USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=35 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 93 THR OG1 : rot -120:sc= -0.215 USER MOD Set 1.2: A 95 MET CE :methyl -157:sc= 0 (180deg=-0.193) USER MOD Set 2.1: A 60 THR OG1 : rot 135:sc= 1.28 USER MOD Set 2.2: A 62 GLN : amide:sc= 0.513 K(o=1.8,f=-1.6) USER MOD Set 3.1: A 27 SER OG : rot -84:sc= 1.25 USER MOD Set 3.2: A 55 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 35 GLN : amide:sc= -0.56 K(o=-0.46,f=0.087) USER MOD Set 4.2: A 39 THR OG1 : rot -160:sc= 0.102 USER MOD Single : A 1 ILE N :NH3+ 180:sc= -0.0447 (180deg=-0.0447) USER MOD Single : A 3 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0108) USER MOD Single : A 4 HIS : no HD1:sc=-0.00321 X(o=-0.0032,f=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -1.92 X(o=-1.9,f=-1.7) USER MOD Single : A 20 THR OG1 : rot 176:sc= 0.212 USER MOD Single : A 21 GLN : amide:sc= -0.697 K(o=-0.7,f=-2.7!) USER MOD Single : A 26 THR OG1 : rot -112:sc= 0.244 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 45 SER OG : rot 94:sc= 0.13 USER MOD Single : A 48 GLN : amide:sc= -0.196 X(o=-0.2,f=-0.25) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0.0118 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= -0.452 X(o=-0.45,f=-0.54) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 87:sc= 1.45 USER MOD Single : A 72 ASN : amide:sc= -1.42 K(o=-1.4,f=0.15) USER MOD Single : A 74 TYR OH : rot -120:sc= -0.662 USER MOD Single : A 75 MET CE :methyl 158:sc= -0.119 (180deg=-2.25) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot -146:sc= 1.13 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ -172:sc= 1.24 (180deg=0.97) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl -128:sc= 0 (180deg=-0.00113) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0706 USER MOD Single : A 103 GLN : amide:sc= -0.0025 X(o=-0.0025,f=-0.24) USER MOD Single : A 108 TYR OH : rot 155:sc= 1.03 USER MOD Single : A 110 ASN : amide:sc= 0.483 X(o=0.48,f=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 118 THR OG1 : rot 0:sc= 0.776 USER MOD Single : A 121 GLN : amide:sc= -0.0718 X(o=-0.072,f=0) USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= 1.62 K(o=1.6,f=-5.9!) USER MOD Single : A 127 GLN : amide:sc= 1.09 K(o=1.1,f=-0.23) USER MOD Single : A 128 MET CE :methyl 164:sc= -0.418 (180deg=-0.913) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 134 ASN : amide:sc= -0.522 X(o=-0.52,f=-0.88) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot -170:sc= 0 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot -48:sc= 0.0203 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 1 21.092 22.928 17.783 1.00 0.00 N ATOM 2 CA ILE A 1 22.209 21.991 17.979 1.00 0.00 C ATOM 3 C ILE A 1 22.541 21.296 16.654 1.00 0.00 C ATOM 4 O ILE A 1 21.896 20.303 16.314 1.00 0.00 O ATOM 5 CB ILE A 1 22.049 21.028 19.178 1.00 0.00 C ATOM 6 CG1 ILE A 1 20.682 20.311 19.310 1.00 0.00 C ATOM 7 CG2 ILE A 1 22.448 21.769 20.469 1.00 0.00 C ATOM 8 CD1 ILE A 1 19.597 21.065 20.091 1.00 0.00 C ATOM 0 H1 ILE A 1 20.870 23.397 18.684 1.00 0.00 H new ATOM 0 H2 ILE A 1 21.359 23.643 17.077 1.00 0.00 H new ATOM 0 H3 ILE A 1 20.256 22.407 17.449 1.00 0.00 H new ATOM 0 HA ILE A 1 23.076 22.581 18.277 1.00 0.00 H new ATOM 0 HB ILE A 1 22.725 20.195 18.986 1.00 0.00 H new ATOM 0 HG12 ILE A 1 20.304 20.106 18.308 1.00 0.00 H new ATOM 0 HG13 ILE A 1 20.845 19.347 19.793 1.00 0.00 H new ATOM 0 HG21 ILE A 1 22.339 21.099 21.322 1.00 0.00 H new ATOM 0 HG22 ILE A 1 23.485 22.096 20.395 1.00 0.00 H new ATOM 0 HG23 ILE A 1 21.803 22.637 20.605 1.00 0.00 H new ATOM 0 HD11 ILE A 1 18.686 20.467 20.118 1.00 0.00 H new ATOM 0 HD12 ILE A 1 19.942 21.247 21.109 1.00 0.00 H new ATOM 0 HD13 ILE A 1 19.392 22.017 19.602 1.00 0.00 H new ATOM 20 N PRO A 2 23.412 21.878 15.809 1.00 0.00 N ATOM 21 CA PRO A 2 23.919 21.179 14.627 1.00 0.00 C ATOM 22 C PRO A 2 24.709 19.920 15.035 1.00 0.00 C ATOM 23 O PRO A 2 24.948 19.682 16.221 1.00 0.00 O ATOM 24 CB PRO A 2 24.799 22.206 13.906 1.00 0.00 C ATOM 25 CG PRO A 2 25.359 23.038 15.057 1.00 0.00 C ATOM 26 CD PRO A 2 24.193 23.088 16.046 1.00 0.00 C ATOM 0 HA PRO A 2 23.120 20.822 13.977 1.00 0.00 H new ATOM 0 HB2 PRO A 2 25.591 21.727 13.330 1.00 0.00 H new ATOM 0 HB3 PRO A 2 24.222 22.815 13.210 1.00 0.00 H new ATOM 0 HG2 PRO A 2 26.242 22.575 15.497 1.00 0.00 H new ATOM 0 HG3 PRO A 2 25.652 24.035 14.729 1.00 0.00 H new ATOM 0 HD2 PRO A 2 24.554 23.124 17.074 1.00 0.00 H new ATOM 0 HD3 PRO A 2 23.587 23.980 15.890 1.00 0.00 H new ATOM 34 N LYS A 3 25.116 19.108 14.055 1.00 0.00 N ATOM 35 CA LYS A 3 26.145 18.087 14.257 1.00 0.00 C ATOM 36 C LYS A 3 27.515 18.782 14.339 1.00 0.00 C ATOM 37 O LYS A 3 27.628 19.989 14.119 1.00 0.00 O ATOM 38 CB LYS A 3 26.112 17.064 13.097 1.00 0.00 C ATOM 39 CG LYS A 3 25.072 15.941 13.221 1.00 0.00 C ATOM 40 CD LYS A 3 23.597 16.367 13.148 1.00 0.00 C ATOM 41 CE LYS A 3 22.941 16.584 14.520 1.00 0.00 C ATOM 42 NZ LYS A 3 22.694 15.318 15.246 1.00 0.00 N ATOM 0 H LYS A 3 24.744 19.140 13.106 1.00 0.00 H new ATOM 0 HA LYS A 3 25.960 17.545 15.184 1.00 0.00 H new ATOM 0 HB2 LYS A 3 25.927 17.603 12.168 1.00 0.00 H new ATOM 0 HB3 LYS A 3 27.099 16.610 13.010 1.00 0.00 H new ATOM 0 HG2 LYS A 3 25.258 15.214 12.430 1.00 0.00 H new ATOM 0 HG3 LYS A 3 25.233 15.428 14.169 1.00 0.00 H new ATOM 0 HD2 LYS A 3 23.524 17.289 12.572 1.00 0.00 H new ATOM 0 HD3 LYS A 3 23.036 15.606 12.605 1.00 0.00 H new ATOM 0 HE2 LYS A 3 23.581 17.226 15.126 1.00 0.00 H new ATOM 0 HE3 LYS A 3 21.996 17.111 14.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 22.190 15.519 16.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 22.117 14.686 14.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 23.602 14.858 15.461 1.00 0.00 H new ATOM 56 N HIS A 4 28.565 18.010 14.627 1.00 0.00 N ATOM 57 CA HIS A 4 29.921 18.353 14.205 1.00 0.00 C ATOM 58 C HIS A 4 29.977 18.316 12.667 1.00 0.00 C ATOM 59 O HIS A 4 29.076 17.738 12.057 1.00 0.00 O ATOM 60 CB HIS A 4 30.906 17.330 14.804 1.00 0.00 C ATOM 61 CG HIS A 4 30.956 17.276 16.314 1.00 0.00 C ATOM 62 ND1 HIS A 4 31.523 16.260 17.051 1.00 0.00 N ATOM 63 CD2 HIS A 4 30.494 18.218 17.197 1.00 0.00 C ATOM 64 CE1 HIS A 4 31.397 16.581 18.351 1.00 0.00 C ATOM 65 NE2 HIS A 4 30.769 17.759 18.487 1.00 0.00 N ATOM 0 H HIS A 4 28.499 17.139 15.154 1.00 0.00 H new ATOM 0 HA HIS A 4 30.194 19.349 14.552 1.00 0.00 H new ATOM 0 HB2 HIS A 4 30.644 16.340 14.432 1.00 0.00 H new ATOM 0 HB3 HIS A 4 31.906 17.556 14.433 1.00 0.00 H new ATOM 0 HD2 HIS A 4 30.006 19.147 16.941 1.00 0.00 H new ATOM 0 HE1 HIS A 4 31.752 15.975 19.171 1.00 0.00 H new ATOM 0 HE2 HIS A 4 30.537 18.228 19.363 1.00 0.00 H new ATOM 73 N PRO A 5 31.012 18.876 12.017 1.00 0.00 N ATOM 74 CA PRO A 5 31.219 18.704 10.582 1.00 0.00 C ATOM 75 C PRO A 5 31.713 17.276 10.270 1.00 0.00 C ATOM 76 O PRO A 5 32.871 17.065 9.922 1.00 0.00 O ATOM 77 CB PRO A 5 32.201 19.812 10.187 1.00 0.00 C ATOM 78 CG PRO A 5 33.033 20.010 11.453 1.00 0.00 C ATOM 79 CD PRO A 5 32.020 19.771 12.573 1.00 0.00 C ATOM 0 HA PRO A 5 30.304 18.799 9.998 1.00 0.00 H new ATOM 0 HB2 PRO A 5 32.821 19.517 9.340 1.00 0.00 H new ATOM 0 HB3 PRO A 5 31.682 20.726 9.899 1.00 0.00 H new ATOM 0 HG2 PRO A 5 33.864 19.306 11.504 1.00 0.00 H new ATOM 0 HG3 PRO A 5 33.460 21.012 11.502 1.00 0.00 H new ATOM 0 HD2 PRO A 5 32.500 19.326 13.445 1.00 0.00 H new ATOM 0 HD3 PRO A 5 31.571 20.709 12.900 1.00 0.00 H new ATOM 87 N ASP A 6 30.818 16.303 10.415 1.00 0.00 N ATOM 88 CA ASP A 6 30.911 14.911 9.990 1.00 0.00 C ATOM 89 C ASP A 6 29.495 14.553 9.548 1.00 0.00 C ATOM 90 O ASP A 6 28.647 14.211 10.377 1.00 0.00 O ATOM 91 CB ASP A 6 31.386 13.993 11.126 1.00 0.00 C ATOM 92 CG ASP A 6 31.072 12.524 10.818 1.00 0.00 C ATOM 93 OD1 ASP A 6 31.395 12.065 9.704 1.00 0.00 O ATOM 94 OD2 ASP A 6 30.442 11.863 11.680 1.00 0.00 O ATOM 0 H ASP A 6 29.927 16.487 10.876 1.00 0.00 H new ATOM 0 HA ASP A 6 31.644 14.780 9.194 1.00 0.00 H new ATOM 0 HB2 ASP A 6 32.459 14.116 11.272 1.00 0.00 H new ATOM 0 HB3 ASP A 6 30.902 14.283 12.059 1.00 0.00 H new ATOM 99 N SER A 7 29.201 14.770 8.267 1.00 0.00 N ATOM 100 CA SER A 7 27.914 14.513 7.636 1.00 0.00 C ATOM 101 C SER A 7 28.055 14.783 6.128 1.00 0.00 C ATOM 102 O SER A 7 29.093 15.249 5.656 1.00 0.00 O ATOM 103 CB SER A 7 26.818 15.411 8.262 1.00 0.00 C ATOM 104 OG SER A 7 25.755 14.633 8.789 1.00 0.00 O ATOM 0 H SER A 7 29.887 15.147 7.614 1.00 0.00 H new ATOM 0 HA SER A 7 27.616 13.477 7.795 1.00 0.00 H new ATOM 0 HB2 SER A 7 27.253 16.021 9.054 1.00 0.00 H new ATOM 0 HB3 SER A 7 26.431 16.096 7.508 1.00 0.00 H new ATOM 0 HG SER A 7 25.079 15.225 9.179 1.00 0.00 H new ATOM 110 N GLU A 8 26.979 14.529 5.383 1.00 0.00 N ATOM 111 CA GLU A 8 26.618 15.166 4.115 1.00 0.00 C ATOM 112 C GLU A 8 27.564 14.928 2.940 1.00 0.00 C ATOM 113 O GLU A 8 27.465 15.607 1.913 1.00 0.00 O ATOM 114 CB GLU A 8 26.274 16.650 4.348 1.00 0.00 C ATOM 115 CG GLU A 8 24.903 16.743 5.026 1.00 0.00 C ATOM 116 CD GLU A 8 24.635 18.093 5.682 1.00 0.00 C ATOM 117 OE1 GLU A 8 24.988 18.239 6.871 1.00 0.00 O ATOM 118 OE2 GLU A 8 23.865 18.885 5.087 1.00 0.00 O ATOM 0 H GLU A 8 26.293 13.829 5.666 1.00 0.00 H new ATOM 0 HA GLU A 8 25.723 14.648 3.770 1.00 0.00 H new ATOM 0 HB2 GLU A 8 27.035 17.120 4.971 1.00 0.00 H new ATOM 0 HB3 GLU A 8 26.262 17.187 3.400 1.00 0.00 H new ATOM 0 HG2 GLU A 8 24.127 16.548 4.286 1.00 0.00 H new ATOM 0 HG3 GLU A 8 24.827 15.960 5.781 1.00 0.00 H new ATOM 125 N ALA A 9 28.383 13.887 3.027 1.00 0.00 N ATOM 126 CA ALA A 9 29.217 13.406 1.936 1.00 0.00 C ATOM 127 C ALA A 9 28.894 11.940 1.630 1.00 0.00 C ATOM 128 O ALA A 9 29.799 11.113 1.510 1.00 0.00 O ATOM 129 CB ALA A 9 30.695 13.656 2.271 1.00 0.00 C ATOM 0 H ALA A 9 28.487 13.340 3.882 1.00 0.00 H new ATOM 0 HA ALA A 9 29.005 13.958 1.021 1.00 0.00 H new ATOM 0 HB1 ALA A 9 31.319 13.296 1.454 1.00 0.00 H new ATOM 0 HB2 ALA A 9 30.861 14.724 2.410 1.00 0.00 H new ATOM 0 HB3 ALA A 9 30.955 13.126 3.187 1.00 0.00 H new ATOM 135 N VAL A 10 27.603 11.610 1.535 1.00 0.00 N ATOM 136 CA VAL A 10 27.108 10.248 1.350 1.00 0.00 C ATOM 137 C VAL A 10 25.994 10.290 0.294 1.00 0.00 C ATOM 138 O VAL A 10 25.134 11.178 0.321 1.00 0.00 O ATOM 139 CB VAL A 10 26.656 9.662 2.714 1.00 0.00 C ATOM 140 CG1 VAL A 10 26.156 8.219 2.577 1.00 0.00 C ATOM 141 CG2 VAL A 10 27.786 9.663 3.759 1.00 0.00 C ATOM 0 H VAL A 10 26.856 12.303 1.586 1.00 0.00 H new ATOM 0 HA VAL A 10 27.887 9.579 0.985 1.00 0.00 H new ATOM 0 HB VAL A 10 25.848 10.312 3.048 1.00 0.00 H new ATOM 0 HG11 VAL A 10 25.849 7.846 3.554 1.00 0.00 H new ATOM 0 HG12 VAL A 10 25.306 8.192 1.895 1.00 0.00 H new ATOM 0 HG13 VAL A 10 26.957 7.592 2.184 1.00 0.00 H new ATOM 0 HG21 VAL A 10 27.417 9.243 4.695 1.00 0.00 H new ATOM 0 HG22 VAL A 10 28.619 9.061 3.395 1.00 0.00 H new ATOM 0 HG23 VAL A 10 28.124 10.685 3.929 1.00 0.00 H new ATOM 151 N ALA A 11 26.026 9.360 -0.665 1.00 0.00 N ATOM 152 CA ALA A 11 25.015 9.236 -1.711 1.00 0.00 C ATOM 153 C ALA A 11 23.649 8.865 -1.110 1.00 0.00 C ATOM 154 O ALA A 11 23.609 8.191 -0.078 1.00 0.00 O ATOM 155 CB ALA A 11 25.458 8.168 -2.714 1.00 0.00 C ATOM 0 H ALA A 11 26.768 8.663 -0.735 1.00 0.00 H new ATOM 0 HA ALA A 11 24.910 10.195 -2.218 1.00 0.00 H new ATOM 0 HB1 ALA A 11 24.707 8.071 -3.498 1.00 0.00 H new ATOM 0 HB2 ALA A 11 26.410 8.459 -3.158 1.00 0.00 H new ATOM 0 HB3 ALA A 11 25.573 7.213 -2.201 1.00 0.00 H new ATOM 161 N PRO A 12 22.532 9.254 -1.750 1.00 0.00 N ATOM 162 CA PRO A 12 21.203 9.076 -1.188 1.00 0.00 C ATOM 163 C PRO A 12 20.750 7.619 -1.263 1.00 0.00 C ATOM 164 O PRO A 12 20.715 6.998 -2.331 1.00 0.00 O ATOM 165 CB PRO A 12 20.284 9.993 -1.990 1.00 0.00 C ATOM 166 CG PRO A 12 20.970 10.059 -3.350 1.00 0.00 C ATOM 167 CD PRO A 12 22.453 10.008 -2.993 1.00 0.00 C ATOM 0 HA PRO A 12 21.186 9.330 -0.128 1.00 0.00 H new ATOM 0 HB2 PRO A 12 19.275 9.588 -2.066 1.00 0.00 H new ATOM 0 HB3 PRO A 12 20.198 10.979 -1.533 1.00 0.00 H new ATOM 0 HG2 PRO A 12 20.680 9.224 -3.988 1.00 0.00 H new ATOM 0 HG3 PRO A 12 20.716 10.974 -3.886 1.00 0.00 H new ATOM 0 HD2 PRO A 12 23.029 9.525 -3.782 1.00 0.00 H new ATOM 0 HD3 PRO A 12 22.861 11.011 -2.869 1.00 0.00 H new ATOM 175 N ASP A 13 20.349 7.100 -0.113 1.00 0.00 N ATOM 176 CA ASP A 13 19.772 5.774 0.058 1.00 0.00 C ATOM 177 C ASP A 13 18.274 5.829 -0.304 1.00 0.00 C ATOM 178 O ASP A 13 17.632 6.860 -0.069 1.00 0.00 O ATOM 179 CB ASP A 13 19.993 5.334 1.513 1.00 0.00 C ATOM 180 CG ASP A 13 19.799 3.831 1.683 1.00 0.00 C ATOM 181 OD1 ASP A 13 20.723 3.057 1.331 1.00 0.00 O ATOM 182 OD2 ASP A 13 18.733 3.396 2.172 1.00 0.00 O ATOM 0 H ASP A 13 20.420 7.613 0.766 1.00 0.00 H new ATOM 0 HA ASP A 13 20.248 5.046 -0.599 1.00 0.00 H new ATOM 0 HB2 ASP A 13 21.000 5.609 1.827 1.00 0.00 H new ATOM 0 HB3 ASP A 13 19.299 5.866 2.164 1.00 0.00 H new ATOM 187 N PRO A 14 17.697 4.774 -0.904 1.00 0.00 N ATOM 188 CA PRO A 14 16.302 4.749 -1.333 1.00 0.00 C ATOM 189 C PRO A 14 15.323 4.684 -0.152 1.00 0.00 C ATOM 190 O PRO A 14 15.714 4.614 1.015 1.00 0.00 O ATOM 191 CB PRO A 14 16.178 3.536 -2.268 1.00 0.00 C ATOM 192 CG PRO A 14 17.307 2.617 -1.817 1.00 0.00 C ATOM 193 CD PRO A 14 18.385 3.575 -1.341 1.00 0.00 C ATOM 0 HA PRO A 14 16.033 5.671 -1.848 1.00 0.00 H new ATOM 0 HB2 PRO A 14 15.206 3.053 -2.171 1.00 0.00 H new ATOM 0 HB3 PRO A 14 16.289 3.823 -3.314 1.00 0.00 H new ATOM 0 HG2 PRO A 14 16.984 1.949 -1.018 1.00 0.00 H new ATOM 0 HG3 PRO A 14 17.662 1.989 -2.634 1.00 0.00 H new ATOM 0 HD2 PRO A 14 18.962 3.138 -0.526 1.00 0.00 H new ATOM 0 HD3 PRO A 14 19.088 3.800 -2.143 1.00 0.00 H new ATOM 201 N PHE A 15 14.024 4.703 -0.475 1.00 0.00 N ATOM 202 CA PHE A 15 12.910 4.750 0.467 1.00 0.00 C ATOM 203 C PHE A 15 13.092 5.896 1.461 1.00 0.00 C ATOM 204 O PHE A 15 12.953 5.744 2.678 1.00 0.00 O ATOM 205 CB PHE A 15 12.710 3.375 1.115 1.00 0.00 C ATOM 206 CG PHE A 15 12.371 2.279 0.126 1.00 0.00 C ATOM 207 CD1 PHE A 15 11.217 2.389 -0.672 1.00 0.00 C ATOM 208 CD2 PHE A 15 13.184 1.136 0.019 1.00 0.00 C ATOM 209 CE1 PHE A 15 10.842 1.342 -1.526 1.00 0.00 C ATOM 210 CE2 PHE A 15 12.788 0.074 -0.816 1.00 0.00 C ATOM 211 CZ PHE A 15 11.619 0.175 -1.587 1.00 0.00 C ATOM 0 H PHE A 15 13.712 4.685 -1.446 1.00 0.00 H new ATOM 0 HA PHE A 15 11.982 4.971 -0.061 1.00 0.00 H new ATOM 0 HB2 PHE A 15 13.618 3.100 1.651 1.00 0.00 H new ATOM 0 HB3 PHE A 15 11.912 3.444 1.855 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.616 3.285 -0.626 1.00 0.00 H new ATOM 0 HD2 PHE A 15 14.108 1.073 0.575 1.00 0.00 H new ATOM 0 HE1 PHE A 15 9.956 1.434 -2.136 1.00 0.00 H new ATOM 0 HE2 PHE A 15 13.387 -0.824 -0.864 1.00 0.00 H new ATOM 0 HZ PHE A 15 11.319 -0.643 -2.225 1.00 0.00 H new ATOM 221 N ASN A 16 13.427 7.066 0.917 1.00 0.00 N ATOM 222 CA ASN A 16 13.637 8.267 1.709 1.00 0.00 C ATOM 223 C ASN A 16 12.290 8.751 2.239 1.00 0.00 C ATOM 224 O ASN A 16 11.334 8.750 1.460 1.00 0.00 O ATOM 225 CB ASN A 16 14.212 9.364 0.803 1.00 0.00 C ATOM 226 CG ASN A 16 15.066 10.333 1.600 1.00 0.00 C ATOM 227 OD1 ASN A 16 15.907 9.919 2.386 1.00 0.00 O ATOM 228 ND2 ASN A 16 14.886 11.621 1.411 1.00 0.00 N ATOM 0 H ASN A 16 13.559 7.203 -0.085 1.00 0.00 H new ATOM 0 HA ASN A 16 14.318 8.052 2.532 1.00 0.00 H new ATOM 0 HB2 ASN A 16 14.810 8.911 0.012 1.00 0.00 H new ATOM 0 HB3 ASN A 16 13.399 9.904 0.318 1.00 0.00 H new ATOM 0 HD21 ASN A 16 15.453 12.296 1.924 1.00 0.00 H new ATOM 0 HD22 ASN A 16 14.179 11.946 0.751 1.00 0.00 H new ATOM 235 N PRO A 17 12.213 9.292 3.463 1.00 0.00 N ATOM 236 CA PRO A 17 10.970 9.801 4.028 1.00 0.00 C ATOM 237 C PRO A 17 10.614 11.185 3.481 1.00 0.00 C ATOM 238 O PRO A 17 9.452 11.586 3.564 1.00 0.00 O ATOM 239 CB PRO A 17 11.195 9.835 5.540 1.00 0.00 C ATOM 240 CG PRO A 17 12.705 10.024 5.661 1.00 0.00 C ATOM 241 CD PRO A 17 13.259 9.265 