.711 -12.658 6.621 1.00 0.00 C ATOM 533 O ALA A 36 8.895 -12.338 6.649 1.00 0.00 O ATOM 534 CB ALA A 36 6.388 -11.539 8.442 1.00 0.00 C ATOM 0 H ALA A 36 4.605 -11.947 6.853 1.00 0.00 H new ATOM 0 HA ALA A 36 7.054 -10.649 6.592 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.325 -11.361 8.970 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.692 -10.728 8.654 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.957 -12.483 8.776 1.00 0.00 H new ATOM 540 N ASP A 37 7.312 -13.896 6.312 1.00 0.00 N ATOM 541 CA ASP A 37 8.275 -14.975 6.049 1.00 0.00 C ATOM 542 C ASP A 37 8.662 -15.071 4.568 1.00 0.00 C ATOM 543 O ASP A 37 9.693 -15.654 4.219 1.00 0.00 O ATOM 544 CB ASP A 37 7.724 -16.318 6.534 1.00 0.00 C ATOM 545 CG ASP A 37 8.874 -17.276 6.859 1.00 0.00 C ATOM 546 OD1 ASP A 37 9.342 -18.002 5.957 1.00 0.00 O ATOM 547 OD2 ASP A 37 9.318 -17.278 8.033 1.00 0.00 O ATOM 0 H ASP A 37 6.334 -14.177 6.238 1.00 0.00 H new ATOM 0 HA ASP A 37 9.179 -14.731 6.606 1.00 0.00 H new ATOM 0 HB2 ASP A 37 7.106 -16.167 7.419 1.00 0.00 H new ATOM 0 HB3 ASP A 37 7.083 -16.754 5.768 1.00 0.00 H new ATOM 552 N GLY A 38 7.873 -14.456 3.684 1.00 0.00 N ATOM 553 CA GLY A 38 8.050 -14.506 2.238 1.00 0.00 C ATOM 554 C GLY A 38 6.839 -15.076 1.497 1.00 0.00 C ATOM 555 O GLY A 38 6.867 -15.147 0.269 1.00 0.00 O ATOM 0 H GLY A 38 7.070 -13.894 3.967 1.00 0.00 H new ATOM 0 HA2 GLY A 38 8.252 -13.500 1.869 1.00 0.00 H new ATOM 0 HA3 GLY A 38 8.926 -15.112 2.007 1.00 0.00 H new ATOM 559 N THR A 39 5.778 -15.500 2.191 1.00 0.00 N ATOM 560 CA THR A 39 4.537 -15.961 1.574 1.00 0.00 C ATOM 561 C THR A 39 3.886 -14.793 0.823 1.00 0.00 C ATOM 562 O THR A 39 3.193 -13.981 1.428 1.00 0.00 O ATOM 563 CB THR A 39 3.620 -16.580 2.650 1.00 0.00 C ATOM 564 OG1 THR A 39 4.348 -17.491 3.462 1.00 0.00 O ATOM 565 CG2 THR A 39 2.365 -17.245 2.079 1.00 0.00 C ATOM 0 H THR A 39 5.760 -15.532 3.210 1.00 0.00 H new ATOM 0 HA THR A 39 4.733 -16.745 0.843 1.00 0.00 H new ATOM 0 HB THR A 39 3.268 -15.751 3.263 1.00 0.00 H new ATOM 0 HG1 THR A 39 3.752 -17.873 4.140 1.00 0.00 H new ATOM 0 HG21 THR A 39 1.769 -17.657 2.893 1.00 0.00 H new ATOM 0 HG22 THR A 39 1.776 -16.505 1.537 1.00 0.00 H new ATOM 0 HG23 THR A 39 2.655 -18.046 1.400 1.00 0.00 H new ATOM 573 N ALA A 40 4.140 -14.636 -0.477 1.00 0.00 N ATOM 574 CA ALA A 40 3.400 -13.703 -1.310 1.00 0.00 C ATOM 575 C ALA A 40 1.920 -14.078 -1.314 1.00 0.00 C ATOM 576 O ALA A 40 1.518 -15.075 -1.919 1.00 0.00 O ATOM 577 CB ALA A 40 3.995 -13.667 -2.713 1.00 0.00 C ATOM 0 H ALA A 40 4.864 -15.153 -0.976 1.00 0.00 H new ATOM 0 HA ALA A 40 3.481 -12.695 -0.902 1.00 0.00 H new ATOM 0 HB1 ALA A 40 3.433 -12.965 -3.329 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.036 -13.349 -2.659 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.942 -14.661 -3.156 1.00 0.00 H new ATOM 583 N ARG A 41 1.104 -13.280 -0.625 1.00 0.00 N ATOM 584 CA ARG A 41 -0.343 -13.381 -0.713 1.00 0.00 C ATOM 585 C ARG A 41 -0.740 -13.080 -2.142 1.00 0.00 C ATOM 586 O ARG A 41 -0.158 -12.199 -2.782 1.00 0.00 O ATOM 587 CB ARG A 41 -1.007 -12.398 0.260 1.00 0.00 C ATOM 588 CG ARG A 41 -1.101 -13.032 1.653 1.00 0.00 C ATOM 589 CD ARG A 41 -1.305 -11.972 2.751 1.00 0.00 C ATOM 590 NE ARG A 41 -2.535 -12.120 3.559 1.00 0.00 N ATOM 591 CZ ARG A 41 -3.037 -13.205 4.173 1.00 0.00 C ATOM 592 NH1 ARG A 41 -2.474 -14.403 4.081 1.00 0.00 N ATOM 593 NH2 ARG A 41 -4.140 -13.080 4.898 1.00 0.00 N ATOM 0 H ARG A 41 1.432 -12.549 0.007 1.00 0.00 H new ATOM 0 HA ARG A 41 -0.674 -14.382 -0.438 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -0.430 -11.474 0.309 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.002 -12.134 -0.098 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.928 -13.741 1.674 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -0.191 -13.597 1.857 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -0.446 -11.998 3.421 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -1.315 -10.987 2.284 1.00 0.00 H new ATOM 0 HE ARG A 41 -3.086 -11.269 3.667 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -1.626 -14.527 3.527 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -2.889 -15.200 4.564 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -4.594 -12.171 4.983 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.534 -13.893 5.371 1.00 0.00 H new ATOM 607 N ALA A 42 -1.748 -13.800 -2.620 1.00 0.00 N ATOM 608 CA ALA A 42 -2.384 -13.452 -3.872 1.00 0.00 C ATOM 609 C ALA A 42 -3.225 -12.215 -3.598 1.00 0.00 C ATOM 610 O ALA A 42 -3.992 -12.185 -2.633 1.00 0.00 O ATOM 611 CB ALA A 42 -3.229 -14.613 -4.396 1.00 0.00 C ATOM 0 H ALA A 42 -2.136 -14.623 -2.158 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.648 -13.246 -4.649 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -3.697 -14.327 -5.338 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -2.592 -15.483 -4.557 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -4.002 -14.859 -3.667 1.00 0.00 H new ATOM 617 N VAL A 43 -3.078 -11.210 -4.447 1.00 0.00 N ATOM 618 CA VAL A 43 -3.850 -9.980 -4.452 1.00 0.00 C ATOM 619 C VAL A 43 -4.367 -9.796 -5.888 1.00 0.00 C ATOM 620 O VAL A 43 -3.749 -10.327 -6.819 1.00 0.00 O ATOM 621 CB VAL A 43 -2.974 -8.814 -3.947 1.00 0.00 C ATOM 622 CG1 VAL A 43 -2.432 -9.088 -2.531 1.00 0.00 C ATOM 623 CG2 VAL A 43 -1.773 -8.541 -4.865 1.00 0.00 C ATOM 0 H VAL A 43 -2.380 -11.233 -5.190 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.705 -10.012 -3.776 1.00 0.00 H new ATOM 0 HB VAL A 43 -3.627 -7.942 -3.940 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.819 -8.247 -2.207 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.266 -9.217 -1.841 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -1.827 -9.994 -2.542 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.190 -7.712 -4.464 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -1.147 -9.432 -4.920 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.129 -8.286 -5.863 1.00 0.00 H new ATOM 633 N PRO A 44 -5.486 -9.098 -6.119 1.00 0.00 N ATOM 634 CA PRO A 44 -6.021 -8.962 -7.459 1.00 0.00 C ATOM 635 C PRO A 44 -5.113 -8.063 -8.304 1.00 0.00 C ATOM 636 O PRO A 44 -4.956 -6.867 -8.024 1.00 0.00 O ATOM 637 CB PRO A 44 -7.447 -8.447 -7.288 1.00 0.00 C ATOM 638 CG PRO A 44 -7.466 -7.778 -5.917 1.00 0.00 C ATOM 639 CD PRO A 44 -6.343 -8.464 -5.132 1.00 0.00 C ATOM 0 HA PRO A 44 -6.052 -9.903 -8.009 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -7.708 -7.740 -8.075 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -8.169 -9.262 -7.339 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -7.294 -6.705 -5.998 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -8.430 -7.910 -5.426 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -5.784 -7.740 -4.539 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -6.747 -9.200 -4.437 1.00 0.00 H new ATOM 647 N SER A 45 -4.475 -8.646 -9.321 1.00 0.00 N ATOM 648 CA SER A 45 -3.817 -7.910 -10.368 1.00 0.00 C ATOM 649 C SER A 45 -4.820 -7.061 -11.141 1.00 0.00 C ATOM 650 O SER A 45 -6.036 -7.247 -11.024 1.00 0.00 O ATOM 651 CB SER A 45 -3.045 -8.921 -11.216 1.00 0.00 C ATOM 652 OG SER A 45 -3.731 -9.399 -12.357 1.00 0.00 O ATOM 0 H SER A 45 -4.408 -9.658 -9.429 1.00 0.00 H new ATOM 0 HA SER A 45 -3.101 -7.187 -9.976 1.00 0.00 H new ATOM 0 HB2 SER A 45 -2.111 -8.462 -11.539 1.00 0.00 H new ATOM 0 HB3 SER A 45 -2.781 -9.772 -10.588 1.00 0.00 H new ATOM 0 HG SER A 45 -3.162 -10.036 -12.837 1.00 0.00 H new ATOM 658 N ALA A 46 -4.310 -6.168 -11.985 1.00 0.00 N ATOM 659 CA ALA A 46 -5.159 -5.364 -12.852 1.00 0.00 C ATOM 660 C ALA A 46 -5.987 -6.230 -13.807 1.00 0.00 C ATOM 661 O ALA A 46 -7.023 -5.773 -14.289 1.00 0.00 O ATOM 662 CB ALA A 46 -4.300 -4.361 -13.620 1.00 0.00 C ATOM 0 H ALA A 46 -3.312 -5.985 -12.085 1.00 0.00 H new ATOM 0 HA ALA A 46 -5.870 -4.822 -12.229 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -4.936 -3.759 -14.269 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -3.782 -3.711 -12.915 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.568 -4.897 -14.225 1.00 0.00 H new ATOM 668 N ASP A 47 -5.569 -7.474 -14.068 1.00 0.00 N ATOM 669 CA ASP A 47 -6.284 -8.391 -14.956 1.00 0.00 C ATOM 670 C ASP A 47 -7.096 -9.434 -14.198 1.00 0.00 C ATOM 671 O ASP A 47 -7.895 -10.135 -14.808 1.00 0.00 O ATOM 672 CB ASP A 47 -5.318 -9.079 -15.927 1.00 0.00 C ATOM 673 CG ASP A 47 -5.995 -9.422 -17.260 1.00 0.00 C ATOM 674 OD1 ASP A 47 -6.706 -8.556 -17.827 1.00 0.00 O ATOM 675 OD2 ASP A 47 -5.721 -10.511 -17.808 1.00 0.00 O ATOM 0 H ASP A 47 -4.721 -7.873 -13.666 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.989 -7.782 -15.522 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -4.463 -8.428 -16.111 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -4.932 -9.991 -15.471 1.00 0.00 H new ATOM 680 N GLN A 48 -6.926 -9.526 -12.874 1.00 0.00 N ATOM 681 CA GLN A 48 -7.738 -10.392 -12.028 1.00 0.00 C ATOM 682 C GLN A 48 -9.188 -9.902 -11.927 1.00 0.00 C ATOM 683 O GLN A 48 -10.038 -10.680 -11.489 1.00 0.00 O ATOM 684 CB GLN A 48 -7.103 -10.518 -10.632 1.00 0.00 C ATOM 685 CG GLN A 48 -5.917 -11.488 -10.591 1.00 0.00 C ATOM 686 CD GLN A 48 -6.278 -12.911 -10.994 1.00 0.00 C ATOM 687 OE1 GLN A 48 -7.299 -13.460 -10.583 1.00 0.00 O ATOM 688 NE2 GLN A 48 -5.450 -13.527 -11.821 1.00 0.00 N ATOM 0 H GLN A 48 -6.218 -8.998 -12.363 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.767 -11.377 -12.493 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -6.770 -9.534 -10.302 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -7.862 -10.852 -9.924 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.134 -11.119 -11.254 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -5.502 -11.499 -9.583 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -4.609 -13.052 -12.149 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -5.652 -14.477 -12.131 1.00 0.00 H new ATOM 697 N GLY A 49 -9.478 -8.657 -12.315 1.00 0.00 N ATOM 698 CA GLY A 49 -10.825 -8.116 -12.332 1.00 0.00 C ATOM 699 C GLY A 49 -10.805 -6.685 -11.841 1.00 0.00 C ATOM 700 O GLY A 49 -10.824 -5.758 -12.649 1.00 0.00 O ATOM 0 H GLY A 49 -8.769 -7.994 -12.629 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -11.232 -8.158 -13.342 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -11.477 -8.719 -11.700 1.00 0.00 H new ATOM 704 N ALA A 50 -10.748 -6.539 -10.524 1.00 0.00 N ATOM 705 CA ALA A 50 -10.935 -5.328 -9.746 1.00 0.00 C ATOM 706 C ALA A 50 -9.733 -5.176 -8.802 1.00 0.00 C ATOM 707 O ALA A 50 -9.767 -5.726 -7.694 1.00 0.00 O ATOM 708 CB ALA A 50 -12.271 -5.398 -8.995 1.00 0.00 C ATOM 0 H ALA A 50 -10.552 -7.339 -9.922 1.00 0.00 H new ATOM 0 HA ALA A 50 -10.981 -4.447 -10.387 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -12.409 -4.488 -8.412 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -13.086 -5.497 -9.712 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -12.268 -6.260 -8.327 1.00 0.00 H new ATOM 714 N PRO A 51 -8.624 -4.562 -9.251 1.00 0.00 N ATOM 715 CA PRO A 51 -7.427 -4.415 -8.434 1.00 0.00 C ATOM 716 C PRO A 51 -7.668 -3.482 -7.244 1.00 0.00 C ATOM 717 O PRO A 51 -8.573 -2.643 -7.241 1.00 0.00 O ATOM 718 CB PRO A 51 -6.351 -3.864 -9.376 1.00 0.00 C ATOM 719 CG PRO A 51 -7.167 -3.084 -10.404 1.00 0.00 C ATOM 720 CD PRO A 51 -8.435 -3.928 -10.548 1.00 0.00 C ATOM 0 HA PRO A 51 -7.123 -5.366 -7.997 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -5.644 -3.223 -8.850 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -5.773 -4.663 -9.841 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -7.391 -2.074 -10.060 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -6.637 -2.987 -11.351 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -9.292 -3.308 -10.811 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -8.325 -4.672 -11.337 1.00 0.00 H new ATOM 728 N ILE A 52 -6.804 -3.601 -6.239 1.00 0.00 N ATOM 729 CA ILE A 52 -6.811 -2.758 -5.057 1.00 0.00 C ATOM 730 C ILE A 52 -6.238 -1.388 -5.439 1.00 0.00 C ATOM 731 O ILE A 52 -5.022 -1.252 -5.586 1.00 0.00 O ATOM 732 CB ILE A 52 -6.031 -3.480 -3.940 1.00 0.00 C ATOM 733 CG1 ILE A 52 -6.840 -4.719 -3.488 1.00 0.00 C ATOM 734 CG2 ILE A 52 -5.740 -2.556 -2.747 1.00 0.00 C ATOM 735 CD1 ILE A 52 -6.284 -5.478 -2.279 1.00 0.00 C ATOM 0 H ILE A 52 -6.065 -4.304 -6.228 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.815 -2.581 -4.672 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.064 -3.790 -4.336 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -7.856 -4.400 -3.256 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -6.907 -5.411 -4.327 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.189 -3.108 -1.985 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.145 -1.706 -3.082 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -6.680 -2.197 -2.327 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -6.931 -6.326 -2.053 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -5.280 -5.838 -2.505 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.245 -4.811 -1.418 1.00 0.00 H new ATOM 747 N THR A 53 -7.080 -0.369 -5.605 1.00 0.00 N ATOM 748 CA THR A 53 -6.652 0.987 -5.941 1.00 0.00 C ATOM 749 C THR A 53 -6.716 1.875 -4.687 1.00 0.00 C ATOM 750 O THR A 53 -7.491 1.612 -3.762 1.00 0.00 O ATOM 751 CB THR A 53 -7.537 1.547 -7.073 1.00 0.00 C ATOM 752 OG1 THR A 53 -8.893 1.630 -6.681 1.00 0.00 O ATOM 753 CG2 THR A 53 -7.478 0.729 -8.366 1.00 0.00 C ATOM 0 H THR A 53 -8.091 -0.464 -5.509 1.00 0.00 H new ATOM 0 HA THR A 53 -5.621 0.973 -6.294 1.00 0.00 H new ATOM 0 HB THR A 53 -7.128 2.538 -7.270 1.00 0.00 H new ATOM 0 HG1 THR A 53 -9.426 1.990 -7.420 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.126 1.185 -9.115 1.00 0.00 H new ATOM 0 HG22 THR A 53 -6.453 0.708 -8.737 1.00 0.00 H new ATOM 0 HG23 THR A 53 -7.813 -0.289 -8.168 1.00 0.00 H new ATOM 761 N LEU A 54 -5.966 2.978 -4.663 1.00 0.00 N ATOM 762 CA LEU A 54 -6.068 4.030 -3.647 1.00 0.00 C ATOM 763 C LEU A 54 -6.248 5.389 -4.342 1.00 0.00 C ATOM 764 O LEU A 54 -5.924 5.535 -5.526 1.00 0.00 O ATOM 765 CB LEU A 54 -4.804 3.911 -2.773 1.00 0.00 C ATOM 766 CG LEU A 54 -4.476 5.023 -1.753 1.00 0.00 C ATOM 767 CD1 LEU A 54 -5.498 5.171 -0.622 1.00 0.00 C ATOM 768 CD2 LEU A 54 -3.109 4.773 -1.083 1.00 0.00 C ATOM 0 H LEU A 54 -5.253 3.170 -5.366 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.937 3.929 -2.997 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.875 2.973 -2.222 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -3.950 3.822 -3.445 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.483 5.936 -2.348 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.187 5.974 0.046 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.475 5.407 -1.043 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.560 4.237 -0.063 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.902 5.571 -0.369 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.129 3.816 -0.562 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.329 4.756 -1.844 1.00 0.00 H new ATOM 780 N THR A 55 -6.798 6.372 -3.628 1.00 0.00 N ATOM 781 CA THR A 55 -6.745 7.788 -3.957 1.00 0.00 C ATOM 782 C THR A 55 -6.574 8.577 -2.659 1.00 0.00 C ATOM 783 O THR A 55 -7.339 8.388 -1.706 1.00 0.00 O ATOM 784 CB THR A 55 -7.980 8.300 -4.726 1.00 0.00 C ATOM 785 OG1 THR A 55 -8.668 7.307 -5.472 1.00 0.00 O ATOM 786 CG2 THR A 55 -7.526 9.400 -5.696 1.00 0.00 C ATOM 0 H THR A 55 -7.314 6.190 -2.767 1.00 0.00 H new ATOM 0 HA THR A 55 -5.900 7.934 -4.629 1.00 0.00 H new ATOM 0 HB THR A 55 -8.680 8.660 -3.972 1.00 0.00 H new ATOM 0 HG1 THR A 55 -9.436 7.713 -5.926 1.00 0.00 H new ATOM 0 HG21 THR A 55 -8.387 9.775 -6.250 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.072 10.216 -5.134 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.796 8.991 -6.394 1.00 0.00 H new ATOM 794 N LEU A 56 -5.577 9.456 -2.625 1.00 0.00 N ATOM 795 CA LEU A 56 -5.434 10.555 -1.701 1.00 0.00 C ATOM 796 C LEU A 56 -5.970 11.790 -2.423 1.00 0.00 C ATOM 797 O LEU A 56 -5.481 12.132 -3.497 1.00 0.00 O ATOM 798 CB LEU A 56 -3.941 10.745 -1.389 1.00 0.00 C ATOM 799 CG LEU A 56 -3.215 9.599 -0.670 1.00 0.00 C ATOM 800 CD1 LEU A 56 -4.035 8.950 0.450 1.00 0.00 C ATOM 801 CD2 LEU A 56 -2.693 8.514 -1.620 1.00 0.00 C ATOM 0 H LEU A 56 -4.803 9.409 -3.288 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.969 10.380 -0.767 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.423 10.934 -2.329 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.836 11.643 -0.781 1.00 0.00 H new ATOM 0 HG LEU A 56 -2.358 10.093 -0.212 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -3.454 8.150 0.909 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -4.279 9.699 1.203 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -4.955 8.539 0.036 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.191 7.736 -1.044 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.528 8.078 -2.168 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.988 8.956 -2.324 1.00 0.00 H new ATOM 813 N SER A 57 -6.983 12.448 -1.867 1.00 0.00 N ATOM 814 CA SER A 57 -7.480 13.718 -2.385 1.00 0.00 C ATOM 815 C SER A 57 -8.079 14.514 -1.216 1.00 0.00 C ATOM 816 O SER A 57 -7.824 14.187 -0.052 1.00 0.00 O ATOM 817 CB SER A 57 -8.455 13.442 -3.550 1.00 0.00 C ATOM 818 OG SER A 57 -8.851 14.633 -4.201 1.00 0.00 O ATOM 0 H SER A 57 -7.483 12.115 -1.043 1.00 0.00 H new ATOM 0 HA SER A 57 -6.687 14.336 -2.806 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.980 12.775 -4.270 1.00 0.00 H new ATOM 0 HB3 SER A 57 -9.337 12.926 -3.171 1.00 0.00 H new ATOM 0 HG SER A 57 -9.466 14.417 -4.933 1.00 0.00 H new ATOM 824 N THR A 58 -8.808 15.587 -1.501 1.00 0.00 N ATOM 825 CA THR A 58 -9.316 16.558 -0.531 1.00 0.00 C ATOM 826 C THR A 58 -10.813 16.836 -0.751 1.00 0.00 C ATOM 827 O THR A 58 -11.331 17.874 -0.335 1.00 0.00 O ATOM 828 CB THR A 58 -8.416 17.816 -0.565 1.00 0.00 C ATOM 829 OG1 THR A 58 -7.993 18.140 -1.890 1.00 0.00 O ATOM 830 CG2 THR A 58 -7.194 17.635 0.342 1.00 0.00 C ATOM 0 H THR A 58 -9.075 15.817 -2.458 1.00 0.00 H new ATOM 0 HA THR A 58 -9.262 16.155 0.480 1.00 0.00 H new ATOM 0 HB THR A 58 -9.019 18.645 -0.195 1.00 0.00 H new ATOM 0 HG1 THR A 58 -7.429 18.941 -1.867 1.00 0.00 H new ATOM 0 HG21 THR A 58 -6.575 18.532 0.302 1.00 0.00 H new ATOM 0 HG22 THR A 58 -7.524 17.467 1.367 1.00 0.00 H new ATOM 0 HG23 THR A 58 -6.613 16.778 0.002 1.00 0.00 H new ATOM 838 N SER A 59 -11.530 15.918 -1.407 1.00 0.00 N ATOM 839 CA SER A 59 -12.857 16.134 -1.974 1.00 0.00 C ATOM 840 C SER A 59 -13.935 16.458 -0.926 1.00 0.00 C ATOM 841 O SER A 59 -14.901 17.157 -1.238 1.00 0.00 O ATOM 842 CB SER A 59 -13.234 14.880 -2.774 1.00 0.00 C ATOM 843 OG SER A 59 -14.295 15.137 -3.674 1.00 0.00 O ATOM 0 H SER A 59 -11.186 14.970 -1.561 1.00 0.00 H new ATOM 0 HA SER A 59 -12.814 17.015 -2.615 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.364 14.525 -3.327 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.522 14.083 -2.088 1.00 0.00 H new ATOM 0 HG SER A 59 -14.510 14.319 -4.169 1.00 0.00 H new ATOM 849 N THR A 60 -13.813 15.960 0.309 1.00 0.00 N ATOM 850 CA THR A 60 -14.749 16.291 1.390 1.00 0.00 C ATOM 851 C THR A 60 -14.442 17.672 1.993 1.00 0.00 C ATOM 852 O THR A 60 -15.264 18.198 2.740 1.00 0.00 O ATOM 853 CB THR A 60 -14.822 15.112 2.399 1.00 0.00 C ATOM 854 OG1 THR A 60 -15.642 15.343 3.531 1.00 0.00 O ATOM 855 CG2 THR A 60 -13.468 14.670 2.948 1.00 0.00 C ATOM 0 H THR A 60 -13.068 15.321 0.587 1.00 0.00 H new ATOM 0 HA THR A 60 -15.761 16.402 1.000 1.00 0.00 H new ATOM 0 HB THR A 60 -15.259 14.334 1.773 1.00 0.00 H new ATOM 0 HG1 THR A 60 -15.874 16.294 3.578 1.00 0.00 H new ATOM 0 HG21 THR A 60 -13.610 13.843 3.644 1.00 0.00 H new ATOM 0 HG22 THR A 60 -12.830 14.346 2.126 1.00 0.00 H new ATOM 0 HG23 THR A 60 -12.996 15.504 3.467 1.00 0.00 H new ATOM 863 N GLY A 61 -13.303 18.280 1.656 1.00 0.00 N ATOM 864 CA GLY A 61 -12.754 19.473 2.288 1.00 0.00 C ATOM 865 C GLY A 61 -11.650 19.126 3.284 1.00 0.00 C ATOM 866 O GLY A 61 -10.977 20.016 3.796 1.00 0.00 O ATOM 0 H GLY A 61 -12.713 17.935 0.899 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -12.358 20.141 1.523 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -13.550 20.013 2.801 1.00 0.00 H new ATOM 870 N GLN A 62 -11.418 17.837 3.550 1.00 0.00 N ATOM 871 CA GLN A 62 -10.461 17.334 4.521 1.00 0.00 C ATOM 872 C GLN A 62 -9.610 16.225 3.899 1.00 0.00 C ATOM 873 O GLN A 62 -9.965 15.679 2.852 1.00 0.00 O ATOM 874 CB GLN A 62 -11.203 16.799 5.751 1.00 0.00 C ATOM 875 CG GLN A 62 -12.034 17.853 6.493 1.00 0.00 C ATOM 876 CD GLN A 62 -13.326 18.305 5.814 1.00 0.00 C ATOM 877 OE1 GLN A 62 -13.640 19.488 5.787 1.00 0.00 O ATOM 878 NE2 GLN A 62 -14.105 17.397 5.256 1.00 0.00 N ATOM 0 H GLN A 62 -11.918 17.089 3.070 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.804 18.149 4.826 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -11.861 15.987 5.440 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.476 16.373 6.443 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -12.286 17.458 7.477 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -11.408 18.731 6.653 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -13.839 16.412 5.281 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -14.972 17.680 4.800 1.00 0.00 H new ATOM 887 N ARG A 63 -8.522 15.866 4.586 1.00 0.00 N ATOM 888 CA ARG A 63 -7.620 14.754 4.282 1.00 0.00 C ATOM 889 C ARG A 63 -8.314 13.393 4.438 1.00 0.00 C ATOM 890 O ARG A 63 -8.072 12.655 5.400 1.00 0.00 O ATOM 891 CB ARG A 63 -6.331 14.888 5.120 1.00 0.00 C ATOM 892 CG ARG A 63 -6.538 15.026 6.645 1.00 0.00 C ATOM 893 CD ARG A 63 -5.209 15.201 7.387 1.00 0.00 C ATOM 894 NE ARG A 63 -4.502 16.433 7.000 1.00 0.00 N ATOM 895 CZ ARG A 63 -4.800 17.675 7.394 1.00 0.00 C ATOM 896 NH1 ARG A 63 -5.814 17.908 8.228 1.00 0.00 N ATOM 897 NH2 ARG A 63 -4.074 18.686 6.939 1.00 0.00 N ATOM 0 H ARG A 63 -8.231 16.376 5.420 1.00 0.00 H new ATOM 0 HA ARG A 63 -7.333 14.803 3.232 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.705 14.015 4.934 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.778 15.758 4.766 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.183 15.881 6.848 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.052 14.142 7.023 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.396 15.216 8.461 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.569 14.341 7.187 1.00 0.00 H new ATOM 0 HE ARG A 63 -3.707 16.329 6.370 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -6.377 17.132 8.576 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -6.027 18.862 8.518 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.301 18.510 6.298 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.289 19.640 7.230 1.00 0.00 H new ATOM 911 N HIS A 64 -9.173 13.043 3.486 1.00 0.00 N ATOM 912 CA HIS A 64 -9.785 11.729 3.380 1.00 0.00 C ATOM 913 C HIS A 64 -9.071 10.977 2.267 1.00 0.00 C ATOM 914 O HIS A 64 -8.756 11.546 1.219 1.00 0.00 O ATOM 915 CB HIS A 64 -11.288 11.857 3.096 1.00 0.00 C ATOM 916 CG HIS A 64 -12.184 11.017 3.967 1.00 0.00 C ATOM 917 ND1 HIS A 64 -13.203 10.222 3.507 1.00 0.00 N ATOM 918 CD2 HIS A 64 -12.236 11.006 5.335 1.00 0.00 C ATOM 919 CE1 HIS A 64 -13.835 9.707 4.568 1.00 0.00 C ATOM 920 NE2 HIS A 64 -13.283 10.150 5.716 1.00 0.00 N ATOM 0 H HIS A 64 -9.468 13.684 2.750 1.00 0.00 H new ATOM 0 HA HIS A 64 -9.686 11.181 4.317 