USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1099 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 22 THR OG1 : rot 132:sc= 1.23 USER MOD Set 1.2: A 82 TYR OH : rot 50:sc= 0.115 USER MOD Set 1.3: A 157 MET CE :methyl 143:sc= -1.39 (180deg=-3.36!) USER MOD Set 2.1: A 101 ASN : amide:sc= -2.84! C(o=-2.7!,f=-4.6!) USER MOD Set 2.2: A 104 THR OG1 : rot 75:sc= 0.107 USER MOD Set 3.1: A 34 SER OG : rot 120:sc= 0.139 USER MOD Set 3.2: A 36 SER OG : rot -106:sc= 0.148 USER MOD Set 3.3: A 76 ASN : amide:sc= -2.05 K(o=-1.7,f=0.24) USER MOD Set 3.4: A 78 THR OG1 : rot 98:sc= 0.0427 USER MOD Set 4.1: A 52 ASN : amide:sc= -2.41 K(o=-2.7,f=-0.45) USER MOD Set 4.2: A 62 THR OG1 : rot -173:sc= 1.19 USER MOD Set 4.3: A 70 ASN : amide:sc= -1.9 K(o=-2.7,f=-0.036) USER MOD Set 4.4: A 85 THR OG1 : rot -58:sc= 0.412 USER MOD Set 5.1: A 53 TYR OH : rot 38:sc= 0.605 USER MOD Set 5.2: A 83 TYR OH : rot 30:sc= 0.717 USER MOD Set 6.1: A 26 ASN : amide:sc= 0.281 K(o=0.56,f=-4.6!) USER MOD Set 6.2: A 32 GLN : amide:sc= 0.277 K(o=0.56,f=-5.6!) USER MOD Set 7.1: A 6 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 99 THR OG1 : rot -68:sc= 1.28 USER MOD Single : A 4 SER OG : rot 136:sc= 0.365 USER MOD Single : A 8 SER OG : rot 180:sc= 0.0121 USER MOD Single : A 9 ASN : amide:sc= -1.78! K(o=-1.8!,f=-0.021) USER MOD Single : A 10 LYS NZ :NH3+ 165:sc= -0.0616 (180deg=-0.351) USER MOD Single : A 11 SER OG : rot -120:sc= -0.319 USER MOD Single : A 12 GLN : amide:sc= -1.16 K(o=-1.2,f=-11!) USER MOD Single : A 13 ASN : amide:sc= -1.49! K(o=-1.5!,f=-0.0015) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 MET CE :methyl 162:sc= -0.104 (180deg=-0.548) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot -132:sc= -0.791 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= -0.774 USER MOD Single : A 40 SER OG : rot 35:sc= 0.597 USER MOD Single : A 41 THR OG1 : rot 38:sc= 0.568 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot -43:sc= 0.477 USER MOD Single : A 54 LYS NZ :NH3+ -168:sc= -0.0765 (180deg=-0.286) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.00585 USER MOD Single : A 57 THR OG1 : rot 91:sc= 1.23 USER MOD Single : A 58 ASN : amide:sc= -4.09! C(o=-4.1!,f=-1.8!) USER MOD Single : A 59 LYS NZ :NH3+ 167:sc= -0.0143 (180deg=-0.23) USER MOD Single : A 60 LYS NZ :NH3+ -142:sc= 0 (180deg=-0.72) USER MOD Single : A 63 ASN : amide:sc= -2.7! K(o=-2.7!,f=-0.96) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 87 THR OG1 : rot 49:sc= -0.901 USER MOD Single : A 91 LYS NZ :NH3+ 169:sc= -0.0208 (180deg=-0.252) USER MOD Single : A 96 SER OG : rot -130:sc=-0.00847 USER MOD Single : A 105 SER OG : rot -35:sc= -1.16 USER MOD Single : A 107 LYS NZ :NH3+ -104:sc= -0.804! (180deg=-3.31!) USER MOD Single : A 109 TYR OH : rot 130:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -0.713 K(o=-0.71,f=-3.1) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 118 ASN : amide:sc= -0.128 K(o=-0.13,f=-0.85) USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.0169 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 125 SER OG : rot 180:sc= 0.0189 USER MOD Single : A 128 GLN : amide:sc= -1.45! K(o=-1.5!,f=-0.02) USER MOD Single : A 131 LYS NZ :NH3+ -133:sc= -4.82! (180deg=-7.75!) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot 94:sc= 0.255 USER MOD Single : A 142 THR OG1 : rot 73:sc= 0.355 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 ASN : amide:sc= -1.62! K(o=-1.6!,f=-0.0097) USER MOD Single : A 147 THR OG1 : rot 121:sc= 0.00333 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0.039 USER MOD Single : A 151 ASN : amide:sc= -5.96! C(o=-6!,f=-2.7!) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot 28:sc= 0.316 USER MOD Single : A 155 TYR OH : rot 180:sc= -0.0622 USER MOD Single : A 158 LYS NZ :NH3+ -136:sc= 0.624 (180deg=-0.0341) USER MOD ----------------------------------------------------------------- ATOM 52 N SER A 4 -17.607 -8.373 1.102 1.00 1.43 N ATOM 53 CA SER A 4 -17.493 -7.306 0.120 1.00 0.82 C ATOM 54 C SER A 4 -17.580 -7.817 -1.323 1.00 0.93 C ATOM 55 O SER A 4 -17.272 -7.077 -2.257 1.00 1.64 O ATOM 56 CB SER A 4 -16.182 -6.562 0.353 1.00 0.60 C ATOM 57 OG SER A 4 -16.124 -6.063 1.680 1.00 1.23 O ATOM 0 HA SER A 4 -18.338 -6.630 0.252 1.00 0.82 H new ATOM 0 HB2 SER A 4 -15.340 -7.231 0.172 1.00 0.60 H new ATOM 0 HB3 SER A 4 -16.093 -5.739 -0.356 1.00 0.60 H new ATOM 0 HG SER A 4 -15.235 -6.234 2.055 1.00 1.23 H new ATOM 63 N ALA A 5 -17.996 -9.079 -1.485 1.00 1.31 N ATOM 64 CA ALA A 5 -18.203 -9.704 -2.803 1.00 1.41 C ATOM 65 C ALA A 5 -16.875 -9.962 -3.512 1.00 1.33 C ATOM 66 O ALA A 5 -16.528 -11.105 -3.817 1.00 1.96 O ATOM 67 CB ALA A 5 -19.131 -8.864 -3.675 1.00 1.72 C ATOM 0 H ALA A 5 -18.200 -9.701 -0.703 1.00 1.31 H new ATOM 0 HA ALA A 5 -18.683 -10.668 -2.634 1.00 1.41 H new ATOM 0 HB1 ALA A 5 -19.264 -9.352 -4.641 1.00 1.72 H new ATOM 0 HB2 ALA A 5 -20.099 -8.762 -3.184 1.00 1.72 H new ATOM 0 HB3 ALA A 5 -18.695 -7.876 -3.825 1.00 1.72 H new ATOM 73 N SER A 6 -16.125 -8.899 -3.761 1.00 1.05 N ATOM 74 CA SER A 6 -14.780 -9.016 -4.297 1.00 0.98 C ATOM 75 C SER A 6 -13.867 -9.608 -3.230 1.00 0.84 C ATOM 76 O SER A 6 -12.726 -9.987 -3.502 1.00 0.79 O ATOM 77 CB SER A 6 -14.270 -7.644 -4.735 1.00 1.17 C ATOM 78 OG SER A 6 -15.259 -6.949 -5.479 1.00 1.25 O ATOM 0 H SER A 6 -16.429 -7.939 -3.598 1.00 1.05 H new ATOM 0 HA SER A 6 -14.788 -9.672 -5.167 1.00 0.98 H new ATOM 0 HB2 SER A 6 -13.991 -7.059 -3.859 1.00 1.17 H new ATOM 0 HB3 SER A 6 -13.371 -7.762 -5.340 1.00 1.17 H new ATOM 0 HG SER A 6 -14.911 -6.073 -5.747 1.00 1.25 H new ATOM 84 N ASP A 7 -14.417 -9.699 -2.019 1.00 0.83 N ATOM 85 CA ASP A 7 -13.739 -10.284 -0.870 1.00 0.77 C ATOM 86 C ASP A 7 -13.398 -11.739 -1.153 1.00 0.72 C ATOM 87 O ASP A 7 -12.459 -12.295 -0.589 1.00 0.82 O ATOM 88 CB ASP A 7 -14.648 -10.196 0.368 1.00 0.85 C ATOM 89 CG ASP A 7 -15.672 -11.317 0.426 1.00 0.92 C ATOM 90 OD1 ASP A 7 -16.671 -11.251 -0.316 1.00 1.18 O ATOM 91 OD2 ASP A 7 -15.474 -12.271 1.202 1.00 1.36 O ATOM 0 H ASP A 7 -15.357 -9.364 -1.809 1.00 0.83 H new ATOM 0 HA ASP A 7 -12.818 -9.733 -0.682 1.00 0.77 H new ATOM 0 HB2 ASP A 7 -14.033 -10.225 1.268 1.00 0.85 H new ATOM 0 HB3 ASP A 7 -15.166 -9.237 0.366 1.00 0.85 H new ATOM 96 N SER A 8 -14.184 -12.343 -2.032 1.00 0.69 N ATOM 97 CA SER A 8 -14.003 -13.732 -2.399 1.00 0.75 C ATOM 98 C SER A 8 -13.571 -13.877 -3.860 1.00 0.78 C ATOM 99 O SER A 8 -12.937 -14.864 -4.238 1.00 1.03 O ATOM 100 CB SER A 8 -15.312 -14.479 -2.147 1.00 0.89 C ATOM 101 OG SER A 8 -16.427 -13.604 -2.268 1.00 1.49 O ATOM 0 H SER A 8 -14.961 -11.883 -2.507 1.00 0.69 H new ATOM 0 HA SER A 8 -13.207 -14.159 -1.789 1.00 0.75 H new ATOM 0 HB2 SER A 8 -15.410 -15.300 -2.858 1.00 0.89 H new ATOM 0 HB3 SER A 8 -15.297 -14.920 -1.151 1.00 0.89 H new ATOM 0 HG SER A 8 -17.254 -14.104 -2.104 1.00 1.49 H new ATOM 107 N ASN A 9 -13.917 -12.894 -4.681 1.00 0.73 N ATOM 108 CA ASN A 9 -13.626 -12.967 -6.110 1.00 0.82 C ATOM 109 C ASN A 9 -12.245 -12.405 -6.443 1.00 0.77 C ATOM 110 O ASN A 9 -11.389 -13.119 -6.962 1.00 0.86 O ATOM 111 CB ASN A 9 -14.699 -12.227 -6.919 1.00 0.94 C ATOM 112 CG ASN A 9 -16.010 -12.993 -7.026 1.00 1.48 C ATOM 113 OD1 ASN A 9 -16.728 -12.875 -8.021 1.00 2.27 O ATOM 114 ND2 ASN A 9 -16.342 -13.774 -6.010 1.00 2.04 N ATOM 0 H ASN A 9 -14.396 -12.043 -4.387 1.00 0.73 H new ATOM 0 HA ASN A 9 -13.632 -14.022 -6.383 1.00 0.82 H new ATOM 0 HB2 ASN A 9 -14.889 -11.259 -6.456 1.00 0.94 H new ATOM 0 HB3 ASN A 9 -14.318 -12.032 -7.921 1.00 0.94 H new ATOM 0 HD21 ASN A 9 -17.215 -14.301 -6.036 1.00 2.04 H new ATOM 0 HD22 ASN A 9 -15.725 -13.849 -5.201 1.00 2.04 H new ATOM 121 N LYS A 10 -12.024 -11.135 -6.142 1.00 0.72 N ATOM 122 CA LYS A 10 -10.798 -10.467 -6.569 1.00 0.75 C ATOM 123 C LYS A 10 -9.678 -10.635 -5.554 1.00 0.70 C ATOM 124 O LYS A 10 -8.512 -10.751 -5.928 1.00 0.76 O ATOM 125 CB LYS A 10 -11.046 -8.981 -6.822 1.00 0.83 C ATOM 126 CG LYS A 10 -9.894 -8.297 -7.544 1.00 0.99 C ATOM 127 CD LYS A 10 -10.186 -6.833 -7.814 1.00 1.03 C ATOM 128 CE LYS A 10 -9.082 -6.191 -8.644 1.00 1.11 C ATOM 129 NZ LYS A 10 -8.945 -6.823 -9.985 1.00 1.56 N ATOM 0 H LYS A 10 -12.667 -10.549 -5.610 1.00 0.72 H new ATOM 0 HA LYS A 10 -10.487 -10.941 -7.500 1.00 0.75 H new ATOM 0 HB2 LYS A 10 -11.956 -8.866 -7.411 1.00 0.83 H new ATOM 0 HB3 LYS A 10 -11.218 -8.480 -5.869 1.00 0.83 H new ATOM 0 HG2 LYS A 10 -8.988 -8.382 -6.944 1.00 0.99 H new ATOM 0 HG3 LYS A 10 -9.701 -8.809 -8.487 1.00 0.99 H new ATOM 0 HD2 LYS A 10 -11.138 -6.741 -8.337 1.00 1.03 H new ATOM 0 HD3 LYS A 10 -10.289 -6.300 -6.869 1.00 1.03 H new ATOM 0 HE2 LYS A 10 -9.292 -5.128 -8.765 1.00 1.11 H new ATOM 0 HE3 LYS A 10 -8.136 -6.270 -8.109 1.00 1.11 H new ATOM 0 HZ1 LYS A 10 -8.375 -6.209 -10.601 1.00 1.56 H new ATOM 0 HZ2 LYS A 10 -8.477 -7.747 -9.887 1.00 1.56 H new ATOM 0 HZ3 LYS A 10 -9.887 -6.955 -10.404 1.00 1.56 H new ATOM 143 N SER A 11 -10.037 -10.647 -4.275 1.00 0.65 N ATOM 144 CA SER A 11 -9.054 -10.685 -3.197 1.00 0.64 C ATOM 145 C SER A 11 -8.092 -11.865 -3.358 1.00 0.66 C ATOM 146 O SER A 11 -6.877 -11.680 -3.429 1.00 0.67 O ATOM 147 CB SER A 11 -9.767 -10.751 -1.846 1.00 0.67 C ATOM 148 OG SER A 11 -8.856 -10.586 -0.776 1.00 1.52 O ATOM 0 H SER A 11 -11.006 -10.631 -3.958 1.00 0.65 H new ATOM 0 HA SER A 11 -8.461 -9.772 -3.243 1.00 0.64 H new ATOM 0 HB2 SER A 11 -10.532 -9.976 -1.798 1.00 0.67 H new ATOM 0 HB3 SER A 11 -10.277 -11.709 -1.748 1.00 0.67 H new ATOM 0 HG SER A 11 -8.877 -11.381 -0.203 1.00 1.52 H new ATOM 154 N GLN A 12 -8.644 -13.070 -3.444 1.00 0.72 N ATOM 155 CA GLN A 12 -7.841 -14.283 -3.565 1.00 0.81 C ATOM 156 C GLN A 12 -7.033 -14.290 -4.861 1.00 0.79 C ATOM 157 O GLN A 12 -5.997 -14.947 -4.953 1.00 0.85 O ATOM 158 CB GLN A 12 -8.726 -15.535 -3.486 1.00 0.95 C ATOM 159 CG GLN A 12 -9.282 -15.822 -2.091 1.00 1.19 C ATOM 160 CD GLN A 12 -10.549 -15.050 -1.760 1.00 1.74 C ATOM 161 OE1 GLN A 12 -10.789 -13.963 -2.283 1.00 2.34 O ATOM 162 NE2 GLN A 12 -11.366 -15.599 -0.871 1.00 2.40 N ATOM 0 H GLN A 12 -9.651 -13.234 -3.432 1.00 0.72 H new ATOM 0 HA GLN A 12 -7.142 -14.296 -2.729 1.00 0.81 H new ATOM 0 HB2 GLN A 12 -9.558 -15.422 -4.181 1.00 0.95 H new ATOM 0 HB3 GLN A 12 -8.148 -16.397 -3.819 1.00 0.95 H new ATOM 0 HG2 GLN A 12 -9.486 -16.889 -2.005 1.00 1.19 H new ATOM 0 HG3 GLN A 12 -8.519 -15.583 -1.350 1.00 1.19 H new ATOM 0 HE21 GLN A 12 -11.136 -16.502 -0.457 1.00 2.40 H new ATOM 0 HE22 GLN A 12 -12.224 -15.118 -0.602 1.00 2.40 H new ATOM 171 N ASN A 13 -7.501 -13.548 -5.856 1.00 0.77 N ATOM 172 CA ASN A 13 -6.804 -13.459 -7.138 1.00 0.81 C ATOM 173 C ASN A 13 -5.625 -12.502 -7.039 1.00 0.73 C ATOM 174 O ASN A 13 -4.600 -12.684 -7.702 1.00 0.76 O ATOM 175 CB ASN A 13 -7.751 -12.991 -8.245 1.00 0.95 C ATOM 176 CG ASN A 13 -8.695 -14.076 -8.734 1.00 1.41 C ATOM 177 OD1 ASN A 13 -9.125 -14.057 -9.885 1.00 2.14 O ATOM 178 ND2 ASN A 13 -9.019 -15.033 -7.876 1.00 1.63 N ATOM 0 H ASN A 13 -8.359 -12.999 -5.803 1.00 0.77 H new ATOM 0 HA ASN A 13 -6.438 -14.455 -7.387 1.00 0.81 H new ATOM 0 HB2 ASN A 13 -8.337 -12.148 -7.878 1.00 0.95 H new ATOM 0 HB3 ASN A 13 -7.162 -12.627 -9.087 1.00 0.95 H new ATOM 0 HD21 ASN A 13 -9.644 -15.786 -8.164 1.00 1.63 H new ATOM 0 HD22 ASN A 13 -8.643 -15.017 -6.928 1.00 1.63 H new ATOM 185 N ALA A 14 -5.776 -11.481 -6.206 1.00 0.69 N ATOM 186 CA ALA A 14 -4.722 -10.501 -5.995 1.00 0.66 C ATOM 187 C ALA A 14 -3.632 -11.081 -5.104 1.00 0.59 C ATOM 188 O ALA A 14 -2.447 -10.821 -5.310 1.00 0.61 O ATOM 189 CB ALA A 14 -5.290 -9.232 -5.381 1.00 0.68 C ATOM 0 H ALA A 14 -6.623 -11.311 -5.664 1.00 0.69 H new ATOM 0 HA ALA A 14 -4.284 -10.250 -6.961 1.00 0.66 H new ATOM 0 HB1 ALA A 14 -4.487 -8.510 -5.230 1.00 0.68 H new ATOM 0 HB2 ALA A 14 -6.039 -8.808 -6.050 1.00 0.68 H new ATOM 0 HB3 ALA A 14 -5.752 -9.467 -4.422 1.00 0.68 H new ATOM 195 N ILE A 15 -4.049 -11.879 -4.124 1.00 0.59 N ATOM 196 CA ILE A 15 -3.121 -12.540 -3.211 1.00 0.60 C ATOM 197 C ILE A 15 -2.066 -13.332 -3.980 1.00 0.59 C ATOM 198 O ILE A 15 -0.882 -13.288 -3.652 1.00 0.59 O ATOM 199 CB ILE A 15 -3.867 -13.487 -2.241 1.00 0.72 C ATOM 200 CG1 ILE A 15 -4.824 -12.686 -1.356 1.00 0.87 C ATOM 201 CG2 ILE A 15 -2.880 -14.271 -1.386 1.00 0.77 C ATOM 