4.467 1.00 0.00 C ATOM 0 HA PRO A 17 10.126 9.166 3.760 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.648 10.652 6.011 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.865 8.913 6.018 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.981 11.078 5.629 1.00 0.00 H new ATOM 0 HG3 PRO A 17 13.085 9.624 6.601 1.00 0.00 H new ATOM 0 HD2 PRO A 17 14.171 9.733 4.095 1.00 0.00 H new ATOM 0 HD3 PRO A 17 13.514 8.241 4.739 1.00 0.00 H new ATOM 249 N ALA A 18 11.563 11.910 2.866 1.00 0.00 N ATOM 250 CA ALA A 18 11.322 13.192 2.199 1.00 0.00 C ATOM 251 C ALA A 18 10.606 13.002 0.843 1.00 0.00 C ATOM 252 O ALA A 18 10.911 13.640 -0.168 1.00 0.00 O ATOM 253 CB ALA A 18 12.630 13.984 2.086 1.00 0.00 C ATOM 0 H ALA A 18 12.537 11.612 2.820 1.00 0.00 H new ATOM 0 HA ALA A 18 10.640 13.784 2.809 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.438 14.935 1.589 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.030 14.170 3.083 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.353 13.411 1.506 1.00 0.00 H new ATOM 259 N ALA A 19 9.655 12.079 0.823 1.00 0.00 N ATOM 260 CA ALA A 19 8.841 11.606 -0.273 1.00 0.00 C ATOM 261 C ALA A 19 7.433 11.426 0.283 1.00 0.00 C ATOM 262 O ALA A 19 6.468 11.914 -0.296 1.00 0.00 O ATOM 263 CB ALA A 19 9.423 10.278 -0.774 1.00 0.00 C ATOM 0 H ALA A 19 9.412 11.588 1.683 1.00 0.00 H new ATOM 0 HA ALA A 19 8.821 12.299 -1.114 1.00 0.00 H new ATOM 0 HB1 ALA A 19 8.820 9.906 -1.602 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.447 10.434 -1.112 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.416 9.549 0.036 1.00 0.00 H new ATOM 269 N THR A 20 7.311 10.797 1.453 1.00 0.00 N ATOM 270 CA THR A 20 6.044 10.470 2.086 1.00 0.00 C ATOM 271 C THR A 20 5.201 11.708 2.403 1.00 0.00 C ATOM 272 O THR A 20 3.986 11.629 2.527 1.00 0.00 O ATOM 273 CB THR A 20 6.315 9.625 3.336 1.00 0.00 C ATOM 274 OG1 THR A 20 7.489 8.840 3.175 1.00 0.00 O ATOM 275 CG2 THR A 20 5.129 8.698 3.567 1.00 0.00 C ATOM 0 H THR A 20 8.118 10.494 1.998 1.00 0.00 H new ATOM 0 HA THR A 20 5.447 9.891 1.382 1.00 0.00 H new ATOM 0 HB THR A 20 6.457 10.292 4.186 1.00 0.00 H new ATOM 0 HG1 THR A 20 7.682 8.365 4.010 1.00 0.00 H new ATOM 0 HG21 THR A 20 5.309 8.091 4.454 1.00 0.00 H new ATOM 0 HG22 THR A 20 4.226 9.291 3.711 1.00 0.00 H new ATOM 0 HG23 THR A 20 5.002 8.047 2.702 1.00 0.00 H new ATOM 283 N GLN A 21 5.824 12.878 2.481 1.00 0.00 N ATOM 284 CA GLN A 21 5.140 14.147 2.660 1.00 0.00 C ATOM 285 C GLN A 21 4.260 14.572 1.484 1.00 0.00 C ATOM 286 O GLN A 21 3.485 15.502 1.678 1.00 0.00 O ATOM 287 CB GLN A 21 6.194 15.197 2.996 1.00 0.00 C ATOM 288 CG GLN A 21 7.232 15.464 1.898 1.00 0.00 C ATOM 289 CD GLN A 21 8.664 15.609 2.410 1.00 0.00 C ATOM 290 OE1 GLN A 21 8.982 15.430 3.584 1.00 0.00 O ATOM 291 NE2 GLN A 21 9.580 15.873 1.501 1.00 0.00 N ATOM 0 H GLN A 21 6.838 12.970 2.420 1.00 0.00 H new ATOM 0 HA GLN A 21 4.427 14.034 3.477 1.00 0.00 H new ATOM 0 HB2 GLN A 21 5.688 16.134 3.229 1.00 0.00 H new ATOM 0 HB3 GLN A 21 6.718 14.885 3.899 1.00 0.00 H new ATOM 0 HG2 GLN A 21 7.198 14.649 1.175 1.00 0.00 H new ATOM 0 HG3 GLN A 21 6.955 16.374 1.365 1.00 0.00 H new ATOM 0 HE21 GLN A 21 9.307 16.020 0.529 1.00 0.00 H new ATOM 0 HE22 GLN A 21 10.563 15.930 1.769 1.00 0.00 H new ATOM 300 N LEU A 22 4.362 13.917 0.322 1.00 0.00 N ATOM 301 CA LEU A 22 3.571 14.189 -0.883 1.00 0.00 C ATOM 302 C LEU A 22 2.390 13.206 -0.989 1.00 0.00 C ATOM 303 O LEU A 22 1.708 13.140 -2.018 1.00 0.00 O ATOM 304 CB LEU A 22 4.479 14.090 -2.132 1.00 0.00 C ATOM 305 CG LEU A 22 5.352 15.304 -2.492 1.00 0.00 C ATOM 306 CD1 LEU A 22 6.134 15.848 -1.315 1.00 0.00 C ATOM 307 CD2 LEU A 22 6.363 14.910 -3.570 1.00 0.00 C ATOM 0 H LEU A 22 5.024 13.153 0.190 1.00 0.00 H new ATOM 0 HA LEU A 22 3.163 15.198 -0.821 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.139 13.233 -1.997 1.00 0.00 H new ATOM 0 HB3 LEU A 22 3.843 13.871 -2.990 1.00 0.00 H new ATOM 0 HG LEU A 22 4.666 16.078 -2.837 1.00 0.00 H new ATOM 0 HD11 LEU A 22 6.729 16.703 -1.637 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.443 16.161 -0.532 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.794 15.072 -0.927 1.00 0.00 H new ATOM 0 HD21 LEU A 22 6.980 15.772 -3.823 1.00 0.00 H new ATOM 0 HD22 LEU A 22 6.998 14.106 -3.197 1.00 0.00 H new ATOM 0 HD23 LEU A 22 5.833 14.570 -4.459 1.00 0.00 H new ATOM 319 N LEU A 23 2.150 12.379 0.037 1.00 0.00 N ATOM 320 CA LEU A 23 1.093 11.358 0.013 1.00 0.00 C ATOM 321 C LEU A 23 -0.247 12.008 0.368 1.00 0.00 C ATOM 322 O LEU A 23 -0.894 11.639 1.345 1.00 0.00 O ATOM 323 CB LEU A 23 1.469 10.151 0.900 1.00 0.00 C ATOM 324 CG LEU A 23 2.384 9.107 0.232 1.00 0.00 C ATOM 325 CD1 LEU A 23 1.584 8.216 -0.715 1.00 0.00 C ATOM 326 CD2 LEU A 23 3.554 9.704 -0.560 1.00 0.00 C ATOM 0 H LEU A 23 2.682 12.398 0.907 1.00 0.00 H new ATOM 0 HA LEU A 23 0.986 10.946 -0.991 1.00 0.00 H new ATOM 0 HB2 LEU A 23 1.962 10.521 1.799 1.00 0.00 H new ATOM 0 HB3 LEU A 23 0.552 9.656 1.220 1.00 0.00 H new ATOM 0 HG LEU A 23 2.803 8.537 1.061 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.249 7.486 -1.176 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.806 7.696 -0.155 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.125 8.829 -1.490 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.146 8.900 -0.996 1.00 0.00 H new ATOM 0 HD22 LEU A 23 3.167 10.342 -1.355 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.181 10.295 0.107 1.00 0.00 H new ATOM 338 N ASP A 24 -0.626 13.036 -0.391 1.00 0.00 N ATOM 339 CA ASP A 24 -1.637 14.001 0.028 1.00 0.00 C ATOM 340 C ASP A 24 -2.626 14.316 -1.079 1.00 0.00 C ATOM 341 O ASP A 24 -3.820 14.359 -0.805 1.00 0.00 O ATOM 342 CB ASP A 24 -0.946 15.274 0.513 1.00 0.00 C ATOM 343 CG ASP A 24 -1.800 16.074 1.492 1.00 0.00 C ATOM 344 OD1 ASP A 24 -2.352 15.510 2.471 1.00 0.00 O ATOM 345 OD2 ASP A 24 -1.809 17.318 1.368 1.00 0.00 O ATOM 0 H ASP A 24 -0.238 13.222 -1.316 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.212 13.559 0.842 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.003 15.010 0.992 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.703 15.900 -0.346 1.00 0.00 H new ATOM 350 N ASP A 25 -2.148 14.448 -2.320 1.00 0.00 N ATOM 351 CA ASP A 25 -2.985 14.598 -3.511 1.00 0.00 C ATOM 352 C ASP A 25 -2.505 13.584 -4.559 1.00 0.00 C ATOM 353 O ASP A 25 -2.346 13.925 -5.736 1.00 0.00 O ATOM 354 CB ASP A 25 -3.012 16.028 -4.094 1.00 0.00 C ATOM 355 CG ASP A 25 -2.976 17.173 -3.092 1.00 0.00 C ATOM 356 OD1 ASP A 25 -1.858 17.530 -2.654 1.00 0.00 O ATOM 357 OD2 ASP A 25 -4.013 17.828 -2.856 1.00 0.00 O ATOM 0 H ASP A 25 -1.149 14.454 -2.527 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.017 14.404 -3.218 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -2.162 16.138 -4.767 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -3.913 16.133 -4.699 1.00 0.00 H new ATOM 362 N THR A 26 -2.144 12.365 -4.152 1.00 0.00 N ATOM 363 CA THR A 26 -1.562 11.347 -5.030 1.00 0.00 C ATOM 364 C THR A 26 -2.425 10.082 -5.050 1.00 0.00 C ATOM 365 O THR A 26 -3.195 9.817 -4.129 1.00 0.00 O ATOM 366 CB THR A 26 -0.093 11.069 -4.646 1.00 0.00 C ATOM 367 OG1 THR A 26 0.075 10.858 -3.259 1.00 0.00 O ATOM 368 CG2 THR A 26 0.830 12.226 -5.033 1.00 0.00 C ATOM 0 H THR A 26 -2.250 12.052 -3.187 1.00 0.00 H new ATOM 0 HA THR A 26 -1.551 11.728 -6.051 1.00 0.00 H new ATOM 0 HB THR A 26 0.170 10.166 -5.197 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.585 11.601 -2.875 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.854 11.987 -4.744 1.00 0.00 H new ATOM 0 HG22 THR A 26 0.784 12.383 -6.111 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.511 13.133 -4.520 1.00 0.00 H new ATOM 376 N SER A 27 -2.297 9.278 -6.101 1.00 0.00 N ATOM 377 CA SER A 27 -3.058 8.055 -6.285 1.00 0.00 C ATOM 378 C SER A 27 -2.107 6.919 -6.560 1.00 0.00 C ATOM 379 O SER A 27 -1.016 7.099 -7.110 1.00 0.00 O ATOM 380 CB SER A 27 -4.031 8.261 -7.438 1.00 0.00 C ATOM 381 OG SER A 27 -4.426 7.113 -8.162 1.00 0.00 O ATOM 0 H SER A 27 -1.646 9.466 -6.863 1.00 0.00 H new ATOM 0 HA SER A 27 -3.627 7.808 -5.389 1.00 0.00 H new ATOM 0 HB2 SER A 27 -4.928 8.736 -7.042 1.00 0.00 H new ATOM 0 HB3 SER A 27 -3.581 8.964 -8.139 1.00 0.00 H new ATOM 0 HG SER A 27 -3.755 6.912 -8.848 1.00 0.00 H new ATOM 387 N TRP A 28 -2.576 5.742 -6.181 1.00 0.00 N ATOM 388 CA TRP A 28 -1.806 4.528 -6.070 1.00 0.00 C ATOM 389 C TRP A 28 -2.724 3.340 -6.359 1.00 0.00 C ATOM 390 O TRP A 28 -3.953 3.473 -6.352 1.00 0.00 O ATOM 391 CB TRP A 28 -1.192 4.470 -4.658 1.00 0.00 C ATOM 392 CG TRP A 28 -0.406 5.692 -4.263 1.00 0.00 C ATOM 393 CD1 TRP A 28 -0.896 6.783 -3.626 1.00 0.00 C ATOM 394 CD2 TRP A 28 0.985 6.007 -4.563 1.00 0.00 C ATOM 395 NE1 TRP A 28 0.074 7.765 -3.576 1.00 0.00 N ATOM 396 CE2 TRP A 28 1.262 7.335 -4.131 1.00 0.00 C ATOM 397 CE3 TRP A 28 2.030 5.310 -5.197 1.00 0.00 C ATOM 398 CZ2 TRP A 28 2.519 7.933 -4.313 1.00 0.00 C ATOM 399 CZ3 TRP A 28 3.289 5.902 -5.415 1.00 0.00 C ATOM 400 CH2 TRP A 28 3.538 7.210 -4.963 1.00 0.00 C ATOM 0 H TRP A 28 -3.556 5.607 -5.931 1.00 0.00 H new ATOM 0 HA TRP A 28 -0.990 4.498 -6.792 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.993 4.320 -3.934 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -0.539 3.599 -4.596 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -1.893 6.871 -3.220 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -0.070 8.693 -3.178 1.00 0.00 H new ATOM 0 HE3 TRP A 28 1.862 4.295 -5.525 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 2.703 8.936 -3.958 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 4.063 5.352 -5.929 1.00 0.00 H new ATOM 0 HH2 TRP A 28 4.508 7.659 -5.114 1.00 0.00 H new ATOM 411 N VAL A 29 -2.146 2.181 -6.656 1.00 0.00 N ATOM 412 CA VAL A 29 -2.859 0.933 -6.929 1.00 0.00 C ATOM 413 C VAL A 29 -1.957 -0.192 -6.419 1.00 0.00 C ATOM 414 O VAL A 29 -0.748 -0.119 -6.619 1.00 0.00 O ATOM 415 CB VAL A 29 -3.134 0.810 -8.446 1.00 0.00 C ATOM 416 CG1 VAL A 29 -3.809 -0.506 -8.862 1.00 0.00 C ATOM 417 CG2 VAL A 29 -3.953 1.979 -8.993 1.00 0.00 C ATOM 0 H VAL A 29 -1.133 2.079 -6.716 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.828 0.892 -6.432 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.137 0.825 -8.886 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.965 -0.510 -9.941 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -3.171 -1.345 -8.585 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -4.770 -0.598 -8.356 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -4.116 1.840 -10.062 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -4.915 2.020 -8.482 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.413 2.911 -8.826 1.00 0.00 H new ATOM 427 N LEU A 30 -2.495 -1.194 -5.720 1.00 0.00 N ATOM 428 CA LEU A 30 -1.699 -2.303 -5.189 1.00 0.00 C ATOM 429 C LEU A 30 -1.461 -3.351 -6.273 1.00 0.00 C ATOM 430 O LEU A 30 -2.336 -3.575 -7.115 1.00 0.00 O ATOM 431 CB LEU A 30 -2.419 -2.964 -4.001 1.00 0.00 C ATOM 432 CG LEU A 30 -1.540 -3.935 -3.196 1.00 0.00 C ATOM 433 CD1 LEU A 30 -0.530 -3.153 -2.366 1.00 0.00 C ATOM 434 CD2 LEU A 30 -2.401 -4.821 -2.290 1.00 0.00 C ATOM 0 H LEU A 30 -3.490 -1.260 -5.507 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.743 -1.902 -4.853 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.786 -2.185 -3.333 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.291 -3.503 -4.372 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.004 -4.580 -3.893 1.00 0.00 H new ATOM 0 HD11 LEU A 30 0.090 -3.847 -1.798 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.102 -2.559 -3.027 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.058 -2.492 -1.679 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -1.759 -5.501 -1.729 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -2.961 -4.195 -1.595 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.096 -5.398 -2.900 1.00 0.00 H new ATOM 446 N SER A 31 -0.338 -4.068 -6.193 1.00 0.00 N ATOM 447 CA SER A 31 -0.025 -5.163 -7.097 1.00 0.00 C ATOM 448 C SER A 31 0.505 -6.431 -6.395 1.00 0.00 C ATOM 449 O SER A 31 0.297 -7.528 -6.921 1.00 0.00 O ATOM 450 CB SER A 31 0.982 -4.612 -8.117 1.00 0.00 C ATOM 451 OG SER A 31 1.228 -5.530 -9.157 1.00 0.00 O ATOM 0 H SER A 31 0.382 -3.899 -5.491 1.00 0.00 H new ATOM 0 HA SER A 31 -0.942 -5.502 -7.579 1.00 0.00 H new ATOM 0 HB2 SER A 31 0.602 -3.681 -8.537 1.00 0.00 H new ATOM 0 HB3 SER A 31 1.918 -4.375 -7.612 1.00 0.00 H new ATOM 0 HG SER A 31 1.872 -5.145 -9.788 1.00 0.00 H new ATOM 457 N ALA A 32 1.152 -6.336 -5.221 1.00 0.00 N ATOM 458 CA ALA A 32 1.648 -7.494 -4.463 1.00 0.00 C ATOM 459 C ALA A 32 1.683 -7.176 -2.965 1.00 0.00 C ATOM 460 O ALA A 32 1.757 -6.004 -2.596 1.00 0.00 O ATOM 461 CB ALA A 32 3.058 -7.870 -4.939 1.00 0.00 C ATOM 0 H ALA A 32 1.347 -5.443 -4.768 1.00 0.00 H new ATOM 0 HA ALA A 32 0.973 -8.333 -4.633 1.00 0.00 H new ATOM 0 HB1 ALA A 32 3.417 -8.729 -4.372 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.029 -8.122 -5.999 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.731 -7.027 -4.785 1.00 0.00 H new ATOM 467 N TRP A 33 1.667 -8.210 -2.116 1.00 0.00 N ATOM 468 CA TRP A 33 1.744 -8.154 -0.657 1.00 0.00 C ATOM 469 C TRP A 33 2.568 -9.344 -0.170 1.00 0.00 C ATOM 470 O TRP A 33 2.096 -10.484 -0.187 1.00 0.00 O ATOM 471 CB TRP A 33 0.320 -8.146 -0.064 1.00 0.00 C ATOM 472 CG TRP A 33 0.022 -8.290 1.398 1.00 0.00 C ATOM 473 CD1 TRP A 33 0.841 -8.678 2.404 1.00 0.00 C ATOM 474 CD2 TRP A 33 -1.258 -8.013 2.027 1.00 0.00 C ATOM 475 NE1 TRP A 33 0.198 -8.510 3.615 1.00 0.00 N ATOM 476 CE2 TRP A 33 -1.092 -8.065 3.437 1.00 0.00 C ATOM 477 CE3 TRP A 33 -2.531 -7.658 1.538 1.00 0.00 C ATOM 478 CZ2 TRP A 33 -2.112 -7.667 4.307 1.00 0.00 C ATOM 479 CZ3 TRP A 33 -3.581 -7.324 2.411 1.00 0.00 C ATOM 480 CH2 TRP A 33 -3.363 -7.303 3.796 1.00 0.00 C ATOM 0 H TRP A 33 1.595 -9.169 -2.455 1.00 0.00 H new ATOM 0 HA TRP A 33 2.235 -7.239 -0.325 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -0.135 -7.206 -0.377 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -0.224 -8.946 -0.566 1.00 0.00 H new ATOM 0 HD1 TRP A 33 1.843 -9.060 2.279 1.00 0.00 H new ATOM 0 HE1 TRP A 33 0.624 -8.692 4.524 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -2.703 -7.642 0.472 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -1.935 -7.641 5.372 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -4.556 -7.083 2.015 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -4.157 -7.007 4.466 1.00 0.00 H new ATOM 491 N LYS A 34 3.800 -9.103 0.272 1.00 0.00 N ATOM 492 CA LYS A 34 4.629 -10.108 0.912 1.00 0.00 C ATOM 493 C LYS A 34 4.310 -10.108 2.400 1.00 0.00 C ATOM 494 O LYS A 34 4.277 -9.036 3.007 1.00 0.00 O ATOM 495 CB LYS A 34 6.117 -9.790 0.681 1.00 0.00 C ATOM 496 CG LYS A 34 6.899 -11.094 0.513 1.00 0.00 C ATOM 497 CD LYS A 34 6.910 -11.557 -0.953 1.00 0.00 C ATOM 498 CE LYS A 34 8.222 -11.147 -1.628 1.00 0.00 C ATOM 499 NZ LYS A 34 8.399 -11.804 -2.938 1.00 0.00 N ATOM 0 H LYS A 34 4.251 -8.192 0.192 1.00 0.00 H new ATOM 0 HA LYS A 34 4.425 -11.092 0.489 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.233 -9.167 -0.206 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.513 -9.222 1.523 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.923 -10.953 0.859 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.455 -11.869 1.138 1.00 0.00 H new ATOM 0 HD2 LYS A 34 6.791 -12.639 -1.001 1.00 0.00 H new ATOM 0 HD3 LYS A 34 6.066 -11.120 -1.486 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.239 -10.065 -1.760 1.00 0.00 H new ATOM 0 HE3 LYS A 34 9.059 -11.402 -0.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 9.299 -11.499 -3.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.409 -12.836 -2.