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -11.574 12.902 3.211 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -11.468 11.590 2.055 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.589 11.556 6.002 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -14.673 9.029 4.513 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -13.567 9.912 6.666 1.00 0.00 H new ATOM 928 N ALA A 65 -8.856 9.688 2.494 1.00 0.00 N ATOM 929 CA ALA A 65 -8.369 8.749 1.504 1.00 0.00 C ATOM 930 C ALA A 65 -9.484 7.751 1.251 1.00 0.00 C ATOM 931 O ALA A 65 -10.206 7.390 2.186 1.00 0.00 O ATOM 932 CB ALA A 65 -7.143 8.018 2.051 1.00 0.00 C ATOM 0 H ALA A 65 -9.023 9.258 3.404 1.00 0.00 H new ATOM 0 HA ALA A 65 -8.086 9.262 0.585 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -6.778 7.312 1.305 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -6.360 8.741 2.280 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -7.416 7.479 2.958 1.00 0.00 H new ATOM 938 N SER A 66 -9.580 7.235 0.033 1.00 0.00 N ATOM 939 CA SER A 66 -10.526 6.180 -0.291 1.00 0.00 C ATOM 940 C SER A 66 -10.002 5.337 -1.448 1.00 0.00 C ATOM 941 O SER A 66 -9.045 5.732 -2.115 1.00 0.00 O ATOM 942 CB SER A 66 -11.912 6.792 -0.549 1.00 0.00 C ATOM 943 OG SER A 66 -11.913 8.093 -1.125 1.00 0.00 O ATOM 0 H SER A 66 -9.006 7.536 -0.755 1.00 0.00 H new ATOM 0 HA SER A 66 -10.637 5.497 0.551 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.468 6.123 -1.206 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.453 6.833 0.396 1.00 0.00 H new ATOM 0 HG SER A 66 -12.837 8.394 -1.252 1.00 0.00 H new ATOM 949 N GLY A 67 -10.603 4.176 -1.699 1.00 0.00 N ATOM 950 CA GLY A 67 -10.123 3.284 -2.739 1.00 0.00 C ATOM 951 C GLY A 67 -10.965 2.024 -2.825 1.00 0.00 C ATOM 952 O GLY A 67 -12.030 1.934 -2.206 1.00 0.00 O ATOM 0 H GLY A 67 -11.422 3.836 -1.195 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -10.140 3.800 -3.699 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -9.085 3.016 -2.540 1.00 0.00 H new ATOM 956 N PHE A 68 -10.474 1.056 -3.593 1.00 0.00 N ATOM 957 CA PHE A 68 -10.995 -0.301 -3.654 1.00 0.00 C ATOM 958 C PHE A 68 -9.988 -1.186 -2.909 1.00 0.00 C ATOM 959 O PHE A 68 -8.794 -1.092 -3.179 1.00 0.00 O ATOM 960 CB PHE A 68 -11.142 -0.743 -5.122 1.00 0.00 C ATOM 961 CG PHE A 68 -12.482 -1.323 -5.534 1.00 0.00 C ATOM 962 CD1 PHE A 68 -13.648 -0.536 -5.490 1.00 0.00 C ATOM 963 CD2 PHE A 68 -12.561 -2.653 -5.996 1.00 0.00 C ATOM 964 CE1 PHE A 68 -14.882 -1.087 -5.883 1.00 0.00 C ATOM 965 CE2 PHE A 68 -13.803 -3.207 -6.349 1.00 0.00 C ATOM 966 CZ PHE A 68 -14.969 -2.433 -6.269 1.00 0.00 C ATOM 0 H PHE A 68 -9.675 1.202 -4.210 1.00 0.00 H new ATOM 0 HA PHE A 68 -11.982 -0.375 -3.197 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -10.935 0.118 -5.758 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -10.372 -1.486 -5.331 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -13.596 0.489 -5.155 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.663 -3.248 -6.079 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -15.768 -0.469 -5.887 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -13.860 -4.232 -6.683 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.928 -2.870 -6.503 1.00 0.00 H new ATOM 976 N SER A 69 -10.455 -2.057 -2.022 1.00 0.00 N ATOM 977 CA SER A 69 -9.677 -3.065 -1.299 1.00 0.00 C ATOM 978 C SER A 69 -10.102 -4.482 -1.711 1.00 0.00 C ATOM 979 O SER A 69 -9.928 -5.444 -0.958 1.00 0.00 O ATOM 980 CB SER A 69 -9.831 -2.826 0.202 1.00 0.00 C ATOM 981 OG SER A 69 -9.204 -1.623 0.547 1.00 0.00 O ATOM 0 H SER A 69 -11.443 -2.083 -1.771 1.00 0.00 H new ATOM 0 HA SER A 69 -8.621 -2.975 -1.555 1.00 0.00 H new ATOM 0 HB2 SER A 69 -10.887 -2.788 0.469 1.00 0.00 H new ATOM 0 HB3 SER A 69 -9.390 -3.652 0.760 1.00 0.00 H new ATOM 0 HG SER A 69 -9.649 -0.879 0.090 1.00 0.00 H new ATOM 987 N GLY A 70 -10.692 -4.618 -2.902 1.00 0.00 N ATOM 988 CA GLY A 70 -11.114 -5.890 -3.455 1.00 0.00 C ATOM 989 C GLY A 70 -12.545 -5.839 -3.985 1.00 0.00 C ATOM 990 O GLY A 70 -12.693 -5.801 -5.203 1.00 0.00 O ATOM 0 H GLY A 70 -10.890 -3.826 -3.514 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -10.439 -6.176 -4.262 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -11.039 -6.661 -2.688 1.00 0.00 H new ATOM 994 N CYS A 71 -13.604 -5.807 -3.154 1.00 0.00 N ATOM 995 CA CYS A 71 -14.984 -5.749 -3.651 1.00 0.00 C ATOM 996 C CYS A 71 -15.928 -4.903 -2.774 1.00 0.00 C ATOM 997 O CYS A 71 -17.083 -4.703 -3.153 1.00 0.00 O ATOM 998 CB CYS A 71 -15.517 -7.179 -3.805 1.00 0.00 C ATOM 999 SG CYS A 71 -16.600 -7.425 -5.211 1.00 0.00 S ATOM 0 H CYS A 71 -13.526 -5.820 -2.137 1.00 0.00 H new ATOM 0 HA CYS A 71 -14.960 -5.243 -4.616 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -14.671 -7.861 -3.891 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -16.055 -7.452 -2.897 1.00 0.00 H new ATOM 1004 N ASN A 72 -15.484 -4.388 -1.624 1.00 0.00 N ATOM 1005 CA ASN A 72 -16.314 -3.705 -0.627 1.00 0.00 C ATOM 1006 C ASN A 72 -15.963 -2.225 -0.421 1.00 0.00 C ATOM 1007 O ASN A 72 -16.713 -1.492 0.229 1.00 0.00 O ATOM 1008 CB ASN A 72 -16.253 -4.446 0.715 1.00 0.00 C ATOM 1009 CG ASN A 72 -16.743 -5.893 0.697 1.00 0.00 C ATOM 1010 OD1 ASN A 72 -16.217 -6.755 1.394 1.00 0.00 O ATOM 1011 ND2 ASN A 72 -17.753 -6.191 -0.106 1.00 0.00 N ATOM 0 H ASN A 72 -14.502 -4.437 -1.352 1.00 0.00 H new ATOM 0 HA ASN A 72 -17.328 -3.724 -1.027 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -15.222 -4.436 1.068 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -16.845 -3.891 1.443 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -18.104 -7.148 -0.151 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -18.180 -5.464 -0.680 1.00 0.00 H new ATOM 1018 N ARG A 73 -14.890 -1.775 -1.056 1.00 0.00 N ATOM 1019 CA ARG A 73 -14.263 -0.454 -1.083 1.00 0.00 C ATOM 1020 C ARG A 73 -13.776 -0.032 0.298 1.00 0.00 C ATOM 1021 O ARG A 73 -14.019 -0.715 1.294 1.00 0.00 O ATOM 1022 CB ARG A 73 -15.153 0.613 -1.754 1.00 0.00 C ATOM 1023 CG ARG A 73 -16.121 0.040 -2.802 1.00 0.00 C ATOM 1024 CD ARG A 73 -16.664 1.070 -3.790 1.00 0.00 C ATOM 1025 NE ARG A 73 -17.469 2.116 -3.139 1.00 0.00 N ATOM 1026 CZ ARG A 73 -18.740 2.428 -3.417 1.00 0.00 C ATOM 1027 NH1 ARG A 73 -19.475 1.687 -4.241 1.00 0.00 N ATOM 1028 NH2 ARG A 73 -19.264 3.510 -2.862 1.00 0.00 N ATOM 0 H ARG A 73 -14.364 -2.417 -1.648 1.00 0.00 H new ATOM 0 HA ARG A 73 -13.379 -0.538 -1.715 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -15.728 1.130 -0.985 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -14.516 1.358 -2.230 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -15.610 -0.746 -3.359 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -16.960 -0.428 -2.287 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -15.831 1.535 -4.318 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -17.273 0.563 -4.539 1.00 0.00 H new ATOM 0 HE ARG A 73 -17.013 2.656 -2.404 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -19.072 0.858 -4.678 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -20.442 1.947 -4.436 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -18.701 4.086 -2.237 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -20.231 3.767 -3.060 1.00 0.00 H new ATOM 1042 N TYR A 74 -13.096 1.108 0.366 1.00 0.00 N ATOM 1043 CA TYR A 74 -12.753 1.733 1.633 1.00 0.00 C ATOM 1044 C TYR A 74 -12.724 3.247 1.523 1.00 0.00 C ATOM 1045 O TYR A 74 -12.647 3.812 0.424 1.00 0.00 O ATOM 1046 CB TYR A 74 -11.430 1.198 2.199 1.00 0.00 C ATOM 1047 CG TYR A 74 -10.167 1.581 1.448 1.00 0.00 C ATOM 1048 CD1 TYR A 74 -9.949 1.074 0.156 1.00 0.00 C ATOM 1049 CD2 TYR A 74 -9.153 2.333 2.074 1.00 0.00 C ATOM 1050 CE1 TYR A 74 -8.710 1.232 -0.477 1.00 0.00 C ATOM 1051 CE2 TYR A 74 -7.912 2.520 1.434 1.00 0.00 C ATOM 1052 CZ TYR A 74 -7.680 1.941 0.165 1.00 0.00 C ATOM 1053 OH TYR A 74 -6.460 2.015 -0.424 1.00 0.00 O ATOM 0 H TYR A 74 -12.770 1.621 -0.453 1.00 0.00 H new ATOM 0 HA TYR A 74 -13.542 1.465 2.336 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -11.334 1.546 3.228 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -11.489 0.110 2.234 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -10.747 0.556 -0.355 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -9.328 2.767 3.047 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -8.546 0.810 -1.457 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -7.139 3.104 1.912 1.00 0.00 H new ATOM 0 HH TYR A 74 -6.533 1.743 -1.363 1.00 0.00 H new ATOM 1063 N MET A 75 -12.809 3.885 2.685 1.00 0.00 N ATOM 1064 CA MET A 75 -12.673 5.308 2.924 1.00 0.00 C ATOM 1065 C MET A 75 -12.270 5.512 4.383 1.00 0.00 C ATOM 1066 O MET A 75 -12.415 4.600 5.205 1.00 0.00 O ATOM 1067 CB MET A 75 -13.982 6.053 2.596 1.00 0.00 C ATOM 1068 CG MET A 75 -15.254 5.415 3.187 1.00 0.00 C ATOM 1069 SD MET A 75 -16.521 5.013 1.948 1.00 0.00 S ATOM 1070 CE MET A 75 -16.099 3.299 1.553 1.00 0.00 C ATOM 0 H MET A 75 -12.989 3.375 3.550 1.00 0.00 H new ATOM 0 HA MET A 75 -11.905 5.721 2.270 1.00 0.00 H new ATOM 0 HB2 MET A 75 -13.902 7.077 2.962 1.00 0.00 H new ATOM 0 HB3 MET A 75 -14.090 6.109 1.513 1.00 0.00 H new ATOM 0 HG2 MET A 75 -14.978 4.504 3.719 1.00 0.00 H new ATOM 0 HG3 MET A 75 -15.682 6.096 3.922 1.00 0.00 H new ATOM 0 HE1 MET A 75 -17.012 2.732 1.371 1.00 0.00 H new ATOM 0 HE2 MET A 75 -15.473 3.275 0.661 1.00 0.00 H new ATOM 0 HE3 MET A 75 -15.558 2.856 2.389 1.00 0.00 H new ATOM 1080 N GLY A 76 -11.799 6.717 4.703 1.00 0.00 N ATOM 1081 CA GLY A 76 -11.477 7.137 6.052 1.00 0.00 C ATOM 1082 C GLY A 76 -10.492 8.304 6.023 1.00 0.00 C ATOM 1083 O GLY A 76 -10.033 8.711 4.949 1.00 0.00 O ATOM 0 H GLY A 76 -11.629 7.442 4.006 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.386 7.433 6.575 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.047 6.303 6.607 1.00 0.00 H new ATOM 1087 N SER A 77 -10.194 8.883 7.186 1.00 0.00 N ATOM 1088 CA SER A 77 -9.309 10.038 7.280 1.00 0.00 C ATOM 1089 C SER A 77 -7.872 9.572 7.443 1.00 0.00 C ATOM 1090 O SER A 77 -7.623 8.457 7.903 1.00 0.00 O ATOM 1091 CB SER A 77 -9.740 10.940 8.437 1.00 0.00 C ATOM 1092 OG SER A 77 -9.899 10.217 9.648 1.00 0.00 O ATOM 0 H SER A 77 -10.558 8.565 8.084 1.00 0.00 H new ATOM 0 HA SER A 77 -9.374 10.622 6.362 1.00 0.00 H new ATOM 0 HB2 SER A 77 -8.998 11.726 8.579 1.00 0.00 H new ATOM 0 HB3 SER A 77 -10.679 11.431 8.183 1.00 0.00 H new ATOM 0 HG SER A 77 -10.173 10.830 10.362 1.00 0.00 H new ATOM 1098 N TYR A 78 -6.909 10.440 7.154 1.00 0.00 N ATOM 1099 CA TYR A 78 -5.510 10.083 7.292 1.00 0.00 C ATOM 1100 C TYR A 78 -4.687 11.233 7.862 1.00 0.00 C ATOM 1101 O TYR A 78 -5.239 12.221 8.354 1.00 0.00 O ATOM 1102 CB TYR A 78 -5.015 9.506 5.962 1.00 0.00 C ATOM 1103 CG TYR A 78 -4.649 10.477 4.857 1.00 0.00 C ATOM 1104 CD1 TYR A 78 -5.632 11.038 4.016 1.00 0.00 C ATOM 1105 CD2 TYR A 78 -3.291 10.723 4.597 1.00 0.00 C ATOM 1106 CE1 TYR A 78 -5.259 11.850 2.924 1.00 0.00 C ATOM 1107 CE2 TYR A 78 -2.916 11.486 3.486 1.00 0.00 C ATOM 1108 CZ TYR A 78 -3.887 12.066 2.653 1.00 0.00 C ATOM 1109 OH TYR A 78 -3.445 12.792 1.595 1.00 0.00 O ATOM 0 H TYR A 78 -7.075 11.391 6.824 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.382 9.296 8.035 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -4.139 8.891 6.170 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -5.788 8.840 5.579 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -6.677 10.845 4.209 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.535 10.322 5.256 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -6.015 12.303 2.300 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -1.869 11.631 3.266 1.00 0.00 H new ATOM 0 HH TYR A 78 -2.465 12.814 1.600 1.00 0.00 H new ATOM 