202 CD1 ILE A 15 -5.673 -13.541 -0.435 1.00 1.80 C ATOM 0 H ILE A 15 -5.031 -12.084 -3.941 1.00 0.59 H new ATOM 0 HA ILE A 15 -2.629 -11.758 -2.632 1.00 0.60 H new ATOM 0 HB ILE A 15 -4.446 -14.199 -2.829 1.00 0.72 H new ATOM 0 HG12 ILE A 15 -4.245 -11.985 -0.754 1.00 0.87 H new ATOM 0 HG13 ILE A 15 -5.481 -12.093 -1.992 1.00 0.87 H new ATOM 0 HG21 ILE A 15 -3.426 -14.930 -0.712 1.00 0.77 H new ATOM 0 HG22 ILE A 15 -2.233 -14.866 -2.030 1.00 0.77 H new ATOM 0 HG23 ILE A 15 -2.273 -13.578 -0.803 1.00 0.77 H new ATOM 0 HD11 ILE A 15 -6.324 -12.900 0.159 1.00 1.80 H new ATOM 0 HD12 ILE A 15 -6.280 -14.224 -1.029 1.00 1.80 H new ATOM 0 HD13 ILE A 15 -5.026 -14.115 0.228 1.00 1.80 H new ATOM 214 N SER A 16 -2.506 -14.041 -5.015 1.00 0.64 N ATOM 215 CA SER A 16 -1.610 -14.843 -5.840 1.00 0.70 C ATOM 216 C SER A 16 -0.513 -13.973 -6.461 1.00 0.69 C ATOM 217 O SER A 16 0.658 -14.351 -6.474 1.00 0.79 O ATOM 218 CB SER A 16 -2.409 -15.546 -6.936 1.00 0.81 C ATOM 219 OG SER A 16 -3.530 -16.228 -6.391 1.00 1.28 O ATOM 0 H SER A 16 -3.484 -14.076 -5.303 1.00 0.64 H new ATOM 0 HA SER A 16 -1.131 -15.590 -5.207 1.00 0.70 H new ATOM 0 HB2 SER A 16 -2.746 -14.815 -7.671 1.00 0.81 H new ATOM 0 HB3 SER A 16 -1.768 -16.254 -7.461 1.00 0.81 H new ATOM 0 HG SER A 16 -4.027 -16.669 -7.112 1.00 1.28 H new ATOM 225 N GLU A 17 -0.899 -12.793 -6.942 1.00 0.68 N ATOM 226 CA GLU A 17 0.038 -11.879 -7.584 1.00 0.75 C ATOM 227 C GLU A 17 1.030 -11.324 -6.566 1.00 0.69 C ATOM 228 O GLU A 17 2.235 -11.285 -6.816 1.00 0.75 O ATOM 229 CB GLU A 17 -0.709 -10.721 -8.256 1.00 0.88 C ATOM 230 CG GLU A 17 -1.764 -11.166 -9.257 1.00 1.30 C ATOM 231 CD GLU A 17 -1.206 -12.076 -10.331 1.00 1.49 C ATOM 232 OE1 GLU A 17 -0.525 -11.575 -11.253 1.00 1.70 O ATOM 233 OE2 GLU A 17 -1.451 -13.296 -10.264 1.00 2.07 O ATOM 0 H GLU A 17 -1.858 -12.448 -6.898 1.00 0.68 H new ATOM 0 HA GLU A 17 0.583 -12.438 -8.344 1.00 0.75 H new ATOM 0 HB2 GLU A 17 -1.186 -10.114 -7.486 1.00 0.88 H new ATOM 0 HB3 GLU A 17 0.013 -10.082 -8.764 1.00 0.88 H new ATOM 0 HG2 GLU A 17 -2.565 -11.683 -8.728 1.00 1.30 H new ATOM 0 HG3 GLU A 17 -2.207 -10.287 -9.726 1.00 1.30 H new ATOM 240 N VAL A 18 0.512 -10.913 -5.416 1.00 0.64 N ATOM 241 CA VAL A 18 1.335 -10.325 -4.365 1.00 0.69 C ATOM 242 C VAL A 18 2.293 -11.358 -3.778 1.00 0.67 C ATOM 243 O VAL A 18 3.484 -11.092 -3.618 1.00 0.76 O ATOM 244 CB VAL A 18 0.462 -9.723 -3.242 1.00 0.75 C ATOM 245 CG1 VAL A 18 1.324 -9.134 -2.138 1.00 1.59 C ATOM 246 CG2 VAL A 18 -0.478 -8.668 -3.805 1.00 1.43 C ATOM 0 H VAL A 18 -0.480 -10.976 -5.186 1.00 0.64 H new ATOM 0 HA VAL A 18 1.918 -9.524 -4.819 1.00 0.69 H new ATOM 0 HB VAL A 18 -0.136 -10.526 -2.811 1.00 0.75 H new ATOM 0 HG11 VAL A 18 0.684 -8.717 -1.360 1.00 1.59 H new ATOM 0 HG12 VAL A 18 1.952 -9.916 -1.711 1.00 1.59 H new ATOM 0 HG13 VAL A 18 1.955 -8.346 -2.550 1.00 1.59 H new ATOM 0 HG21 VAL A 18 -1.085 -8.255 -3.000 1.00 1.43 H new ATOM 0 HG22 VAL A 18 0.105 -7.870 -4.266 1.00 1.43 H new ATOM 0 HG23 VAL A 18 -1.128 -9.122 -4.553 1.00 1.43 H new ATOM 256 N MET A 19 1.774 -12.546 -3.486 1.00 0.65 N ATOM 257 CA MET A 19 2.584 -13.627 -2.934 1.00 0.75 C ATOM 258 C MET A 19 3.694 -14.016 -3.910 1.00 0.74 C ATOM 259 O MET A 19 4.804 -14.365 -3.506 1.00 0.78 O ATOM 260 CB MET A 19 1.702 -14.841 -2.620 1.00 0.89 C ATOM 261 CG MET A 19 2.439 -15.980 -1.932 1.00 1.25 C ATOM 262 SD MET A 19 1.349 -17.351 -1.492 1.00 2.00 S ATOM 263 CE MET A 19 0.772 -17.859 -3.111 1.00 2.13 C ATOM 0 H MET A 19 0.792 -12.786 -3.623 1.00 0.65 H new ATOM 0 HA MET A 19 3.044 -13.279 -2.009 1.00 0.75 H new ATOM 0 HB2 MET A 19 0.875 -14.522 -1.986 1.00 0.89 H new ATOM 0 HB3 MET A 19 1.268 -15.211 -3.549 1.00 0.89 H new ATOM 0 HG2 MET A 19 3.229 -16.345 -2.589 1.00 1.25 H new ATOM 0 HG3 MET A 19 2.923 -15.602 -1.031 1.00 1.25 H new ATOM 0 HE1 MET A 19 0.359 -18.866 -3.051 1.00 2.13 H new ATOM 0 HE2 MET A 19 0.000 -17.170 -3.455 1.00 2.13 H new ATOM 0 HE3 MET A 19 1.605 -17.850 -3.814 1.00 2.13 H new ATOM 273 N SER A 20 3.391 -13.944 -5.198 1.00 0.75 N ATOM 274 CA SER A 20 4.379 -14.222 -6.227 1.00 0.82 C ATOM 275 C SER A 20 5.426 -13.105 -6.265 1.00 0.82 C ATOM 276 O SER A 20 6.628 -13.365 -6.379 1.00 0.90 O ATOM 277 CB SER A 20 3.684 -14.370 -7.588 1.00 0.91 C ATOM 278 OG SER A 20 4.593 -14.748 -8.606 1.00 1.63 O ATOM 0 H SER A 20 2.468 -13.695 -5.554 1.00 0.75 H new ATOM 0 HA SER A 20 4.888 -15.158 -5.996 1.00 0.82 H new ATOM 0 HB2 SER A 20 2.893 -15.116 -7.512 1.00 0.91 H new ATOM 0 HB3 SER A 20 3.209 -13.427 -7.857 1.00 0.91 H new ATOM 0 HG SER A 20 4.114 -14.834 -9.457 1.00 1.63 H new ATOM 284 N ALA A 21 4.965 -11.867 -6.122 1.00 0.78 N ATOM 285 CA ALA A 21 5.846 -10.705 -6.170 1.00 0.85 C ATOM 286 C ALA A 21 6.810 -10.689 -4.989 1.00 0.82 C ATOM 287 O ALA A 21 8.000 -10.424 -5.156 1.00 0.89 O ATOM 288 CB ALA A 21 5.029 -9.422 -6.202 1.00 0.93 C ATOM 0 H ALA A 21 3.982 -11.642 -5.971 1.00 0.78 H new ATOM 0 HA ALA A 21 6.437 -10.772 -7.084 1.00 0.85 H new ATOM 0 HB1 ALA A 21 5.700 -8.564 -6.238 1.00 0.93 H new ATOM 0 HB2 ALA A 21 4.390 -9.420 -7.085 1.00 0.93 H new ATOM 0 HB3 ALA A 21 4.411 -9.362 -5.306 1.00 0.93 H new ATOM 294 N THR A 22 6.295 -10.995 -3.802 1.00 0.78 N ATOM 295 CA THR A 22 7.104 -10.990 -2.590 1.00 0.83 C ATOM 296 C THR A 22 8.208 -12.052 -2.666 1.00 0.87 C ATOM 297 O THR A 22 9.252 -11.931 -2.020 1.00 0.94 O ATOM 298 CB THR A 22 6.229 -11.201 -1.325 1.00 0.89 C ATOM 299 OG1 THR A 22 6.915 -10.739 -0.156 1.00 1.42 O ATOM 300 CG2 THR A 22 5.848 -12.661 -1.134 1.00 1.93 C ATOM 0 H THR A 22 5.318 -11.250 -3.655 1.00 0.78 H new ATOM 0 HA THR A 22 7.574 -10.010 -2.512 1.00 0.83 H new ATOM 0 HB THR A 22 5.316 -10.623 -1.471 1.00 0.89 H new ATOM 0 HG1 THR A 22 6.316 -10.171 0.372 1.00 1.42 H new ATOM 0 HG21 THR A 22 5.236 -12.763 -0.238 1.00 1.93 H new ATOM 0 HG22 THR A 22 5.283 -13.006 -2.000 1.00 1.93 H new ATOM 0 HG23 THR A 22 6.751 -13.262 -1.027 1.00 1.93 H new ATOM 308 N SER A 23 7.980 -13.083 -3.471 1.00 0.89 N ATOM 309 CA SER A 23 8.989 -14.104 -3.694 1.00 0.99 C ATOM 310 C SER A 23 9.983 -13.634 -4.755 1.00 1.01 C ATOM 311 O SER A 23 11.187 -13.864 -4.643 1.00 1.11 O ATOM 312 CB SER A 23 8.330 -15.415 -4.126 1.00 1.07 C ATOM 313 OG SER A 23 9.291 -16.443 -4.286 1.00 1.55 O ATOM 0 H SER A 23 7.107 -13.231 -3.978 1.00 0.89 H new ATOM 0 HA SER A 23 9.527 -14.278 -2.762 1.00 0.99 H new ATOM 0 HB2 SER A 23 7.592 -15.716 -3.383 1.00 1.07 H new ATOM 0 HB3 SER A 23 7.795 -15.264 -5.064 1.00 1.07 H new ATOM 0 HG SER A 23 8.843 -17.270 -4.561 1.00 1.55 H new ATOM 319 N ALA A 24 9.467 -12.958 -5.775 1.00 0.96 N ATOM 320 CA ALA A 24 10.297 -12.453 -6.860 1.00 1.03 C ATOM 321 C ALA A 24 11.308 -11.432 -6.351 1.00 1.01 C ATOM 322 O ALA A 24 12.504 -11.557 -6.604 1.00 1.10 O ATOM 323 CB ALA A 24 9.431 -11.840 -7.950 1.00 1.05 C ATOM 0 H ALA A 24 8.474 -12.747 -5.872 1.00 0.96 H new ATOM 0 HA ALA A 24 10.849 -13.294 -7.280 1.00 1.03 H new ATOM 0 HB1 ALA A 24 10.067 -11.467 -8.753 1.00 1.05 H new ATOM 0 HB2 ALA A 24 8.753 -12.597 -8.345 1.00 1.05 H new ATOM 0 HB3 ALA A 24 8.852 -11.016 -7.534 1.00 1.05 H new ATOM 329 N ILE A 25 10.822 -10.439 -5.612 1.00 0.93 N ATOM 330 CA ILE A 25 11.680 -9.376 -5.102 1.00 0.93 C ATOM 331 C ILE A 25 12.710 -9.924 -4.110 1.00 0.97 C ATOM 332 O ILE A 25 13.811 -9.386 -3.976 1.00 1.02 O ATOM 333 CB ILE A 25 10.854 -8.239 -4.449 1.00 0.89 C ATOM 334 CG1 ILE A 25 11.771 -7.089 -4.021 1.00 1.23 C ATOM 335 CG2 ILE A 25 10.051 -8.765 -3.265 1.00 1.11 C ATOM 336 CD1 ILE A 25 11.036 -5.887 -3.468 1.00 1.56 C ATOM 0 H ILE A 25 9.839 -10.349 -5.353 1.00 0.93 H new ATOM 0 HA ILE A 25 12.213 -8.957 -5.956 1.00 0.93 H new ATOM 0 HB ILE A 25 10.150 -7.857 -5.188 1.00 0.89 H new ATOM 0 HG12 ILE A 25 12.467 -7.455 -3.266 1.00 1.23 H new ATOM 0 HG13 ILE A 25 12.367 -6.775 -4.878 1.00 1.23 H new ATOM 0 HG21 ILE A 25 9.479 -7.950 -2.822 1.00 1.11 H new ATOM 0 HG22 ILE A 25 9.369 -9.544 -3.605 1.00 1.11 H new ATOM 0 HG23 ILE A 25 10.730 -9.178 -2.519 1.00 1.11 H new ATOM 0 HD11 ILE A 25 11.756 -5.118 -3.188 1.00 1.56 H new ATOM 0 HD12 ILE A 25 10.360 -5.493 -4.227 1.00 1.56 H new ATOM 0 HD13 ILE A 25 10.462 -6.184 -2.590 1.00 1.56 H new ATOM 348 N ASN A 26 12.356 -11.010 -3.437 1.00 0.98 N ATOM 349 CA ASN A 26 13.276 -11.676 -2.523 1.00 1.08 C ATOM 350 C ASN A 26 14.460 -12.234 -3.301 1.00 1.12 C ATOM 351 O ASN A 26 15.618 -12.018 -2.939 1.00 1.20 O ATOM 352 CB ASN A 26 12.566 -12.814 -1.788 1.00 1.15 C ATOM 353 CG ASN A 26 13.468 -13.527 -0.798 1.00 1.48 C ATOM 354 OD1 ASN A 26 14.337 -12.913 -0.171 1.00 1.96 O ATOM 355 ND2 ASN A 26 13.281 -14.832 -0.665 1.00 2.02 N ATOM 0 H ASN A 26 11.438 -11.449 -3.506 1.00 0.98 H new ATOM 0 HA ASN A 26 13.629 -10.949 -1.792 1.00 1.08 H new ATOM 0 HB2 ASN A 26 11.699 -12.415 -1.261 1.00 1.15 H new ATOM 0 HB3 ASN A 26 12.193 -13.534 -2.516 1.00 1.15 H new ATOM 0 HD21 ASN A 26 13.867 -15.369 -0.025 1.00 2.02 H new ATOM 0 HD22 ASN A 26 12.551 -15.300 -1.202 1.00 2.02 H new ATOM 362 N GLY A 27 14.148 -12.924 -4.395 1.00 1.12 N ATOM 363 CA GLY A 27 15.173 -13.542 -5.219 1.00 1.20 C ATOM 364 C GLY A 27 15.994 -12.530 -5.993 1.00 1.23 C ATOM 365 O GLY A 27 17.070 -12.852 -6.496 1.00 1.36 O ATOM 0 H GLY A 27 13.194 -13.067 -4.728 1.00 1.12 H new ATOM 0 HA2 GLY A 27 15.835 -14.132 -4.585 1.00 1.20 H new ATOM 0 HA3 GLY A 27 14.703 -14.233 -5.919 1.00 1.20 H new ATOM 369 N LEU A 28 15.483 -11.309 -6.098 1.00 1.16 N ATOM 370 CA LEU A 28 16.202 -10.233 -6.771 1.00 1.22 C ATOM 371 C LEU A 28 17.381 -9.768 -5.928 1.00 1.28 C ATOM 372 O LEU A 28 18.353 -9.218 -6.446 1.00 1.42 O ATOM 373 CB LEU A 28 15.274 -9.043 -7.041 1.00 1.18 C ATOM 374 CG LEU A 28 14.084 -9.330 -7.955 1.00 1.39 C ATOM 375 CD1 LEU A 28 13.240 -8.079 -8.133 1.00 1.69 C ATOM 376 CD2 LEU A 28 14.557 -9.854 -9.303 1.00 1.81 C ATOM 0 H LEU A 28 14.573 -11.039 -5.725 1.00 1.16 H new ATOM 0 HA LEU A 28 16.568 -10.622 -7.721 1.00 1.22 H new ATOM 0 HB2 LEU A 28 14.896 -8.676 -6.087 1.00 1.18 H new ATOM 0 HB3 LEU A 28 15.863 -8.239 -7.482 1.00 1.18 H new ATOM 0 HG LEU A 28 13.468 -10.099 -7.488 1.00 1.39 H new ATOM 0 HD11 LEU A 28 12.396 -8.299 -8.787 1.00 1.69 H new ATOM 0 HD12 LEU A 28 12.870 -7.748 -7.162 1.00 1.69 H new ATOM 0 HD13 LEU A 28 13.847 -7.291 -8.578 1.00 1.69 H new ATOM 0 HD21 LEU A 28 13.694 -10.052 -9.939 1.00 1.81 H new ATOM 0 HD22 LEU A 28 15.196 -9.110 -9.779 1.00 1.81 H new ATOM 0 HD23 LEU A 28 15.120 -10.776 -9.158 1.00 1.81 H new ATOM 388 N TYR A 29 17.281 -9.986 -4.625 1.00 1.22 N ATOM 389 CA TYR A 29 18.303 -9.536 -3.694 1.00 1.31 C ATOM 390 C TYR A 29 19.060 -10.715 -3.094 1.00 1.58 C ATOM 391 O TYR A 29 20.269 -10.834 -3.282 1.00 2.30 O ATOM 392 CB TYR A 29 17.675 -8.683 -2.587 1.00 1.13 C ATOM 393 CG TYR A 29 17.328 -7.274 -3.025 1.00 0.94 C ATOM 394 CD1 TYR A 29 16.499 -7.045 -4.116 1.00 0.91 C ATOM 395 CD2 TYR A 29 17.839 -6.175 -2.349 1.00 0.90 C ATOM 396 CE1 TYR A 29 16.193 -5.761 -4.526 1.00 0.87 C ATOM 397 CE2 TYR A 29 17.534 -4.885 -2.750 1.00 0.84 C ATOM 398 CZ TYR A 29 16.714 -4.685 -3.841 1.00 0.85 C ATOM 399 OH TYR A 29 16.424 -3.407 -4.258 1.00 0.96 O ATOM 0 H TYR A 29 16.499 -10.474 -4.188 1.00 1.22 H new ATOM 0 HA TYR A 29 19.018 -8.926 -4.246 1.00 1.31 H new ATOM 0 HB2 TYR A 29 16.771 -9.176 -2.230 1.00 1.13 H new ATOM 0 HB3 TYR A 29 18.365 -8.632 -1.744 1.00 1.13 H new ATOM 0 HD1 TYR A 29 16.086 -7.886 -4.654 1.00 0.91 H new ATOM 0 HD2 TYR A 29 18.485 -6.328 -1.497 1.00 0.90 H new ATOM 0 HE1 TYR A 29 15.549 -5.602 -5.378 1.00 0.87 H new ATOM 0 HE2 TYR A 29 17.936 -4.040 -2.211 1.00 0.84 H new ATOM 0 HH TYR A 29 17.250 -2.882 -4.303 1.00 0.96 H new ATOM 409 N ILE A 30 18.333 -11.590 -2.396 1.00 1.25 N ATOM 410 CA ILE A 30 18.920 -12.753 -1.723 1.00 1.45 C ATOM 411 C ILE A 30 19.875 -12.332 -0.603 1.00 1.45 C ATOM 412 O ILE A 30 20.948 -11.778 -0.850 1.00 1.99 O ATOM 413 CB ILE A 30 19.652 -13.683 -2.719 1.00 1.67 C ATOM 414 CG1 ILE A 30 18.683 -14.150 -3.813 1.00 1.88 C ATOM 415 CG2 ILE A 30 20.264 -14.877 -1.994 1.00 1.89 C ATOM 416 CD1 ILE A 30 19.335 -14.989 -4.891 1.00 2.50 C ATOM 0 H ILE A 30 17.322 -11.514 -2.281 1.00 1.25 H new ATOM 0 HA ILE A 30 18.092 -13.308 -1.282 1.00 1.45 H new ATOM 0 HB ILE A 30 20.462 -13.123 -3.187 1.00 1.67 H new ATOM 0 HG12 ILE A 30 17.881 -14.727 -3.352 1.00 1.88 H new ATOM 0 HG13 ILE A 30 18.223 -13.276 -4.275 1.00 1.88 H new ATOM 0 HG21 ILE A 30 20.774 -15.518 -2.714 1.00 1.89 H new ATOM 0 HG22 ILE A 30 20.980 -14.524 -1.252 1.00 1.89 H new ATOM 0 HG23 ILE A 30 19.476 -15.444 -1.498 1.00 1.89 H new ATOM 0 HD11 ILE A 30 18.586 -15.281 -5.628 1.00 2.50 H new ATOM 0 HD12 ILE A 30 20.118 -14.409 -5.380 1.00 2.50 H new ATOM 0 HD13 ILE A 30 19.771 -15.882 -4.443 1.00 2.50 H new ATOM 428 N GLY A 31 19.477 -12.603 0.630 1.00 1.43 N ATOM 429 CA GLY A 31 20.281 -12.220 1.773 1.00 1.69 C ATOM 430 C GLY A 31 20.137 -10.751 2.096 1.00 1.52 C ATOM 431 O GLY A 31 21.104 -10.081 2.447 1.00 1.93 O ATOM 0 H GLY A 31 18.608 -13.084 0.861 1.00 1.43 H new ATOM 0 HA2 GLY A 31 19.986 -12.813 2.639 1.00 1.69 H new ATOM 0 HA3 GLY A 31 21.328 -12.447 1.573 1.00 1.69 H new ATOM 435 N GLN A 32 18.923 -10.248 1.972 1.00 1.16 N ATOM 436 CA GLN A 32 18.665 -8.833 2.201 1.00 1.10 C ATOM 437 C GLN A 32 18.155 -8.570 3.608 1.00 1.14 C ATOM 438 O GLN A 32 18.153 -7.425 4.056 1.00 1.93 O ATOM 439 CB GLN A 32 17.681 -8.278 1.165 1.00 1.09 C ATOM 440 CG GLN A 32 16.613 -9.261 0.687 1.00 1.38 C ATOM 441 CD GLN A 32 15.585 -9.601 1.742 1.00 2.15 C ATOM 442 OE1 GLN A 32 15.263 -8.782 2.595 1.00 2.74 O ATOM 443 NE2 GLN A 32 15.057 -10.812 1.683 1.00 2.84 N ATOM 0 H GLN A 32 18.100 -10.794 1.715 1.00 1.16 H new ATOM 0 HA GLN A 32 19.617 -8.314 2.091 1.00 1.10 H new ATOM 0 HB2 GLN A 32 17.184 -7.406 1.590 1.00 1.09 H new ATOM 0 HB3 GLN A 32 18.247 -7.932 0.300 1.00 1.09 H new ATOM 0 HG2 GLN A 32 16.105 -8.839 -0.180 1.00 1.38 H new ATOM 0 HG3 GLN A 32 17.099 -10.179 0.356 1.00 1.38 H new ATOM 0 HE21 GLN A 32 15.354 -11.463 0.956 1.00 2.84 H new ATOM 0 HE22 GLN A 32 14.353 -11.095 2.364 1.00 2.84 H new ATOM 452 N THR A 33 17.719 -9.629 4.284 1.00 1.15 N ATOM 453 CA THR A 33 17.183 -9.534 5.646 1.00 1.20 C ATOM 454 C THR A 33 15.827 -8.822 5.664 1.00 1.09 C ATOM 455 O THR A 33 14.822 -9.389 6.091 1.00 1.21 O ATOM 456 CB THR A 33 18.168 -8.805 6.587 1.00 1.54 C ATOM 457 OG1 THR A 33 19.441 -9.465 6.564 1.00 1.91 O ATOM 458 CG2 THR A 33 17.641 -8.768 8.013 1.00 1.83 C ATOM 0 H THR A 33 17.725 -10.577 3.908 1.00 1.15 H new ATOM 0 HA THR A 33 17.045 -10.554 6.006 1.00 1.20 H new ATOM 0 HB THR A 33 18.277 -7.780 6.234 1.00 1.54 H new ATOM 0 HG1 THR A 33 20.062 -8.998 7.161 1.00 1.91 H new ATOM 0 HG21 THR A 33 18.356 -8.249 8.652 1.00 1.83 H new ATOM 0 HG22 THR A 33 16.686 -8.242 8.035 1.00 1.83 H new ATOM 0 HG23 THR A 33 17.503 -9.786 8.376 1.00 1.83 H new ATOM 466 N SER A 34 15.812 -7.593 5.175 1.00 1.12 N ATOM 467 CA SER A 34 14.611 -6.776 5.156 1.00 1.35 C ATOM 468 C SER A 34 14.754 -5.649 4.137 1.00 1.13 C ATOM 469 O SER A 34 14.087 -4.619 4.240 1.00 1.18 O ATOM 470 CB SER A 34 14.338 -6.211 6.553 1.00 1.82 C ATOM 471 OG SER A 34 15.542 -5.837 7.210 1.00 2.42 O ATOM 0 H SER A 34 16.633 -7.134 4.780 1.00 1.12 H new ATOM 0 HA SER A 34 13.765 -7.397 4.862 1.00 1.35 H new ATOM 0 HB2 SER A 34 13.682 -5.344 6.474 1.00 1.82 H new ATOM 0 HB3 SER A 34 13.812 -6.955 7.151 1.00 1.82 H new ATOM 0 HG SER A 34 15.517 -4.880 7.419 1.00 2.42 H new ATOM 477 N TYR A 35 15.624 -5.875 3.143 1.00 0.96 N ATOM 478 CA TYR A 35 15.936 -4.874 2.115 1.00 0.78 C ATOM 479 C TYR A 35 16.548 -3.635 2.759 1.00 0.74 C ATOM 480 O TYR A 35 16.612 -2.563 2.154 1.00 0.68 O ATOM 481 CB TYR A 35 14.681 -4.503 1.308 1.00 0.90 C ATOM 482 CG TYR A 35 13.881 -5.699 0.827 1.00 0.97 C ATOM 483 CD1 TYR A 35 14.269 -6.421 -0.293 1.00 1.27 C ATOM 484 CD2 TYR A 35 12.733 -6.100 1.501 1.00 0.97 C ATOM 485 CE1 TYR A 35 13.536 -7.513 -0.726 1.00 1.37 C ATOM 486 CE2 TYR A 35 11.998 -7.188 1.077 1.00 1.12 C ATOM 487 CZ TYR A 35 12.402 -7.892 -0.038 1.00 1.23 C ATOM 488 OH TYR A 35 11.669 -8.978 -0.459 1.00 1.41 O ATOM 0 H TYR A 35 16.129 -6.754 3.030 1.00 0.96 H new ATOM 0 HA TYR A 35 16.661 -5.304 1.424 1.00 0.78 H new ATOM 0 HB2 TYR A 35 14.039 -3.873 1.924 1.00 0.90 H new ATOM 0 HB3 TYR A 35 14.979 -3.907 0.445 1.00 0.90 H new ATOM 0 HD1 TYR A 35 15.156 -6.127 -0.835 1.00 1.27 H new ATOM 0 HD2 TYR A 35 12.411 -5.550 2.373 1.00 0.97 H new ATOM 0 HE1 TYR A 35 13.851 -8.066 -1.599 1.00 1.37 H new ATOM 0 HE2 TYR A 35 11.111 -7.487 1.616 1.00 1.12 H new ATOM 0 HH TYR A 35 10.903 -9.107 0.138 1.00 1.41 H new ATOM 498 N SER A 36 17.028 -3.816 3.981 1.00 0.89 N ATOM 499 CA SER A 36 17.635 -2.746 4.742 1.00 1.03 C ATOM 500 C SER A 36 18.897 -2.253 4.045 1.00 1.25 C ATOM 501 O SER A 36 19.677 -3.043 3.508 1.00 2.03 O ATOM 502 CB SER A 36 17.932 -3.240 6.157 1.00 1.37 C ATOM 503 OG SER A 36 18.308 -4.610 6.144 1.00 2.08 O ATOM 0 H SER A 36 17.005 -4.712 4.469 1.00 0.89 H new ATOM 0 HA SER A 36 16.947 -1.903 4.807 1.00 1.03 H new ATOM 0 HB2 SER A 36 18.732 -2.643 6.595 1.00 1.37 H new ATOM 0 HB3 SER A 36 17.052 -3.106 6.786 1.00 1.37 H new ATOM 0 HG SER A 36 17.574 -5.154 6.499 1.00 2.08 H new ATOM 509 N GLY A 37 19.077 -0.949 4.045 1.00 1.42 N ATOM 510 CA GLY A 37 20.150 -0.349 3.294 1.00 1.83 C ATOM 511 C GLY A 37 19.602 0.569 2.229 1.00 1.52 C ATOM 512 O GLY A 37 20.206 1.591 1.902 1.00 1.88 O ATOM 0 H GLY A 37 18.493 -0.288 4.557 1.00 1.42 H new ATOM 0 HA2 GLY A 37 20.802 0.211 3.964 1.00 1.83 H new ATOM 0 HA3 GLY A 37 20.759 -1.127 2.833 1.00 1.83 H new ATOM 516 N LEU A 38 18.444 0.208 1.684 1.00 0.95 N ATOM 517 CA LEU A 38 17.756 1.078 0.740 1.00 0.77 C ATOM 518 C LEU A 38 16.914 2.106 1.490 1.00 0.68 C ATOM 519 O LEU A 38 16.618 3.184 0.980 1.00 0.66 O ATOM 520 CB LEU A 38 16.845 0.265 -0.178 1.00 0.68 C ATOM 521 CG LEU A 38 17.509 -0.880 -0.935 1.00 0.87 C ATOM 522 CD1 LEU A 38 16.472 -1.612 -1.764 1.00 1.11 C ATOM 523 CD2 LEU A 38 18.630 -0.360 -1.823 1.00 1.19 C ATOM 0 H LEU A 38 17.967 -0.673 1.878 1.00 0.95 H new ATOM 0 HA LEU A 38 18.510 1.586 0.139 1.00 0.77 H new ATOM 0 HB2 LEU A 38 16.032 -0.145 0.421 1.00 0.68 H new ATOM 0 HB3 LEU A 38 16.396 0.943 -0.904 1.00 0.68 H new ATOM 0 HG LEU A 38 17.944 -1.573 -0.215 1.00 0.87 H new ATOM 0 HD11 LEU A 38 16.949 -2.430 -2.304 1.00 1.11 H new ATOM 0 HD12 LEU A 38 15.699 -2.012 -1.108 1.00 1.11 H new ATOM 0 HD13 LEU A 38 16.022 -0.921 -2.476 1.00 1.11 H new