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.614 -11.540 -3.567 1.00 0.00 H new ATOM 513 N GLN A 35 4.075 -11.277 2.993 1.00 0.00 N ATOM 514 CA GLN A 35 4.198 -11.440 4.432 1.00 0.00 C ATOM 515 C GLN A 35 5.640 -11.149 4.834 1.00 0.00 C ATOM 516 O GLN A 35 6.551 -11.377 4.039 1.00 0.00 O ATOM 517 CB GLN A 35 3.950 -12.892 4.866 1.00 0.00 C ATOM 518 CG GLN A 35 2.541 -13.462 4.683 1.00 0.00 C ATOM 519 CD GLN A 35 2.332 -14.536 5.760 1.00 0.00 C ATOM 520 OE1 GLN A 35 1.472 -14.388 6.624 1.00 0.00 O ATOM 521 NE2 GLN A 35 3.157 -15.576 5.825 1.00 0.00 N ATOM 0 H GLN A 35 3.798 -12.123 2.495 1.00 0.00 H new ATOM 0 HA GLN A 35 3.471 -10.772 4.893 1.00 0.00 H new ATOM 0 HB2 GLN A 35 4.643 -13.529 4.316 1.00 0.00 H new ATOM 0 HB3 GLN A 35 4.210 -12.975 5.921 1.00 0.00 H new ATOM 0 HG2 GLN A 35 1.794 -12.674 4.778 1.00 0.00 H new ATOM 0 HG3 GLN A 35 2.428 -13.891 3.687 1.00 0.00 H new ATOM 0 HE21 GLN A 35 3.873 -15.704 5.110 1.00 0.00 H new ATOM 0 HE22 GLN A 35 3.074 -16.246 6.590 1.00 0.00 H new ATOM 530 N ALA A 36 5.830 -10.882 6.128 1.00 0.00 N ATOM 531 CA ALA A 36 7.105 -10.860 6.819 1.00 0.00 C ATOM 532 C ALA A 36 7.995 -12.048 6.451 1.00 0.00 C ATOM 533 O ALA A 36 9.178 -11.882 6.198 1.00 0.00 O ATOM 534 CB ALA A 36 6.798 -10.849 8.316 1.00 0.00 C ATOM 0 H ALA A 36 5.051 -10.664 6.749 1.00 0.00 H new ATOM 0 HA ALA A 36 7.667 -9.974 6.523 1.00 0.00 H new ATOM 0 HB1 ALA A 36 7.731 -10.832 8.879 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.211 -9.964 8.561 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.232 -11.743 8.578 1.00 0.00 H new ATOM 540 N ASP A 37 7.400 -13.247 6.377 1.00 0.00 N ATOM 541 CA ASP A 37 8.081 -14.527 6.182 1.00 0.00 C ATOM 542 C ASP A 37 8.632 -14.672 4.763 1.00 0.00 C ATOM 543 O ASP A 37 9.438 -15.555 4.480 1.00 0.00 O ATOM 544 CB ASP A 37 7.089 -15.672 6.450 1.00 0.00 C ATOM 545 CG ASP A 37 7.657 -16.731 7.391 1.00 0.00 C ATOM 546 OD1 ASP A 37 8.811 -17.163 7.204 1.00 0.00 O ATOM 547 OD2 ASP A 37 6.939 -17.096 8.355 1.00 0.00 O ATOM 0 H ASP A 37 6.388 -13.352 6.455 1.00 0.00 H new ATOM 0 HA ASP A 37 8.920 -14.567 6.876 1.00 0.00 H new ATOM 0 HB2 ASP A 37 6.174 -15.263 6.879 1.00 0.00 H new ATOM 0 HB3 ASP A 37 6.816 -16.140 5.504 1.00 0.00 H new ATOM 552 N GLY A 38 8.191 -13.811 3.848 1.00 0.00 N ATOM 553 CA GLY A 38 8.513 -13.832 2.434 1.00 0.00 C ATOM 554 C GLY A 38 7.430 -14.513 1.593 1.00 0.00 C ATOM 555 O GLY A 38 7.558 -14.608 0.373 1.00 0.00 O ATOM 0 H GLY A 38 7.567 -13.042 4.092 1.00 0.00 H new ATOM 0 HA2 GLY A 38 8.652 -12.810 2.082 1.00 0.00 H new ATOM 0 HA3 GLY A 38 9.460 -14.351 2.289 1.00 0.00 H new ATOM 559 N THR A 39 6.342 -14.960 2.216 1.00 0.00 N ATOM 560 CA THR A 39 5.164 -15.524 1.581 1.00 0.00 C ATOM 561 C THR A 39 4.410 -14.431 0.826 1.00 0.00 C ATOM 562 O THR A 39 3.794 -13.568 1.452 1.00 0.00 O ATOM 563 CB THR A 39 4.273 -16.104 2.687 1.00 0.00 C ATOM 564 OG1 THR A 39 4.995 -16.878 3.614 1.00 0.00 O ATOM 565 CG2 THR A 39 3.055 -16.851 2.163 1.00 0.00 C ATOM 0 H THR A 39 6.259 -14.935 3.232 1.00 0.00 H new ATOM 0 HA THR A 39 5.446 -16.301 0.870 1.00 0.00 H new ATOM 0 HB THR A 39 3.888 -15.235 3.220 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.380 -17.471 4.095 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.473 -17.232 3.002 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.439 -16.173 1.572 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.380 -17.683 1.538 1.00 0.00 H new ATOM 573 N ALA A 40 4.424 -14.438 -0.503 1.00 0.00 N ATOM 574 CA ALA A 40 3.561 -13.544 -1.261 1.00 0.00 C ATOM 575 C ALA A 40 2.097 -14.004 -1.177 1.00 0.00 C ATOM 576 O ALA A 40 1.806 -15.206 -1.213 1.00 0.00 O ATOM 577 CB ALA A 40 4.061 -13.486 -2.692 1.00 0.00 C ATOM 0 H ALA A 40 5.016 -15.045 -1.070 1.00 0.00 H new ATOM 0 HA ALA A 40 3.596 -12.540 -0.839 1.00 0.00 H new ATOM 0 HB1 ALA A 40 3.424 -12.819 -3.273 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.085 -13.112 -2.705 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.034 -14.485 -3.128 1.00 0.00 H new ATOM 583 N ARG A 41 1.168 -13.053 -1.054 1.00 0.00 N ATOM 584 CA ARG A 41 -0.267 -13.286 -0.862 1.00 0.00 C ATOM 585 C ARG A 41 -1.031 -13.205 -2.181 1.00 0.00 C ATOM 586 O ARG A 41 -0.514 -12.716 -3.192 1.00 0.00 O ATOM 587 CB ARG A 41 -0.785 -12.273 0.178 1.00 0.00 C ATOM 588 CG ARG A 41 -0.532 -12.762 1.618 1.00 0.00 C ATOM 589 CD ARG A 41 -0.609 -11.589 2.609 1.00 0.00 C ATOM 590 NE ARG A 41 -1.448 -11.880 3.784 1.00 0.00 N ATOM 591 CZ ARG A 41 -2.721 -11.519 3.995 1.00 0.00 C ATOM 592 NH1 ARG A 41 -3.363 -10.706 3.158 1.00 0.00 N ATOM 593 NH2 ARG A 41 -3.356 -11.984 5.061 1.00 0.00 N ATOM 0 H ARG A 41 1.403 -12.061 -1.087 1.00 0.00 H new ATOM 0 HA ARG A 41 -0.432 -14.297 -0.489 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -0.293 -11.312 0.027 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.853 -12.112 0.030 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.268 -13.520 1.885 1.00 0.00 H new ATOM 0 HG3 ARG A 41 0.448 -13.234 1.681 1.00 0.00 H new ATOM 0 HD2 ARG A 41 0.397 -11.336 2.942 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -1.005 -10.713 2.096 1.00 0.00 H new ATOM 0 HE ARG A 41 -1.007 -12.422 4.527 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -2.885 -10.343 2.333 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -4.332 -10.447 3.342 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -2.876 -12.609 5.709 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.325 -11.717 5.234 1.00 0.00 H new ATOM 607 N ALA A 42 -2.281 -13.665 -2.191 1.00 0.00 N ATOM 608 CA ALA A 42 -3.168 -13.526 -3.338 1.00 0.00 C ATOM 609 C ALA A 42 -3.861 -12.171 -3.283 1.00 0.00 C ATOM 610 O ALA A 42 -4.814 -12.009 -2.529 1.00 0.00 O ATOM 611 CB ALA A 42 -4.184 -14.675 -3.379 1.00 0.00 C ATOM 0 H ALA A 42 -2.706 -14.146 -1.399 1.00 0.00 H new ATOM 0 HA ALA A 42 -2.582 -13.578 -4.256 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -4.837 -14.553 -4.243 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -3.656 -15.625 -3.455 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -4.782 -14.665 -2.468 1.00 0.00 H new ATOM 617 N VAL A 43 -3.410 -11.215 -4.095 1.00 0.00 N ATOM 618 CA VAL A 43 -4.057 -9.918 -4.252 1.00 0.00 C ATOM 619 C VAL A 43 -4.587 -9.821 -5.691 1.00 0.00 C ATOM 620 O VAL A 43 -4.009 -10.442 -6.591 1.00 0.00 O ATOM 621 CB VAL A 43 -3.092 -8.764 -3.916 1.00 0.00 C ATOM 622 CG1 VAL A 43 -2.540 -8.844 -2.484 1.00 0.00 C ATOM 623 CG2 VAL A 43 -1.887 -8.694 -4.864 1.00 0.00 C ATOM 0 H VAL A 43 -2.574 -11.324 -4.669 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.888 -9.829 -3.552 1.00 0.00 H new ATOM 0 HB VAL A 43 -3.705 -7.870 -4.030 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.867 -8.005 -2.306 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.365 -8.804 -1.773 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -1.996 -9.780 -2.356 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.245 -7.861 -4.576 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -1.323 -9.625 -4.805 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.236 -8.546 -5.886 1.00 0.00 H new ATOM 633 N PRO A 44 -5.693 -9.103 -5.931 1.00 0.00 N ATOM 634 CA PRO A 44 -6.309 -9.007 -7.245 1.00 0.00 C ATOM 635 C PRO A 44 -5.510 -8.051 -8.135 1.00 0.00 C ATOM 636 O PRO A 44 -5.594 -6.831 -7.993 1.00 0.00 O ATOM 637 CB PRO A 44 -7.741 -8.535 -6.991 1.00 0.00 C ATOM 638 CG PRO A 44 -7.591 -7.688 -5.730 1.00 0.00 C ATOM 639 CD PRO A 44 -6.480 -8.389 -4.941 1.00 0.00 C ATOM 0 HA PRO A 44 -6.319 -9.957 -7.780 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -8.131 -7.953 -7.826 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -8.423 -9.372 -6.839 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -7.322 -6.659 -5.970 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -8.521 -7.650 -5.162 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -5.868 -7.668 -4.399 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -6.896 -9.074 -4.202 1.00 0.00 H new ATOM 647 N SER A 45 -4.724 -8.621 -9.039 1.00 0.00 N ATOM 648 CA SER A 45 -4.066 -7.953 -10.141 1.00 0.00 C ATOM 649 C SER A 45 -5.013 -7.184 -11.075 1.00 0.00 C ATOM 650 O SER A 45 -6.231 -7.376 -11.058 1.00 0.00 O ATOM 651 CB SER A 45 -3.266 -9.023 -10.898 1.00 0.00 C ATOM 652 OG SER A 45 -2.858 -10.124 -10.087 1.00 0.00 O ATOM 0 H SER A 45 -4.521 -9.620 -9.016 1.00 0.00 H new ATOM 0 HA SER A 45 -3.416 -7.175 -9.740 1.00 0.00 H new ATOM 0 HB2 SER A 45 -3.871 -9.398 -11.724 1.00 0.00 H new ATOM 0 HB3 SER A 45 -2.382 -8.559 -11.335 1.00 0.00 H new ATOM 0 HG SER A 45 -3.520 -10.844 -10.155 1.00 0.00 H new ATOM 658 N ALA A 46 -4.441 -6.377 -11.969 1.00 0.00 N ATOM 659 CA ALA A 46 -5.181 -5.566 -12.927 1.00 0.00 C ATOM 660 C ALA A 46 -6.112 -6.396 -13.816 1.00 0.00 C ATOM 661 O ALA A 46 -7.222 -5.952 -14.121 1.00 0.00 O ATOM 662 CB ALA A 46 -4.183 -4.751 -13.749 1.00 0.00 C ATOM 0 H ALA A 46 -3.430 -6.269 -12.046 1.00 0.00 H new ATOM 0 HA ALA A 46 -5.840 -4.893 -12.378 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -4.722 -4.138 -14.472 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -3.605 -4.107 -13.086 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.509 -5.426 -14.277 1.00 0.00 H new ATOM 668 N ASP A 47 -5.685 -7.597 -14.215 1.00 0.00 N ATOM 669 CA ASP A 47 -6.487 -8.495 -15.055 1.00 0.00 C ATOM 670 C ASP A 47 -7.526 -9.280 -14.255 1.00 0.00 C ATOM 671 O ASP A 47 -8.429 -9.889 -14.828 1.00 0.00 O ATOM 672 CB ASP A 47 -5.595 -9.521 -15.772 1.00 0.00 C ATOM 673 CG ASP A 47 -4.752 -8.906 -16.874 1.00 0.00 C ATOM 674 OD1 ASP A 47 -5.290 -8.617 -17.967 1.00 0.00 O ATOM 675 OD2 ASP A 47 -3.532 -8.731 -16.642 1.00 0.00 O ATOM 0 H ASP A 47 -4.772 -7.976 -13.965 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.995 -7.848 -15.770 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -4.939 -9.996 -15.043 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.222 -10.305 -16.196 1.00 0.00 H new ATOM 680 N GLN A 48 -7.392 -9.315 -12.929 1.00 0.00 N ATOM 681 CA GLN A 48 -8.220 -10.166 -12.084 1.00 0.00 C ATOM 682 C GLN A 48 -9.646 -9.618 -11.960 1.00 0.00 C ATOM 683 O GLN A 48 -10.570 -10.400 -11.716 1.00 0.00 O ATOM 684 CB GLN A 48 -7.546 -10.382 -10.720 1.00 0.00 C ATOM 685 CG GLN A 48 -6.381 -11.378 -10.790 1.00 0.00 C ATOM 686 CD GLN A 48 -6.813 -12.801 -11.144 1.00 0.00 C ATOM 687 OE1 GLN A 48 -7.776 -13.331 -10.589 1.00 0.00 O ATOM 688 NE2 GLN A 48 -6.138 -13.447 -12.081 1.00 0.00 N ATOM 0 H GLN A 48 -6.710 -8.757 -12.416 1.00 0.00 H new ATOM 0 HA GLN A 48 -8.313 -11.143 -12.558 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -7.180 -9.426 -10.344 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -8.286 -10.743 -10.006 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.661 -11.031 -11.531 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -5.867 -11.392 -9.829 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -5.342 -13.000 -12.535 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.414 -14.392 -12.349 1.00 0.00 H new ATOM 697 N GLY A 49 -9.862 -8.317 -12.179 1.00 0.00 N ATOM 698 CA GLY A 49 -11.166 -7.797 -12.573 1.00 0.00 C ATOM 699 C GLY A 49 -11.581 -6.499 -11.896 1.00 0.00 C ATOM 700 O GLY A 49 -12.276 -5.691 -12.522 1.00 0.00 O ATOM 0 H GLY A 49 -9.140 -7.602 -12.088 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -11.165 -7.641 -13.652 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -11.920 -8.555 -12.361 1.00 0.00 H new ATOM 704 N ALA A 50 -11.162 -6.291 -10.655 1.00 0.00 N ATOM 705 CA ALA A 50 -11.316 -5.050 -9.909 1.00 0.00 C ATOM 706 C ALA A 50 -10.069 -4.900 -9.031 1.00 0.00 C ATOM 707 O ALA A 50 -10.075 -5.387 -7.898 1.00 0.00 O ATOM 708 CB ALA A 50 -12.613 -5.064 -9.089 1.00 0.00 C ATOM 0 H ALA A 50 -10.685 -7.015 -10.118 1.00 0.00 H new ATOM 0 HA ALA A 50 -11.399 -4.193 -10.577 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -12.707 -4.127 -8.540 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -13.465 -5.179 -9.758 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -12.589 -5.896 -8.385 1.00 0.00 H new ATOM 714 N PRO A 51 -8.970 -4.334 -9.561 1.00 0.00 N ATOM 715 CA PRO A 51 -7.738 -4.185 -8.804 1.00 0.00 C ATOM 716 C PRO A 51 -7.908 -3.183 -7.662 1.00 0.00 C ATOM 717 O PRO A 51 -8.837 -2.368 -7.639 1.00 0.00 O ATOM 718 CB PRO A 51 -6.682 -3.728 -9.812 1.00 0.00 C ATOM 719 CG PRO A 51 -7.508 -3.002 -10.868 1.00 0.00 C ATOM 720 CD PRO A 51 -8.807 -3.802 -10.905 1.00 0.00 C ATOM 0 HA PRO A 51 -7.443 -5.121 -8.329 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -5.944 -3.069 -9.353 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.137 -4.571 -10.236 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -7.684 -1.961 -10.596 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -7.009 -2.999 -11.837 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -9.650 -3.170 -11.182 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -8.754 -4.604 -11.641 1.00 0.00 H new ATOM 728 N ILE A 52 -6.982 -3.252 -6.711 1.00 0.00 N ATOM 729 CA ILE A 52 -6.985 -2.452 -5.500 1.00 0.00 C ATOM 730 C ILE A 52 -6.491 -1.047 -5.829 1.00 0.00 C ATOM 731 O ILE A 52 -5.295 -0.868 -6.043 1.00 0.00 O ATOM 732 CB ILE A 52 -6.136 -3.177 -4.434 1.00 0.00 C ATOM 733 CG1 ILE A 52 -6.942 -4.415 -3.998 1.00 0.00 C ATOM 734 CG2 ILE A 52 -5.767 -2.280 -3.232 1.00 0.00 C ATOM 735 CD1 ILE A 52 -6.289 -5.282 -2.927 1.00 0.00 C ATOM 0 H ILE A 52 -6.186 -3.887 -6.768 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.988 -2.338 -5.088 1.00 0.00 H new ATOM 0 HB ILE A 52 -5.174 -3.461 -4.861 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -7.913 -4.083 -3.630 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -7.129 -5.033 -4.876 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.171 -2.852 -2.521 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.192 -1.422 -3.581 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -6.678 -1.932 -2.744 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -6.940 -6.125 -2.694 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -5.332 -5.653 -3.293 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.128 -4.689 -2.027 1.00 0.00 H new ATOM 747 N THR A 53 -7.372 -0.051 -5.856 1.00 0.00 N ATOM 748 CA THR A 53 -7.000 1.345 -6.068 1.00 0.00 C ATOM 749 C THR A 53 -6.943 2.076 -4.715 1.00 0.00 C ATOM 750 O THR A 53 -7.588 1.671 -3.740 1.00 0.00 O ATOM 751 CB THR A 53 -8.033 2.005 -7.006 1.00 0.00 C ATOM 752 OG1 THR A 53 -9.368 1.825 -6.550 1.00 0.00 O ATOM 753 CG2 THR A 53 -7.935 1.475 -8.440 1.00 0.00 C ATOM 0 H THR A 53 -8.374 -0.192 -5.730 1.00 0.00 H new ATOM 0 HA THR A 53 -6.015 1.404 -6.531 1.00 0.00 H new ATOM 0 HB THR A 53 -7.790 3.068 -6.997 1.00 0.00 H new ATOM 0 HG1 THR A 53 -9.988 2.260 -7.172 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.681 1.969 -9.062 1.00 0.00 H new ATOM 0 HG22 THR A 53 -6.940 1.679 -8.836 1.00 0.00 H new ATOM 0 HG23 THR A 53 -8.114 0.400 -8.444 1.00 0.00 H new ATOM 761 N LEU A 54 -6.224 3.198 -4.664 1.00 0.00 N ATOM 762 CA LEU A 54 -6.240 4.214 -3.617 1.00 0.00 C ATOM 763 C LEU A 54 -6.154 5.562 -4.322 1.00 0.00 C ATOM 764 O LEU A 54 -5.388 5.726 -5.274 1.00 0.00 O ATOM 765 CB LEU A 54 -5.015 4.033 -2.698 1.00 0.00 C ATOM 766 CG LEU A 54 -4.667 5.227 -1.773 1.00 0.00 C ATOM 767 CD1 LEU A 54 -5.781 5.579 -0.780 1.00 0.00 C ATOM 768 CD2 LEU A 54 -3.378 4.955 -0.981 1.00 0.00 C ATOM 0 H LEU A 54 -5.568 3.435 -5.409 1.00 0.00 H new ATOM 0 HA LEU A 54 -7.140 4.140 -3.007 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.182 3.155 -2.074 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.147 3.820 -3.323 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.534 6.076 -2.443 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.468 6.423 -0.166 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.686 5.844 -1.327 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.983 