1119 N ALA A 79 -3.372 11.066 7.933 1.00 0.00 N ATOM 1120 CA ALA A 79 -2.402 12.110 8.186 1.00 0.00 C ATOM 1121 C ALA A 79 -1.075 11.703 7.553 1.00 0.00 C ATOM 1122 O ALA A 79 -0.852 10.529 7.251 1.00 0.00 O ATOM 1123 CB ALA A 79 -2.199 12.308 9.685 1.00 0.00 C ATOM 0 H ALA A 79 -2.938 10.151 7.809 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.764 13.045 7.758 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -1.466 13.097 9.852 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.146 12.589 10.146 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.840 11.380 10.129 1.00 0.00 H new ATOM 1129 N LEU A 80 -0.170 12.671 7.439 1.00 0.00 N ATOM 1130 CA LEU A 80 1.156 12.525 6.861 1.00 0.00 C ATOM 1131 C LEU A 80 2.131 13.099 7.878 1.00 0.00 C ATOM 1132 O LEU A 80 2.136 14.317 8.086 1.00 0.00 O ATOM 1133 CB LEU A 80 1.217 13.297 5.530 1.00 0.00 C ATOM 1134 CG LEU A 80 0.341 12.685 4.422 1.00 0.00 C ATOM 1135 CD1 LEU A 80 0.200 13.672 3.258 1.00 0.00 C ATOM 1136 CD2 LEU A 80 0.889 11.341 3.939 1.00 0.00 C ATOM 0 H LEU A 80 -0.353 13.621 7.763 1.00 0.00 H new ATOM 0 HA LEU A 80 1.402 11.485 6.647 1.00 0.00 H new ATOM 0 HB2 LEU A 80 0.904 14.327 5.702 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.251 13.332 5.187 1.00 0.00 H new ATOM 0 HG LEU A 80 -0.646 12.492 4.842 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -0.421 13.230 2.479 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.265 14.591 3.615 1.00 0.00 H new ATOM 0 HD13 LEU A 80 1.186 13.898 2.851 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.241 10.944 3.157 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.894 11.480 3.541 1.00 0.00 H new ATOM 0 HD23 LEU A 80 0.922 10.641 4.773 1.00 0.00 H new ATOM 1148 N LYS A 81 2.866 12.242 8.585 1.00 0.00 N ATOM 1149 CA LYS A 81 3.824 12.588 9.638 1.00 0.00 C ATOM 1150 C LYS A 81 4.734 11.387 9.884 1.00 0.00 C ATOM 1151 O LYS A 81 4.430 10.299 9.409 1.00 0.00 O ATOM 1152 CB LYS A 81 3.067 12.999 10.915 1.00 0.00 C ATOM 1153 CG LYS A 81 2.180 11.905 11.548 1.00 0.00 C ATOM 1154 CD LYS A 81 0.719 12.337 11.746 1.00 0.00 C ATOM 1155 CE LYS A 81 0.568 13.542 12.689 1.00 0.00 C ATOM 1156 NZ LYS A 81 -0.833 13.998 12.844 1.00 0.00 N ATOM 0 H LYS A 81 2.808 11.235 8.432 1.00 0.00 H new ATOM 0 HA LYS A 81 4.439 13.435 9.334 1.00 0.00 H new ATOM 0 HB2 LYS A 81 3.795 13.326 11.658 1.00 0.00 H new ATOM 0 HB3 LYS A 81 2.440 13.860 10.683 1.00 0.00 H new ATOM 0 HG2 LYS A 81 2.205 11.017 10.916 1.00 0.00 H new ATOM 0 HG3 LYS A 81 2.600 11.621 12.513 1.00 0.00 H new ATOM 0 HD2 LYS A 81 0.285 12.585 10.777 1.00 0.00 H new ATOM 0 HD3 LYS A 81 0.149 11.498 12.145 1.00 0.00 H new ATOM 0 HE2 LYS A 81 0.967 13.279 13.669 1.00 0.00 H new ATOM 0 HE3 LYS A 81 1.171 14.367 12.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -0.864 14.811 13.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -1.211 14.279 11.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -1.409 13.224 13.233 1.00 0.00 H new ATOM 1170 N ASP A 82 5.805 11.535 10.661 1.00 0.00 N ATOM 1171 CA ASP A 82 6.728 10.466 11.029 1.00 0.00 C ATOM 1172 C ASP A 82 7.364 9.777 9.811 1.00 0.00 C ATOM 1173 O ASP A 82 7.813 8.633 9.904 1.00 0.00 O ATOM 1174 CB ASP A 82 6.076 9.444 11.977 1.00 0.00 C ATOM 1175 CG ASP A 82 5.096 10.000 13.006 1.00 0.00 C ATOM 1176 OD1 ASP A 82 5.378 11.066 13.604 1.00 0.00 O ATOM 1177 OD2 ASP A 82 4.017 9.380 13.174 1.00 0.00 O ATOM 0 H ASP A 82 6.062 12.435 11.066 1.00 0.00 H new ATOM 0 HA ASP A 82 7.542 10.947 11.572 1.00 0.00 H new ATOM 0 HB2 ASP A 82 5.553 8.703 11.373 1.00 0.00 H new ATOM 0 HB3 ASP A 82 6.869 8.918 12.510 1.00 0.00 H new ATOM 1182 N GLY A 83 7.398 10.436 8.647 1.00 0.00 N ATOM 1183 CA GLY A 83 7.814 9.820 7.399 1.00 0.00 C ATOM 1184 C GLY A 83 6.876 8.698 6.955 1.00 0.00 C ATOM 1185 O GLY A 83 7.309 7.842 6.182 1.00 0.00 O ATOM 0 H GLY A 83 7.135 11.417 8.553 1.00 0.00 H new ATOM 0 HA2 GLY A 83 7.858 10.581 6.620 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.822 9.422 7.513 1.00 0.00 H new ATOM 1189 N LYS A 84 5.636 8.646 7.449 1.00 0.00 N ATOM 1190 CA LYS A 84 4.655 7.638 7.081 1.00 0.00 C ATOM 1191 C LYS A 84 3.269 8.249 6.928 1.00 0.00 C ATOM 1192 O LYS A 84 3.064 9.454 7.098 1.00 0.00 O ATOM 1193 CB LYS A 84 4.711 6.453 8.068 1.00 0.00 C ATOM 1194 CG LYS A 84 4.051 6.706 9.434 1.00 0.00 C ATOM 1195 CD LYS A 84 4.813 5.976 10.547 1.00 0.00 C ATOM 1196 CE LYS A 84 4.039 5.872 11.866 1.00 0.00 C ATOM 1197 NZ LYS A 84 4.899 5.571 13.032 1.00 0.00 N ATOM 0 H LYS A 84 5.285 9.320 8.129 1.00 0.00 H new ATOM 0 HA LYS A 84 4.902 7.233 6.100 1.00 0.00 H new ATOM 0 HB2 LYS A 84 4.230 5.592 7.604 1.00 0.00 H new ATOM 0 HB3 LYS A 84 5.755 6.186 8.231 1.00 0.00 H new ATOM 0 HG2 LYS A 84 4.031 7.776 9.641 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.016 6.366 9.412 1.00 0.00 H new ATOM 0 HD2 LYS A 84 5.063 4.972 10.204 1.00 0.00 H new ATOM 0 HD3 LYS A 84 5.754 6.494 10.730 1.00 0.00 H new ATOM 0 HE2 LYS A 84 3.513 6.810 12.045 1.00 0.00 H new ATOM 0 HE3 LYS A 84 3.281 5.094 11.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 4.314 5.514 13.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 5.382 4.662 12.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 5.607 6.325 13.145 1.00 0.00 H new ATOM 1211 N LEU A 85 2.314 7.404 6.567 1.00 0.00 N ATOM 1212 CA LEU A 85 0.919 7.767 6.398 1.00 0.00 C ATOM 1213 C LEU A 85 0.161 6.989 7.467 1.00 0.00 C ATOM 1214 O LEU A 85 0.148 5.763 7.393 1.00 0.00 O ATOM 1215 CB LEU A 85 0.506 7.408 4.959 1.00 0.00 C ATOM 1216 CG LEU A 85 -0.859 7.942 4.502 1.00 0.00 C ATOM 1217 CD1 LEU A 85 -1.136 7.524 3.063 1.00 0.00 C ATOM 1218 CD2 LEU A 85 -2.007 7.500 5.395 1.00 0.00 C ATOM 0 H LEU A 85 2.496 6.418 6.379 1.00 0.00 H new ATOM 0 HA LEU A 85 0.710 8.829 6.523 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.269 7.785 4.278 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.501 6.322 4.863 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.802 9.028 4.572 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.107 7.910 2.753 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -0.361 7.927 2.411 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.139 6.436 2.994 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.942 7.912 5.016 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.066 6.412 5.400 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.837 7.859 6.410 1.00 0.00 H new ATOM 1230 N SER A 86 -0.426 7.668 8.454 1.00 0.00 N ATOM 1231 CA SER A 86 -1.344 7.042 9.406 1.00 0.00 C ATOM 1232 C SER A 86 -2.772 7.227 8.907 1.00 0.00 C ATOM 1233 O SER A 86 -3.147 8.333 8.507 1.00 0.00 O ATOM 1234 CB SER A 86 -1.190 7.617 10.823 1.00 0.00 C ATOM 1235 OG SER A 86 -0.717 8.959 10.871 1.00 0.00 O ATOM 0 H SER A 86 -0.279 8.664 8.615 1.00 0.00 H new ATOM 0 HA SER A 86 -1.103 5.981 9.470 1.00 0.00 H new ATOM 0 HB2 SER A 86 -2.155 7.568 11.328 1.00 0.00 H new ATOM 0 HB3 SER A 86 -0.504 6.984 11.385 1.00 0.00 H new ATOM 0 HG SER A 86 -0.649 9.249 11.805 1.00 0.00 H new ATOM 1241 N PHE A 87 -3.576 6.168 8.934 1.00 0.00 N ATOM 1242 CA PHE A 87 -5.010 6.243 8.661 1.00 0.00 C ATOM 1243 C PHE A 87 -5.763 6.533 9.975 1.00 0.00 C ATOM 1244 O PHE A 87 -5.156 6.875 10.994 1.00 0.00 O ATOM 1245 CB PHE A 87 -5.454 4.976 7.907 1.00 0.00 C ATOM 1246 CG PHE A 87 -4.855 4.879 6.507 1.00 0.00 C ATOM 1247 CD1 PHE A 87 -5.428 5.597 5.435 1.00 0.00 C ATOM 1248 CD2 PHE A 87 -3.686 4.124 6.284 1.00 0.00 C ATOM 1249 CE1 PHE A 87 -4.807 5.599 4.168 1.00 0.00 C ATOM 1250 CE2 PHE A 87 -3.067 4.131 5.021 1.00 0.00 C ATOM 1251 CZ PHE A 87 -3.606 4.899 3.976 1.00 0.00 C ATOM 0 H PHE A 87 -3.249 5.226 9.148 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.257 7.072 7.998 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.165 4.097 8.482 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.541 4.965 7.833 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.345 6.147 5.585 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.264 3.537 7.086 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.255 6.139 3.347 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -2.175 3.545 4.855 1.00 0.00 H new ATOM 0 HZ PHE A 87 -3.096 4.951 3.025 1.00 0.00 H new ATOM 1261 N GLY A 88 -7.095 6.494 9.962 1.00 0.00 N ATOM 1262 CA GLY A 88 -7.981 6.621 11.113 1.00 0.00 C ATOM 1263 C GLY A 88 -8.863 5.384 11.219 1.00 0.00 C ATOM 1264 O GLY A 88 -8.451 4.294 10.817 1.00 0.00 O ATOM 0 H GLY A 88 -7.613 6.365 9.093 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -7.395 6.741 12.024 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.599 7.513 11.012 1.00 0.00 H new ATOM 1268 N THR A 89 -10.080 5.567 11.739 1.00 0.00 N ATOM 1269 CA THR A 89 -11.149 4.593 11.577 1.00 0.00 C ATOM 1270 C THR A 89 -11.425 4.474 10.076 1.00 0.00 C ATOM 1271 O THR A 89 -11.824 5.435 9.407 1.00 0.00 O ATOM 1272 CB THR A 89 -12.380 4.978 12.423 1.00 0.00 C ATOM 1273 OG1 THR A 89 -13.424 4.038 12.252 1.00 0.00 O ATOM 1274 CG2 THR A 89 -12.919 6.389 12.171 1.00 0.00 C ATOM 0 H THR A 89 -10.345 6.390 12.280 1.00 0.00 H new ATOM 0 HA THR A 89 -10.864 3.610 11.952 1.00 0.00 H new ATOM 0 HB THR A 89 -12.020 4.969 13.452 1.00 0.00 H new ATOM 0 HG1 THR A 89 -14.194 4.301 12.799 1.00 0.00 H new ATOM 0 HG21 THR A 89 -13.783 6.568 12.811 1.00 0.00 H new ATOM 0 HG22 THR A 89 -12.143 7.121 12.396 1.00 0.00 H new ATOM 0 HG23 THR A 89 -13.215 6.484 11.126 1.00 0.00 H new ATOM 1282 N LEU A 90 -11.075 3.338 9.492 1.00 0.00 N ATOM 1283 CA LEU A 90 -11.410 2.955 8.133 1.00 0.00 C ATOM 1284 C LEU A 90 -12.751 2.249 8.125 1.00 0.00 C ATOM 1285 O LEU A 90 -13.230 1.793 9.166 1.00 0.00 O ATOM 1286 CB LEU A 90 -10.335 1.971 7.653 1.00 0.00 C ATOM 1287 CG LEU A 90 -8.947 2.621 7.582 1.00 0.00 C ATOM 1288 CD1 LEU A 90 -7.883 1.543 7.632 1.00 0.00 C ATOM 1289 CD2 LEU A 90 -8.829 3.451 6.309 1.00 0.00 C ATOM 0 H LEU A 90 -10.525 2.628 9.976 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.459 3.833 7.489 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.300 1.116 8.328 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -10.607 1.590 6.669 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.806 3.286 8.434 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.896 2.003 7.582 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -7.975 0.983 8.563 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.011 0.866 6.787 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.841 3.910 6.264 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.970 2.807 5.441 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -9.591 4.230 6.311 1.00 0.00 H new ATOM 1301 N GLY A 91 -13.291 2.028 6.935 1.00 0.00 N ATOM 1302 CA GLY A 91 -14.293 1.007 6.741 1.00 0.00 C ATOM 1303 C GLY A 91 -14.785 1.002 5.309 1.00 0.00 C ATOM 1304 O GLY A 91 -14.346 1.810 4.488 1.00 0.00 O ATOM 0 H GLY A 91 -13.047 2.547 6.092 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -13.877 0.031 6.991 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -15.130 1.179 7.417 1.00 0.00 H new ATOM 1308 N GLY A 92 -15.678 0.062 5.010 1.00 0.00 N ATOM 1309 CA GLY A 92 -16.266 -0.114 3.694 1.00 0.00 C ATOM 1310 C GLY A 92 -17.598 -0.846 3.803 1.00 0.00 C ATOM 1311 O GLY A 92 -18.109 -1.057 4.909 1.00 0.00 O ATOM 0 H GLY A 92 -16.018 -0.612 5.696 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -16.415 0.857 3.222 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -15.585 -0.677 3.056 1.00 0.00 H new ATOM 1315 N THR A 93 -18.186 -1.190 2.662 1.00 0.00 N ATOM 1316 CA THR A 93 -19.463 -1.895 2.584 1.00 0.00 C ATOM 1317 C THR A 93 -19.324 -3.361 3.031 1.00 0.00 C ATOM 1318 O THR A 93 -18.230 -3.828 3.363 1.00 0.00 O ATOM 1319 CB THR A 93 -20.045 -1.781 1.161 1.00 0.00 C ATOM 1320 OG1 