ATOM 0 HD21 LEU A 38 19.090 -1.193 -2.354 1.00 1.19 H new ATOM 0 HD22 LEU A 38 18.224 0.349 -2.544 1.00 1.19 H new ATOM 0 HD23 LEU A 38 19.380 0.137 -1.208 1.00 1.19 H new ATOM 535 N ASP A 39 16.541 1.754 2.716 1.00 0.76 N ATOM 536 CA ASP A 39 15.632 2.562 3.530 1.00 0.85 C ATOM 537 C ASP A 39 16.169 3.969 3.748 1.00 0.82 C ATOM 538 O ASP A 39 15.472 4.955 3.506 1.00 0.90 O ATOM 539 CB ASP A 39 15.389 1.878 4.884 1.00 1.08 C ATOM 540 CG ASP A 39 16.677 1.586 5.635 1.00 1.59 C ATOM 541 OD1 ASP A 39 17.309 0.538 5.369 1.00 2.42 O ATOM 542 OD2 ASP A 39 17.052 2.387 6.513 1.00 1.84 O ATOM 0 H ASP A 39 16.859 0.901 3.176 1.00 0.76 H new ATOM 0 HA ASP A 39 14.690 2.646 2.989 1.00 0.85 H new ATOM 0 HB2 ASP A 39 14.752 2.514 5.498 1.00 1.08 H new ATOM 0 HB3 ASP A 39 14.848 0.945 4.723 1.00 1.08 H new ATOM 547 N SER A 40 17.411 4.055 4.188 1.00 0.82 N ATOM 548 CA SER A 40 18.020 5.328 4.509 1.00 0.94 C ATOM 549 C SER A 40 18.207 6.180 3.254 1.00 0.89 C ATOM 550 O SER A 40 17.900 7.372 3.260 1.00 1.00 O ATOM 551 CB SER A 40 19.353 5.094 5.223 1.00 1.13 C ATOM 552 OG SER A 40 19.169 4.309 6.397 1.00 1.71 O ATOM 0 H SER A 40 18.020 3.250 4.331 1.00 0.82 H new ATOM 0 HA SER A 40 17.357 5.878 5.176 1.00 0.94 H new ATOM 0 HB2 SER A 40 20.048 4.592 4.550 1.00 1.13 H new ATOM 0 HB3 SER A 40 19.802 6.052 5.487 1.00 1.13 H new ATOM 0 HG SER A 40 18.458 3.653 6.243 1.00 1.71 H new ATOM 558 N THR A 41 18.660 5.556 2.172 1.00 0.81 N ATOM 559 CA THR A 41 18.944 6.279 0.942 1.00 0.85 C ATOM 560 C THR A 41 17.673 6.836 0.300 1.00 0.79 C ATOM 561 O THR A 41 17.650 7.986 -0.133 1.00 0.95 O ATOM 562 CB THR A 41 19.694 5.388 -0.062 1.00 0.92 C ATOM 563 OG1 THR A 41 19.280 4.025 0.090 1.00 1.25 O ATOM 564 CG2 THR A 41 21.195 5.495 0.141 1.00 1.38 C ATOM 0 H THR A 41 18.838 4.553 2.124 1.00 0.81 H new ATOM 0 HA THR A 41 19.581 7.121 1.211 1.00 0.85 H new ATOM 0 HB THR A 41 19.455 5.728 -1.070 1.00 0.92 H new ATOM 0 HG1 THR A 41 18.318 3.994 0.275 1.00 1.25 H new ATOM 0 HG21 THR A 41 21.706 4.857 -0.580 1.00 1.38 H new ATOM 0 HG22 THR A 41 21.509 6.529 -0.003 1.00 1.38 H new ATOM 0 HG23 THR A 41 21.449 5.176 1.152 1.00 1.38 H new ATOM 572 N ILE A 42 16.617 6.028 0.252 1.00 0.67 N ATOM 573 CA ILE A 42 15.339 6.482 -0.295 1.00 0.67 C ATOM 574 C ILE A 42 14.770 7.621 0.552 1.00 0.64 C ATOM 575 O ILE A 42 14.162 8.558 0.033 1.00 0.68 O ATOM 576 CB ILE A 42 14.309 5.326 -0.374 1.00 0.73 C ATOM 577 CG1 ILE A 42 14.819 4.203 -1.288 1.00 0.82 C ATOM 578 CG2 ILE A 42 12.956 5.836 -0.859 1.00 0.78 C ATOM 579 CD1 ILE A 42 15.091 4.645 -2.711 1.00 0.87 C ATOM 0 H ILE A 42 16.619 5.063 0.582 1.00 0.67 H new ATOM 0 HA ILE A 42 15.527 6.841 -1.307 1.00 0.67 H new ATOM 0 HB ILE A 42 14.182 4.920 0.630 1.00 0.73 H new ATOM 0 HG12 ILE A 42 15.735 3.791 -0.865 1.00 0.82 H new ATOM 0 HG13 ILE A 42 14.084 3.398 -1.302 1.00 0.82 H new ATOM 0 HG21 ILE A 42 12.250 5.007 -0.906 1.00 0.78 H new ATOM 0 HG22 ILE A 42 12.583 6.591 -0.167 1.00 0.78 H new ATOM 0 HG23 ILE A 42 13.067 6.275 -1.851 1.00 0.78 H new ATOM 0 HD11 ILE A 42 15.448 3.796 -3.294 1.00 0.87 H new ATOM 0 HD12 ILE A 42 14.172 5.029 -3.155 1.00 0.87 H new ATOM 0 HD13 ILE A 42 15.849 5.429 -2.710 1.00 0.87 H new ATOM 591 N LEU A 43 14.993 7.543 1.858 1.00 0.64 N ATOM 592 CA LEU A 43 14.511 8.560 2.783 1.00 0.70 C ATOM 593 C LEU A 43 15.224 9.893 2.563 1.00 0.75 C ATOM 594 O LEU A 43 14.591 10.902 2.257 1.00 0.75 O ATOM 595 CB LEU A 43 14.720 8.095 4.225 1.00 0.85 C ATOM 596 CG LEU A 43 14.146 9.014 5.304 1.00 1.07 C ATOM 597 CD1 LEU A 43 12.625 8.974 5.284 1.00 1.20 C ATOM 598 CD2 LEU A 43 14.679 8.622 6.674 1.00 1.43 C ATOM 0 H LEU A 43 15.507 6.782 2.302 1.00 0.64 H new ATOM 0 HA LEU A 43 13.447 8.708 2.596 1.00 0.70 H new ATOM 0 HB2 LEU A 43 14.273 7.108 4.338 1.00 0.85 H new ATOM 0 HB3 LEU A 43 15.790 7.982 4.400 1.00 0.85 H new ATOM 0 HG LEU A 43 14.462 10.036 5.094 1.00 1.07 H new ATOM 0 HD11 LEU A 43 12.233 9.634 6.058 1.00 1.20 H new ATOM 0 HD12 LEU A 43 12.265 9.304 4.310 1.00 1.20 H new ATOM 0 HD13 LEU A 43 12.285 7.955 5.470 1.00 1.20 H new ATOM 0 HD21 LEU A 43 14.261 9.286 7.431 1.00 1.43 H new ATOM 0 HD22 LEU A 43 14.393 7.594 6.895 1.00 1.43 H new ATOM 0 HD23 LEU A 43 15.766 8.705 6.679 1.00 1.43 H new ATOM 610 N LEU A 44 16.549 9.886 2.698 1.00 0.85 N ATOM 611 CA LEU A 44 17.342 11.112 2.590 1.00 0.98 C ATOM 612 C LEU A 44 17.400 11.620 1.148 1.00 0.92 C ATOM 613 O LEU A 44 17.886 12.723 0.895 1.00 1.03 O ATOM 614 CB LEU A 44 18.758 10.908 3.167 1.00 1.19 C ATOM 615 CG LEU A 44 19.556 9.711 2.628 1.00 1.33 C ATOM 616 CD1 LEU A 44 20.121 9.992 1.244 1.00 1.54 C ATOM 617 CD2 LEU A 44 20.672 9.344 3.590 1.00 1.66 C ATOM 0 H LEU A 44 17.097 9.046 2.882 1.00 0.85 H new ATOM 0 HA LEU A 44 16.844 11.878 3.184 1.00 0.98 H new ATOM 0 HB2 LEU A 44 19.335 11.814 2.981 1.00 1.19 H new ATOM 0 HB3 LEU A 44 18.673 10.801 4.248 1.00 1.19 H new ATOM 0 HG LEU A 44 18.871 8.868 2.541 1.00 1.33 H new ATOM 0 HD11 LEU A 44 20.679 9.123 0.896 1.00 1.54 H new ATOM 0 HD12 LEU A 44 19.304 10.200 0.553 1.00 1.54 H new ATOM 0 HD13 LEU A 44 20.785 10.855 1.291 1.00 1.54 H new ATOM 0 HD21 LEU A 44 21.229 8.494 3.195 1.00 1.66 H new ATOM 0 HD22 LEU A 44 21.344 10.194 3.709 1.00 1.66 H new ATOM 0 HD23 LEU A 44 20.246 9.080 4.558 1.00 1.66 H new ATOM 629 N ASN A 45 16.916 10.797 0.219 1.00 0.84 N ATOM 630 CA ASN A 45 16.861 11.151 -1.199 1.00 0.91 C ATOM 631 C ASN A 45 16.280 12.544 -1.401 1.00 0.88 C ATOM 632 O ASN A 45 16.933 13.430 -1.953 1.00 1.02 O ATOM 633 CB ASN A 45 15.999 10.144 -1.954 1.00 1.01 C ATOM 634 CG ASN A 45 15.959 10.404 -3.446 1.00 1.17 C ATOM 635 OD1 ASN A 45 16.927 10.878 -4.036 1.00 1.88 O ATOM 636 ND2 ASN A 45 14.831 10.097 -4.066 1.00 1.32 N ATOM 0 H ASN A 45 16.551 9.867 0.427 1.00 0.84 H new ATOM 0 HA ASN A 45 17.881 11.137 -1.583 1.00 0.91 H new ATOM 0 HB2 ASN A 45 16.382 9.139 -1.776 1.00 1.01 H new ATOM 0 HB3 ASN A 45 14.984 10.173 -1.558 1.00 1.01 H new ATOM 0 HD21 ASN A 45 14.742 10.252 -5.070 1.00 1.32 H new ATOM 0 HD22 ASN A 45 14.050 9.705 -3.540 1.00 1.32 H new ATOM 643 N THR A 46 15.059 12.734 -0.935 1.00 0.79 N ATOM 644 CA THR A 46 