4.720 -0.140 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.158 5.809 -0.340 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.510 4.065 -0.366 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.551 4.798 -1.674 1.00 0.00 H new ATOM 780 N THR A 55 -6.860 6.571 -3.838 1.00 0.00 N ATOM 781 CA THR A 55 -6.534 7.952 -4.141 1.00 0.00 C ATOM 782 C THR A 55 -6.587 8.746 -2.846 1.00 0.00 C ATOM 783 O THR A 55 -7.377 8.449 -1.943 1.00 0.00 O ATOM 784 CB THR A 55 -7.462 8.478 -5.239 1.00 0.00 C ATOM 785 OG1 THR A 55 -7.321 7.658 -6.391 1.00 0.00 O ATOM 786 CG2 THR A 55 -7.156 9.928 -5.625 1.00 0.00 C ATOM 0 H THR A 55 -7.670 6.456 -3.228 1.00 0.00 H new ATOM 0 HA THR A 55 -5.525 8.052 -4.541 1.00 0.00 H new ATOM 0 HB THR A 55 -8.480 8.449 -4.851 1.00 0.00 H new ATOM 0 HG1 THR A 55 -7.913 7.986 -7.100 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.844 10.249 -6.407 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.274 10.570 -4.752 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.132 9.999 -5.991 1.00 0.00 H new ATOM 794 N LEU A 56 -5.699 9.730 -2.776 1.00 0.00 N ATOM 795 CA LEU A 56 -5.522 10.641 -1.657 1.00 0.00 C ATOM 796 C LEU A 56 -5.822 12.006 -2.253 1.00 0.00 C ATOM 797 O LEU A 56 -5.152 12.379 -3.214 1.00 0.00 O ATOM 798 CB LEU A 56 -4.075 10.550 -1.116 1.00 0.00 C ATOM 799 CG LEU A 56 -3.647 9.129 -0.689 1.00 0.00 C ATOM 800 CD1 LEU A 56 -2.128 9.010 -0.549 1.00 0.00 C ATOM 801 CD2 LEU A 56 -4.308 8.731 0.632 1.00 0.00 C ATOM 0 H LEU A 56 -5.050 9.922 -3.539 1.00 0.00 H new ATOM 0 HA LEU A 56 -6.167 10.418 -0.807 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.389 10.909 -1.883 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.976 11.219 -0.261 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.976 8.452 -1.477 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.869 7.995 -0.247 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -1.656 9.236 -1.505 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.776 9.714 0.205 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -3.990 7.726 0.910 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.014 9.433 1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.392 8.749 0.517 1.00 0.00 H new ATOM 813 N SER A 57 -6.859 12.695 -1.775 1.00 0.00 N ATOM 814 CA SER A 57 -7.144 14.080 -2.119 1.00 0.00 C ATOM 815 C SER A 57 -8.137 14.642 -1.085 1.00 0.00 C ATOM 816 O SER A 57 -8.591 13.932 -0.180 1.00 0.00 O ATOM 817 CB SER A 57 -7.690 14.163 -3.560 1.00 0.00 C ATOM 818 OG SER A 57 -7.595 15.483 -4.070 1.00 0.00 O ATOM 0 H SER A 57 -7.535 12.294 -1.125 1.00 0.00 H new ATOM 0 HA SER A 57 -6.236 14.683 -2.090 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.133 13.481 -4.203 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.730 13.838 -3.577 1.00 0.00 H new ATOM 0 HG SER A 57 -7.946 15.506 -4.985 1.00 0.00 H new ATOM 824 N THR A 58 -8.505 15.918 -1.214 1.00 0.00 N ATOM 825 CA THR A 58 -9.109 16.710 -0.143 1.00 0.00 C ATOM 826 C THR A 58 -10.543 17.182 -0.453 1.00 0.00 C ATOM 827 O THR A 58 -11.060 18.072 0.226 1.00 0.00 O ATOM 828 CB THR A 58 -8.135 17.834 0.245 1.00 0.00 C ATOM 829 OG1 THR A 58 -7.805 18.611 -0.886 1.00 0.00 O ATOM 830 CG2 THR A 58 -6.823 17.290 0.826 1.00 0.00 C ATOM 0 H THR A 58 -8.389 16.439 -2.083 1.00 0.00 H new ATOM 0 HA THR A 58 -9.258 16.074 0.730 1.00 0.00 H new ATOM 0 HB THR A 58 -8.644 18.433 1.000 1.00 0.00 H new ATOM 0 HG1 THR A 58 -7.186 19.324 -0.624 1.00 0.00 H new ATOM 0 HG21 THR A 58 -6.167 18.121 1.085 1.00 0.00 H new ATOM 0 HG22 THR A 58 -7.036 16.704 1.720 1.00 0.00 H new ATOM 0 HG23 THR A 58 -6.332 16.658 0.086 1.00 0.00 H new ATOM 838 N SER A 59 -11.224 16.593 -1.444 1.00 0.00 N ATOM 839 CA SER A 59 -12.586 16.945 -1.845 1.00 0.00 C ATOM 840 C SER A 59 -13.628 16.981 -0.712 1.00 0.00 C ATOM 841 O SER A 59 -14.528 17.824 -0.774 1.00 0.00 O ATOM 842 CB SER A 59 -13.058 15.995 -2.949 1.00 0.00 C ATOM 843 OG SER A 59 -12.548 16.403 -4.198 1.00 0.00 O ATOM 0 H SER A 59 -10.829 15.837 -2.003 1.00 0.00 H new ATOM 0 HA SER A 59 -12.520 17.974 -2.200 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.729 14.979 -2.729 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.147 15.978 -2.982 1.00 0.00 H new ATOM 0 HG SER A 59 -12.856 15.786 -4.894 1.00 0.00 H new ATOM 849 N THR A 60 -13.544 16.154 0.338 1.00 0.00 N ATOM 850 CA THR A 60 -14.505 16.265 1.442 1.00 0.00 C ATOM 851 C THR A 60 -14.354 17.592 2.201 1.00 0.00 C ATOM 852 O THR A 60 -15.291 18.028 2.866 1.00 0.00 O ATOM 853 CB THR A 60 -14.390 15.088 2.420 1.00 0.00 C ATOM 854 OG1 THR A 60 -13.107 15.040 2.997 1.00 0.00 O ATOM 855 CG2 THR A 60 -14.659 13.730 1.775 1.00 0.00 C ATOM 0 H THR A 60 -12.843 15.421 0.446 1.00 0.00 H new ATOM 0 HA THR A 60 -15.496 16.240 0.988 1.00 0.00 H new ATOM 0 HB THR A 60 -15.156 15.269 3.174 1.00 0.00 H new ATOM 0 HG1 THR A 60 -13.188 14.886 3.962 1.00 0.00 H new ATOM 0 HG21 THR A 60 -14.560 12.945 2.525 1.00 0.00 H new ATOM 0 HG22 THR A 60 -15.669 13.715 1.365 1.00 0.00 H new ATOM 0 HG23 THR A 60 -13.940 13.559 0.974 1.00 0.00 H new ATOM 863 N GLY A 61 -13.182 18.222 2.100 1.00 0.00 N ATOM 864 CA GLY A 61 -12.682 19.239 3.006 1.00 0.00 C ATOM 865 C GLY A 61 -11.739 18.630 4.049 1.00 0.00 C ATOM 866 O GLY A 61 -11.222 19.355 4.897 1.00 0.00 O ATOM 0 H GLY A 61 -12.528 18.021 1.343 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -12.156 20.008 2.440 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -13.518 19.727 3.507 1.00 0.00 H new ATOM 870 N GLN A 62 -11.494 17.314 4.016 1.00 0.00 N ATOM 871 CA GLN A 62 -10.491 16.635 4.821 1.00 0.00 C ATOM 872 C GLN A 62 -9.647 15.722 3.933 1.00 0.00 C ATOM 873 O GLN A 62 -10.032 15.395 2.806 1.00 0.00 O ATOM 874 CB GLN A 62 -11.110 15.808 5.951 1.00 0.00 C ATOM 875 CG GLN A 62 -12.295 16.468 6.660 1.00 0.00 C ATOM 876 CD GLN A 62 -13.613 16.217 5.934 1.00 0.00 C ATOM 877 OE1 GLN A 62 -13.938 15.078 5.592 1.00 0.00 O ATOM 878 NE2 GLN A 62 -14.364 17.260 5.623 1.00 0.00 N ATOM 0 H GLN A 62 -12.009 16.679 3.406 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.869 17.405 5.277 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -11.436 14.851 5.544 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.337 15.594 6.689 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -12.365 16.087 7.679 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -12.121 17.542 6.733 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -14.082 18.196 5.913 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -15.226 17.128 5.093 1.00 0.00 H new ATOM 887 N ARG A 63 -8.538 15.236 4.489 1.00 0.00 N ATOM 888 CA ARG A 63 -7.633 14.238 3.912 1.00 0.00 C ATOM 889 C ARG A 63 -8.369 12.902 3.952 1.00 0.00 C ATOM 890 O ARG A 63 -8.206 12.118 4.885 1.00 0.00 O ATOM 891 CB ARG A 63 -6.273 14.167 4.659 1.00 0.00 C ATOM 892 CG ARG A 63 -5.913 15.448 5.396 1.00 0.00 C ATOM 893 CD ARG A 63 -4.631 15.365 6.230 1.00 0.00 C ATOM 894 NE ARG A 63 -3.404 15.347 5.417 1.00 0.00 N ATOM 895 CZ ARG A 63 -2.212 15.799 5.821 1.00 0.00 C ATOM 896 NH1 ARG A 63 -1.988 16.145 7.087 1.00 0.00 N ATOM 897 NH2 ARG A 63 -1.224 15.881 4.949 1.00 0.00 N ATOM 0 H ARG A 63 -8.227 15.546 5.410 1.00 0.00 H new ATOM 0 HA ARG A 63 -7.378 14.511 2.888 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.303 13.344 5.373 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.486 13.938 3.941 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.806 16.252 4.668 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.740 15.719 6.052 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.594 16.215 6.911 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.664 14.465 6.845 1.00 0.00 H new ATOM 0 HE ARG A 63 -3.468 14.961 4.475 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -2.736 16.068 7.777 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -1.069 16.487 7.367 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -1.375 15.601 3.980 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -0.310 16.224 5.245 1.00 0.00 H new ATOM 911 N HIS A 64 -9.250 12.697 2.985 1.00 0.00 N ATOM 912 CA HIS A 64 -10.100 11.518 2.848 1.00 0.00 C ATOM 913 C HIS A 64 -9.576 10.659 1.718 1.00 0.00 C ATOM 914 O HIS A 64 -9.585 11.039 0.545 1.00 0.00 O ATOM 915 CB HIS A 64 -11.567 11.882 2.625 1.00 0.00 C ATOM 916 CG HIS A 64 -12.554 10.930 3.233 1.00 0.00 C ATOM 917 ND1 HIS A 64 -13.525 10.219 2.562 1.00 0.00 N ATOM 918 CD2 HIS A 64 -12.762 10.766 4.572 1.00 0.00 C ATOM 919 CE1 HIS A 64 -14.314 9.648 3.485 1.00 0.00 C ATOM 920 NE2 HIS A 64 -13.878 9.939 4.722 1.00 0.00 N ATOM 0 H HIS A 64 -9.401 13.377 2.240 1.00 0.00 H new ATOM 0 HA HIS A 64 -10.063 10.959 3.783 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -11.745 12.877 3.033 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -11.753 11.939 1.553 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -12.173 11.196 5.368 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -15.179 9.040 3.264 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -14.284 9.618 5.601 1.00 0.00 H new ATOM 928 N ALA A 65 -9.086 9.497 2.101 1.00 0.00 N ATOM 929 CA ALA A 65 -8.755 8.439 1.170 1.00 0.00 C ATOM 930 C ALA A 65 -10.070 7.872 0.643 1.00 0.00 C ATOM 931 O ALA A 65 -11.071 7.820 1.366 1.00 0.00 O ATOM 932 CB ALA A 65 -7.934 7.349 1.872 1.00 0.00 C ATOM 0 H ALA A 65 -8.905 9.259 3.076 1.00 0.00 H new ATOM 0 HA ALA A 65 -8.150 8.821 0.348 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -7.692 6.560 1.160 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -7.012 7.782 2.261 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -8.514 6.930 2.695 1.00 0.00 H new ATOM 938 N SER A 66 -10.049 7.381 -0.587 1.00 0.00 N ATOM 939 CA SER A 66 -11.107 6.566 -1.157 1.00 0.00 C ATOM 940 C SER A 66 -10.450 5.551 -2.088 1.00 0.00 C ATOM 941 O SER A 66 -9.371 5.800 -2.636 1.00 0.00 O ATOM 942 CB SER A 66 -12.147 7.461 -1.856 1.00 0.00 C ATOM 943 OG SER A 66 -11.578 8.594 -2.498 1.00 0.00 O ATOM 0 H SER A 66 -9.275 7.543 -1.231 1.00 0.00 H new ATOM 0 HA SER A 66 -11.659 6.021 -0.391 1.00 0.00 H new ATOM 0 HB2 SER A 66 -12.688 6.868 -2.594 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.878 7.798 -1.121 1.00 0.00 H new ATOM 0 HG SER A 66 -12.287 9.120 -2.923 1.00 0.00 H new ATOM 949 N GLY A 67 -11.090 4.400 -2.267 1.00 0.00 N ATOM 950 CA GLY A 67 -10.537 3.346 -3.087 1.00 0.00 C ATOM 951 C GLY A 67 -11.425 2.112 -3.061 1.00 0.00 C ATOM 952 O GLY A 67 -12.564 2.138 -2.575 1.00 0.00 O ATOM 0 H GLY A 67 -11.995 4.180 -1.851 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -10.428 3.698 -4.113 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -9.540 3.088 -2.730 1.00 0.00 H new ATOM 956 N PHE A 68 -10.882 1.026 -3.591 1.00 0.00 N ATOM 957 CA PHE A 68 -11.438 -0.312 -3.560 1.00 0.00 C ATOM 958 C PHE A 68 -10.263 -1.171 -3.102 1.00 0.00 C ATOM 959 O PHE A 68 -9.190 -1.042 -3.691 1.00 0.00 O ATOM 960 CB PHE A 68 -11.917 -0.688 -4.975 1.00 0.00 C ATOM 961 CG PHE A 68 -13.052 -1.683 -5.131 1.00 0.00 C ATOM 962 CD1 PHE A 68 -14.381 -1.230 -5.232 1.00 0.00 C ATOM 963 CD2 PHE A 68 -12.769 -3.042 -5.365 1.00 0.00 C ATOM 964 CE1 PHE A 68 -15.432 -2.138 -5.458 1.00 0.00 C ATOM 965 CE2 PHE A 68 -13.815 -3.940 -5.647 1.00 0.00 C ATOM 966 CZ PHE A 68 -15.150 -3.501 -5.643 1.00 0.00 C ATOM 0 H PHE A 68 -9.989 1.061 -4.082 1.00 0.00 H new ATOM 0 HA PHE A 68 -12.301 -0.431 -2.905 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -12.216 0.233 -5.476 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -11.058 -1.082 -5.519 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -14.596 -0.176 -5.135 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.749 -3.395 -5.328 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.453 -1.787 -5.489 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -13.590 -4.973 -5.868 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.955 -4.208 -5.781 1.00 0.00 H new ATOM 976 N SER A 69 -10.424 -2.009 -2.079 1.00 0.00 N ATOM 977 CA SER A 69 -9.360 -2.875 -1.580 1.00 0.00 C ATOM 978 C SER A 69 -9.696 -4.373 -1.663 1.00 0.00 C ATOM 979 O SER A 69 -8.952 -5.202 -1.135 1.00 0.00 O ATOM 980 CB SER A 69 -8.865 -2.410 -0.213 1.00 0.00 C ATOM 981 OG SER A 69 -8.179 -1.186 -0.369 1.00 0.00 O ATOM 0 H SER A 69 -11.303 -2.106 -1.571 1.00 0.00 H new ATOM 0 HA SER A 69 -8.514 -2.771 -2.259 1.00 0.00 H new ATOM 0 HB2 SER A 69 -9.705 -2.287 0.471 1.00 0.00 H new ATOM 0 HB3 SER A 69 -8.205 -3.159 0.224 1.00 0.00 H new ATOM 0 HG SER A 69 -8.819 -0.445 -0.325 1.00 0.00 H new ATOM 987 N GLY A 70 -10.771 -4.740 -2.364 1.00 0.00 N ATOM 988 CA GLY A 70 -11.067 -6.113 -2.731 1.00 0.00 C ATOM 989 C GLY A 70 -12.477 -6.266 -3.295 1.00 0.00 C ATOM 990 O GLY A 70 -12.602 -6.664 -4.451 1.00 0.00 O ATOM 0 H GLY A 70 -11.469 -4.074 -2.695 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -10.342 -6.454 -3.470 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -10.956 -6.754 -1.856 1.00 0.00 H new ATOM 994 N CYS A 71 -13.535 -5.993 -2.518 1.00 0.00 N ATOM 995 CA CYS A 71 -14.943 -6.050 -2.967 1.00 0.00 C ATOM 996 C CYS A 71 -15.931 -5.393 -1.989 1.00 0.00 C ATOM 997 O CYS A 71 -17.141 -5.539 -2.102 1.00 0.00 O ATOM 998 CB CYS A 71 -15.385 -7.491 -3.272 1.00 0.00 C ATOM 999 SG CYS A 71 -16.900 -7.639 -4.256 1.00 0.00 S ATOM 0 H CYS A 71 -13.439 -5.721 -1.540 1.00 0.00 H new ATOM 0 HA CYS A 71 -14.970 -5.465 -3.887 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -14.577 -7.998 -3.799 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -15.530 -8.017 -2.329 1.00 0.00 H new ATOM 1004 N ASN A 72 -15.467 -4.680 -0.977 1.00 0.00 N ATOM 1005 CA ASN A 72 -16.318 -3.907 -0.068 1.00 0.00 C ATOM 1006 C ASN A 72 -16.128 -2.407 -0.212 1.00 0.00 C ATOM 1007 O ASN A 72 -16.913 -1.631 0.334 1.00 0.00 O ATOM 1008 CB ASN A 72 -16.117 -4.384 1.383 1.00 0.00 C ATOM 1009 CG ASN A 72 -16.890 -5.652 1.741 1.00 0.00 C ATOM 1010 OD1 ASN A 72 -16.956 -6.043 2.901 1.00 0.00 O ATOM 1011 ND2 ASN A 72 -17.491 -6.326 0.768 1.00 0.00 N ATOM 0 H ASN A 72 -14.474 -4.616 -0.754 1.00 0.00 H new ATOM 0 HA ASN A 72 -17.354 -4.094 -0.349 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -15.055 -4.561 1.551 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -16.418 -3.585 2.061 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -18.012 -7.176 0.983 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -17.431 -5.994 -0.195 1.00 0.00 H new ATOM 1018 N ARG A 73 -15.132 -2.007 -1.001 1.00 0.00 N ATOM 1019 CA ARG A 73 -14.539 -0.699 -1.071 1.00 0.00 C ATOM 1020 C ARG A 73 -14.275 -0.089 0.300 1.00 0.00 C ATOM 1021 O ARG A 73 -14.521 -0.663 1.362 1.00 0.00 O ATOM 1022 CB ARG A 73 -15.204 0.216 -2.109 1.00 0.00 C ATOM 1023 CG ARG A 73 -16.652 -0.084 -2.498 1.00 0.00 C ATOM 1024 CD ARG A 73 -17.208 0.911 -3.525 1.00 0.00 C ATOM 1025 NE ARG A 73 -17.099 2.311 -3.073 1.00 0.00 N ATOM 1026 CZ ARG A 73 -18.015 3.052 -2.448 1.00 0.00 C ATOM 1027 NH1 ARG A 73 -19.252 2.609 -2.276 1.00 0.00 N ATOM 1028 NH2 ARG A 73 -17.677 4.247 -1.980 1.00 0.00 N ATOM 0 H ARG A 73 -14.692 -2.653 -1.657 1.00 0.00 H new ATOM 0 HA ARG A 73 -13.536 -0.828 -1.477 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -15.163 1.237 -1.731 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -14.600 0.188 -3.016 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -16.713 -1.093 -2.906 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -17.276 -0.064 -1.604 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -16.671 0.794 -4.467 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -18.254 0.677 -3.723 1.00 0.00 H new ATOM 0 HE ARG A 73 -16.209 2.771 -3.263 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -19.517 1.687 -2.624 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -19.939 3.190 -1.796 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -16.724 