THR A 93 -19.208 -2.427 0.230 1.00 0.00 O ATOM 1321 CG2 THR A 93 -20.236 -0.329 0.710 1.00 0.00 C ATOM 0 H THR A 93 -17.782 -0.983 1.748 1.00 0.00 H new ATOM 0 HA THR A 93 -20.162 -1.423 3.274 1.00 0.00 H new ATOM 0 HB THR A 93 -21.023 -2.260 1.198 1.00 0.00 H new ATOM 0 HG1 THR A 93 -18.448 -1.847 0.016 1.00 0.00 H new ATOM 0 HG21 THR A 93 -20.648 -0.313 -0.299 1.00 0.00 H new ATOM 0 HG22 THR A 93 -20.922 0.176 1.390 1.00 0.00 H new ATOM 0 HG23 THR A 93 -19.274 0.184 0.717 1.00 0.00 H new ATOM 1329 N ARG A 94 -20.432 -4.105 3.013 1.00 0.00 N ATOM 1330 CA ARG A 94 -20.482 -5.549 3.246 1.00 0.00 C ATOM 1331 C ARG A 94 -21.315 -6.185 2.136 1.00 0.00 C ATOM 1332 O ARG A 94 -22.236 -6.959 2.386 1.00 0.00 O ATOM 1333 CB ARG A 94 -21.030 -5.828 4.662 1.00 0.00 C ATOM 1334 CG ARG A 94 -20.066 -5.397 5.779 1.00 0.00 C ATOM 1335 CD ARG A 94 -19.080 -6.512 6.172 1.00 0.00 C ATOM 1336 NE ARG A 94 -17.743 -6.033 6.583 1.00 0.00 N ATOM 1337 CZ ARG A 94 -17.401 -4.993 7.355 1.00 0.00 C ATOM 1338 NH1 ARG A 94 -18.309 -4.237 7.969 1.00 0.00 N ATOM 1339 NH2 ARG A 94 -16.119 -4.707 7.512 1.00 0.00 N ATOM 0 H ARG A 94 -21.352 -3.704 2.829 1.00 0.00 H new ATOM 0 HA ARG A 94 -19.488 -5.995 3.211 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -21.978 -5.305 4.787 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -21.238 -6.893 4.761 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -19.506 -4.520 5.453 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -20.641 -5.100 6.656 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -19.512 -7.090 6.989 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -18.965 -7.191 5.328 1.00 0.00 H new ATOM 0 HE ARG A 94 -16.960 -6.579 6.223 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -19.302 -4.442 7.859 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -18.011 -3.453 8.549 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -15.409 -5.275 7.049 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -15.840 -3.919 8.096 1.00 0.00 H new ATOM 1353 N MET A 95 -21.016 -5.802 0.894 1.00 0.00 N ATOM 1354 CA MET A 95 -21.497 -6.518 -0.281 1.00 0.00 C ATOM 1355 C MET A 95 -20.913 -7.933 -0.261 1.00 0.00 C ATOM 1356 O MET A 95 -19.850 -8.133 0.329 1.00 0.00 O ATOM 1357 CB MET A 95 -21.057 -5.767 -1.544 1.00 0.00 C ATOM 1358 CG MET A 95 -21.746 -4.402 -1.636 1.00 0.00 C ATOM 1359 SD MET A 95 -21.452 -3.497 -3.177 1.00 0.00 S ATOM 1360 CE MET A 95 -19.839 -2.734 -2.858 1.00 0.00 C ATOM 0 H MET A 95 -20.437 -4.991 0.678 1.00 0.00 H new ATOM 0 HA MET A 95 -22.585 -6.580 -0.276 1.00 0.00 H new ATOM 0 HB2 MET A 95 -19.975 -5.633 -1.534 1.00 0.00 H new ATOM 0 HB3 MET A 95 -21.297 -6.360 -2.427 1.00 0.00 H new ATOM 0 HG2 MET A 95 -22.820 -4.545 -1.516 1.00 0.00 H new ATOM 0 HG3 MET A 95 -21.411 -3.786 -0.801 1.00 0.00 H new ATOM 0 HE1 MET A 95 -19.399 -2.407 -3.800 1.00 0.00 H new ATOM 0 HE2 MET A 95 -19.967 -1.875 -2.200 1.00 0.00 H new ATOM 0 HE3 MET A 95 -19.180 -3.461 -2.382 1.00 0.00 H new ATOM 1370 N ALA A 96 -21.552 -8.887 -0.941 1.00 0.00 N ATOM 1371 CA ALA A 96 -21.076 -10.266 -1.023 1.00 0.00 C ATOM 1372 C ALA A 96 -20.641 -10.539 -2.458 1.00 0.00 C ATOM 1373 O ALA A 96 -21.380 -10.248 -3.404 1.00 0.00 O ATOM 1374 CB ALA A 96 -22.138 -11.261 -0.540 1.00 0.00 C ATOM 0 H ALA A 96 -22.419 -8.722 -1.453 1.00 0.00 H new ATOM 0 HA ALA A 96 -20.222 -10.401 -0.359 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -21.747 -12.276 -0.616 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -22.392 -11.047 0.498 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -23.031 -11.169 -1.158 1.00 0.00 H new ATOM 1380 N CYS A 97 -19.434 -11.078 -2.606 1.00 0.00 N ATOM 1381 CA CYS A 97 -18.702 -11.249 -3.849 1.00 0.00 C ATOM 1382 C CYS A 97 -18.079 -12.637 -3.850 1.00 0.00 C ATOM 1383 O CYS A 97 -17.397 -13.009 -2.895 1.00 0.00 O ATOM 1384 CB CYS A 97 -17.634 -10.151 -3.962 1.00 0.00 C ATOM 1385 SG CYS A 97 -18.344 -8.498 -4.126 1.00 0.00 S ATOM 0 H CYS A 97 -18.910 -11.429 -1.805 1.00 0.00 H new ATOM 0 HA CYS A 97 -19.364 -11.161 -4.710 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -16.994 -10.181 -3.080 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -16.999 -10.356 -4.824 1.00 0.00 H new ATOM 1390 N MET A 98 -18.332 -13.444 -4.881 1.00 0.00 N ATOM 1391 CA MET A 98 -17.875 -14.838 -4.899 1.00 0.00 C ATOM 1392 C MET A 98 -16.495 -14.921 -5.544 1.00 0.00 C ATOM 1393 O MET A 98 -16.268 -15.654 -6.510 1.00 0.00 O ATOM 1394 CB MET A 98 -18.914 -15.766 -5.536 1.00 0.00 C ATOM 1395 CG MET A 98 -20.312 -15.460 -4.995 1.00 0.00 C ATOM 1396 SD MET A 98 -21.349 -16.914 -4.724 1.00 0.00 S ATOM 1397 CE MET A 98 -20.808 -17.245 -3.025 1.00 0.00 C ATOM 0 H MET A 98 -18.849 -13.160 -5.713 1.00 0.00 H new ATOM 0 HA MET A 98 -17.769 -15.197 -3.875 1.00 0.00 H new ATOM 0 HB2 MET A 98 -18.903 -15.645 -6.619 1.00 0.00 H new ATOM 0 HB3 MET A 98 -18.657 -16.805 -5.329 1.00 0.00 H new ATOM 0 HG2 MET A 98 -20.213 -14.920 -4.053 1.00 0.00 H new ATOM 0 HG3 MET A 98 -20.819 -14.793 -5.692 1.00 0.00 H new ATOM 0 HE1 MET A 98 -21.329 -18.122 -2.642 1.00 0.00 H new ATOM 0 HE2 MET A 98 -19.734 -17.428 -3.014 1.00 0.00 H new ATOM 0 HE3 MET A 98 -21.036 -16.384 -2.396 1.00 0.00 H new ATOM 1407 N THR A 99 -15.578 -14.114 -5.024 1.00 0.00 N ATOM 1408 CA THR A 99 -14.265 -13.888 -5.598 1.00 0.00 C ATOM 1409 C THR A 99 -13.231 -13.959 -4.472 1.00 0.00 C ATOM 1410 O THR A 99 -13.564 -13.672 -3.314 1.00 0.00 O ATOM 1411 CB THR A 99 -14.269 -12.528 -6.322 1.00 0.00 C ATOM 1412 OG1 THR A 99 -14.614 -11.473 -5.444 1.00 0.00 O ATOM 1413 CG2 THR A 99 -15.300 -12.491 -7.450 1.00 0.00 C ATOM 0 H THR A 99 -15.736 -13.585 -4.166 1.00 0.00 H new ATOM 0 HA THR A 99 -14.006 -14.647 -6.336 1.00 0.00 H new ATOM 0 HB THR A 99 -13.258 -12.403 -6.711 1.00 0.00 H new ATOM 0 HG1 THR A 99 -14.606 -10.624 -5.934 1.00 0.00 H new ATOM 0 HG21 THR A 99 -15.272 -11.516 -7.936 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.069 -13.267 -8.180 1.00 0.00 H new ATOM 0 HG23 THR A 99 -16.295 -12.664 -7.039 1.00 0.00 H new ATOM 1421 N PRO A 100 -11.971 -14.319 -4.761 1.00 0.00 N ATOM 1422 CA PRO A 100 -10.940 -14.339 -3.739 1.00 0.00 C ATOM 1423 C PRO A 100 -10.566 -12.895 -3.383 1.00 0.00 C ATOM 1424 O PRO A 100 -10.433 -12.556 -2.205 1.00 0.00 O ATOM 1425 CB PRO A 100 -9.801 -15.142 -4.359 1.00 0.00 C ATOM 1426 CG PRO A 100 -9.920 -14.868 -5.859 1.00 0.00 C ATOM 1427 CD PRO A 100 -11.423 -14.667 -6.065 1.00 0.00 C ATOM 0 HA PRO A 100 -11.241 -14.799 -2.798 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -8.833 -14.824 -3.972 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -9.898 -16.205 -4.140 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -9.353 -13.985 -6.152 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -9.541 -15.701 -6.451 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -11.614 -13.876 -6.791 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -11.887 -15.574 -6.452 1.00 0.00 H new ATOM 1435 N GLY A 101 -10.533 -12.013 -4.387 1.00 0.00 N ATOM 1436 CA GLY A 101 -10.354 -10.582 -4.231 1.00 0.00 C ATOM 1437 C GLY A 101 -11.634 -9.895 -3.759 1.00 0.00 C ATOM 1438 O GLY A 101 -11.728 -8.685 -3.913 1.00 0.00 O ATOM 0 H GLY A 101 -10.635 -12.295 -5.362 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.555 -10.392 -3.514 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -10.039 -10.150 -5.181 1.00 0.00 H new ATOM 1442 N GLY A 102 -12.638 -10.611 -3.245 1.00 0.00 N ATOM 1443 CA GLY A 102 -13.733 -10.036 -2.471 1.00 0.00 C ATOM 1444 C GLY A 102 -13.700 -10.492 -1.014 1.00 0.00 C ATOM 1445 O GLY A 102 -14.412 -9.934 -0.177 1.00 0.00 O ATOM 0 H GLY A 102 -12.711 -11.622 -3.359 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -13.675 -8.948 -2.513 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -14.684 -10.322 -2.920 1.00 0.00 H new ATOM 1449 N GLN A 103 -12.869 -11.486 -0.690 1.00 0.00 N ATOM 1450 CA GLN A 103 -12.596 -11.848 0.693 1.00 0.00 C ATOM 1451 C GLN A 103 -11.435 -11.067 1.308 1.00 0.00 C ATOM 1452 O GLN A 103 -11.362 -10.996 2.534 1.00 0.00 O ATOM 1453 CB GLN A 103 -12.348 -13.346 0.819 1.00 0.00 C ATOM 1454 CG GLN A 103 -13.622 -14.149 0.529 1.00 0.00 C ATOM 1455 CD GLN A 103 -13.626 -15.423 1.359 1.00 0.00 C ATOM 1456 OE1 GLN A 103 -14.505 -15.645 2.193 1.00 0.00 O ATOM 1457 NE2 GLN A 103 -12.617 -16.260 1.210 1.00 0.00 N ATOM 0 H GLN A 103 -12.373 -12.055 -1.376 1.00 0.00 H new ATOM 0 HA GLN A 103 -13.488 -11.577 1.258 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -11.561 -13.646 0.127 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -11.993 -13.575 1.824 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -14.502 -13.549 0.762 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -13.675 -14.395 -0.532 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -11.894 -16.068 0.517 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -12.560 -17.099 1.788 1.00 0.00 H new ATOM 1466 N ILE A 104 -10.528 -10.487 0.521 1.00 0.00 N ATOM 1467 CA ILE A 104 -9.292 -9.921 1.065 1.00 0.00 C ATOM 1468 C ILE A 104 -9.521 -8.631 1.875 1.00 0.00 C ATOM 1469 O ILE A 104 -8.645 -8.228 2.635 1.00 0.00 O ATOM 1470 CB ILE A 104 -8.226 -9.799 -0.050 1.00 0.00 C ATOM 1471 CG1 ILE A 104 -6.849 -9.501 0.579 1.00 0.00 C ATOM 1472 CG2 ILE A 104 -8.595 -8.783 -1.146 1.00 0.00 C ATOM 1473 CD1 ILE A 104 -5.673 -9.805 -0.345 1.00 0.00 C ATOM 0 H ILE A 104 -10.625 -10.397 -0.490 1.00 0.00 H new ATOM 0 HA ILE A 104 -8.894 -10.614 1.806 1.00 0.00 H new ATOM 0 HB ILE A 104 -8.181 -10.758 -0.566 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -6.811 -8.450 0.867 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -6.743 -10.086 1.492 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -7.802 -8.750 -1.894 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -9.529 -9.083 -1.621 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -8.715 -7.795 -0.701 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.739 -9.571 0.166 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.685 -10.861 -0.613 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.754 -9.200 -1.248 1.00 0.00 H new ATOM 1485 N GLU A 105 -10.691 -8.001 1.781 1.00 0.00 N ATOM 1486 CA GLU A 105 -10.972 -6.693 2.369 1.00 0.00 C ATOM 1487 C GLU A 105 -10.739 -6.668 3.880 1.00 0.00 C ATOM 1488 O GLU A 105 -10.155 -5.716 4.396 1.00 0.00 O ATOM 1489 CB GLU A 105 -12.414 -6.278 2.032 1.00 0.00 C ATOM 1490 CG GLU A 105 -12.518 -4.845 1.500 1.00 0.00 C ATOM 1491 CD GLU A 105 -12.890 -4.834 0.019 1.00 0.00 C ATOM 1492 OE1 GLU A 105 -13.401 -5.850 -0.485 1.00 0.00 O ATOM 1493 OE2 GLU A 105 -12.782 -3.800 -0.673 1.00 0.00 O ATOM 0 H GLU A 105 -11.488 -8.396 1.282 1.00 0.00 H new ATOM 0 HA GLU A 105 -10.274 -5.976 1.937 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -12.819 -6.965 1.289 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -13.031 -6.373 2.925 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -13.267 -4.296 2.070 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -11.568 -4.331 1.643 1.00 0.00 H new ATOM 1500 N GLY A 106 -11.150 -7.727 4.583 1.00 0.00 N ATOM 1501 CA GLY A 106 -10.906 -7.913 6.003 1.00 0.00 C ATOM 1502 C GLY A 106 -9.416 -7.873 6.317 1.00 0.00 C ATOM 1503 O GLY A 106 -9.011 -7.161 7.232 1.00 0.00 O ATOM 0 H GLY A 106 -11.674 -8.494 4.163 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -11.420 -7.135 6.568 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.322 -8.868 6.324 1.00 0.00 H new ATOM 1507 N ALA A 107 -8.596 -8.602 5.547 1.00 0.00 N ATOM 1508 CA ALA A 107 -7.154 -8.582 5.726 1.00 0.00 C ATOM 1509 C ALA A 107 -6.624 -7.175 5.469 1.00 0.00 C ATOM 1510 O ALA A 107 -5.865 -6.645 6.273 1.00 0.00 O ATOM 1511 CB ALA A 107 -6.493 -9.593 4.778 1.00 0.00 C ATOM 0 H ALA A 107 -8.917 -9.212 4.795 1.00 0.00 H new ATOM 0 HA ALA A 107 -6.912 -8.864 6.751 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.412 -9.571 4.919 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -6.867 -10.594 4.995 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -6.730 -9.333 3.746 1.00 0.00 H new ATOM 1517 N TYR A 108 -6.982 -6.581 4.330 1.00 0.00 N ATOM 1518 CA TYR A 108 -6.385 -5.334 3.878 1.00 0.00 C ATOM 1519 C TYR A 108 -6.706 -4.184 4.834 1.00 0.00 C ATOM 1520 O TYR A 108 -5.824 -3.388 5.141 1.00 0.00 O ATOM 1521 CB TYR A 108 -6.863 -5.043 2.455 1.00 0.00 C ATOM 1522 CG TYR A 108 -6.163 -3.873 1.795 1.00 0.00 C ATOM 1523 CD1 TYR A 108 -4.995 -4.078 1.039 1.00 0.00 C ATOM 1524 CD2 TYR A 108 -6.692 -2.576 1.917 1.00 0.00 C ATOM 1525 CE1 TYR A 108 -4.394 -3.001 0.370 1.00 0.00 C ATOM 1526 CE2 TYR A 108 -6.109 -1.501 1.226 1.00 0.00 C ATOM 1527 CZ TYR A 108 -4.959 -1.710 0.443 1.00 0.00 C ATOM 1528 OH TYR A 108 -4.376 -0.678 -0.219 1.00 0.00 O ATOM 0 H TYR A 108 -7.692 -6.953 3.700 1.00 0.00 H new ATOM 0 HA TYR A 108 -5.299 -5.433 3.872 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -6.714 -5.933 1.844 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -7.935 -4.846 2.476 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -4.561 -5.065 0.973 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -7.553 -2.405 2.547 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -3.493 -3.161 -0.204 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -6.543 -0.515 1.296 1.00 0.00 H new ATOM 0 HH TYR A 108 -4.891 0.142 -0.065 1.00 0.00 H new ATOM 1538 N LEU A 109 -7.935 -4.094 5.356 1.00 0.00 N ATOM 1539 CA LEU A 109 -8.261 -3.093 6.373 1.00 0.00 C ATOM 1540 C LEU A 109 -7.412 -3.309 7.628 1.00 0.00 C ATOM 1541 O LEU A 109 -6.950 -2.331 8.204 1.00 0.00 O ATOM 1542 CB LEU A 109 -9.769 -3.094 6.689 1.00 0.00 C ATOM 1543 CG LEU A 109 -10.569 -2.050 5.887 1.00 0.00 C ATOM 1544 CD1 LEU A 109 -10.398 -2.123 4.365 1.00 0.00 C ATOM 1545 CD2 LEU A 109 -12.057 -2.219 6.198 1.00 0.00 C ATOM 0 H LEU A 109 -8.713 -4.698 5.092 1.00 0.00 H new ATOM 0 HA LEU A 109 -8.020 -2.106 5.978 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.174 -4.085 6.484 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -9.909 -2.907 7.754 1.00 0.00 H new ATOM 0 HG LEU A 109 -10.173 -1.083 6.198 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -11.001 -1.347 3.893 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.349 -1.973 4.109 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -10.722 -3.101 4.009 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -12.632 -1.484 5.635 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -12.376 -3.223 5.916 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -12.225 -2.071 7.265 1.00 0.00 H new ATOM 1557 N ASN A 110 -7.140 -4.562 8.009 1.00 0.00 N ATOM 1558 CA ASN A 110 -6.245 -4.887 9.126 1.00 0.00 C ATOM 1559 C ASN A 110 -4.785 -4.537 8.849 1.00 0.00 C ATOM 1560 O ASN A 110 -3.968 -4.505 9.766 1.00 0.00 O ATOM 1561 CB ASN A 110 -6.279 -6.393 9.422 1.00 0.00 C ATOM 1562 CG ASN A 110 -6.223 -6.678 10.917 1.00 0.00 C ATOM 1563 OD1 ASN A 110 -7.109 -7.340 11.457 1.00 0.00 O ATOM 1564 ND2 ASN A 110 -5.226 -6.191 11.628 1.00 0.00 N ATOM 0 H ASN A 110 -7.536 -5.382 7.550 1.00 0.00 H new ATOM 0 HA ASN A 110 -6.608 -4.293 9.965 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -7.188 -6.825 9.004 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -5.438 -6.879 8.928 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -5.185 -6.362 12.633 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -4.495 -5.643 11.174 1.00 0.00 H new ATOM 1571 N ALA A 111 -4.407 -4.410 7.584 1.00 0.00 N ATOM 1572 CA ALA A 111 -3.059 -4.050 7.187 1.00 0.00 C ATOM 1573 C ALA A 111 -2.901 -2.531 7.239 1.00 0.00 C ATOM 1574 O ALA A 111 -1.890 -2.040 7.738 1.00 0.00 O ATOM 1575 CB ALA A 111 -2.799 -4.627 5.801 1.00 0.00 C ATOM 0 H ALA A 111 -5.039 -4.557 6.797 1.00 0.00 H new ATOM 0 HA ALA A 111 -2.317 -4.466 7.869 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -1.789 -4.368 5.483 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -2.902 -5.712 5.833 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -3.519 -4.215 5.094 1.00 0.00 H new ATOM 1581 N LEU A 112 -3.932 -1.793 6.812 1.00 0.00 N ATOM 1582 CA LEU A 112 -3.974 -0.333 6.867 1.00 0.00 C ATOM 1583 C LEU A 112 -3.923 0.219 8.300 1.00 0.00 C ATOM 1584 O LEU A 112 -3.725 1.419 8.481 1.00 0.00 O ATOM 1585 CB LEU A 112 -5.251 0.196 6.195 1.00 0.00 C ATOM 1586 CG LEU A 112 -5.398 0.017 4.679 1.00 0.00 C ATOM 1587 CD1 LEU A 112 -6.793 0.487 4.237 1.00 0.00 C ATOM 1588 CD2 LEU A 112 -4.383 0.850 3.912 1.00 0.00 C ATOM 0 H LEU A 112 -4.775 -2.205 6.412 1.00 0.00 H new ATOM 0 HA LEU A 112 -3.085 0.009 6.338 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.103 -0.288 6.672 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -5.326 1.261 6.414 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.241 -1.040 4.465 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -6.896 0.359 3.159 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -7.554 -0.104 4.747 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -6.920 1.539 4.491 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -4.520 0.696 2.842 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -4.525 1.905 4.148 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -3.375 0.548 4.196 1.00 0.00 H new ATOM 1600 N THR A 113 -4.122 -0.616 9.319 1.00 0.00 N ATOM 1601 CA THR A 113 -4.058 -0.246 10.730 1.00 0.00 C ATOM 1602 C THR A 113 -2.684 -0.602 11.328 1.00 0.00 C ATOM 1603 O THR A 113 -2.484 -0.518 12.545 1.00 0.00 O ATOM 1604 CB THR A 113 -5.248 -0.903 11.451 1.00 0.00 C ATOM 1605 OG1 THR A 113 -5.255 -2.300 11.242 1.00 0.00 O ATOM 1606 CG2 THR A 113 -6.586 -0.358 10.932 1.00 0.00 C ATOM 0 H THR A 113 -4.340 -1.603 9.179 1.00 0.00 H new ATOM 0 HA THR A 113 -4.147 0.833 10.860 1.00 0.00 H new ATOM 0 HB THR A 113 -5.134 -0.673 12.510 1.00 0.00 H new ATOM 0 HG1 THR A 113 -6.019 -2.697 11.710 1.00 0.00 H new ATOM 0 HG21 THR A 113 -7.406 -0.842 11.462 1.00 0.00 H new ATOM 0 HG22 THR A 113 -6.631 0.718 11.100 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.673 -0.562 9.865 1.00 0.00 H new ATOM 1614 N HIS A 114 -1.726 -1.000 10.484 1.00 0.00 N ATOM 1615 CA HIS A 114 -0.363 -1.345 10.841 1.00 0.00 C ATOM 1616 C HIS A 114 0.604 -0.698 9.856 1.00 0.00 C ATOM 1617 O HIS A 114 1.333 -1.387 9.152 1.00 0.00 O ATOM 1618 CB HIS A 114 -0.218 -2.868 10.927 1.00 0.00 C ATOM 1619 CG HIS A 114 -0.709 -3.465 12.216 1.00 0.00 C ATOM 1620 ND1 HIS A 114 -0.071 -3.375 13.432 1.00 0.00 N ATOM 1621 CD2 HIS A 114 -1.726 -4.370 12.341 1.00 0.00 C ATOM 1622 CE1 HIS A 114 -0.654 -4.257 14.255 1.00 0.00 C ATOM 1623 NE2 HIS A 114 -1.680 -4.880 13.643 1.00 0.00 N ATOM 0 H HIS A 114 -1.899 -1.092 9.483 1.00 0.00 H new ATOM 0 HA HIS A 114 -0.114 -0.954 11.828 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -0.764 -3.320 10.099 1.00 0.00 H new ATOM 0 HB3 HIS A 114 0.832 -3.129 10.796 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -2.436 -4.642 11.574 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -0.343 -4.444 15.272 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -2.299 -5.582 14.048 1.00 0.00 H new ATOM 1631 N ILE A 115 0.666 0.632 9.843 1.00 0.00 N ATOM 1632 CA ILE A 115 1.697 1.367 9.131 1.00 0.00 C ATOM 1633 C ILE A 115 2.721 1.794 10.185 1.00 0.00 C ATOM 1634 O ILE A 115 2.701 2.942 10.642 1.00 0.00 O ATOM 1635 CB ILE A 115 1.110 2.577 8.350 1.00 0.00 C ATOM 1636 CG1 ILE A 115 -0.293 2.380 7.736 1.00 0.00 C ATOM 1637 CG2 ILE A 115 2.142 3.042 7.311 1.00 0.00 C ATOM 1638 CD1 ILE A 115 -0.406 1.255 6.714 1.00 0.00 C ATOM 0 H ILE A 115 -0.003 1.228 10.330 1.00 0.00 H new ATOM 0 HA ILE A 115 2.168 0.746 8.369 1.00 0.00 H new ATOM 0 HB ILE A 115 0.928 3.357 9.089 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -1.001 2.188 8.543 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.597 3.312 7.260 1.00 0.00 H new ATOM 0 HG21 ILE A 115 1.742 3.891 6.756 1.00 0.00 H new ATOM 0 HG22 ILE A 115 3.060 3.340 7.818 1.00 0.00 H new ATOM 0 HG23 ILE A 115 2.357 2.226 6.621 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -1.430 1.201 6.344 1.00 0.00 H new ATOM 0 HD12 ILE A 115 0.270 1.450 5.882 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -0.139 0.308 7.184 1.00 0.00 H new ATOM 1650 N ASP A 116 3.612 0.890 10.607 1.00 0.00 N ATOM 1651 CA ASP A 116 4.727 1.339 11.445 1.00 0.00 C ATOM 1652 C ASP A 116 5.685 2.199 10.630 1.00 0.00 C ATOM 1653 O ASP A 116 6.239 3.173 11.141 1.00 0.00 O ATOM 1654 CB ASP A 116 5.529 0.204 12.079 1.00 0.00 C ATOM 1655 CG ASP A 116 6.466 0.843 13.112 1.00 0.00 C ATOM 1656 OD1 ASP A 116 5.950 1.341 14.140 1.00 0.00 O ATOM 1657 OD2 ASP A 116 7.663 1.065 12.822 1.00 0.00 O ATOM 0 H ASP A 116 3.589 -0.108 10.396 1.00 0.00 H new ATOM 0 HA ASP A 116 4.267 1.906 12.254 1.00 0.00 H new ATOM 0 HB2 ASP A 116 4.866 -0.519 12.554 1.00 0.00 H new ATOM 0 HB3 ASP A 116 6.099 -0.336 11.323 1.00 0.00 H new ATOM 1662 N ARG A 117 5.875 1.844 9.357 1.00 0.00 N ATOM 1663 CA ARG A 117 6.838 2.479 8.455 1.00 0.00 C ATOM 1664 C ARG A 117 6.185 2.845 7.133 1.00 0.00 C ATOM 1665 O ARG A 117 5.184 2.255 6.731 1.00 0.00 O ATOM 1666 CB ARG A 117 8.037 1.539 8.288 1.00 0.00 C ATOM 1667 CG ARG A 117 7.982 0.536 7.179 1.00 0.00 C ATOM 1668 CD ARG A 117 8.642 0.896 5.844 1.00 0.00 C ATOM 1669 NE ARG A 117 10.098 0.948 6.009 1.00 0.00 N ATOM 1670 CZ ARG A 117 11.029 0.813 5.067 1.00 0.00 C ATOM 1671 NH1 ARG A 117 10.702 0.654 3.789 1.00 0.00 N ATOM 1672 NH2 ARG A 117 12.291 0.858 5.453 1.00 0.00 N ATOM 0 H ARG A 117 5.351 1.089 8.915 1.00 0.00 H new ATOM 0 HA ARG A 117 7.194 3.418 8.878 1.00 0.00 H new ATOM 0 HB2 ARG A 117 8.927 2.152 8.143 1.00 0.00 H new ATOM 0 HB3 ARG A 117 8.172 0.998 9.224 1.00 0.00 H new ATOM 0 HG2 ARG A 117 8.441 -0.385 7.540 1.00 0.00 H new ATOM 0 HG3 ARG A 117 6.933 0.314 6.983 1.00 0.00 H new ATOM 0 HD2 ARG A 117 8.379 0.158 5.087 1.00 0.00 H new ATOM 0 HD3 ARG A 117 8.272 1.859 5.493 1.00 0.00 H new ATOM 0 HE ARG A 117 10.438 1.106 6.958 1.00 0.00 H new ATOM 0 HH11 ARG A 117 9.720 0.633 3.512 1.00 0.00 H new ATOM 0 HH12 ARG A 117 11.433 0.553 3.084 1.00 0.00 H new ATOM 0 HH21 ARG A 117 12.518 0.992 6.438 1.00 0.00 H new ATOM 0 HH22 ARG A 117 13.038 0.759 4.766 1.00 0.00 H new ATOM 1686 N THR A 118 6.800 3.744 6.382 1.00 0.00 N ATOM 1687 CA THR A 118 6.582 3.881 4.938 1.00 0.00 C ATOM 1688 C THR A 118 7.896 4.386 4.320 1.00 0.00 C ATOM 1689 O THR A 118 8.824 4.766 5.042 1.00 0.00 O ATOM 1690 CB THR A 118 5.371 4.796 4.647 1.00 0.00 C ATOM 1691 OG1 THR A 118 4.205 4.352 5.323 1.00 0.00 O ATOM 1692 CG2 THR A 118 4.943 4.870 3.178 1.00 0.00 C ATOM 0 H THR A 118 7.475 4.411 6.756 1.00 0.00 H new ATOM 0 HA THR A 118 6.328 2.924 4.482 1.00 0.00 H new ATOM 0 HB THR A 118 5.732 5.769 4.981 1.00 0.00 H new ATOM 0 HG1 THR A 118 4.389 3.497 5.765 1.00 0.00 H new ATOM 0 HG21 THR A 118 4.086 5.537 3.082 1.00 0.00 H new ATOM 0 HG22 THR A 118 5.769 5.251 2.577 1.00 0.00 H new ATOM 0 HG23 THR A 118 4.669 3.875 2.828 1.00 0.00 H new ATOM 1700 N GLY A 119 8.008 4.390 2.999 1.00 0.00 N ATOM 1701 CA GLY A 119 8.866 5.285 2.260 1.00 0.00 C ATOM 1702 C GLY A 119 8.363 5.344 0.824 1.00 0.00 C ATOM 1703 O GLY A 119 7.619 4.467 0.377 1.00 0.00 O ATOM 0 H GLY A 119 7.486 3.749 2.401 1.00 0.00 H new ATOM 0 HA2 GLY A 119 8.856 6.279 2.708 1.00 0.00 H new ATOM 0 HA3 GLY A 119 9.897 4.933 2.288 1.00 0.00 H new ATOM 1707 N VAL A 120 8.774 6.367 0.080 1.00 0.00 N ATOM 1708 CA VAL A 120 8.296 6.589 -1.281 1.00 0.00 C ATOM 1709 C VAL A 120 9.497 6.667 -2.188 1.00 0.00 C ATOM 1710 O VAL A 