14.370 13.990 -1.134 1.00 0.85 C ATOM 645 C THR A 46 14.082 14.669 0.200 1.00 0.79 C ATOM 646 O THR A 46 13.117 14.330 0.878 1.00 0.68 O ATOM 647 CB THR A 46 13.045 13.766 -1.888 1.00 0.93 C ATOM 648 OG1 THR A 46 13.281 12.994 -3.073 1.00 1.15 O ATOM 649 CG2 THR A 46 12.397 15.090 -2.263 1.00 1.12 C ATOM 0 H THR A 46 14.527 12.034 -0.417 1.00 0.79 H new ATOM 0 HA THR A 46 15.019 14.634 -1.727 1.00 0.85 H new ATOM 0 HB THR A 46 12.367 13.225 -1.227 1.00 0.93 H new ATOM 0 HG1 THR A 46 12.434 12.854 -3.546 1.00 1.15 H new ATOM 0 HG21 THR A 46 11.464 14.901 -2.794 1.00 1.12 H new ATOM 0 HG22 THR A 46 12.191 15.663 -1.359 1.00 1.12 H new ATOM 0 HG23 THR A 46 13.072 15.656 -2.905 1.00 1.12 H new ATOM 657 N SER A 47 14.953 15.602 0.585 1.00 0.97 N ATOM 658 CA SER A 47 14.747 16.435 1.769 1.00 1.13 C ATOM 659 C SER A 47 14.616 15.601 3.053 1.00 1.06 C ATOM 660 O SER A 47 14.162 16.110 4.079 1.00 1.32 O ATOM 661 CB SER A 47 13.494 17.295 1.563 1.00 1.29 C ATOM 662 OG SER A 47 13.385 18.310 2.550 1.00 1.87 O ATOM 0 H SER A 47 15.820 15.801 0.085 1.00 0.97 H new ATOM 0 HA SER A 47 15.624 17.070 1.894 1.00 1.13 H new ATOM 0 HB2 SER A 47 13.525 17.751 0.574 1.00 1.29 H new ATOM 0 HB3 SER A 47 12.608 16.661 1.594 1.00 1.29 H new ATOM 0 HG SER A 47 13.607 17.937 3.429 1.00 1.87 H new ATOM 668 N ALA A 48 15.034 14.333 2.985 1.00 0.92 N ATOM 669 CA ALA A 48 14.899 13.385 4.098 1.00 0.97 C ATOM 670 C ALA A 48 13.429 13.061 4.373 1.00 0.88 C ATOM 671 O ALA A 48 13.095 12.424 5.374 1.00 1.00 O ATOM 672 CB ALA A 48 15.589 13.902 5.354 1.00 1.22 C ATOM 0 H ALA A 48 15.476 13.934 2.157 1.00 0.92 H new ATOM 0 HA ALA A 48 15.396 12.461 3.804 1.00 0.97 H new ATOM 0 HB1 ALA A 48 15.470 13.177 6.159 1.00 1.22 H new ATOM 0 HB2 ALA A 48 16.650 14.049 5.152 1.00 1.22 H new ATOM 0 HB3 ALA A 48 15.141 14.850 5.651 1.00 1.22 H new ATOM 678 N ILE A 49 12.562 13.494 3.465 1.00 0.78 N ATOM 679 CA ILE A 49 11.133 13.223 3.546 1.00 0.75 C ATOM 680 C ILE A 49 10.598 12.950 2.142 1.00 0.62 C ATOM 681 O ILE A 49 10.259 13.881 1.409 1.00 0.65 O ATOM 682 CB ILE A 49 10.344 14.407 4.163 1.00 0.86 C ATOM 683 CG1 ILE A 49 10.902 14.779 5.542 1.00 1.17 C ATOM 684 CG2 ILE A 49 8.862 14.060 4.268 1.00 0.95 C ATOM 685 CD1 ILE A 49 10.239 15.991 6.163 1.00 1.93 C ATOM 0 H ILE A 49 12.832 14.044 2.650 1.00 0.78 H new ATOM 0 HA ILE A 49 10.996 12.357 4.194 1.00 0.75 H new ATOM 0 HB ILE A 49 10.458 15.269 3.506 1.00 0.86 H new ATOM 0 HG12 ILE A 49 10.784 13.928 6.213 1.00 1.17 H new ATOM 0 HG13 ILE A 49 11.972 14.968 5.452 1.00 1.17 H new ATOM 0 HG21 ILE A 49 8.321 14.901 4.703 1.00 0.95 H new ATOM 0 HG22 ILE A 49 8.466 13.849 3.274 1.00 0.95 H new ATOM 0 HG23 ILE A 49 8.738 13.182 4.902 1.00 0.95 H new ATOM 0 HD11 ILE A 49 10.687 16.192 7.136 1.00 1.93 H new ATOM 0 HD12 ILE A 49 10.379 16.855 5.514 1.00 1.93 H new ATOM 0 HD13 ILE A 49 9.173 15.799 6.287 1.00 1.93 H new ATOM 697 N PRO A 50 10.552 11.669 1.739 1.00 0.57 N ATOM 698 CA PRO A 50 10.134 11.281 0.390 1.00 0.52 C ATOM 699 C PRO A 50 8.727 11.770 0.053 1.00 0.53 C ATOM 700 O PRO A 50 7.736 11.338 0.651 1.00 0.53 O ATOM 701 CB PRO A 50 10.199 9.750 0.407 1.00 0.54 C ATOM 702 CG PRO A 50 11.084 9.410 1.557 1.00 0.66 C ATOM 703 CD PRO A 50 10.902 10.508 2.565 1.00 0.68 C ATOM 0 HA PRO A 50 10.771 11.726 -0.374 1.00 0.52 H new ATOM 0 HB2 PRO A 50 9.207 9.315 0.531 1.00 0.54 H new ATOM 0 HB3 PRO A 50 10.602 9.362 -0.529 1.00 0.54 H new ATOM 0 HG2 PRO A 50 10.815 8.443 1.982 1.00 0.66 H new ATOM 0 HG3 PRO A 50 12.125 9.341 1.240 1.00 0.66 H new ATOM 0 HD2 PRO A 50 10.114 10.271 3.280 1.00 0.68 H new ATOM 0 HD3 PRO A 50 11.812 10.682 3.139 1.00 0.68 H new ATOM 711 N ASP A 51 8.657 12.673 -0.917 1.00 0.59 N ATOM 712 CA ASP A 51 7.402 13.289 -1.338 1.00 0.63 C ATOM 713 C ASP A 51 6.512 12.287 -2.061 1.00 0.52 C ATOM 714 O ASP A 51 5.328 12.537 -2.276 1.00 0.54 O ATOM 715 CB ASP A 51 7.693 14.485 -2.252 1.00 0.84 C ATOM 716 CG ASP A 51 8.450 14.093 -3.510 1.00 1.30 C ATOM 717 OD1 ASP A 51 9.602 13.615 -3.398 1.00 2.04 O ATOM 718 OD2 ASP A 51 7.905 14.264 -4.620 1.00 1.86 O ATOM 0 H ASP A 51 9.471 13.001 -1.437 1.00 0.59 H new ATOM 0 HA ASP A 51 6.873 13.630 -0.448 1.00 0.63 H new ATOM 0 HB2 ASP A 51 6.753 14.960 -2.532 1.00 0.84 H new ATOM 0 HB3 ASP A 51 8.272 15.226 -1.701 1.00 0.84 H new ATOM 723 N ASN A 52 7.080 11.136 -2.402 1.00 0.47 N ATOM 724 CA ASN A 52 6.349 10.115 -3.142 1.00 0.49 C ATOM 725 C ASN A 52 5.322 9.427 -2.255 1.00 0.43 C ATOM 726 O ASN A 52 4.470 8.693 -2.745 1.00 0.56 O ATOM 727 CB ASN A 52 7.308 9.069 -3.717 1.00 0.59 C ATOM 728 CG ASN A 52 7.937 8.197 -2.647 1.00 1.32 C ATOM 729 OD1 ASN A 52 8.984 8.528 -2.098 1.00 2.22 O ATOM 730 ND2 ASN A 52 7.307 7.067 -2.352 1.00 1.84 N ATOM 0 H ASN A 52 8.043 10.887 -2.178 1.00 0.47 H new ATOM 0 HA ASN A 52 5.830 10.613 -3.961 1.00 0.49 H new ATOM 0 HB2 ASN A 52 6.769 8.438 -4.423 1.00 0.59 H new ATOM 0 HB3 ASN A 52 8.095 9.574 -4.277 1.00 0.59 H new ATOM 0 HD21 ASN A 52 7.691 6.438 -1.647 1.00 1.84 H new ATOM 0 HD22 ASN A 52 6.439 6.827 -2.831 1.00 1.84 H new ATOM 737 N TYR A 53 5.398 9.674 -0.952 1.00 0.39 N ATOM 738 CA TYR A 53 4.489 9.043 0.001 1.00 0.52 C ATOM 739 C TYR A 53 3.078 9.613 -0.101 1.00 0.56 C ATOM 740 O TYR A 53 2.176 9.189 0.619 1.00 0.83 O ATOM 741 CB TYR A 53 4.998 9.215 1.433 1.00 0.66 C ATOM 742 CG TYR A 53 6.176 8.336 1.788 1.00 0.63 C ATOM 743 CD1 TYR A 53 6.295 7.052 1.270 1.00 0.67 C ATOM 744 CD2 TYR A 53 7.157 8.782 2.665 1.00 0.67 C ATOM 745 CE1 TYR A 53 7.359 6.240 1.616 1.00 0.73 C ATOM 746 CE2 TYR A 53 8.224 7.977 3.011 1.00 0.67 C ATOM 747 CZ TYR A 53 8.320 6.707 2.486 1.00 0.70 C ATOM 748 OH TYR A 53 9.378 5.902 2.841 1.00 0.79 O ATOM 0 H TYR A 53 6.079 10.306 -0.531 1.00 0.39 H new ATOM 0 HA TYR A 53 4.454 7.983 -0.249 1.00 0.52 H new ATOM 0 HB2 TYR A 53 5.280 10.257 1.582 1.00 0.66 H new ATOM 0 HB3 TYR A 53 4.182 9.004 2.124 1.00 0.66 H new ATOM 0 HD1 TYR A 53 5.545 6.683 0.587 1.00 0.67 H new ATOM 0 HD2 TYR A 53 7.084 9.775 3.083 1.00 0.67 H new ATOM 0 HE1 TYR A 53 7.437 5.244 1.206 1.00 0.73 H new ATOM 0 HE2 TYR A 53 8.980 8.341 3.690 1.00 0.67 H new ATOM 0 HH TYR A 53 