4.591 -2.100 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -18.370 4.822 -1.501 1.00 0.00 H new ATOM 1042 N TYR A 74 -13.723 1.112 0.261 1.00 0.00 N ATOM 1043 CA TYR A 74 -13.459 1.861 1.470 1.00 0.00 C ATOM 1044 C TYR A 74 -13.288 3.342 1.185 1.00 0.00 C ATOM 1045 O TYR A 74 -13.122 3.789 0.046 1.00 0.00 O ATOM 1046 CB TYR A 74 -12.215 1.316 2.182 1.00 0.00 C ATOM 1047 CG TYR A 74 -10.921 1.724 1.506 1.00 0.00 C ATOM 1048 CD1 TYR A 74 -10.563 1.170 0.256 1.00 0.00 C ATOM 1049 CD2 TYR A 74 -10.076 2.675 2.124 1.00 0.00 C ATOM 1050 CE1 TYR A 74 -9.406 1.612 -0.399 1.00 0.00 C ATOM 1051 CE2 TYR A 74 -8.915 3.112 1.464 1.00 0.00 C ATOM 1052 CZ TYR A 74 -8.578 2.584 0.199 1.00 0.00 C ATOM 1053 OH TYR A 74 -7.415 2.943 -0.393 1.00 0.00 O ATOM 0 H TYR A 74 -13.450 1.587 -0.599 1.00 0.00 H new ATOM 0 HA TYR A 74 -14.324 1.741 2.122 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -12.208 1.671 3.213 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -12.272 0.228 2.220 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -11.181 0.407 -0.194 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -10.322 3.064 3.101 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -9.147 1.206 -1.366 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -8.279 3.853 1.925 1.00 0.00 H new ATOM 0 HH TYR A 74 -6.668 2.753 0.212 1.00 0.00 H new ATOM 1063 N MET A 75 -13.323 4.091 2.277 1.00 0.00 N ATOM 1064 CA MET A 75 -13.061 5.507 2.392 1.00 0.00 C ATOM 1065 C MET A 75 -12.672 5.758 3.855 1.00 0.00 C ATOM 1066 O MET A 75 -12.846 4.865 4.693 1.00 0.00 O ATOM 1067 CB MET A 75 -14.311 6.289 1.944 1.00 0.00 C ATOM 1068 CG MET A 75 -15.597 5.852 2.683 1.00 0.00 C ATOM 1069 SD MET A 75 -17.032 5.459 1.646 1.00 0.00 S ATOM 1070 CE MET A 75 -16.560 3.822 1.024 1.00 0.00 C ATOM 0 H MET A 75 -13.557 3.681 3.181 1.00 0.00 H new ATOM 0 HA MET A 75 -12.248 5.847 1.751 1.00 0.00 H new ATOM 0 HB2 MET A 75 -14.146 7.353 2.112 1.00 0.00 H new ATOM 0 HB3 MET A 75 -14.452 6.154 0.872 1.00 0.00 H new ATOM 0 HG2 MET A 75 -15.362 4.976 3.287 1.00 0.00 H new ATOM 0 HG3 MET A 75 -15.882 6.647 3.372 1.00 0.00 H new ATOM 0 HE1 MET A 75 -17.452 3.281 0.708 1.00 0.00 H new ATOM 0 HE2 MET A 75 -15.886 3.936 0.175 1.00 0.00 H new ATOM 0 HE3 MET A 75 -16.058 3.263 1.814 1.00 0.00 H new ATOM 1080 N GLY A 76 -12.152 6.944 4.171 1.00 0.00 N ATOM 1081 CA GLY A 76 -11.834 7.371 5.533 1.00 0.00 C ATOM 1082 C GLY A 76 -10.568 8.225 5.554 1.00 0.00 C ATOM 1083 O GLY A 76 -9.945 8.449 4.518 1.00 0.00 O ATOM 0 H GLY A 76 -11.935 7.652 3.469 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.668 7.940 5.944 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.699 6.497 6.170 1.00 0.00 H new ATOM 1087 N SER A 77 -10.204 8.755 6.719 1.00 0.00 N ATOM 1088 CA SER A 77 -9.203 9.808 6.841 1.00 0.00 C ATOM 1089 C SER A 77 -7.762 9.289 6.764 1.00 0.00 C ATOM 1090 O SER A 77 -7.510 8.099 6.982 1.00 0.00 O ATOM 1091 CB SER A 77 -9.419 10.563 8.153 1.00 0.00 C ATOM 1092 OG SER A 77 -10.722 11.117 8.179 1.00 0.00 O ATOM 0 H SER A 77 -10.600 8.462 7.612 1.00 0.00 H new ATOM 0 HA SER A 77 -9.335 10.475 5.989 1.00 0.00 H new ATOM 0 HB2 SER A 77 -9.284 9.888 8.998 1.00 0.00 H new ATOM 0 HB3 SER A 77 -8.676 11.354 8.255 1.00 0.00 H new ATOM 0 HG SER A 77 -10.856 11.598 9.022 1.00 0.00 H new ATOM 1098 N TYR A 78 -6.809 10.204 6.545 1.00 0.00 N ATOM 1099 CA TYR A 78 -5.374 9.947 6.638 1.00 0.00 C ATOM 1100 C TYR A 78 -4.625 11.144 7.239 1.00 0.00 C ATOM 1101 O TYR A 78 -5.241 12.152 7.597 1.00 0.00 O ATOM 1102 CB TYR A 78 -4.819 9.502 5.274 1.00 0.00 C ATOM 1103 CG TYR A 78 -4.940 10.484 4.123 1.00 0.00 C ATOM 1104 CD1 TYR A 78 -6.082 10.444 3.307 1.00 0.00 C ATOM 1105 CD2 TYR A 78 -3.902 11.390 3.822 1.00 0.00 C ATOM 1106 CE1 TYR A 78 -6.205 11.322 2.219 1.00 0.00 C ATOM 1107 CE2 TYR A 78 -4.026 12.278 2.737 1.00 0.00 C ATOM 1108 CZ TYR A 78 -5.198 12.264 1.944 1.00 0.00 C ATOM 1109 OH TYR A 78 -5.445 13.179 0.968 1.00 0.00 O ATOM 0 H TYR A 78 -7.025 11.168 6.292 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.209 9.121 7.330 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.764 9.259 5.401 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -5.326 8.581 4.987 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -6.869 9.735 3.517 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -3.007 11.403 4.427 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -7.080 11.274 1.588 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -3.228 12.969 2.510 1.00 0.00 H new ATOM 0 HH TYR A 78 -4.610 13.395 0.503 1.00 0.00 H new ATOM 1119 N ALA A 79 -3.308 11.025 7.444 1.00 0.00 N ATOM 1120 CA ALA A 79 -2.415 12.115 7.844 1.00 0.00 C ATOM 1121 C ALA A 79 -0.974 11.781 7.473 1.00 0.00 C ATOM 1122 O ALA A 79 -0.615 10.604 7.363 1.00 0.00 O ATOM 1123 CB ALA A 79 -2.477 12.343 9.361 1.00 0.00 C ATOM 0 H ALA A 79 -2.820 10.137 7.332 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.741 13.015 7.323 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -1.806 13.157 9.634 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.496 12.601 9.649 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -2.173 11.433 9.878 1.00 0.00 H new ATOM 1129 N LEU A 80 -0.140 12.818 7.379 1.00 0.00 N ATOM 1130 CA LEU A 80 1.261 12.741 6.987 1.00 0.00 C ATOM 1131 C LEU A 80 2.109 13.337 8.088 1.00 0.00 C ATOM 1132 O LEU A 80 1.814 14.428 8.574 1.00 0.00 O ATOM 1133 CB LEU A 80 1.515 13.518 5.692 1.00 0.00 C ATOM 1134 CG LEU A 80 0.710 12.997 4.498 1.00 0.00 C ATOM 1135 CD1 LEU A 80 1.103 13.793 3.265 1.00 0.00 C ATOM 1136 CD2 LEU A 80 0.961 11.509 4.263 1.00 0.00 C ATOM 0 H LEU A 80 -0.438 13.772 7.583 1.00 0.00 H new ATOM 0 HA LEU A 80 1.519 11.695 6.821 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.271 14.568 5.854 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.577 13.471 5.452 1.00 0.00 H new ATOM 0 HG LEU A 80 -0.353 13.120 4.706 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.538 13.434 2.405 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.884 14.848 3.428 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.169 13.669 3.076 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.374 11.172 3.409 1.00 0.00 H new ATOM 0 HD22 LEU A 80 2.020 11.346 4.063 1.00 0.00 H new ATOM 0 HD23 LEU A 80 0.668 10.946 5.149 1.00 0.00 H new ATOM 1148 N LYS A 81 3.115 12.574 8.509 1.00 0.00 N ATOM 1149 CA LYS A 81 3.992 12.793 9.649 1.00 0.00 C ATOM 1150 C LYS A 81 4.907 11.586 9.749 1.00 0.00 C ATOM 1151 O LYS A 81 4.613 10.559 9.138 1.00 0.00 O ATOM 1152 CB LYS A 81 3.144 12.886 10.924 1.00 0.00 C ATOM 1153 CG LYS A 81 2.239 11.656 11.160 1.00 0.00 C ATOM 1154 CD LYS A 81 1.057 12.009 12.057 1.00 0.00 C ATOM 1155 CE LYS A 81 1.517 12.150 13.510 1.00 0.00 C ATOM 1156 NZ LYS A 81 0.458 12.706 14.370 1.00 0.00 N ATOM 0 H LYS A 81 3.355 11.714 8.017 1.00 0.00 H new ATOM 0 HA LYS A 81 4.566 13.712 9.531 1.00 0.00 H new ATOM 0 HB2 LYS A 81 3.806 13.009 11.781 1.00 0.00 H new ATOM 0 HB3 LYS A 81 2.521 13.779 10.871 1.00 0.00 H new ATOM 0 HG2 LYS A 81 1.875 11.280 10.204 1.00 0.00 H new ATOM 0 HG3 LYS A 81 2.820 10.855 11.617 1.00 0.00 H new ATOM 0 HD2 LYS A 81 0.602 12.940 11.720 1.00 0.00 H new ATOM 0 HD3 LYS A 81 0.292 11.236 11.984 1.00 0.00 H new ATOM 0 HE2 LYS A 81 1.820 11.175 13.891 1.00 0.00 H new ATOM 0 HE3 LYS A 81 2.395 12.795 13.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 0.809 12.786 15.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 0.187 13.648 14.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -0.371 12.078 14.351 1.00 0.00 H new ATOM 1170 N ASP A 82 5.912 11.643 10.619 1.00 0.00 N ATOM 1171 CA ASP A 82 6.575 10.450 11.145 1.00 0.00 C ATOM 1172 C ASP A 82 7.190 9.552 10.057 1.00 0.00 C ATOM 1173 O ASP A 82 7.337 8.343 10.241 1.00 0.00 O ATOM 1174 CB ASP A 82 5.582 9.714 12.064 1.00 0.00 C ATOM 1175 CG ASP A 82 6.219 8.683 12.990 1.00 0.00 C ATOM 1176 OD1 ASP A 82 7.411 8.835 13.356 1.00 0.00 O ATOM 1177 OD2 ASP A 82 5.460 7.786 13.429 1.00 0.00 O ATOM 0 H ASP A 82 6.291 12.518 10.980 1.00 0.00 H new ATOM 0 HA ASP A 82 7.443 10.755 11.729 1.00 0.00 H new ATOM 0 HB2 ASP A 82 5.054 10.450 12.670 1.00 0.00 H new ATOM 0 HB3 ASP A 82 4.836 9.216 11.445 1.00 0.00 H new ATOM 1182 N GLY A 83 7.507 10.127 8.891 1.00 0.00 N ATOM 1183 CA GLY A 83 8.026 9.418 7.732 1.00 0.00 C ATOM 1184 C GLY A 83 6.996 8.527 7.035 1.00 0.00 C ATOM 1185 O GLY A 83 7.378 7.807 6.110 1.00 0.00 O ATOM 0 H GLY A 83 7.404 11.129 8.731 1.00 0.00 H new ATOM 0 HA2 GLY A 83 8.407 10.145 7.015 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.871 8.804 8.043 1.00 0.00 H new ATOM 1189 N LYS A 84 5.719 8.546 7.437 1.00 0.00 N ATOM 1190 CA LYS A 84 4.688 7.624 6.968 1.00 0.00 C ATOM 1191 C LYS A 84 3.414 8.354 6.540 1.00 0.00 C ATOM 1192 O LYS A 84 3.249 9.554 6.790 1.00 0.00 O ATOM 1193 CB LYS A 84 4.477 6.510 8.001 1.00 0.00 C ATOM 1194 CG LYS A 84 3.815 6.903 9.328 1.00 0.00 C ATOM 1195 CD LYS A 84 4.368 6.000 10.439 1.00 0.00 C ATOM 1196 CE LYS A 84 3.477 5.945 11.678 1.00 0.00 C ATOM 1197 NZ LYS A 84 4.232 5.416 12.830 1.00 0.00 N ATOM 0 H LYS A 84 5.370 9.223 8.115 1.00 0.00 H new ATOM 0 HA LYS A 84 5.026 7.135 6.054 1.00 0.00 H new ATOM 0 HB2 LYS A 84 3.871 5.730 7.539 1.00 0.00 H new ATOM 0 HB3 LYS A 84 5.448 6.068 8.225 1.00 0.00 H new ATOM 0 HG2 LYS A 84 4.017 7.950 9.556 1.00 0.00 H new ATOM 0 HG3 LYS A 84 2.733 6.795 9.257 1.00 0.00 H new ATOM 0 HD2 LYS A 84 4.495 4.991 10.047 1.00 0.00 H new ATOM 0 HD3 LYS A 84 5.357 6.356 10.728 1.00 0.00 H new ATOM 0 HE2 LYS A 84 3.101 6.942 11.908 1.00 0.00 H new ATOM 0 HE3 LYS A 84 2.610 5.314 11.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 3.583 5.257 13.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 4.683 4.517 12.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.963 6.101 13.110 1.00 0.00 H new ATOM 1211 N LEU A 85 2.525 7.615 5.881 1.00 0.00 N ATOM 1212 CA LEU A 85 1.114 7.947 5.660 1.00 0.00 C ATOM 1213 C LEU A 85 0.339 7.108 6.671 1.00 0.00 C ATOM 1214 O LEU A 85 0.341 5.882 6.572 1.00 0.00 O ATOM 1215 CB LEU A 85 0.707 7.649 4.197 1.00 0.00 C ATOM 1216 CG LEU A 85 -0.798 7.543 3.887 1.00 0.00 C ATOM 1217 CD1 LEU A 85 -1.497 8.895 3.929 1.00 0.00 C ATOM 1218 CD2 LEU A 85 -0.979 6.954 2.482 1.00 0.00 C ATOM 0 H LEU A 85 2.780 6.720 5.463 1.00 0.00 H new ATOM 0 HA LEU A 85 0.905 9.007 5.804 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.127 8.431 3.565 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.179 6.712 3.900 1.00 0.00 H new ATOM 0 HG LEU A 85 -1.243 6.906 4.651 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.555 8.765 3.704 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -1.389 9.330 4.923 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.048 9.560 3.191 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.042 6.876 2.255 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.498 7.604 1.750 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.525 5.964 2.441 1.00 0.00 H new ATOM 1230 N SER A 86 -0.238 7.746 7.689 1.00 0.00 N ATOM 1231 CA SER A 86 -1.120 7.079 8.648 1.00 0.00 C ATOM 1232 C SER A 86 -2.564 7.176 8.138 1.00 0.00 C ATOM 1233 O SER A 86 -2.871 8.087 7.368 1.00 0.00 O ATOM 1234 CB SER A 86 -1.000 7.762 10.015 1.00 0.00 C ATOM 1235 OG SER A 86 0.358 8.031 10.343 1.00 0.00 O ATOM 0 H SER A 86 -0.107 8.741 7.873 1.00 0.00 H new ATOM 0 HA SER A 86 -0.837 6.031 8.752 1.00 0.00 H new ATOM 0 HB2 SER A 86 -1.566 8.694 10.009 1.00 0.00 H new ATOM 0 HB3 SER A 86 -1.442 7.126 10.782 1.00 0.00 H new ATOM 0 HG SER A 86 0.403 8.468 11.219 1.00 0.00 H new ATOM 1241 N PHE A 87 -3.459 6.307 8.611 1.00 0.00 N ATOM 1242 CA PHE A 87 -4.879 6.299 8.250 1.00 0.00 C ATOM 1243 C PHE A 87 -5.741 6.497 9.499 1.00 0.00 C ATOM 1244 O PHE A 87 -5.221 6.670 10.600 1.00 0.00 O ATOM 1245 CB PHE A 87 -5.242 5.021 7.478 1.00 0.00 C ATOM 1246 CG PHE A 87 -4.685 4.980 6.070 1.00 0.00 C ATOM 1247 CD1 PHE A 87 -3.378 4.520 5.820 1.00 0.00 C ATOM 1248 CD2 PHE A 87 -5.479 5.433 5.001 1.00 0.00 C ATOM 1249 CE1 PHE A 87 -2.870 4.521 4.507 1.00 0.00 C ATOM 1250 CE2 PHE A 87 -4.988 5.392 3.688 1.00 0.00 C ATOM 1251 CZ PHE A 87 -3.686 4.927 3.435 1.00 0.00 C ATOM 0 H PHE A 87 -3.211 5.571 9.272 1.00 0.00 H new ATOM 0 HA PHE A 87 -5.082 7.134 7.579 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.873 4.157 8.030 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -6.327 4.931 7.432 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -2.765 4.166 6.636 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.471 5.814 5.192 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -1.852 4.210 4.322 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -5.612 5.719 2.869 1.00 0.00 H new ATOM 0 HZ PHE A 87 -3.314 4.882 2.422 1.00 0.00 H new ATOM 1261 N GLY A 88 -7.062 6.536 9.330 1.00 0.00 N ATOM 1262 CA GLY A 88 -8.025 6.613 10.414 1.00 0.00 C ATOM 1263 C GLY A 88 -8.642 5.248 10.669 1.00 0.00 C ATOM 1264 O GLY A 88 -7.975 4.339 11.154 1.00 0.00 O ATOM 0 H GLY A 88 -7.498 6.514 8.408 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -7.536 6.973 11.319 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.806 7.332 10.166 1.00 0.00 H new ATOM 1268 N THR A 89 -9.928 5.139 10.365 1.00 0.00 N ATOM 1269 CA THR A 89 -10.864 4.131 10.795 1.00 0.00 C ATOM 1270 C THR A 89 -11.781 3.896 9.597 1.00 0.00 C ATOM 1271 O THR A 89 -12.927 4.346 9.537 1.00 0.00 O ATOM 1272 CB THR A 89 -11.513 4.687 12.074 1.00 0.00 C ATOM 1273 OG1 THR A 89 -12.489 3.822 12.622 1.00 0.00 O ATOM 1274 CG2 THR A 89 -12.125 6.091 11.994 1.00 0.00 C ATOM 0 H THR A 89 -10.375 5.822 9.754 1.00 0.00 H new ATOM 0 HA THR A 89 -10.462 3.155 11.066 1.00 0.00 H new ATOM 0 HB THR A 89 -10.641 4.762 12.723 1.00 0.00 H new ATOM 0 HG1 THR A 89 -12.866 4.225 13.432 1.00 0.00 H new ATOM 0 HG21 THR A 89 -12.547 6.360 12.962 1.00 0.00 H new ATOM 0 HG22 THR A 89 -11.352 6.810 11.723 1.00 0.00 H new ATOM 0 HG23 THR A 89 -12.911 6.103 11.239 1.00 0.00 H new ATOM 1282 N LEU A 90 -11.196 3.335 8.540 1.00 0.00 N ATOM 1283 CA LEU A 90 -11.820 3.185 7.263 1.00 0.00 C ATOM 1284 C LEU A 90 -12.956 2.184 7.327 1.00 0.00 C ATOM 1285 O LEU A 90 -12.990 1.302 8.189 1.00 0.00 O ATOM 1286 CB LEU A 90 -10.737 2.640 6.342 1.00 0.00 C ATOM 1287 CG LEU A 90 -9.395 3.366 6.375 1.00 0.00 C ATOM 1288 CD1 LEU A 90 -9.441 4.887 6.368 1.00 0.00 C ATOM 1289 CD2 LEU A 90 -8.429 2.733 7.346 1.00 0.00 C ATOM 0 H LEU A 90 -10.245 2.967 8.568 1.00 0.00 H new ATOM 0 HA LEU A 90 -12.233 4.133 6.920 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.567 1.594 6.596 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -11.114 2.663 5.319 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.964 3.199 5.388 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.425 5.282 6.394 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -9.942 5.232 5.463 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -9.989 5.238 7.242 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.488 3.284 7.335 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.853 2.759 8.350 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -8.247 1.698 7.056 1.00 0.00 H new ATOM 1301 N GLY A 91 -13.797 2.223 6.307 1.00 0.00 N ATOM 1302 CA GLY A 91 -14.760 1.164 6.078 1.00 0.00 C ATOM 1303 C GLY A 91 -15.527 1.408 4.791 1.00 0.00 C ATOM 1304 O GLY A 91 -15.414 2.479 4.181 1.00 0.00 O ATOM 0 H GLY A 91 -13.831 2.980 5.624 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -14.247 0.204 6.025 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -15.454 1.109 6.917 1.00 0.00 H new ATOM 1308 N GLY A 92 -16.336 0.432 4.394 1.00 0.00 N ATOM 1309 CA GLY A 92 -17.110 0.457 3.168 1.00 0.00 C ATOM 1310 C GLY A 92 -18.462 -0.225 3.380 1.00 0.00 C ATOM 1311 O GLY A 92 -19.154 0.038 4.368 1.00 0.00 O ATOM 0 H