120 10.519 7.241 -1.817 1.00 0.00 O ATOM 1711 CB VAL A 120 7.488 7.893 -1.386 1.00 0.00 C ATOM 1712 CG1 VAL A 120 6.919 8.054 -2.808 1.00 0.00 C ATOM 1713 CG2 VAL A 120 6.380 7.942 -0.334 1.00 0.00 C ATOM 0 H VAL A 120 9.446 7.063 0.402 1.00 0.00 H new ATOM 0 HA VAL A 120 7.639 5.769 -1.569 1.00 0.00 H new ATOM 0 HB VAL A 120 8.158 8.730 -1.190 1.00 0.00 H new ATOM 0 HG11 VAL A 120 6.349 8.981 -2.869 1.00 0.00 H new ATOM 0 HG12 VAL A 120 7.738 8.084 -3.526 1.00 0.00 H new ATOM 0 HG13 VAL A 120 6.266 7.211 -3.036 1.00 0.00 H new ATOM 0 HG21 VAL A 120 5.826 8.875 -0.433 1.00 0.00 H new ATOM 0 HG22 VAL A 120 5.703 7.101 -0.480 1.00 0.00 H new ATOM 0 HG23 VAL A 120 6.821 7.885 0.661 1.00 0.00 H new ATOM 1723 N GLN A 121 9.361 6.169 -3.404 1.00 0.00 N ATOM 1724 CA GLN A 121 10.349 6.358 -4.427 1.00 0.00 C ATOM 1725 C GLN A 121 9.766 7.298 -5.479 1.00 0.00 C ATOM 1726 O GLN A 121 9.087 6.871 -6.414 1.00 0.00 O ATOM 1727 CB GLN A 121 10.712 4.988 -4.967 1.00 0.00 C ATOM 1728 CG GLN A 121 11.951 5.146 -5.842 1.00 0.00 C ATOM 1729 CD GLN A 121 12.251 3.920 -6.686 1.00 0.00 C ATOM 1730 OE1 GLN A 121 13.364 3.771 -7.172 1.00 0.00 O ATOM 1731 NE2 GLN A 121 11.258 3.087 -6.942 1.00 0.00 N ATOM 0 H GLN A 121 8.554 5.621 -3.702 1.00 0.00 H new ATOM 0 HA GLN A 121 11.266 6.820 -4.061 1.00 0.00 H new ATOM 0 HB2 GLN A 121 10.908 4.294 -4.149 1.00 0.00 H new ATOM 0 HB3 GLN A 121 9.886 4.574 -5.545 1.00 0.00 H new ATOM 0 HG2 GLN A 121 11.817 6.006 -6.498 1.00 0.00 H new ATOM 0 HG3 GLN A 121 12.811 5.361 -5.207 1.00 0.00 H new ATOM 0 HE21 GLN A 121 10.342 3.240 -6.520 1.00 0.00 H new ATOM 0 HE22 GLN A 121 11.407 2.291 -7.561 1.00 0.00 H new ATOM 1740 N MET A 122 10.029 8.594 -5.337 1.00 0.00 N ATOM 1741 CA MET A 122 9.614 9.626 -6.276 1.00 0.00 C ATOM 1742 C MET A 122 10.551 9.690 -7.493 1.00 0.00 C ATOM 1743 O MET A 122 10.808 10.766 -8.042 1.00 0.00 O ATOM 1744 CB MET A 122 9.509 10.957 -5.519 1.00 0.00 C ATOM 1745 CG MET A 122 8.626 10.837 -4.278 1.00 0.00 C ATOM 1746 SD MET A 122 7.769 12.351 -3.818 1.00 0.00 S ATOM 1747 CE MET A 122 6.506 12.294 -5.105 1.00 0.00 C ATOM 0 H MET A 122 10.551 8.963 -4.543 1.00 0.00 H new ATOM 0 HA MET A 122 8.633 9.389 -6.688 1.00 0.00 H new ATOM 0 HB2 MET A 122 10.505 11.287 -5.225 1.00 0.00 H new ATOM 0 HB3 MET A 122 9.102 11.721 -6.182 1.00 0.00 H new ATOM 0 HG2 MET A 122 7.887 10.054 -4.449 1.00 0.00 H new ATOM 0 HG3 MET A 122 9.243 10.515 -3.439 1.00 0.00 H new ATOM 0 HE1 MET A 122 6.522 13.225 -5.672 1.00 0.00 H new ATOM 0 HE2 MET A 122 6.706 11.457 -5.774 1.00 0.00 H new ATOM 0 HE3 MET A 122 5.525 12.166 -4.647 1.00 0.00 H new ATOM 1757 N ARG A 123 11.065 8.542 -7.940 1.00 0.00 N ATOM 1758 CA ARG A 123 11.991 8.391 -9.052 1.00 0.00 C ATOM 1759 C ARG A 123 11.430 7.268 -9.910 1.00 0.00 C ATOM 1760 O ARG A 123 11.123 6.207 -9.368 1.00 0.00 O ATOM 1761 CB ARG A 123 13.391 8.106 -8.480 1.00 0.00 C ATOM 1762 CG ARG A 123 14.483 8.002 -9.559 1.00 0.00 C ATOM 1763 CD ARG A 123 14.757 6.559 -10.009 1.00 0.00 C ATOM 1764 NE ARG A 123 15.773 5.920 -9.158 1.00 0.00 N ATOM 1765 CZ ARG A 123 16.534 4.868 -9.483 1.00 0.00 C ATOM 1766 NH1 ARG A 123 16.309 4.144 -10.573 1.00 0.00 N ATOM 1767 NH2 ARG A 123 17.559 4.585 -8.703 1.00 0.00 N ATOM 0 H ARG A 123 10.830 7.648 -7.509 1.00 0.00 H new ATOM 0 HA ARG A 123 12.095 9.281 -9.673 1.00 0.00 H new ATOM 0 HB2 ARG A 123 13.657 8.898 -7.780 1.00 0.00 H new ATOM 0 HB3 ARG A 123 13.361 7.176 -7.913 1.00 0.00 H new ATOM 0 HG2 ARG A 123 14.187 8.595 -10.424 1.00 0.00 H new ATOM 0 HG3 ARG A 123 15.406 8.437 -9.175 1.00 0.00 H new ATOM 0 HD2 ARG A 123 13.833 5.982 -9.972 1.00 0.00 H new ATOM 0 HD3 ARG A 123 15.093 6.556 -11.046 1.00 0.00 H new ATOM 0 HE ARG A 123 15.911 6.318 -8.229 1.00 0.00 H new ATOM 0 HH11 ARG A 123 15.536 4.383 -11.194 1.00 0.00 H new ATOM 0 HH12 ARG A 123 16.909 3.349 -10.790 1.00 0.00 H new ATOM 0 HH21 ARG A 123 17.750 5.161 -7.883 1.00 0.00 H new ATOM 0 HH22 ARG A 123 18.161 3.790 -8.920 1.00 0.00 H new ATOM 1781 N ALA A 124 11.209 7.532 -11.196 1.00 0.00 N ATOM 1782 CA ALA A 124 10.553 6.617 -12.110 1.00 0.00 C ATOM 1783 C ALA A 124 11.319 5.285 -12.184 1.00 0.00 C ATOM 1784 O ALA A 124 12.551 5.309 -12.087 1.00 0.00 O ATOM 1785 CB ALA A 124 10.443 7.270 -13.492 1.00 0.00 C ATOM 0 H ALA A 124 11.489 8.409 -11.635 1.00 0.00 H new ATOM 0 HA ALA A 124 9.549 6.399 -11.745 1.00 0.00 H new ATOM 0 HB1 ALA A 124 9.950 6.584 -14.181 1.00 0.00 H new ATOM 0 HB2 ALA A 124 9.860 8.188 -13.415 1.00 0.00 H new ATOM 0 HB3 ALA A 124 11.440 7.504 -13.864 1.00 0.00 H new ATOM 1791 N PRO A 125 10.645 4.146 -12.415 1.00 0.00 N ATOM 1792 CA PRO A 125 9.202 3.989 -12.311 1.00 0.00 C ATOM 1793 C PRO A 125 8.795 4.096 -10.833 1.00 0.00 C ATOM 1794 O PRO A 125 9.364 3.418 -9.972 1.00 0.00 O ATOM 1795 CB PRO A 125 8.894 2.629 -12.937 1.00 0.00 C ATOM 1796 CG PRO A 125 10.165 1.814 -12.707 1.00 0.00 C ATOM 1797 CD PRO A 125 11.274 2.869 -12.717 1.00 0.00 C ATOM 0 HA PRO A 125 8.634 4.760 -12.831 1.00 0.00 H new ATOM 0 HB2 PRO A 125 8.030 2.160 -12.466 1.00 0.00 H new ATOM 0 HB3 PRO A 125 8.667 2.722 -13.999 1.00 0.00 H new ATOM 0 HG2 PRO A 125 10.131 1.277 -11.759 1.00 0.00 H new ATOM 0 HG3 PRO A 125 10.312 1.070 -13.490 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.040 2.631 -11.979 1.00 0.00 H new ATOM 0 HD3 PRO A 125 11.767 2.902 -13.688 1.00 0.00 H new ATOM 1805 N GLN A 126 7.909 5.045 -10.524 1.00 0.00 N ATOM 1806 CA GLN A 126 7.619 5.422 -9.147 1.00 0.00 C ATOM 1807 C GLN A 126 6.826 4.319 -8.439 1.00 0.00 C ATOM 1808 O GLN A 126 5.825 3.821 -8.958 1.00 0.00 O ATOM 1809 CB GLN A 126 6.851 6.750 -9.093 1.00 0.00 C ATOM 1810 CG GLN A 126 7.624 7.942 -9.679 1.00 0.00 C ATOM 1811 CD GLN A 126 6.937 9.271 -9.357 1.00 0.00 C ATOM 1812 OE1 GLN A 126 5.719 9.381 -9.300 1.00 0.00 O ATOM 1813 NE2 GLN A 126 7.681 10.334 -9.122 1.00 0.00 N ATOM 0 H GLN A 126 7.377 5.569 -11.219 1.00 0.00 H new ATOM 0 HA GLN A 126 8.568 5.554 -8.628 1.00 0.00 H new ATOM 0 HB2 GLN A 126 5.912 6.637 -9.635 1.00 0.00 H new ATOM 0 HB3 GLN A 126 6.597 6.969 -8.056 1.00 0.00 H new ATOM 0 HG2 GLN A 126 8.638 7.950 -9.280 1.00 0.00 H new ATOM 0 HG3 GLN A 126 7.707 7.827 -10.760 1.00 0.00 H new ATOM 0 HE21 GLN A 126 8.698 10.264 -9.164 1.00 0.00 H new ATOM 0 HE22 GLN A 126 7.240 11.226 -8.898 1.00 0.00 H new ATOM 1822 N GLN A 127 7.228 4.004 -7.207 1.00 0.00 N ATOM 1823 CA GLN A 127 6.538 3.076 -6.318 1.00 0.00 C ATOM 1824 C GLN A 127 6.551 3.637 -4.892 1.00 0.00 C ATOM 1825 O GLN A 127 7.271 4.595 -4.587 1.00 0.00 O ATOM 1826 CB GLN A 127 7.177 1.673 -6.362 1.00 0.00 C ATOM 1827 CG GLN A 127 7.024 0.938 -7.706 1.00 0.00 C ATOM 1828 CD GLN A 127 7.149 -0.579 -7.524 1.00 0.00 C ATOM 1829 OE1 GLN A 127 7.932 -1.061 -6.707 1.00 0.00 O ATOM 1830 NE2 GLN A 127 6.356 -1.368 -8.234 1.00 0.00 N ATOM 0 H GLN A 127 8.070 4.402 -6.790 1.00 0.00 H new ATOM 0 HA GLN A 127 5.507 2.969 -6.655 1.00 0.00 H new ATOM 0 HB2 GLN A 127 8.239 1.765 -6.133 1.00 0.00 H new ATOM 0 HB3 GLN A 127 6.733 1.062 -5.576 1.00 0.00 H new ATOM 0 HG2 GLN A 127 6.055 1.176 -8.146 1.00 0.00 H new ATOM 0 HG3 GLN A 127 7.785 1.287 -8.404 1.00 0.00 H new ATOM 0 HE21 GLN A 127 5.708 -0.964 -8.911 1.00 0.00 H new ATOM 0 HE22 GLN A 127 6.393 -2.379 -8.104 1.00 0.00 H new ATOM 1839 N MET A 128 5.767 3.024 -4.011 1.00 0.00 N ATOM 1840 CA MET A 128 5.635 3.341 -2.597 1.00 0.00 C ATOM 1841 C MET A 128 5.739 2.021 -1.836 1.00 0.00 C ATOM 1842 O MET A 128 5.256 0.996 -2.327 1.00 0.00 O ATOM 1843 CB MET A 128 4.272 3.999 -2.372 1.00 0.00 C ATOM 1844 CG MET A 128 4.070 4.571 -0.974 1.00 0.00 C ATOM 1845 SD MET A 128 3.122 3.520 0.142 1.00 0.00 S ATOM 1846 CE MET A 128 1.557 3.762 -0.735 1.00 0.00 C ATOM 0 H MET A 128 5.170 2.244 -4.285 1.00 0.00 H new ATOM 0 HA MET A 128 6.407 4.029 -2.253 1.00 0.00 H new ATOM 0 HB2 MET A 128 4.144 4.800 -3.100 1.00 0.00 H new ATOM 0 HB3 MET A 128 3.491 3.264 -2.566 1.00 0.00 H new ATOM 0 HG2 MET A 128 5.047 4.761 -0.530 1.00 0.00 H new ATOM 0 HG3 MET A 128 3.566 5.534 -1.060 1.00 0.00 H new ATOM 0 HE1 MET A 128 0.750 3.288 -0.177 1.00 0.00 H new ATOM 0 HE2 MET A 128 1.354 4.829 -0.830 1.00 0.00 H new ATOM 0 HE3 MET A 128 1.623 3.315 -1.727 1.00 0.00 H new ATOM 1856 N GLN A 129 6.365 2.026 -0.657 1.00 0.00 N ATOM 1857 CA GLN A 129 6.617 0.806 0.093 1.00 0.00 C ATOM 1858 C GLN A 129 6.342 1.029 1.574 1.00 0.00 C ATOM 1859 O GLN A 129 6.709 2.049 2.157 1.00 0.00 O ATOM 1860 CB GLN A 129 8.061 0.329 -0.140 1.00 0.00 C ATOM 1861 CG GLN A 129 8.073 -1.192 -0.322 1.00 0.00 C ATOM 1862 CD GLN A 129 9.459 -1.824 -0.304 1.00 0.00 C ATOM 1863 OE1 GLN A 129 10.468 -1.204 0.026 1.00 0.00 O ATOM 1864 NE2 GLN A 129 9.504 -3.111 -0.591 1.00 0.00 N ATOM 0 H GLN A 129 6.707 2.873 -0.203 1.00 0.00 H new ATOM 0 HA GLN A 129 5.942 0.026 -0.260 1.00 0.00 H new ATOM 0 HB2 GLN A 129 8.478 0.815 -1.022 1.00 0.00 H new ATOM 0 HB3 GLN A 129 8.689 0.610 0.705 1.00 0.00 H new ATOM 0 HG2 GLN A 129 7.472 -1.644 0.468 1.00 0.00 H new ATOM 0 HG3 GLN A 129 7.590 -1.435 -1.268 1.00 0.00 H new ATOM 0 HE21 GLN A 129 8.653 -3.603 -0.862 1.00 0.00 H new ATOM 0 HE22 GLN A 129 10.390 -3.614 -0.542 1.00 0.00 H new ATOM 1873 N LEU A 130 5.728 0.033 2.193 1.00 0.00 N ATOM 1874 CA LEU A 130 5.394 -0.065 3.606 1.00 0.00 C ATOM 1875 C LEU A 130 5.780 -1.445 4.126 1.00 0.00 C ATOM 1876 O LEU A 130 5.958 -2.405 3.372 1.00 0.00 O ATOM 1877 CB LEU A 130 3.959 0.357 4.042 1.00 0.00 C ATOM 1878 CG LEU A 130 2.855 0.368 2.989 1.00 0.00 C ATOM 1879 CD1 LEU A 130 3.065 -0.848 2.124 1.00 0.00 C ATOM 1880 CD2 LEU A 130 1.449 0.305 3.596 1.00 0.00 C ATOM 0 H LEU A 130 5.426 -0.795 1.679 1.00 0.00 H new ATOM 0 HA LEU A 130 5.993 0.710 4.084 1.00 0.00 H new ATOM 0 HB2 LEU A 130 3.646 -0.311 4.844 1.00 0.00 H new ATOM 0 HB3 LEU A 130 4.022 1.359 4.467 1.00 0.00 H new ATOM 0 HG LEU A 130 2.914 1.302 2.430 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.296 -0.883 1.353 1.00 0.00 H new ATOM 0 HD12 LEU A 130 4.047 -0.795 1.655 1.00 0.00 H new ATOM 0 HD13 LEU A 130 3.004 -1.746 2.738 1.00 0.00 H new ATOM 0 HD21 LEU A 130 0.707 0.316 2.797 1.00 0.00 H new ATOM 0 HD22 LEU A 130 1.344 -0.612 4.176 1.00 0.00 H new ATOM 0 HD23 LEU A 130 1.295 1.166 4.247 1.00 0.00 H new ATOM 1892 N VAL A 131 5.892 -1.519 5.441 1.00 0.00 N ATOM 1893 CA VAL A 131 6.105 -2.731 6.211 1.00 0.00 C ATOM 1894 C VAL A 131 5.101 -2.619 7.338 1.00 0.00 C ATOM 1895 O VAL A 131 4.911 -1.527 7.895 1.00 0.00 O ATOM 1896 CB VAL A 131 7.551 -2.758 6.719 1.00 0.00 C ATOM 1897 CG1 VAL A 131 8.005 -3.687 7.828 1.00 0.00 C ATOM 1898 CG2 VAL A 131 8.578 -2.787 5.583 1.00 0.00 C ATOM 0 H VAL A 131 5.833 -0.689 6.032 1.00 0.00 H new ATOM 0 HA VAL A 131 5.967 -3.653 5.647 1.00 0.00 H new ATOM 0 HB VAL A 131 7.510 -1.806 7.249 1.00 0.00 H new ATOM 0 HG11 VAL A 131 9.067 -3.532 8.021 1.00 0.00 H new ATOM 0 HG12 VAL A 131 7.437 -3.476 8.734 1.00 0.00 H new ATOM 0 HG13 VAL A 131 7.838 -4.721 7.527 1.00 0.00 H new ATOM 0 HG21 VAL A 131 9.584 -2.805 6.002 1.00 0.00 H new ATOM 0 HG22 VAL A 131 8.422 -3.678 4.974 1.00 0.00 H new ATOM 0 HG23 VAL A 131 8.460 -1.899 4.963 1.00 0.00 H new ATOM 1908 N LEU A 132 4.437 -3.729 7.617 1.00 0.00 N ATOM 1909 CA LEU A 132 3.563 -3.818 8.769 1.00 0.00 C ATOM 1910 C LEU A 132 4.424 -4.129 9.974 1.00 0.00 C ATOM 1911 O LEU A 132 5.530 -4.649 9.845 1.00 0.00 O ATOM 1912 CB LEU A 132 2.540 -4.935 8.564 1.00 0.00 C ATOM 1913 CG LEU A 132 1.280 -4.547 7.766 1.00 0.00 C ATOM 1914 CD1 LEU A 132 1.446 -3.518 6.644 1.00 0.00 C ATOM 1915 CD2 LEU A 132 0.653 -5.806 7.162 1.00 0.00 C ATOM 0 H LEU A 132 4.489 -4.581 7.059 1.00 0.00 H new ATOM 0 HA LEU A 132 3.024 -2.881 8.911 1.00 0.00 H new ATOM 0 HB2 LEU A 132 3.031 -5.763 8.053 1.00 0.00 H new ATOM 0 HB3 LEU A 132 2.230 -5.303 9.542 1.00 0.00 H new ATOM 0 HG