GLY A 92 -16.472 -0.422 4.936 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -17.261 1.487 2.846 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -16.561 -0.048 2.373 1.00 0.00 H new ATOM 1315 N THR A 93 -18.850 -1.082 2.438 1.00 0.00 N ATOM 1316 CA THR A 93 -20.126 -1.795 2.405 1.00 0.00 C ATOM 1317 C THR A 93 -19.917 -3.257 2.839 1.00 0.00 C ATOM 1318 O THR A 93 -18.892 -3.587 3.435 1.00 0.00 O ATOM 1319 CB THR A 93 -20.736 -1.638 0.999 1.00 0.00 C ATOM 1320 OG1 THR A 93 -19.866 -2.163 0.027 1.00 0.00 O ATOM 1321 CG2 THR A 93 -20.965 -0.174 0.617 1.00 0.00 C ATOM 0 H THR A 93 -18.256 -1.309 1.640 1.00 0.00 H new ATOM 0 HA THR A 93 -20.840 -1.375 3.114 1.00 0.00 H new ATOM 0 HB THR A 93 -21.688 -2.168 1.030 1.00 0.00 H new ATOM 0 HG1 THR A 93 -19.615 -1.456 -0.604 1.00 0.00 H new ATOM 0 HG21 THR A 93 -21.396 -0.122 -0.383 1.00 0.00 H new ATOM 0 HG22 THR A 93 -21.648 0.286 1.331 1.00 0.00 H new ATOM 0 HG23 THR A 93 -20.014 0.359 0.630 1.00 0.00 H new ATOM 1329 N ARG A 94 -20.908 -4.134 2.644 1.00 0.00 N ATOM 1330 CA ARG A 94 -20.863 -5.560 2.944 1.00 0.00 C ATOM 1331 C ARG A 94 -21.295 -6.352 1.715 1.00 0.00 C ATOM 1332 O ARG A 94 -22.389 -6.922 1.695 1.00 0.00 O ATOM 1333 CB ARG A 94 -21.772 -5.869 4.145 1.00 0.00 C ATOM 1334 CG ARG A 94 -21.266 -5.281 5.459 1.00 0.00 C ATOM 1335 CD ARG A 94 -21.732 -3.855 5.744 1.00 0.00 C ATOM 1336 NE ARG A 94 -21.173 -3.365 7.005 1.00 0.00 N ATOM 1337 CZ ARG A 94 -19.983 -2.782 7.178 1.00 0.00 C ATOM 1338 NH1 ARG A 94 -19.089 -2.716 6.191 1.00 0.00 N ATOM 1339 NH2 ARG A 94 -19.705 -2.262 8.365 1.00 0.00 N ATOM 0 H ARG A 94 -21.806 -3.849 2.253 1.00 0.00 H new ATOM 0 HA ARG A 94 -19.845 -5.850 3.204 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -22.771 -5.482 3.944 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -21.865 -6.950 4.252 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -21.590 -5.924 6.277 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -20.176 -5.298 5.452 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -21.429 -3.199 4.928 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -22.821 -3.826 5.789 1.00 0.00 H new ATOM 0 HE ARG A 94 -21.751 -3.480 7.837 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -19.307 -3.116 5.278 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -18.188 -2.265 6.349 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -20.392 -2.313 9.118 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -18.804 -1.811 8.526 1.00 0.00 H new ATOM 1353 N MET A 95 -20.500 -6.330 0.647 1.00 0.00 N ATOM 1354 CA MET A 95 -20.840 -6.987 -0.619 1.00 0.00 C ATOM 1355 C MET A 95 -20.084 -8.310 -0.716 1.00 0.00 C ATOM 1356 O MET A 95 -19.041 -8.472 -0.079 1.00 0.00 O ATOM 1357 CB MET A 95 -20.536 -6.059 -1.807 1.00 0.00 C ATOM 1358 CG MET A 95 -21.204 -4.688 -1.626 1.00 0.00 C ATOM 1359 SD MET A 95 -21.008 -3.426 -2.926 1.00 0.00 S ATOM 1360 CE MET A 95 -19.203 -3.200 -3.019 1.00 0.00 C ATOM 0 H MET A 95 -19.598 -5.855 0.633 1.00 0.00 H new ATOM 0 HA MET A 95 -21.908 -7.201 -0.651 1.00 0.00 H new ATOM 0 HB2 MET A 95 -19.458 -5.931 -1.905 1.00 0.00 H new ATOM 0 HB3 MET A 95 -20.888 -6.519 -2.730 1.00 0.00 H new ATOM 0 HG2 MET A 95 -22.272 -4.858 -1.492 1.00 0.00 H new ATOM 0 HG3 MET A 95 -20.830 -4.261 -0.695 1.00 0.00 H new ATOM 0 HE1 MET A 95 -18.980 -2.220 -3.442 1.00 0.00 H new ATOM 0 HE2 MET A 95 -18.776 -3.269 -2.019 1.00 0.00 H new ATOM 0 HE3 MET A 95 -18.771 -3.975 -3.652 1.00 0.00 H new ATOM 1370 N ALA A 96 -20.575 -9.251 -1.520 1.00 0.00 N ATOM 1371 CA ALA A 96 -20.067 -10.610 -1.586 1.00 0.00 C ATOM 1372 C ALA A 96 -19.568 -10.875 -3.000 1.00 0.00 C ATOM 1373 O ALA A 96 -20.324 -10.785 -3.967 1.00 0.00 O ATOM 1374 CB ALA A 96 -21.167 -11.582 -1.168 1.00 0.00 C ATOM 0 H ALA A 96 -21.354 -9.081 -2.156 1.00 0.00 H new ATOM 0 HA ALA A 96 -19.231 -10.750 -0.900 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -20.788 -12.603 -1.217 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -21.481 -11.360 -0.148 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -22.019 -11.479 -1.840 1.00 0.00 H new ATOM 1380 N CYS A 97 -18.279 -11.169 -3.141 1.00 0.00 N ATOM 1381 CA CYS A 97 -17.659 -11.491 -4.431 1.00 0.00 C ATOM 1382 C CYS A 97 -17.409 -12.996 -4.651 1.00 0.00 C ATOM 1383 O CYS A 97 -17.251 -13.420 -5.798 1.00 0.00 O ATOM 1384 CB CYS A 97 -16.321 -10.734 -4.522 1.00 0.00 C ATOM 1385 SG CYS A 97 -16.297 -9.350 -5.698 1.00 0.00 S ATOM 0 H CYS A 97 -17.626 -11.192 -2.358 1.00 0.00 H new ATOM 0 HA CYS A 97 -18.358 -11.186 -5.210 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -16.068 -10.354 -3.532 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -15.540 -11.441 -4.801 1.00 0.00 H new ATOM 1390 N MET A 98 -17.315 -13.787 -3.579 1.00 0.00 N ATOM 1391 CA MET A 98 -16.868 -15.184 -3.594 1.00 0.00 C ATOM 1392 C MET A 98 -15.557 -15.446 -4.346 1.00 0.00 C ATOM 1393 O MET A 98 -15.364 -16.545 -4.870 1.00 0.00 O ATOM 1394 CB MET A 98 -17.991 -16.171 -3.962 1.00 0.00 C ATOM 1395 CG MET A 98 -18.587 -16.069 -5.364 1.00 0.00 C ATOM 1396 SD MET A 98 -19.776 -17.386 -5.761 1.00 0.00 S ATOM 1397 CE MET A 98 -21.216 -16.789 -4.832 1.00 0.00 C ATOM 0 H MET A 98 -17.556 -13.461 -2.643 1.00 0.00 H new ATOM 0 HA MET A 98 -16.609 -15.387 -2.555 1.00 0.00 H new ATOM 0 HB2 MET A 98 -17.606 -17.182 -3.833 1.00 0.00 H new ATOM 0 HB3 MET A 98 -18.800 -16.044 -3.242 1.00 0.00 H new ATOM 0 HG2 MET A 98 -19.082 -15.104 -5.468 1.00 0.00 H new ATOM 0 HG3 MET A 98 -17.778 -16.092 -6.094 1.00 0.00 H new ATOM 0 HE1 MET A 98 -21.593 -17.587 -4.192 1.00 0.00 H new ATOM 0 HE2 MET A 98 -20.925 -15.938 -4.217 1.00 0.00 H new ATOM 0 HE3 MET A 98 -21.997 -16.483 -5.528 1.00 0.00 H new ATOM 1407 N THR A 99 -14.642 -14.480 -4.357 1.00 0.00 N ATOM 1408 CA THR A 99 -13.312 -14.576 -4.960 1.00 0.00 C ATOM 1409 C THR A 99 -12.285 -14.283 -3.859 1.00 0.00 C ATOM 1410 O THR A 99 -12.649 -13.650 -2.863 1.00 0.00 O ATOM 1411 CB THR A 99 -13.196 -13.566 -6.118 1.00 0.00 C ATOM 1412 OG1 THR A 99 -13.341 -12.258 -5.608 1.00 0.00 O ATOM 1413 CG2 THR A 99 -14.230 -13.793 -7.223 1.00 0.00 C ATOM 0 H THR A 99 -14.813 -13.570 -3.928 1.00 0.00 H new ATOM 0 HA THR A 99 -13.133 -15.569 -5.372 1.00 0.00 H new ATOM 0 HB THR A 99 -12.213 -13.708 -6.568 1.00 0.00 H new ATOM 0 HG1 THR A 99 -13.266 -11.611 -6.340 1.00 0.00 H new ATOM 0 HG21 THR A 99 -14.094 -13.049 -8.007 1.00 0.00 H new ATOM 0 HG22 THR A 99 -14.101 -14.791 -7.643 1.00 0.00 H new ATOM 0 HG23 THR A 99 -15.233 -13.702 -6.807 1.00 0.00 H new ATOM 1421 N PRO A 100 -11.003 -14.668 -4.005 1.00 0.00 N ATOM 1422 CA PRO A 100 -9.998 -14.392 -2.984 1.00 0.00 C ATOM 1423 C PRO A 100 -9.704 -12.894 -2.872 1.00 0.00 C ATOM 1424 O PRO A 100 -9.599 -12.377 -1.762 1.00 0.00 O ATOM 1425 CB PRO A 100 -8.756 -15.194 -3.380 1.00 0.00 C ATOM 1426 CG PRO A 100 -8.905 -15.343 -4.892 1.00 0.00 C ATOM 1427 CD PRO A 100 -10.418 -15.426 -5.101 1.00 0.00 C ATOM 0 HA PRO A 100 -10.349 -14.688 -1.996 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -7.837 -14.670 -3.116 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -8.726 -16.163 -2.881 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -8.474 -14.494 -5.422 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -8.401 -16.237 -5.258 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -10.705 -15.007 -6.065 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -10.760 -16.461 -5.089 1.00 0.00 H new ATOM 1435 N GLY A 101 -9.601 -12.177 -3.999 1.00 0.00 N ATOM 1436 CA GLY A 101 -9.373 -10.740 -3.964 1.00 0.00 C ATOM 1437 C GLY A 101 -10.572 -10.013 -3.384 1.00 0.00 C ATOM 1438 O GLY A 101 -10.381 -9.019 -2.701 1.00 0.00 O ATOM 0 H GLY A 101 -9.672 -12.572 -4.937 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -8.488 -10.523 -3.366 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.174 -10.375 -4.972 1.00 0.00 H new ATOM 1442 N GLY A 102 -11.799 -10.511 -3.555 1.00 0.00 N ATOM 1443 CA GLY A 102 -12.940 -9.909 -2.888 1.00 0.00 C ATOM 1444 C GLY A 102 -12.930 -10.113 -1.375 1.00 0.00 C ATOM 1445 O GLY A 102 -13.632 -9.401 -0.659 1.00 0.00 O ATOM 0 H GLY A 102 -12.019 -11.316 -4.141 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.956 -8.841 -3.104 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -13.857 -10.331 -3.299 1.00 0.00 H new ATOM 1449 N GLN A 103 -12.143 -11.058 -0.865 1.00 0.00 N ATOM 1450 CA GLN A 103 -12.141 -11.442 0.541 1.00 0.00 C ATOM 1451 C GLN A 103 -11.000 -10.784 1.324 1.00 0.00 C ATOM 1452 O GLN A 103 -11.001 -10.825 2.558 1.00 0.00 O ATOM 1453 CB GLN A 103 -12.116 -12.954 0.632 1.00 0.00 C ATOM 1454 CG GLN A 103 -13.472 -13.463 0.132 1.00 0.00 C ATOM 1455 CD GLN A 103 -14.550 -13.497 1.205 1.00 0.00 C ATOM 1456 OE1 GLN A 103 -15.195 -12.488 1.493 1.00 0.00 O ATOM 1457 NE2 GLN A 103 -14.752 -14.654 1.807 1.00 0.00 N ATOM 0 H GLN A 103 -11.478 -11.587 -1.429 1.00 0.00 H new ATOM 0 HA GLN A 103 -13.053 -11.076 1.013 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -11.306 -13.362 0.028 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -11.940 -13.274 1.659 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -13.808 -12.828 -0.687 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -13.345 -14.467 -0.274 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -14.199 -15.470 1.543 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -15.461 -14.733 2.536 1.00 0.00 H new ATOM 1466 N ILE A 104 -10.041 -10.178 0.618 1.00 0.00 N ATOM 1467 CA ILE A 104 -8.838 -9.608 1.214 1.00 0.00 C ATOM 1468 C ILE A 104 -9.050 -8.208 1.798 1.00 0.00 C ATOM 1469 O ILE A 104 -8.216 -7.756 2.585 1.00 0.00 O ATOM 1470 CB ILE A 104 -7.685 -9.654 0.189 1.00 0.00 C ATOM 1471 CG1 ILE A 104 -6.325 -9.632 0.915 1.00 0.00 C ATOM 1472 CG2 ILE A 104 -7.770 -8.501 -0.831 1.00 0.00 C ATOM 1473 CD1 ILE A 104 -5.186 -10.054 -0.008 1.00 0.00 C ATOM 0 H ILE A 104 -10.083 -10.070 -0.395 1.00 0.00 H new ATOM 0 HA ILE A 104 -8.569 -10.222 2.074 1.00 0.00 H new ATOM 0 HB ILE A 104 -7.779 -10.586 -0.368 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -6.132 -8.629 1.296 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -6.361 -10.299 1.776 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -6.939 -8.574 -1.532 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -8.712 -8.566 -1.376 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -7.720 -7.547 -0.307 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.244 -10.026 0.540 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.366 -11.067 -0.368 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.133 -9.371 -0.856 1.00 0.00 H new ATOM 1485 N GLU A 105 -10.140 -7.517 1.443 1.00 0.00 N ATOM 1486 CA GLU A 105 -10.352 -6.134 1.870 1.00 0.00 C ATOM 1487 C GLU A 105 -10.350 -6.037 3.400 1.00 0.00 C ATOM 1488 O GLU A 105 -9.745 -5.124 3.964 1.00 0.00 O ATOM 1489 CB GLU A 105 -11.637 -5.582 1.232 1.00 0.00 C ATOM 1490 CG GLU A 105 -11.822 -4.067 1.470 1.00 0.00 C ATOM 1491 CD GLU A 105 -12.324 -3.292 0.240 1.00 0.00 C ATOM 1492 OE1 GLU A 105 -12.914 -3.892 -0.688 1.00 0.00 O ATOM 1493 OE2 GLU A 105 -12.053 -2.079 0.139 1.00 0.00 O ATOM 0 H GLU A 105 -10.887 -7.895 0.861 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.529 -5.510 1.523 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -11.617 -5.777 0.160 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -12.496 -6.116 1.637 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -12.527 -3.923 2.289 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.871 -3.642 1.790 1.00 0.00 H new ATOM 1500 N GLY A 106 -10.919 -7.036 4.078 1.00 0.00 N ATOM 1501 CA GLY A 106 -10.917 -7.112 5.526 1.00 0.00 C ATOM 1502 C GLY A 106 -9.522 -7.298 6.124 1.00 0.00 C ATOM 1503 O GLY A 106 -9.296 -6.845 7.248 1.00 0.00 O ATOM 0 H GLY A 106 -11.396 -7.817 3.627 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -11.359 -6.201 5.931 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.552 -7.941 5.840 1.00 0.00 H new ATOM 1507 N ALA A 107 -8.568 -7.925 5.422 1.00 0.00 N ATOM 1508 CA ALA A 107 -7.187 -7.993 5.893 1.00 0.00 C ATOM 1509 C ALA A 107 -6.493 -6.647 5.686 1.00 0.00 C ATOM 1510 O ALA A 107 -5.670 -6.244 6.508 1.00 0.00 O ATOM 1511 CB ALA A 107 -6.414 -9.096 5.160 1.00 0.00 C ATOM 0 H ALA A 107 -8.731 -8.390 4.529 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.201 -8.229 6.957 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.388 -9.127 5.528 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -6.894 -10.058 5.340 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -6.410 -8.888 4.090 1.00 0.00 H new ATOM 1517 N TYR A 108 -6.792 -5.973 4.573 1.00 0.00 N ATOM 1518 CA TYR A 108 -6.145 -4.735 4.159 1.00 0.00 C ATOM 1519 C TYR A 108 -6.576 -3.569 5.063 1.00 0.00 C ATOM 1520 O TYR A 108 -5.729 -2.824 5.548 1.00 0.00 O ATOM 1521 CB TYR A 108 -6.463 -4.514 2.674 1.00 0.00 C ATOM 1522 CG TYR A 108 -5.772 -3.328 2.037 1.00 0.00 C ATOM 1523 CD1 TYR A 108 -6.317 -2.052 2.230 1.00 0.00 C ATOM 1524 CD2 TYR A 108 -4.631 -3.482 1.223 1.00 0.00 C ATOM 1525 CE1 TYR A 108 -5.765 -0.935 1.590 1.00 0.00 C ATOM 1526 CE2 TYR A 108 -4.082 -2.366 0.561 1.00 0.00 C ATOM 1527 CZ TYR A 108 -4.676 -1.094 0.721 1.00 0.00 C ATOM 1528 OH TYR A 108 -4.245 -0.014 0.022 1.00 0.00 O ATOM 0 H TYR A 108 -7.511 -6.285 3.920 1.00 0.00 H new ATOM 0 HA TYR A 108 -5.062 -4.796 4.270 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -6.189 -5.413 2.122 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -7.540 -4.389 2.564 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -7.171 -1.928 2.879 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -4.178 -4.455 1.107 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -6.178 0.048 1.766 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -3.211 -2.482 -0.066 1.00 0.00 H new ATOM 0 HH TYR A 108 -3.300 -0.131 -0.211 1.00 0.00 H new ATOM 1538 N LEU A 109 -7.868 -3.434 5.388 1.00 0.00 N ATOM 1539 CA LEU A 109 -8.346 -2.444 6.371 1.00 0.00 C ATOM 1540 C LEU A 109 -7.733 -2.689 7.746 1.00 0.00 C ATOM 1541 O LEU A 109 -7.563 -1.741 8.508 1.00 0.00 O ATOM 1542 CB LEU A 109 -9.887 -2.495 6.468 1.00 0.00 C ATOM 1543 CG LEU A 109 -10.587 -1.431 5.620 1.00 0.00 C ATOM 1544 CD1 LEU A 109 -10.124 -1.395 4.172 1.00 0.00 C ATOM 1545 CD2 LEU A 109 -12.092 -1.664 5.659 1.00 0.00 C ATOM 0 H LEU A 109 -8.611 -4.003 4.981 1.00 0.00 H new ATOM 0 HA LEU A 109 -8.036 -1.456 6.031 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.230 -3.481 6.156 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.182 -2.370 7.510 1.00 0.00 H new ATOM 0 HG LEU A 109 -10.323 -0.467 6.055 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.666 -0.616 3.636 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.055 -1.184 4.137 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -10.319 -2.360 3.704 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -12.593 -0.907 5.056 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -12.317 -2.653 5.261 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -12.444 -1.598 6.689 1.00 0.00 H new ATOM 1557 N ASN A 110 -7.386 -3.940 8.053 1.00 0.00 N ATOM 1558 CA ASN A 110 -6.678 -4.289 9.284 1.00 0.00 C ATOM 1559 C ASN A 110 -5.181 -3.988 9.223 1.00 0.00 C ATOM 1560 O ASN A 110 -4.528 -3.973 10.265 1.00 0.00 O ATOM 1561 CB ASN A 110 -6.834 -5.786 9.588 1.00 0.00 C ATOM 1562 CG ASN A 110 -7.184 -6.015 11.049 1.00 0.00 C ATOM 1563 OD1 ASN A 110 -8.219 -6.605 11.355 1.00 0.00 O ATOM 1564 ND2 ASN A 110 -6.355 -5.525 11.960 1.00 0.00 N ATOM 0 H ASN A 110 -7.589 -4.740 7.454 1.00 0.00 H new ATOM 0 HA ASN A 110 -7.127 -3.674 10.064 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -7.613 -6.210 8.954 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -5.908 -6.307 9.347 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -6.567 -5.632 12.952 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -5.505 -5.041 11.669 1.00 0.00 H new ATOM 1571 N ALA A 111 -4.619 -3.866 8.022 1.00 0.00 N ATOM 1572 CA ALA A 111 -3.216 -3.556 7.772 1.00 0.00 C ATOM 1573 C ALA A 111 -2.990 -2.048 7.872 1.00 0.00 C ATOM 1574 O ALA A 111 -1.994 -1.611 8.443 1.00 0.00 O ATOM 1575 CB ALA A 111 -2.835 -4.081 6.386 1.00 0.00 C ATOM 0 H ALA A 111 -5.153 -3.986 7.161 1.00 0.00 H new ATOM 0 HA ALA A 111 -2.585 -4.038 8.519 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -1.787 -3.855 6.187 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -2.987 -5.160 6.351 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -3.459 -3.602 5.631 1.00 0.00 H new ATOM 1581 N LEU A 112 -3.968 -1.274 7.391 1.00 0.00 N ATOM 1582 CA LEU A 112 -4.017 0.186 7.358 1.00 0.00 C ATOM 1583 C LEU A 112 -3.775 0.864 8.714 1.00 0.00 C ATOM 1584 O LEU A 112 -3.546 2.071 8.742 1.00 0.00 O ATOM 1585 CB LEU A 112 -5.392 0.615 6.795 1.00 0.00 C ATOM 1586 CG LEU A 112 -5.463 1.193 5.362 1.00 0.00 C ATOM 1587 CD1 LEU A 112 -4.266 0.926 4.436 1.00 0.00 C ATOM 1588 CD2 LEU A 112 -6.726 0.698 4.652 1.00 0.00 C ATOM 0 H LEU A 112 -4.808 -1.686 6.985 1.00 0.00 H new ATOM 0 HA LEU A 112 -3.196 0.515 6.721 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.050 -0.253 6.834 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -5.808 1.361 7.473 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.463 2.269 5.535 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -4.447 1.386 3.465 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -3.364 1.351 4.876 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -4.137 -0.149 4.309 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -6.763 1.112 3.645 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -6.709 -0.390 4.596 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.606 1.019 5.209 1.00 0.00 H new ATOM 1600 N THR A 113 -3.823 0.123 9.819 1.00 0.00 N ATOM 1601 CA THR A 113 -3.682 0.618 11.180 1.00 0.00 C ATOM 1602 C THR A 113 -2.424 0.088 11.887 1.00 0.00 C ATOM 1603 O THR A 113 -2.153 0.498 13.016 1.00 0.00 O ATOM 1604 CB THR A 113 -4.972 0.277 11.941 1.00 0.00 C ATOM 1605 OG1 THR A 113 -5.394 -1.042 11.621 1.00 0.00 O ATOM 1606 CG2 THR A 113 -6.092 1.259 11.576 1.00 0.00 C ATOM 0 H THR A 113 -3.968 -0.886 9.784 1.00 0.00 H new ATOM 0 HA THR A 113 -3.541 1.699 11.156 1.00 0.00 H new ATOM 0 HB THR A 113 -4.763 0.350 13.008 1.00 0.00 H new ATOM 0 HG1 THR A 113 -6.216 -1.251 12.112 1.00 0.00 H new ATOM 0 HG21 THR A 113 -6.997 1.000 12.126 1.00 0.00 H new ATOM 0 HG22 THR A 113 -5.787 2.272 11.837 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.290 1.204 10.505 1.00 0.00 H new ATOM 1614 N HIS A 114 -1.603 -0.746 11.239 1.00 0.00 N ATOM 1615 CA HIS A 114 -0.303 -1.181 11.755 1.00 0.00 C ATOM 1616 C HIS A 114 0.831 -0.560 10.916 1.00 0.00 C ATOM 1617 O HIS A 114 1.849 -1.213 10.675 1.00 0.00 O ATOM 1618 CB HIS A 114 -0.232 -2.720 11.829 1.00 0.00 C ATOM 1619 CG HIS A 114 -1.005 -3.357 12.959 1.00 0.00 C ATOM 1620 ND1 HIS A 114 -0.491 -3.771 14.171 1.00 0.00 N ATOM 1621 CD2 HIS A 114 -2.306 -3.773 12.905 1.00 0.00 C ATOM 1622 CE1 HIS A 114 -1.444 -4.477 14.800 1.00 0.00 C ATOM 1623 NE2 HIS A 114 -2.579 -4.495 14.074 1.00 0.00 N ATOM 0 H HIS A 114 -1.828 -1.143 10.327 1.00 0.00 H new ATOM 0 HA HIS A 114 -0.176 -0.822 12.776 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -0.599 -3.128 10.887 1.00 0.00 H new ATOM 0 HB3 HIS A 114 0.814 -3.013 11.918 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -3.002 -3.579 12.102 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -1.318 -4.963 15.756 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -3.460 -4.944 14.325 1.00 0.00 H new ATOM 1631 N ILE A 115 0.658 0.682 10.439 1.00 0.00 N ATOM 1632 CA ILE A 115 1.661 1.436 9.692 1.00 0.00 C ATOM 1633 C ILE A 115 2.767 1.851 10.669 1.00 0.00 C ATOM 1634 O ILE A 115 2.868 3.007 11.086 1.00 0.00 O ATOM 1635 CB ILE A 115 1.068 2.667 8.957 1.00 0.00 C ATOM 1636 CG1 ILE A 115 -0.277 2.447 8.234 1.00 0.00 C ATOM 1637 CG2 ILE A 115 2.123 3.213 7.975 1.00 0.00 C ATOM 1638 CD1 ILE A 115 -0.274 1.430 7.089 1.00 0.00 C ATOM 0 H ILE A 115 -0.211 1.200 10.569 1.00 0.00 H new ATOM 0 HA ILE A 115 2.066 0.798 8.906 1.00 0.00 H new ATOM 0 HB ILE A 115 0.827 3.387 9.739 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -1.014 2.129 8.972 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.614 3.406 7.839 1.00 0.00 H new ATOM 0 HG21 ILE A 115 1.719 4.079 7.451 1.00 0.00 H new ATOM 0 HG22 ILE A 115 3.016 3.507 8.527 1.00 0.00 H new ATOM 0 HG23 ILE A 115 2.381 2.440 7.252 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -1.274 1.362 6.660 1.00 0.00 H new ATOM 0 HD12 ILE A 115 0.430 1.749 6.321 1.00 0.00 H new ATOM 0 HD13 ILE A 115 0.024 0.453 7.471 1.00 0.00 H new ATOM 1650 N ASP A 116 3.602 0.900 11.062 1.00 0.00 N ATOM 1651 CA ASP A 116 4.777 1.182 11.869 1.00 0.00 C ATOM 1652 C ASP A 116 5.945 1.596 10.967 1.00 0.00 C ATOM 1653 O ASP A 116 6.794 2.399 11.371 1.00 0.00 O ATOM 1654 CB ASP A 116 5.090 -0.010 12.781 1.00 0.00 C ATOM 1655 CG ASP A 116 5.049 0.434 14.252 1.00 0.00 C ATOM 1656 OD1 ASP A 116 5.804 1.327 14.687 1.00 0.00 O ATOM 1657 OD2 ASP A 116 4.083 0.055 14.953 1.00 0.00 O ATOM 0 H ASP A 116 3.483 -0.086 10.830 1.00 0.00 H new ATOM 0 HA ASP A 116 4.587 2.027 12.531 1.00 0.00 H new ATOM 0 HB2 ASP A 116 4.367 -0.808 12.612 1.00 0.00 H new ATOM 0 HB3 ASP A 116 6.073 -0.415 12.541 1.00 0.00 H new ATOM 1662 N ARG A 117 5.945 1.157 9.701 1.00 0.00 N ATOM 1663 CA ARG A 117 6.917 1.562 8.695 1.00 0.00 C ATOM 1664 C ARG A 117 6.278 1.845 7.346 1.00 0.00 C ATOM 1665 O ARG A 117 5.111 1.548 7.093 1.00 0.00 O ATOM 1666 CB ARG A 117 8.047 0.527 8.601 1.00 0.00 C ATOM 1667 CG ARG A 117 9.189 0.872 9.567 1.00 0.00 C ATOM 1668 CD ARG A 117 10.578 0.668 8.944 1.00 0.00 C ATOM 1669 NE ARG A 117 10.744 1.464 7.712 1.00 0.00 N ATOM 1670 CZ ARG A 117 11.779 1.460 6.869 1.00 0.00 C ATOM 1671 NH1 ARG A 117 12.898 0.809 7.173 1.00 0.00 N ATOM 1672 NH2 ARG A 117 11.678 2.110 5.712 1.00 0.00 N ATOM 0 H ARG A 117 5.252 0.497 9.348 1.00 0.00 H new ATOM 0 HA ARG A 117 7.352 2.509 9.014 1.00 0.00 H new ATOM 0 HB2 ARG A 117 7.657 -0.464 8.832 1.00 0.00 H new ATOM 0 HB3 ARG A 117 8.428 0.490 7.580 1.00 0.00 H new ATOM 0 HG2 ARG A 117 9.088 1.909 9.886 1.00 0.00 H new ATOM 0 HG3 ARG A 117 9.102 0.254 10.460 1.00 0.00 H new ATOM 0 HD2 ARG A 117 11.346 0.949 9.665 1.00 0.00 H new ATOM 0 HD3 ARG A 117 10.724 -0.388 8.718 1.00 0.00 H new ATOM 0 HE ARG A 117 9.976 2.092 7.477 1.00 0.00 H new ATOM 0 HH11 ARG A 117 12.971 0.306 8.057 1.00 0.00 H new ATOM 0 HH12 ARG A 117 13.683 0.812 6.522 1.00 0.00 H new ATOM 0 HH21 ARG A 117 10.817 2.604 5.478 1.00 0.00 H new ATOM 0 HH22 ARG A 117 12.462 2.114 5.059 1.00 0.00 H new ATOM 1686 N THR A 118 7.041 2.507 6.487 1.00 0.00 N ATOM 1687 CA THR A 118 6.678 2.983 5.167 1.00 0.00 C ATOM 1688 C THR A 118 7.988 3.184 4.381 1.00 0.00 C ATOM 1689 O THR A 118 9.073 3.288 4.977 1.00 0.00 O ATOM 1690 CB THR A 118 5.853 4.268 5.359 1.00 0.00 C ATOM 1691 OG1 THR A 118 4.595 3.912 5.908 1.00 0.00 O ATOM 1692 CG2 THR A 118 5.570 5.038 4.073 1.00 0.00 C ATOM 0 H THR A 118 8.006 2.742 6.718 1.00 0.00 H new ATOM 0 HA THR A 118 6.063 2.289 4.594 1.00 0.00 H new ATOM 0 HB THR A 118 6.449 4.914 6.004 1.00 0.00 H new ATOM 0 HG1 THR A 118 4.557 2.941 6.036 1.00 0.00 H new ATOM 0 HG21 THR A 118 4.984 5.928 4.303 1.00 0.00 H new ATOM 0 HG22 THR A 118 6.512 5.333 3.611 1.00 0.00 H new ATOM 0 HG23 THR A 118 5.011 4.404 3.385 1.00 0.00 H new ATOM 1700 N GLY A 119 7.871 3.276 3.055 1.00 0.00 N ATOM 1701 CA GLY A 119 8.919 3.687 2.145 1.00 0.00 C ATOM 1702 C GLY A 119 8.298 3.993 0.787 1.00 0.00 C ATOM 1703 O GLY A 119 8.143 3.098 -0.039 1.00 0.00 O ATOM 0 H GLY A 119 7.000 3.054 2.574 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.432 4.567 2.533 1.00 0.00 H new ATOM 0 HA3 GLY A 119 9.666 2.899 2.049 1.00 0.00 H new ATOM 1707 N VAL A 120 7.908 5.239 0.509 1.00 0.00 N ATOM 1708 CA VAL A 120 7.599 5.620 -0.873 1.00 0.00 C ATOM 1709 C VAL A 120 8.907 5.839 -1.641 1.00 0.00 C ATOM 1710 O VAL A 120 9.892 6.346 -1.095 1.00 0.00 O ATOM 1711 CB VAL A 120 6.574 6.767 -0.958 1.00 0.00 C ATOM 1712 CG1 VAL A 120 6.931 7.899 -0.006 1.00 0.00 C ATOM 1713 CG2 VAL A 120 6.387 7.274 -2.399 1.00 0.00 C ATOM 0 H VAL A 120 7.800 5.983 1.199 1.00 0.00 H new ATOM 0 HA VAL A 120 7.080 4.804 -1.375 1.00 0.00 H new ATOM 0 HB VAL A 120 5.613 6.361 -0.643 1.00 0.00 H new ATOM 0 HG11 VAL A 120 6.189 8.693 -0.090 1.00 0.00 H new ATOM 0 HG12 VAL A 120 6.946 7.523 1.017 1.00 0.00 H new ATOM 0 HG13 VAL A 120 7.914 8.293 -0.262 1.00 0.00 H new ATOM 0 HG21 VAL A 120 5.655 8.082 -2.408 1.00 0.00 H new ATOM 0 HG22 VAL A 120 7.339 7.642 -2.782 1.00 0.00 H new ATOM 0 HG23 VAL A 120 6.034 6.458 -3.029 1.00 0.00 H new ATOM 1723 N GLN A 121 8.902 5.499 -2.928 1.00 0.00 N ATOM 1724 CA GLN A 121 9.968 5.722 -3.880 1.00 0.00 C ATOM 1725 C GLN A 121 9.405 6.593 -5.000 1.00 0.00 C ATOM 1726 O GLN A 121 8.731 6.095 -5.898 1.00 0.00 O ATOM 1727 CB GLN A 121 10.427 4.375 -4.444 1.00 0.00 C ATOM 1728 CG GLN A 121 11.667 4.550 -5.328 1.00 0.00 C ATOM 1729 CD GLN A 121 11.846 3.381 -6.282 1.00 0.00 C ATOM 1730 OE1 GLN A 121 12.861 2.690 -6.243 1.00 0.00 O ATOM 1731 NE2 GLN A 121 10.895 3.184 -7.179 1.00 0.00 N ATOM 0 H GLN A 121 8.100 5.032 -3.352 1.00 0.00 H new ATOM 0 HA GLN A 121 10.821 6.212 -3.410 1.00 0.00 H new ATOM 0 HB2 GLN A 121 10.651 3.690 -3.626 1.00 0.00 H new ATOM 0 HB3 GLN A 121 9.622 3.925 -5.024 1.00 0.00 H new ATOM 0 HG2 GLN A 121 11.580 5.475 -5.898 1.00 0.00 H new ATOM 0 HG3 GLN A 121 12.552 4.645 -4.699 1.00 0.00 H new ATOM 0 HE21 GLN A 121 10.065 3.778 -7.182 1.00 0.00 H new ATOM 0 HE22 GLN A 121 10.991 2.438 -7.868 1.00 0.00 H new ATOM 1740 N MET A 122 9.649 7.903 -4.958 1.00 0.00 N ATOM 1741 CA MET A 122 9.202 8.816 -6.010 1.00 0.00 C ATOM 1742 C MET A 122 10.198 8.970 -7.158 1.00 0.00 C ATOM 1743 O MET A 122 9.923 9.665 -8.134 1.00 0.00 O ATOM 1744 CB MET A 122 8.776 10.150 -5.388 1.00 0.00 C ATOM 1745 CG MET A 122 7.808 9.877 -4.244 1.00 0.00 C ATOM 1746 SD MET A 122 6.815 11.267 -3.685 1.00 0.00 S ATOM 1747 CE MET A 122 5.270 10.693 -4.419 1.00 0.00 C ATOM 0 H MET A 122 10.158 8.358 -4.200 1.00 0.00 H new ATOM 0 HA MET A 122 8.330 8.370 -6.489 1.00 0.00 H new ATOM 0 HB2 MET A 122 9.649 10.690 -5.022 1.00 0.00 H new ATOM 0 HB3 MET A 122 8.302 10.782 -6.139 1.00 0.00 H new ATOM 0 HG2 MET A 122 7.134 9.078 -4.551 1.00 0.00 H new ATOM 0 HG3 MET A 122 8.380 9.503 -3.395 1.00 0.00 H new ATOM 0 HE1 MET A 122 4.477 11.409 -4.204 1.00 0.00 H new ATOM 0 HE2 MET A 122 5.392 10.601 -5.498 1.00 0.00 H new ATOM 0 HE3 MET A 122 5.006 9.722 -3.999 1.00 0.00 H new ATOM 1757 N ARG A 123 11.317 8.252 -7.103 1.00 0.00 N ATOM 1758 CA ARG A 123 12.097 7.921 -8.286 1.00 0.00 C ATOM 1759 C ARG A 123 11.184 7.082 -9.181 1.00 0.00 C ATOM 1760 O ARG A 123 10.533 6.174 -8.670 1.00 0.00 O ATOM 1761 CB ARG A 123 13.329 7.118 -7.825 1.00 0.00 C ATOM 1762 CG ARG A 123 14.668 7.645 -8.371 1.00 0.00 C ATOM 1763 CD ARG A 123 15.126 8.989 -7.777 1.00 0.00 C ATOM 1764 NE ARG A 123 15.500 8.880 -6.354 1.00 0.00 N ATOM 1765 CZ ARG A 123 15.882 9.868 -5.533 1.00 0.00 C ATOM 1766 NH1 ARG A 123 15.959 11.121 -5.965 1.00 0.00 N ATOM 1767 NH2 ARG A 123 16.193 9.592 -4.271 1.00 0.00 N ATOM 0 H ARG A 123 11.706 7.884 -6.235 1.00 0.00 H new ATOM 0 HA ARG A 123 12.444 8.797 -8.834 1.00 0.00 H new ATOM 0 HB2 ARG A 123 13.366 7.125 -6.736 1.00 0.00 H new ATOM 0 HB3 ARG A 123 13.208 6.080 -8.133 1.00 0.00 H new ATOM 0 HG2 ARG A 123 15.440 6.899 -8.182 1.00 0.00 H new ATOM 0 HG3 ARG A 123 14.586 7.752 -9.453 1.00 0.00 H new ATOM 0 HD2 ARG A 123 15.978 9.362 -8.346 1.00 0.00 H new ATOM 0 HD3 ARG A 123 14.326 9.721 -7.884 1.00 0.00 H new ATOM 0 HE ARG A 123 15.464 7.945 -5.948 1.00 0.00 H new ATOM 0 HH11 ARG A 123 15.726 11.342 -6.933 1.00 0.00 H new ATOM 0 HH12 ARG A 123 16.251 11.863 -5.329 1.00 0.00 H new ATOM 0 HH21 ARG A 123 16.140 8.632 -3.931 1.00 0.00 H new ATOM 0 HH22 ARG A 123 16.484 10.340 -3.642 1.00 0.00 H new ATOM 1781 N ALA A 124 11.087 7.386 -10.476 1.00 0.00 N ATOM 1782 CA ALA A 124 10.403 6.534 -11.417 1.00 0.00 C ATOM 1783 C ALA A 124 11.178 5.207 -11.511 1.00 0.00 C ATOM 1784 O ALA A 124 12.415 5.251 -11.545 1.00 0.00 O ATOM 1785 CB ALA A 124 10.270 7.255 -12.759 1.00 0.00 C ATOM 0 H ALA A 124 11.483 8.230 -10.889 1.00 0.00 H new ATOM 0 HA ALA A 124 9.388 6.306 -11.091 1.00 0.00 H new ATOM 0 HB1 ALA A 124 9.753 6.610 -13.469 1.00 0.00 H new ATOM 0 HB2 ALA A 124 9.701 8.175 -12.623 1.00 0.00 H new ATOM 0 HB3 ALA A 124 11.262 7.495 -13.143 1.00 0.00 H new ATOM 1791 N PRO A 125 10.509 4.048 -11.605 1.00 0.00 N ATOM 1792 CA PRO A 125 9.063 3.892 -11.607 1.00 0.00 C ATOM 1793 C PRO A 125 8.492 4.147 -10.207 1.00 0.00 C ATOM 1794 O PRO A 125 8.869 3.480 -9.243 1.00 0.00 O ATOM 1795 CB PRO A 125 8.823 2.449 -12.070 1.00 0.00 C ATOM 1796 CG PRO A 125 10.070 1.699 -11.603 1.00 0.00 C ATOM 1797 CD PRO A 125 11.168 2.754 -11.711 1.00 0.00 C ATOM 0 HA PRO A 125 8.565 4.606 -12.263 1.00 0.00 H new ATOM 0 HB2 PRO A 125 7.918 2.033 -11.627 1.00 0.00 H new ATOM 0 HB3 PRO A 125 8.704 2.391 -13.152 1.00 0.00 H new ATOM 0 HG2 PRO A 125 9.962 1.333 -10.582 1.00 0.00 H new ATOM 0 HG3 PRO A 125 10.279 0.833 -12.232 1.00 0.00 H new ATOM 0 HD2 PRO A 125 11.906 2.628 -10.919 1.00 0.00 H new ATOM 0 HD3 PRO A 125 11.699 2.666 -12.659 1.00 0.00 H new ATOM 1805 N GLN A 126 7.630 5.160 -10.078 1.00 0.00 N ATOM 1806 CA GLN A 126 7.155 5.585 -8.776 1.00 0.00 C ATOM 1807 C GLN A 126 6.269 4.508 -8.194 1.00 0.00 C ATOM 1808 O GLN A 126 5.280 4.082 -8.800 1.00 0.00 O ATOM 1809 CB GLN A 126 6.363 6.890 -8.814 1.00 0.00 C ATOM 1810 CG GLN A 126 7.141 8.086 -9.361 1.00 0.00 C ATOM 1811 CD GLN A 126 6.464 9.393 -8.951 1.00 0.00 C ATOM 1812 OE1 GLN A 126 5.246 9.466 -8.825 1.00 0.00 O ATOM 1813 NE2 GLN A 126 7.228 10.448 -8.720 1.00 0.00 N ATOM 0 H GLN A 126 7.253 5.694 -10.861 1.00 0.00 H new ATOM 0 HA GLN A 126 8.040 5.757 -8.164 1.00 0.00 H new ATOM 0 HB2 GLN A 126 5.472 6.742 -9.424 1.00 0.00 H new ATOM 0 HB3 GLN A 126 6.023 7.124 -7.805 1.00 0.00 H new ATOM 0 HG2 GLN A 126 8.164 8.065 -8.985 1.00 0.00 H new ATOM 0 HG3 GLN A 126 7.199 8.024 -10.448 1.00 0.00 H new ATOM 0 HE21 GLN A 126 8.240 10.378 -8.827 1.00 0.00 H new ATOM 0 HE22 GLN A 126 6.805 11.331 -8.435 1.00 0.00 H new ATOM 1822 N GLN A 127 6.612 4.125 -6.978 1.00 0.00 N ATOM 1823 CA GLN A 127 5.893 3.144 -6.215 1.00 0.00 C ATOM 1824 C GLN A 127 5.850 3.602 -4.773 1.00 0.00 C ATOM 1825 O GLN A 127 6.655 4.425 -4.332 1.00 0.00 O ATOM 1826 CB GLN A 127 6.588 1.785 -6.334 1.00 0.00 C ATOM 1827 CG GLN A 127 6.408 1.145 -7.716 1.00 0.00 C ATOM 1828 CD GLN A 127 6.399 -0.382 -7.641 1.00 0.00 C ATOM 1829 OE1 GLN A 127 7.065 -0.986 -6.791 1.00 0.00 O ATOM 1830 NE2 GLN A 127 5.614 -1.034 -8.477 1.00 0.00 N ATOM 0 H GLN A 127 7.422 4.504 -6.488 1.00 0.00 H new ATOM 0 HA GLN A 127 4.876 3.036 -6.592 1.00 0.00 H new ATOM 0 HB2 GLN A 127 7.652 1.907 -6.131 1.00 0.00 H new ATOM 0 HB3 GLN A 127 6.193 1.112 -5.573 1.00 0.00 H new ATOM 0 HG2 GLN A 127 5.474 1.492 -8.158 1.00 0.00 H new ATOM 0 HG3 GLN A 127 7.213 1.471 -8.375 1.00 0.00 H new ATOM 0 HE21 GLN A 127 5.071 -0.521 -9.172 1.00 0.00 H new ATOM 0 HE22 GLN A 127 5.550 -2.051 -8.428 1.00 0.00 H new ATOM 1839 N MET A 128 4.922 3.028 -4.026 1.00 0.00 N ATOM 1840 CA MET A 128 4.885 3.125 -2.587 1.00 0.00 C ATOM 1841 C MET A 128 5.103 1.714 -2.055 1.00 0.00 C ATOM 1842 O MET A 128 4.756 0.719 -2.701 1.00 0.00 O ATOM 1843 CB MET A 128 3.600 3.836 -2.148 1.00 0.00 C ATOM 1844 CG MET A 128 3.436 3.912 -0.629 1.00 0.00 C ATOM 1845 SD MET A 128 1.942 4.771 -0.074 1.00 0.00 S ATOM 1846 CE MET A 128 0.687 3.861 -1.002 1.00 0.00 C ATOM 0 H MET A 128 4.161 2.472 -4.416 