LEU A 132 0.651 -4.057 8.509 1.00 0.00 H new ATOM 0 HD11 LEU A 132 0.482 -3.340 6.168 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.824 -2.584 7.060 1.00 0.00 H new ATOM 0 HD13 LEU A 132 2.151 -3.897 5.904 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -0.238 -5.533 6.597 1.00 0.00 H new ATOM 0 HD22 LEU A 132 1.371 -6.287 6.497 1.00 0.00 H new ATOM 0 HD23 LEU A 132 0.380 -6.495 7.961 1.00 0.00 H new ATOM 1927 N ASP A 133 3.881 -3.891 11.159 1.00 0.00 N ATOM 1928 CA ASP A 133 4.641 -4.022 12.397 1.00 0.00 C ATOM 1929 C ASP A 133 5.048 -5.485 12.665 1.00 0.00 C ATOM 1930 O ASP A 133 6.086 -5.764 13.266 1.00 0.00 O ATOM 1931 CB ASP A 133 3.815 -3.432 13.552 1.00 0.00 C ATOM 1932 CG ASP A 133 4.655 -3.116 14.789 1.00 0.00 C ATOM 1933 OD1 ASP A 133 5.903 -3.183 14.720 1.00 0.00 O ATOM 1934 OD2 ASP A 133 4.056 -2.786 15.839 1.00 0.00 O ATOM 0 H ASP A 133 2.911 -3.604 11.291 1.00 0.00 H new ATOM 0 HA ASP A 133 5.573 -3.464 12.308 1.00 0.00 H new ATOM 0 HB2 ASP A 133 3.324 -2.521 13.211 1.00 0.00 H new ATOM 0 HB3 ASP A 133 3.028 -4.135 13.824 1.00 0.00 H new ATOM 1939 N ASN A 134 4.276 -6.445 12.145 1.00 0.00 N ATOM 1940 CA ASN A 134 4.535 -7.877 12.222 1.00 0.00 C ATOM 1941 C ASN A 134 5.539 -8.325 11.162 1.00 0.00 C ATOM 1942 O ASN A 134 5.902 -9.504 11.149 1.00 0.00 O ATOM 1943 CB ASN A 134 3.229 -8.676 12.053 1.00 0.00 C ATOM 1944 CG ASN A 134 2.786 -8.819 10.599 1.00 0.00 C ATOM 1945 OD1 ASN A 134 1.973 -8.041 10.106 1.00 0.00 O ATOM 1946 ND2 ASN A 134 3.288 -9.816 9.889 1.00 0.00 N ATOM 0 H ASN A 134 3.417 -6.230 11.638 1.00 0.00 H new ATOM 0 HA ASN A 134 4.958 -8.073 13.207 1.00 0.00 H new ATOM 0 HB2 ASN A 134 3.361 -9.669 12.483 1.00 0.00 H new ATOM 0 HB3 ASN A 134 2.437 -8.186 12.619 1.00 0.00 H new ATOM 0 HD21 ASN A 134 3.001 -9.947 8.919 1.00 0.00 H new ATOM 0 HD22 ASN A 134 3.962 -10.454 10.312 1.00 0.00 H new ATOM 1953 N GLY A 135 5.946 -7.431 10.256 1.00 0.00 N ATOM 1954 CA GLY A 135 7.052 -7.657 9.351 1.00 0.00 C ATOM 1955 C GLY A 135 6.664 -8.002 7.913 1.00 0.00 C ATOM 1956 O GLY A 135 7.567 -8.293 7.123 1.00 0.00 O ATOM 0 H GLY A 135 5.503 -6.520 10.137 1.00 0.00 H new ATOM 0 HA2 GLY A 135 7.676 -6.763 9.336 1.00 0.00 H new ATOM 0 HA3 GLY A 135 7.664 -8.467 9.748 1.00 0.00 H new ATOM 1960 N ASP A 136 5.371 -7.988 7.554 1.00 0.00 N ATOM 1961 CA ASP A 136 4.903 -8.145 6.164 1.00 0.00 C ATOM 1962 C ASP A 136 5.445 -6.986 5.313 1.00 0.00 C ATOM 1963 O ASP A 136 5.729 -5.912 5.848 1.00 0.00 O ATOM 1964 CB ASP A 136 3.359 -8.132 6.073 1.00 0.00 C ATOM 1965 CG ASP A 136 2.630 -9.432 6.420 1.00 0.00 C ATOM 1966 OD1 ASP A 136 3.192 -10.285 7.139 1.00 0.00 O ATOM 1967 OD2 ASP A 136 1.468 -9.592 5.971 1.00 0.00 O ATOM 0 H ASP A 136 4.612 -7.866 8.225 1.00 0.00 H new ATOM 0 HA ASP A 136 5.266 -9.106 5.799 1.00 0.00 H new ATOM 0 HB2 ASP A 136 2.988 -7.349 6.734 1.00 0.00 H new ATOM 0 HB3 ASP A 136 3.082 -7.850 5.057 1.00 0.00 H new ATOM 1972 N THR A 137 5.517 -7.155 3.989 1.00 0.00 N ATOM 1973 CA THR A 137 6.072 -6.178 3.051 1.00 0.00 C ATOM 1974 C THR A 137 5.082 -5.917 1.926 1.00 0.00 C ATOM 1975 O THR A 137 4.793 -6.807 1.115 1.00 0.00 O ATOM 1976 CB THR A 137 7.398 -6.667 2.453 1.00 0.00 C ATOM 1977 OG1 THR A 137 8.252 -7.170 3.452 1.00 0.00 O ATOM 1978 CG2 THR A 137 8.118 -5.496 1.771 1.00 0.00 C ATOM 0 H THR A 137 5.181 -8.001 3.528 1.00 0.00 H new ATOM 0 HA THR A 137 6.260 -5.257 3.603 1.00 0.00 H new ATOM 0 HB THR A 137 7.167 -7.457 1.738 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.089 -7.476 3.044 1.00 0.00 H new ATOM 0 HG21 THR A 137 9.059 -5.845 1.347 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.489 -5.095 0.976 1.00 0.00 H new ATOM 0 HG23 THR A 137 8.318 -4.715 2.505 1.00 0.00 H new ATOM 1986 N LEU A 138 4.570 -4.693 1.833 1.00 0.00 N ATOM 1987 CA LEU A 138 3.574 -4.323 0.841 1.00 0.00 C ATOM 1988 C LEU A 138 4.155 -3.274 -0.101 1.00 0.00 C ATOM 1989 O LEU A 138 5.065 -2.523 0.262 1.00 0.00 O ATOM 1990 CB LEU A 138 2.299 -3.859 1.550 1.00 0.00 C ATOM 1991 CG LEU A 138 1.284 -4.974 1.792 1.00 0.00 C ATOM 1992 CD1 LEU A 138 0.452 -5.164 0.562 1.00 0.00 C ATOM 1993 CD2 LEU A 138 1.824 -6.078 2.695 1.00 0.00 C ATOM 0 H LEU A 138 4.839 -3.927 2.450 1.00 0.00 H new ATOM 0 HA LEU A 138 3.302 -5.181 0.226 1.00 0.00 H new ATOM 0 HB2 LEU A 138 2.569 -3.413 2.507 1.00 0.00 H new ATOM 0 HB3 LEU A 138 1.829 -3.076 0.955 1.00 0.00 H new ATOM 0 HG LEU A 138 0.465 -4.760 2.479 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -0.273 -5.960 0.733 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -0.073 -4.237 0.331 1.00 0.00 H new ATOM 0 HD13 LEU A 138 1.096 -5.434 -0.275 1.00 0.00 H new ATOM 0 HD21 LEU A 138 1.059 -6.843 2.832 1.00 0.00 H new ATOM 0 HD22 LEU A 138 2.706 -6.525 2.236 1.00 0.00 H new ATOM 0 HD23 LEU A 138 2.093 -5.657 3.664 1.00 0.00 H new ATOM 2005 N THR A 139 3.636 -3.266 -1.326 1.00 0.00 N ATOM 2006 CA THR A 139 4.261 -2.572 -2.457 1.00 0.00 C ATOM 2007 C THR A 139 3.194 -2.002 -3.394 1.00 0.00 C ATOM 2008 O THR A 139 2.396 -2.759 -3.955 1.00 0.00 O ATOM 2009 CB THR A 139 5.207 -3.531 -3.211 1.00 0.00 C ATOM 2010 OG1 THR A 139 6.250 -3.997 -2.370 1.00 0.00 O ATOM 2011 CG2 THR A 139 5.881 -2.811 -4.383 1.00 0.00 C ATOM 0 H THR A 139 2.766 -3.742 -1.567 1.00 0.00 H new ATOM 0 HA THR A 139 4.851 -1.738 -2.076 1.00 0.00 H new ATOM 0 HB THR A 139 4.593 -4.363 -3.556 1.00 0.00 H new ATOM 0 HG1 THR A 139 6.831 -4.603 -2.875 1.00 0.00 H new ATOM 0 HG21 THR A 139 6.544 -3.503 -4.902 1.00 0.00 H new ATOM 0 HG22 THR A 139 5.120 -2.450 -5.074 1.00 0.00 H new ATOM 0 HG23 THR A 139 6.460 -1.967 -4.007 1.00 0.00 H new ATOM 2019 N PHE A 140 3.188 -0.678 -3.581 1.00 0.00 N ATOM 2020 CA PHE A 140 2.223 0.011 -4.430 1.00 0.00 C ATOM 2021 C PHE A 140 2.921 0.622 -5.631 1.00 0.00 C ATOM 2022 O PHE A 140 3.980 1.244 -5.507 1.00 0.00 O ATOM 2023 CB PHE A 140 1.524 1.130 -3.660 1.00 0.00 C ATOM 2024 CG PHE A 140 0.819 0.683 -2.411 1.00 0.00 C ATOM 2025 CD1 PHE A 140 1.551 0.686 -1.217 1.00 0.00 C ATOM 2026 CD2 PHE A 140 -0.539 0.307 -2.409 1.00 0.00 C ATOM 2027 CE1 PHE A 140 0.898 0.410 -0.015 1.00 0.00 C ATOM 2028 CE2 PHE A 140 -1.093 -0.217 -1.225 1.00 0.00 C ATOM 2029 CZ PHE A 140 -0.407 -0.092 -0.015 1.00 0.00 C ATOM 0 H PHE A 140 3.862 -0.052 -3.140 1.00 0.00 H new ATOM 0 HA PHE A 140 1.487 -0.724 -4.757 1.00 0.00 H new ATOM 0 HB2 PHE A 140 2.262 1.886 -3.394 1.00 0.00 H new ATOM 0 HB3 PHE A 140 0.800 1.609 -4.319 1.00 0.00 H new ATOM 0 HD1 PHE A 140 2.610 0.900 -1.226 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -1.143 0.418 -3.297 1.00 0.00 H new ATOM 0 HE1 PHE A 140 1.405 0.586 0.923 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -2.050 -0.716 -1.253 1.00 0.00 H new ATOM 0 HZ PHE A 140 -0.880 -0.380 0.912 1.00 0.00 H new ATOM 2039 N ASP A 141 2.258 0.528 -6.772 1.00 0.00 N ATOM 2040 CA ASP A 141 2.648 1.146 -8.023 1.00 0.00 C ATOM 2041 C ASP A 141 1.943 2.487 -8.115 1.00 0.00 C ATOM 2042 O ASP A 141 0.762 2.602 -7.782 1.00 0.00 O ATOM 2043 CB ASP A 141 2.264 0.223 -9.184 1.00 0.00 C ATOM 2044 CG ASP A 141 3.401 -0.765 -9.399 1.00 0.00 C ATOM 2045 OD1 ASP A 141 4.407 -0.359 -10.026 1.00 0.00 O ATOM 2046 OD2 ASP A 141 3.346 -1.877 -8.831 1.00 0.00 O ATOM 0 H ASP A 141 1.393 -0.007 -6.852 1.00 0.00 H new ATOM 0 HA ASP A 141 3.725 1.305 -8.072 1.00 0.00 H new ATOM 0 HB2 ASP A 141 1.338 -0.306 -8.959 1.00 0.00 H new ATOM 0 HB3 ASP A 141 2.088 0.804 -10.090 1.00 0.00 H new ATOM 2051 N ARG A 142 2.659 3.530 -8.533 1.00 0.00 N ATOM 2052 CA ARG A 142 2.094 4.856 -8.783 1.00 0.00 C ATOM 2053 C ARG A 142 1.042 4.727 -9.883 1.00 0.00 C ATOM 2054 O ARG A 142 1.333 4.067 -10.882 1.00 0.00 O ATOM 2055 CB ARG A 142 3.272 5.739 -9.221 1.00 0.00 C ATOM 2056 CG ARG A 142 2.957 7.196 -9.552 1.00 0.00 C ATOM 2057 CD ARG A 142 2.869 8.099 -8.321 1.00 0.00 C ATOM 2058 NE ARG A 142 2.770 9.500 -8.752 1.00 0.00 N ATOM 2059 CZ ARG A 142 2.967 10.587 -8.003 1.00 0.00 C ATOM 2060 NH1 ARG A 142 3.202 10.493 -6.698 1.00 0.00 N ATOM 2061 NH2 ARG A 142 2.873 11.783 -8.561 1.00 0.00 N ATOM 0 H ARG A 142 3.662 3.477 -8.710 1.00 0.00 H new ATOM 0 HA ARG A 142 1.608 5.291 -7.910 1.00 0.00 H new ATOM 0 HB2 ARG A 142 4.020 5.725 -8.428 1.00 0.00 H new ATOM 0 HB3 ARG A 142 3.730 5.283 -10.099 1.00 0.00 H new ATOM 0 HG2 ARG A 142 3.726 7.582 -10.221 1.00 0.00 H new ATOM 0 HG3 ARG A 142 2.012 7.241 -10.093 1.00 0.00 H new ATOM 0 HD2 ARG A 142 2.001 7.829 -7.719 1.00 0.00 H new ATOM 0 HD3 ARG A 142 3.748 7.962 -7.691 1.00 0.00 H new ATOM 0 HE ARG A 142 2.524 9.659 -9.729 1.00 0.00 H new ATOM 0 HH11 ARG A 142 3.235 9.577 -6.250 1.00 0.00 H new ATOM 0 HH12 ARG A 142 3.350 11.337 -6.144 1.00 0.00 H new ATOM 0 HH21 ARG A 142 2.652 11.867 -9.553 1.00 0.00 H new ATOM 0 HH22 ARG A 142 3.021 12.621 -7.999 1.00 0.00 H new ATOM 2075 N SER A 143 -0.128 5.373 -9.762 1.00 0.00 N ATOM 2076 CA SER A 143 -1.072 5.401 -10.878 1.00 0.00 C ATOM 2077 C SER A 143 -1.694 6.774 -11.035 1.00 0.00 C ATOM 2078 O SER A 143 -2.846 6.924 -11.438 1.00 0.00 O ATOM 2079 CB SER A 143 -2.071 4.255 -10.731 1.00 0.00 C ATOM 2080 OG SER A 143 -2.810 3.974 -11.905 1.00 0.00 O ATOM 0 H SER A 143 -0.433 5.869 -8.925 1.00 0.00 H new ATOM 0 HA SER A 143 -0.550 5.231 -11.820 1.00 0.00 H new ATOM 0 HB2 SER A 143 -1.533 3.356 -10.430 1.00 0.00 H new ATOM 0 HB3 SER A 143 -2.766 4.495 -9.927 1.00 0.00 H new ATOM 0 HG SER A 143 -3.156 4.810 -12.281 1.00 0.00 H new ATOM 2086 N THR A 144 -0.889 7.795 -10.773 1.00 0.00 N ATOM 2087 CA THR A 144 -1.243 9.198 -10.932 1.00 0.00 C ATOM 2088 C THR A 144 -1.200 9.583 -12.428 1.00 0.00 C ATOM 2089 O THR A 144 -1.038 10.760 -12.749 1.00 0.00 O ATOM 2090 CB THR A 144 -0.341 10.038 -9.999 1.00 0.00 C ATOM 2091 OG1 THR A 144 -0.115 9.343 -8.775 1.00 0.00 O ATOM 2092 CG2 THR A 144 -0.922 11.392 -9.584 1.00 0.00 C ATOM 0 H THR A 144 0.063 7.663 -10.431 1.00 0.00 H new ATOM 0 HA THR A 144 -2.269 9.404 -10.626 1.00 0.00 H new ATOM 0 HB THR A 144 0.561 10.202 -10.589 1.00 0.00 H new ATOM 0 HG1 THR A 144 0.321 9.943 -8.134 1.00 0.00 H new ATOM 0 HG21 THR A 144 -0.217 11.906 -8.931 1.00 0.00 H new ATOM 0 HG22 THR A 144 -1.102 11.998 -10.472 1.00 0.00 H new ATOM 0 HG23 THR A 144 -1.861 11.238 -9.053 1.00 0.00 H new ATOM 2100 N ARG A 145 -1.383 8.595 -13.329 1.00 0.00 N ATOM 2101 CA ARG A 145 -1.555 8.720 -14.769 1.00 0.00 C ATOM 2102 C ARG A 145 -0.262 9.112 -15.457 1.00 0.00 C ATOM 2103 O ARG A 145 0.526 8.182 -15.753 1.00 0.00 O ATOM 2104 CB ARG A 145 -2.755 9.635 -15.039 1.00 0.00 C ATOM 2105 CG ARG A 145 -3.328 9.456 -16.437 1.00 0.00 C ATOM 2106 CD ARG A 145 -4.563 10.357 -16.535 1.00 0.00 C ATOM 2107 NE ARG A 145 -5.205 10.284 -17.848 1.00 0.00 N ATOM 2108 CZ ARG A 145 -6.390 10.807 -18.169 1.00 0.00 C ATOM 2109 NH1 ARG A 145 -7.102 11.505 -17.286 1.00 0.00 N ATOM 2110 NH2 ARG A 145 -6.870 10.626 -19.392 1.00 0.00 N ATOM 0 H ARG A 145 -1.415 7.619 -13.033 1.00 0.00 H new ATOM 0 HA ARG A 145 -1.791 7.756 -15.219 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -3.533 9.433 -14.303 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -2.452 10.673 -14.905 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -2.592 9.728 -17.193 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -3.596 8.414 -16.613 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -5.281 10.070 -15.766 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -4.274 11.388 -16.332 1.00 0.00 H new ATOM 0 HE ARG A 145 -4.701 9.789 -18.584 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -6.744 11.649 -16.342 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -8.005 11.895 -17.554 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -6.334 10.092 -20.076 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -7.775 11.021 -19.648 1.00 0.00 H new TER 2124 ARG A 145