1.00 0.00 H new ATOM 0 HA MET A 128 5.672 3.747 -2.162 1.00 0.00 H new ATOM 0 HB2 MET A 128 3.594 4.846 -2.558 1.00 0.00 H new ATOM 0 HB3 MET A 128 2.742 3.315 -2.573 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.427 2.899 -0.227 1.00 0.00 H new ATOM 0 HG3 MET A 128 4.306 4.415 -0.208 1.00 0.00 H new ATOM 0 HE1 MET A 128 -0.296 4.060 -0.576 1.00 0.00 H new ATOM 0 HE2 MET A 128 0.702 4.180 -2.044 1.00 0.00 H new ATOM 0 HE3 MET A 128 0.897 2.793 -0.947 1.00 0.00 H new ATOM 1856 N GLN A 129 5.724 1.628 -0.888 1.00 0.00 N ATOM 1857 CA GLN A 129 5.979 0.404 -0.167 1.00 0.00 C ATOM 1858 C GLN A 129 5.489 0.679 1.251 1.00 0.00 C ATOM 1859 O GLN A 129 5.764 1.754 1.795 1.00 0.00 O ATOM 1860 CB GLN A 129 7.485 0.081 -0.221 1.00 0.00 C ATOM 1861 CG GLN A 129 7.728 -1.424 -0.320 1.00 0.00 C ATOM 1862 CD GLN A 129 9.116 -1.827 0.180 1.00 0.00 C ATOM 1863 OE1 GLN A 129 9.481 -1.537 1.317 1.00 0.00 O ATOM 1864 NE2 GLN A 129 9.899 -2.533 -0.622 1.00 0.00 N ATOM 0 H GLN A 129 6.078 2.452 -0.401 1.00 0.00 H new ATOM 0 HA GLN A 129 5.471 -0.464 -0.586 1.00 0.00 H new ATOM 0 HB2 GLN A 129 7.936 0.581 -1.078 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.975 0.473 0.670 1.00 0.00 H new ATOM 0 HG2 GLN A 129 6.970 -1.950 0.260 1.00 0.00 H new ATOM 0 HG3 GLN A 129 7.613 -1.740 -1.357 1.00 0.00 H new ATOM 0 HE21 GLN A 129 9.585 -2.768 -1.564 1.00 0.00 H new ATOM 0 HE22 GLN A 129 10.815 -2.842 -0.298 1.00 0.00 H new ATOM 1873 N LEU A 130 4.733 -0.252 1.828 1.00 0.00 N ATOM 1874 CA LEU A 130 4.306 -0.192 3.220 1.00 0.00 C ATOM 1875 C LEU A 130 4.877 -1.420 3.912 1.00 0.00 C ATOM 1876 O LEU A 130 5.142 -2.426 3.247 1.00 0.00 O ATOM 1877 CB LEU A 130 2.774 -0.121 3.370 1.00 0.00 C ATOM 1878 CG LEU A 130 2.061 0.967 2.549 1.00 0.00 C ATOM 1879 CD1 LEU A 130 0.543 0.886 2.746 1.00 0.00 C ATOM 1880 CD2 LEU A 130 2.517 2.363 2.972 1.00 0.00 C ATOM 0 H LEU A 130 4.397 -1.079 1.334 1.00 0.00 H new ATOM 0 HA LEU A 130 4.678 0.724 3.680 1.00 0.00 H new ATOM 0 HB2 LEU A 130 2.357 -1.089 3.091 1.00 0.00 H new ATOM 0 HB3 LEU A 130 2.540 0.036 4.423 1.00 0.00 H new ATOM 0 HG LEU A 130 2.315 0.796 1.503 1.00 0.00 H new ATOM 0 HD11 LEU A 130 0.058 1.664 2.157 1.00 0.00 H new ATOM 0 HD12 LEU A 130 0.186 -0.091 2.421 1.00 0.00 H new ATOM 0 HD13 LEU A 130 0.305 1.028 3.800 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.997 3.112 2.375 1.00 0.00 H new ATOM 0 HD22 LEU A 130 2.288 2.516 4.027 1.00 0.00 H new ATOM 0 HD23 LEU A 130 3.592 2.457 2.816 1.00 0.00 H new ATOM 1892 N VAL A 131 5.078 -1.315 5.222 1.00 0.00 N ATOM 1893 CA VAL A 131 5.656 -2.350 6.062 1.00 0.00 C ATOM 1894 C VAL A 131 4.905 -2.302 7.381 1.00 0.00 C ATOM 1895 O VAL A 131 4.763 -1.232 7.984 1.00 0.00 O ATOM 1896 CB VAL A 131 7.157 -2.086 6.273 1.00 0.00 C ATOM 1897 CG1 VAL A 131 7.769 -2.991 7.354 1.00 0.00 C ATOM 1898 CG2 VAL A 131 7.974 -2.227 4.988 1.00 0.00 C ATOM 0 H VAL A 131 4.832 -0.474 5.744 1.00 0.00 H new ATOM 0 HA VAL A 131 5.567 -3.334 5.602 1.00 0.00 H new ATOM 0 HB VAL A 131 7.209 -1.049 6.606 1.00 0.00 H new ATOM 0 HG11 VAL A 131 8.829 -2.763 7.462 1.00 0.00 H new ATOM 0 HG12 VAL A 131 7.262 -2.818 8.303 1.00 0.00 H new ATOM 0 HG13 VAL A 131 7.650 -4.035 7.064 1.00 0.00 H new ATOM 0 HG21 VAL A 131 9.024 -2.029 5.201 1.00 0.00 H new ATOM 0 HG22 VAL A 131 7.867 -3.239 4.598 1.00 0.00 H new ATOM 0 HG23 VAL A 131 7.613 -1.513 4.247 1.00 0.00 H new ATOM 1908 N LEU A 132 4.375 -3.441 7.807 1.00 0.00 N ATOM 1909 CA LEU A 132 3.695 -3.531 9.096 1.00 0.00 C ATOM 1910 C LEU A 132 4.684 -3.768 10.224 1.00 0.00 C ATOM 1911 O LEU A 132 5.830 -4.140 9.993 1.00 0.00 O ATOM 1912 CB LEU A 132 2.659 -4.663 9.095 1.00 0.00 C ATOM 1913 CG LEU A 132 1.581 -4.589 8.011 1.00 0.00 C ATOM 1914 CD1 LEU A 132 0.582 -5.721 8.232 1.00 0.00 C ATOM 1915 CD2 LEU A 132 0.887 -3.238 7.921 1.00 0.00 C ATOM 0 H LEU A 132 4.402 -4.315 7.281 1.00 0.00 H new ATOM 0 HA LEU A 132 3.189 -2.579 9.257 1.00 0.00 H new ATOM 0 HB2 LEU A 132 3.187 -5.611 8.990 1.00 0.00 H new ATOM 0 HB3 LEU A 132 2.167 -4.679 10.068 1.00 0.00 H new ATOM 0 HG LEU A 132 2.075 -4.708 7.047 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -0.191 -5.679 7.465 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.099 -6.679 8.174 1.00 0.00 H new ATOM 0 HD13 LEU A 132 0.124 -5.615 9.215 1.00 0.00 H new ATOM 0 HD21 LEU A 132 0.137 -3.266 7.130 1.00 0.00 H new ATOM 0 HD22 LEU A 132 0.403 -3.013 8.872 1.00 0.00 H new ATOM 0 HD23 LEU A 132 1.622 -2.465 7.697 1.00 0.00 H new ATOM 1927 N ASP A 133 4.181 -3.676 11.453 1.00 0.00 N ATOM 1928 CA ASP A 133 4.898 -3.909 12.709 1.00 0.00 C ATOM 1929 C ASP A 133 5.421 -5.350 12.891 1.00 0.00 C ATOM 1930 O ASP A 133 6.057 -5.678 13.892 1.00 0.00 O ATOM 1931 CB ASP A 133 3.957 -3.541 13.860 1.00 0.00 C ATOM 1932 CG ASP A 133 4.657 -3.389 15.208 1.00 0.00 C ATOM 1933 OD1 ASP A 133 5.883 -3.129 15.258 1.00 0.00 O ATOM 1934 OD2 ASP A 133 3.925 -3.425 16.222 1.00 0.00 O ATOM 0 H ASP A 133 3.206 -3.422 11.610 1.00 0.00 H new ATOM 0 HA ASP A 133 5.792 -3.285 12.695 1.00 0.00 H new ATOM 0 HB2 ASP A 133 3.451 -2.607 13.617 1.00 0.00 H new ATOM 0 HB3 ASP A 133 3.187 -4.308 13.946 1.00 0.00 H new ATOM 1939 N ASN A 134 5.146 -6.245 11.941 1.00 0.00 N ATOM 1940 CA ASN A 134 5.678 -7.591 11.862 1.00 0.00 C ATOM 1941 C ASN A 134 6.678 -7.751 10.711 1.00 0.00 C ATOM 1942 O ASN A 134 7.413 -8.738 10.680 1.00 0.00 O ATOM 1943 CB ASN A 134 4.524 -8.581 11.730 1.00 0.00 C ATOM 1944 CG ASN A 134 3.627 -8.316 10.536 1.00 0.00 C ATOM 1945 OD1 ASN A 134 3.793 -8.880 9.459 1.00 0.00 O ATOM 1946 ND2 ASN A 134 2.638 -7.455 10.698 1.00 0.00 N ATOM 0 H ASN A 134 4.513 -6.032 11.170 1.00 0.00 H new ATOM 0 HA ASN A 134 6.230 -7.797 12.779 1.00 0.00 H new ATOM 0 HB2 ASN A 134 4.929 -9.590 11.652 1.00 0.00 H new ATOM 0 HB3 ASN A 134 3.923 -8.548 12.639 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.005 -7.254 9.924 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.508 -6.991 11.597 1.00 0.00 H new ATOM 1953 N GLY A 135 6.802 -6.776 9.809 1.00 0.00 N ATOM 1954 CA GLY A 135 7.866 -6.743 8.812 1.00 0.00 C ATOM 1955 C GLY A 135 7.428 -7.159 7.418 1.00 0.00 C ATOM 1956 O GLY A 135 8.282 -7.532 6.611 1.00 0.00 O ATOM 0 H GLY A 135 6.162 -5.984 9.752 1.00 0.00 H new ATOM 0 HA2 GLY A 135 8.274 -5.733 8.766 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.674 -7.399 9.137 1.00 0.00 H new ATOM 1960 N ASP A 136 6.123 -7.139 7.141 1.00 0.00 N ATOM 1961 CA ASP A 136 5.556 -7.409 5.819 1.00 0.00 C ATOM 1962 C ASP A 136 6.044 -6.373 4.787 1.00 0.00 C ATOM 1963 O ASP A 136 6.672 -5.386 5.167 1.00 0.00 O ATOM 1964 CB ASP A 136 4.026 -7.579 5.969 1.00 0.00 C ATOM 1965 CG ASP A 136 3.112 -6.496 5.399 1.00 0.00 C ATOM 1966 OD1 ASP A 136 3.516 -5.321 5.261 1.00 0.00 O ATOM 1967 OD2 ASP A 136 1.920 -6.831 5.206 1.00 0.00 O ATOM 0 H ASP A 136 5.415 -6.930 7.845 1.00 0.00 H new ATOM 0 HA ASP A 136 5.915 -8.350 5.402 1.00 0.00 H new ATOM 0 HB2 ASP A 136 3.750 -8.525 5.502 1.00 0.00 H new ATOM 0 HB3 ASP A 136 3.806 -7.672 7.032 1.00 0.00 H new ATOM 1972 N THR A 137 5.828 -6.602 3.488 1.00 0.00 N ATOM 1973 CA THR A 137 6.287 -5.694 2.437 1.00 0.00 C ATOM 1974 C THR A 137 5.200 -5.580 1.365 1.00 0.00 C ATOM 1975 O THR A 137 5.017 -6.498 0.557 1.00 0.00 O ATOM 1976 CB THR A 137 7.620 -6.182 1.823 1.00 0.00 C ATOM 1977 OG1 THR A 137 8.570 -6.642 2.763 1.00 0.00 O ATOM 1978 CG2 THR A 137 8.302 -5.046 1.069 1.00 0.00 C ATOM 0 H THR A 137 5.331 -7.421 3.138 1.00 0.00 H new ATOM 0 HA THR A 137 6.472 -4.711 2.869 1.00 0.00 H new ATOM 0 HB THR A 137 7.329 -7.013 1.181 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.380 -6.932 2.294 1.00 0.00 H new ATOM 0 HG21 THR A 137 9.239 -5.404 0.642 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.649 -4.696 0.269 1.00 0.00 H new ATOM 0 HG23 THR A 137 8.506 -4.225 1.756 1.00 0.00 H new ATOM 1986 N LEU A 138 4.454 -4.475 1.327 1.00 0.00 N ATOM 1987 CA LEU A 138 3.398 -4.256 0.327 1.00 0.00 C ATOM 1988 C LEU A 138 3.941 -3.508 -0.885 1.00 0.00 C ATOM 1989 O LEU A 138 5.004 -2.886 -0.821 1.00 0.00 O ATOM 1990 CB LEU A 138 2.165 -3.594 0.987 1.00 0.00 C ATOM 1991 CG LEU A 138 1.150 -4.680 1.412 1.00 0.00 C ATOM 1992 CD1 LEU A 138 0.202 -5.007 0.296 1.00 0.00 C ATOM 1993 CD2 LEU A 138 1.798 -5.782 2.225 1.00 0.00 C ATOM 0 H LEU A 138 4.562 -3.705 1.987 1.00 0.00 H new ATOM 0 HA LEU A 138 3.053 -5.214 -0.061 1.00 0.00 H new ATOM 0 HB2 LEU A 138 2.475 -3.013 1.856 1.00 0.00 H new ATOM 0 HB3 LEU A 138 1.697 -2.899 0.289 1.00 0.00 H new ATOM 0 HG LEU A 138 0.450 -4.304 2.158 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -0.499 -5.774 0.627 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -0.349 -4.110 0.012 1.00 0.00 H new ATOM 0 HD13 LEU A 138 0.764 -5.375 -0.563 1.00 0.00 H new ATOM 0 HD21 LEU A 138 1.046 -6.521 2.500 1.00 0.00 H new ATOM 0 HD22 LEU A 138 2.578 -6.261 1.633 1.00 0.00 H new ATOM 0 HD23 LEU A 138 2.237 -5.358 3.128 1.00 0.00 H new ATOM 2005 N THR A 139 3.231 -3.585 -2.010 1.00 0.00 N ATOM 2006 CA THR A 139 3.699 -3.022 -3.277 1.00 0.00 C ATOM 2007 C THR A 139 2.595 -2.255 -3.977 1.00 0.00 C ATOM 2008 O THR A 139 1.657 -2.868 -4.497 1.00 0.00 O ATOM 2009 CB THR A 139 4.231 -4.094 -4.239 1.00 0.00 C ATOM 2010 OG1 THR A 139 4.965 -5.096 -3.550 1.00 0.00 O ATOM 2011 CG2 THR A 139 5.078 -3.387 -5.308 1.00 0.00 C ATOM 0 H THR A 139 2.319 -4.037 -2.070 1.00 0.00 H new ATOM 0 HA THR A 139 4.517 -2.350 -3.018 1.00 0.00 H new ATOM 0 HB THR A 139 3.401 -4.615 -4.717 1.00 0.00 H new ATOM 0 HG1 THR A 139 5.420 -5.672 -4.199 1.00 0.00 H new ATOM 0 HG21 THR A 139 5.471 -4.125 -6.008 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.459 -2.669 -5.847 1.00 0.00 H new ATOM 0 HG23 THR A 139 5.906 -2.864 -4.829 1.00 0.00 H new ATOM 2019 N PHE A 140 2.743 -0.934 -4.035 1.00 0.00 N ATOM 2020 CA PHE A 140 1.835 -0.086 -4.794 1.00 0.00 C ATOM 2021 C PHE A 140 2.561 0.557 -5.955 1.00 0.00 C ATOM 2022 O PHE A 140 3.680 1.037 -5.782 1.00 0.00 O ATOM 2023 CB PHE A 140 1.287 1.024 -3.913 1.00 0.00 C ATOM 2024 CG PHE A 140 0.503 0.520 -2.735 1.00 0.00 C ATOM 2025 CD1 PHE A 140 1.171 0.090 -1.572 1.00 0.00 C ATOM 2026 CD2 PHE A 140 -0.895 0.450 -2.812 1.00 0.00 C ATOM 2027 CE1 PHE A 140 0.423 -0.314 -0.455 1.00 0.00 C ATOM 2028 CE2 PHE A 140 -1.616 -0.100 -1.747 1.00 0.00 C ATOM 2029 CZ PHE A 140 -0.979 -0.344 -0.526 1.00 0.00 C ATOM 0 H PHE A 140 3.490 -0.427 -3.561 1.00 0.00 H new ATOM 0 HA PHE A 140 1.022 -0.713 -5.159 1.00 0.00 H new ATOM 0 HB2 PHE A 140 2.115 1.635 -3.554 1.00 0.00 H new ATOM 0 HB3 PHE A 140 0.649 1.673 -4.513 1.00 0.00 H new ATOM 0 HD1 PHE A 140 2.250 0.071 -1.540 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -1.411 0.818 -3.687 1.00 0.00 H new ATOM 0 HE1 PHE A 140 0.925 -0.601 0.457 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -2.663 -0.336 -1.867 1.00 0.00 H new ATOM 0 HZ PHE A 140 -1.563 -0.554 0.358 1.00 0.00 H new ATOM 2039 N ASP A 141 1.893 0.658 -7.096 1.00 0.00 N ATOM 2040 CA ASP A 141 2.277 1.528 -8.193 1.00 0.00 C ATOM 2041 C ASP A 141 1.676 2.904 -7.923 1.00 0.00 C ATOM 2042 O ASP A 141 0.570 2.983 -7.386 1.00 0.00 O ATOM 2043 CB ASP A 141 1.692 0.980 -9.501 1.00 0.00 C ATOM 2044 CG ASP A 141 2.525 -0.169 -10.051 1.00 0.00 C ATOM 2045 OD1 ASP A 141 3.738 0.030 -10.283 1.00 0.00 O ATOM 2046 OD2 ASP A 141 1.957 -1.264 -10.291 1.00 0.00 O ATOM 0 H ASP A 141 1.047 0.122 -7.287 1.00 0.00 H new ATOM 0 HA ASP A 141 3.362 1.585 -8.276 1.00 0.00 H new ATOM 0 HB2 ASP A 141 0.671 0.640 -9.329 1.00 0.00 H new ATOM 0 HB3 ASP A 141 1.641 1.779 -10.240 1.00 0.00 H new ATOM 2051 N ARG A 142 2.332 3.999 -8.325 1.00 0.00 N ATOM 2052 CA ARG A 142 1.643 5.289 -8.490 1.00 0.00 C ATOM 2053 C ARG A 142 0.635 5.101 -9.615 1.00 0.00 C ATOM 2054 O ARG A 142 1.043 4.562 -10.652 1.00 0.00 O ATOM 2055 CB ARG A 142 2.673 6.380 -8.857 1.00 0.00 C ATOM 2056 CG ARG A 142 2.084 7.776 -9.144 1.00 0.00 C ATOM 2057 CD ARG A 142 1.860 8.620 -7.883 1.00 0.00 C ATOM 2058 NE ARG A 142 1.184 9.894 -8.199 1.00 0.00 N ATOM 2059 CZ ARG A 142 1.762 11.046 -8.571 1.00 0.00 C ATOM 2060 NH1 ARG A 142 3.069 11.134 -8.771 1.00 0.00 N ATOM 2061 NH2 ARG A 142 1.013 12.126 -8.743 1.00 0.00 N ATOM 0 H ARG A 142 3.329 4.021 -8.541 1.00 0.00 H new ATOM 0 HA ARG A 142 1.142 5.600 -7.573 1.00 0.00 H new ATOM 0 HB2 ARG A 142 3.390 6.468 -8.041 1.00 0.00 H new ATOM 0 HB3 ARG A 142 3.228 6.051 -9.735 1.00 0.00 H new ATOM 0 HG2 ARG A 142 2.754 8.313 -9.816 1.00 0.00 H new ATOM 0 HG3 ARG A 142 1.135 7.660 -9.667 1.00 0.00 H new ATOM 0 HD2 ARG A 142 1.261 8.056 -7.168 1.00 0.00 H new ATOM 0 HD3 ARG A 142 2.818 8.824 -7.405 1.00 0.00 H new ATOM 0 HE ARG A 142 0.167 9.899 -8.127 1.00 0.00 H new ATOM 0 HH11 ARG A 142 3.661 10.313 -8.642 1.00 0.00 H new ATOM 0 HH12 ARG A 142 3.483 12.022 -9.054 1.00 0.00 H new ATOM 0 HH21 ARG A 142 0.005 12.077 -8.593 1.00 0.00 H new ATOM 0 HH22 ARG A 142 1.444 13.006 -9.026 1.00 0.00 H new ATOM 2075 N SER A 143 -0.604 5.601 -9.501 1.00 0.00 N ATOM 2076 CA SER A 143 -1.418 5.744 -10.690 1.00 0.00 C ATOM 2077 C SER A 143 -1.847 7.186 -10.790 1.00 0.00 C ATOM 2078 O SER A 143 -2.715 7.607 -10.037 1.00 0.00 O ATOM 2079 CB SER A 143 -2.547 4.724 -10.710 1.00 0.00 C ATOM 2080 OG SER A 143 -3.313 4.828 -11.900 1.00 0.00 O ATOM 0 H SER A 143 -1.041 5.899 -8.629 1.00 0.00 H new ATOM 0 HA SER A 143 -0.852 5.516 -11.593 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.134 3.719 -10.627 1.00 0.00 H new ATOM 0 HB3 SER A 143 -3.192 4.875 -9.845 1.00 0.00 H new ATOM 0 HG SER A 143 -4.030 4.160 -11.887 1.00 0.00 H new ATOM 2086 N THR A 144 -1.231 7.941 -11.694 1.00 0.00 N ATOM 2087 CA THR A 144 -1.628 9.312 -11.971 1.00 0.00 C ATOM 2088 C THR A 144 -1.973 9.505 -13.459 1.00 0.00 C ATOM 2089 O THR A 144 -1.997 10.637 -13.944 1.00 0.00 O ATOM 2090 CB THR A 144 -0.565 10.256 -11.392 1.00 0.00 C ATOM 2091 OG1 THR A 144 -1.120 11.537 -11.180 1.00 0.00 O ATOM 2092 CG2 THR A 144 0.733 10.359 -12.193 1.00 0.00 C ATOM 0 H THR A 144 -0.442 7.617 -12.254 1.00 0.00 H new ATOM 0 HA THR A 144 -2.561 9.567 -11.469 1.00 0.00 H new ATOM 0 HB THR A 144 -0.267 9.803 -10.446 1.00 0.00 H new ATOM 0 HG1 THR A 144 -1.611 11.818 -11.981 1.00 0.00 H new ATOM 0 HG21 THR A 144 1.413 11.051 -11.696 1.00 0.00 H new ATOM 0 HG22 THR A 144 1.199 9.376 -12.258 1.00 0.00 H new ATOM 0 HG23 THR A 144 0.513 10.724 -13.196 1.00 0.00 H new ATOM 2100 N ARG A 145 -2.224 8.415 -14.200 1.00 0.00 N ATOM 2101 CA ARG A 145 -3.060 8.470 -15.400 1.00 0.00 C ATOM 2102 C ARG A 145 -4.511 8.334 -14.964 1.00 0.00 C ATOM 2103 O ARG A 145 -4.796 8.410 -13.748 1.00 0.00 O ATOM 2104 CB ARG A 145 -2.666 7.373 -16.417 1.00 0.00 C ATOM 2105 CG ARG A 145 -1.191 7.382 -16.872 1.00 0.00 C ATOM 2106 CD ARG A 145 -0.887 8.292 -18.076 1.00 0.00 C ATOM 2107 NE ARG A 145 -1.355 9.675 -17.898 1.00 0.00 N ATOM 2108 CZ ARG A 145 -0.882 10.593 -17.051 1.00 0.00 C ATOM 2109 NH1 ARG A 145 0.251 10.412 -16.377 1.00 0.00 N ATOM 2110 NH2 ARG A 145 -1.584 11.703 -16.889 1.00 0.00 N ATOM 0 H ARG A 145 -1.858 7.487 -13.986 1.00 0.00 H new ATOM 0 HA ARG A 145 -2.914 9.422 -15.911 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -2.886 6.400 -15.978 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -3.300 7.475 -17.298 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -0.570 7.695 -16.033 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -0.898 6.363 -17.123 1.00 0.00 H new ATOM 0 HD2 ARG A 145 0.189 8.301 -18.253 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -1.353 7.871 -18.967 1.00 0.00 H new ATOM 0 HE ARG A 145 -2.132 9.967 -18.491 1.00 0.00 H new ATOM 0 HH11 ARG A 145 0.786 9.552 -16.500 1.00 0.00 H new ATOM 0 HH12 ARG A 145 0.585 11.133 -15.738 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -2.455 11.835 -17.403 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -1.254 12.427 -16.250 1.00 0.00 H new TER 2124 ARG A 145