9.670 5.383 2.063 1.00 0.79 H new ATOM 758 N LYS A 54 2.886 10.579 -0.980 1.00 0.46 N ATOM 759 CA LYS A 54 1.584 11.188 -1.152 1.00 0.49 C ATOM 760 C LYS A 54 1.467 11.802 -2.541 1.00 0.52 C ATOM 761 O LYS A 54 2.459 12.253 -3.112 1.00 0.72 O ATOM 762 CB LYS A 54 1.359 12.254 -0.073 1.00 0.61 C ATOM 763 CG LYS A 54 2.422 13.344 -0.052 1.00 0.85 C ATOM 764 CD LYS A 54 2.320 14.186 1.209 1.00 1.15 C ATOM 765 CE LYS A 54 3.362 15.296 1.239 1.00 1.15 C ATOM 766 NZ LYS A 54 4.742 14.783 1.032 1.00 1.75 N ATOM 0 H LYS A 54 3.615 10.957 -1.584 1.00 0.46 H new ATOM 0 HA LYS A 54 0.818 10.420 -1.051 1.00 0.49 H new ATOM 0 HB2 LYS A 54 0.383 12.714 -0.229 1.00 0.61 H new ATOM 0 HB3 LYS A 54 1.330 11.769 0.903 1.00 0.61 H new ATOM 0 HG2 LYS A 54 3.412 12.892 -0.111 1.00 0.85 H new ATOM 0 HG3 LYS A 54 2.310 13.982 -0.929 1.00 0.85 H new ATOM 0 HD2 LYS A 54 1.323 14.622 1.274 1.00 1.15 H new ATOM 0 HD3 LYS A 54 2.446 13.547 2.083 1.00 1.15 H new ATOM 0 HE2 LYS A 54 3.130 16.029 0.467 1.00 1.15 H new ATOM 0 HE3 LYS A 54 3.310 15.814 2.197 1.00 1.15 H new ATOM 0 HZ1 LYS A 54 5.428 15.530 1.260 1.00 1.75 H new ATOM 0 HZ2 LYS A 54 4.904 13.963 1.651 1.00 1.75 H new ATOM 0 HZ3 LYS A 54 4.860 14.496 0.039 1.00 1.75 H new ATOM 780 N ASP A 55 0.266 11.787 -3.093 1.00 0.48 N ATOM 781 CA ASP A 55 0.013 12.395 -4.390 1.00 0.51 C ATOM 782 C ASP A 55 -1.149 13.372 -4.300 1.00 0.60 C ATOM 783 O ASP A 55 -2.172 13.070 -3.691 1.00 0.72 O ATOM 784 CB ASP A 55 -0.284 11.329 -5.442 1.00 0.49 C ATOM 785 CG ASP A 55 -0.642 11.925 -6.782 1.00 0.90 C ATOM 786 OD1 ASP A 55 0.246 12.491 -7.453 1.00 1.35 O ATOM 787 OD2 ASP A 55 -1.819 11.842 -7.164 1.00 1.29 O ATOM 0 H ASP A 55 -0.553 11.359 -2.662 1.00 0.48 H new ATOM 0 HA ASP A 55 0.910 12.937 -4.689 1.00 0.51 H new ATOM 0 HB2 ASP A 55 0.586 10.683 -5.556 1.00 0.49 H new ATOM 0 HB3 ASP A 55 -1.105 10.700 -5.096 1.00 0.49 H new ATOM 792 N THR A 56 -0.987 14.539 -4.901 1.00 0.67 N ATOM 793 CA THR A 56 -2.031 15.548 -4.895 1.00 0.78 C ATOM 794 C THR A 56 -2.770 15.562 -6.228 1.00 0.75 C ATOM 795 O THR A 56 -3.658 16.385 -6.463 1.00 0.78 O ATOM 796 CB THR A 56 -1.443 16.937 -4.597 1.00 0.98 C ATOM 797 OG1 THR A 56 -0.251 17.132 -5.367 1.00 1.50 O ATOM 798 CG2 THR A 56 -1.124 17.080 -3.116 1.00 1.52 C ATOM 0 H THR A 56 -0.140 14.811 -5.400 1.00 0.67 H new ATOM 0 HA THR A 56 -2.741 15.297 -4.107 1.00 0.78 H new ATOM 0 HB THR A 56 -2.182 17.691 -4.868 1.00 0.98 H new ATOM 0 HG1 THR A 56 0.120 18.019 -5.176 1.00 1.50 H new ATOM 0 HG21 THR A 56 -0.709 18.070 -2.927 1.00 1.52 H new ATOM 0 HG22 THR A 56 -2.036 16.952 -2.533 1.00 1.52 H new ATOM 0 HG23 THR A 56 -0.398 16.321 -2.825 1.00 1.52 H new ATOM 806 N THR A 57 -2.394 14.627 -7.093 1.00 0.76 N ATOM 807 CA THR A 57 -3.036 14.453 -8.384 1.00 0.79 C ATOM 808 C THR A 57 -4.235 13.515 -8.239 1.00 0.74 C ATOM 809 O THR A 57 -4.949 13.236 -9.206 1.00 1.04 O ATOM 810 CB THR A 57 -2.053 13.872 -9.414 1.00 0.89 C ATOM 811 OG1 THR A 57 -0.732 14.376 -9.160 1.00 1.00 O ATOM 812 CG2 THR A 57 -2.471 14.236 -10.832 1.00 1.05 C ATOM 0 H THR A 57 -1.635 13.969 -6.916 1.00 0.76 H new ATOM 0 HA THR A 57 -3.369 15.429 -8.736 1.00 0.79 H new ATOM 0 HB THR A 57 -2.060 12.786 -9.319 1.00 0.89 H new ATOM 0 HG1 THR A 57 -0.260 13.766 -8.556 1.00 1.00 H new ATOM 0 HG21 THR A 57 -1.759 13.813 -11.541 1.00 1.05 H new ATOM 0 HG22 THR A 57 -3.465 13.835 -11.033 1.00 1.05 H new ATOM 0 HG23 THR A 57 -2.489 15.321 -10.939 1.00 1.05 H new ATOM 820 N ASN A 58 -4.400 13.019 -7.008 1.00 0.65 N ATOM 821 CA ASN A 58 -5.537 12.187 -6.591 1.00 0.70 C ATOM 822 C ASN A 58 -5.296 10.714 -6.900 1.00 0.59 C ATOM 823 O ASN A 58 -6.250 9.945 -7.022 1.00 0.66 O ATOM 824 CB ASN A 58 -6.865 12.628 -7.232 1.00 0.95 C ATOM 825 CG ASN A 58 -7.178 14.107 -7.059 1.00 1.91 C ATOM 826 OD1 ASN A 58 -7.913 14.686 -7.858 1.00 2.73 O ATOM 827 ND2 ASN A 58 -6.609 14.734 -6.044 1.00 2.46 N ATOM 0 H ASN A 58 -3.732 13.188 -6.256 1.00 0.65 H new ATOM 0 HA ASN A 58 -5.620 12.323 -5.513 1.00 0.70 H new ATOM 0 HB2 ASN A 58 -6.837 12.396 -8.297 1.00 0.95 H new ATOM 0 HB3 ASN A 58 -7.677 12.043 -6.800 1.00 0.95 H new ATOM 0 HD21 ASN A 58 -6.774 15.731 -5.903 1.00 2.46 H new ATOM 0 HD22 ASN A 58 -6.005 14.221 -5.401 1.00 2.46 H new ATOM 834 N LYS A 59 -4.031 10.308 -7.015 1.00 0.52 N ATOM 835 CA LYS A 59 -3.722 8.908 -7.296 1.00 0.51 C ATOM 836 C LYS A 59 -2.306 8.485 -6.869 1.00 0.45 C ATOM 837 O LYS A 59 -1.360 8.547 -7.651 1.00 0.48 O ATOM 838 CB LYS A 59 -3.954 8.601 -8.787 1.00 0.58 C ATOM 839 CG LYS A 59 -3.797 9.802 -9.723 1.00 0.83 C ATOM 840 CD LYS A 59 -2.344 10.167 -9.973 1.00 0.64 C ATOM 841 CE LYS A 59 -1.618 9.083 -10.750 1.00 1.53 C ATOM 842 NZ LYS A 59 -2.175 8.905 -12.118 1.00 2.11 N ATOM 0 H LYS A 59 -3.218 10.917 -6.920 1.00 0.52 H new ATOM 0 HA LYS A 59 -4.405 8.316 -6.686 1.00 0.51 H new ATOM 0 HB2 LYS A 59 -3.255 7.824 -9.096 1.00 0.58 H new ATOM 0 HB3 LYS A 59 -4.958 8.193 -8.907 1.00 0.58 H new ATOM 0 HG2 LYS A 59 -4.280 9.581 -10.675 1.00 0.83 H new ATOM 0 HG3 LYS A 59 -4.314 10.661 -9.295 1.00 0.83 H new ATOM 0 HD2 LYS A 59 -2.294 11.106 -10.525 1.00 0.64 H new ATOM 0 HD3 LYS A 59 -1.841 10.331 -9.020 1.00 0.64 H new ATOM 0 HE2 LYS A 59 -0.560 9.335 -10.820 1.00 1.53 H new ATOM 0 HE3 LYS A 59 -1.686 8.141 -10.206 1.00 1.53 H new ATOM 0 HZ1 LYS A 59 -1.525 8.324 -12.685 1.00 2.11 H new ATOM 0 HZ2 LYS A 59 -3.099 8.432 -12.058 1.00 2.11 H new ATOM 0 HZ3 LYS A 59 -2.291 9.835 -12.569 1.00 2.11 H new ATOM 856 N LYS A 60 -2.170 8.050 -5.619 1.00 0.41 N ATOM 857 CA LYS A 60 -0.948 7.381 -5.162 1.00 0.38 C ATOM 858 C LYS A 60 -1.298 6.194 -4.276 1.00 0.38 C ATOM 859 O LYS A 60 -1.997 6.352 -3.278 1.00 0.41 O ATOM 860 CB LYS A 60 -0.042 8.329 -4.373 1.00 0.41 C ATOM 861 CG LYS A 60 1.317 7.730 -4.029 1.00 0.45 C ATOM 862 CD LYS A 60 2.334 7.961 -5.135 1.00 1.22 C ATOM 863 CE LYS A 60 2.751 9.425 -5.205 1.00 2.18 C ATOM 864 NZ LYS A 60 3.893 9.655 -6.132 1.00 3.14 N ATOM 0 H LYS A 60 -2.889 8.147 -4.902 1.00 0.41 H new ATOM 0 HA LYS A 60 -0.414 7.046 -6.052 1.00 0.38 H new ATOM 0 HB2 LYS A 60 0.108 9.240 -4.952 1.00 0.41 H new ATOM 0 HB3 LYS A 60 -0.547 8.617 -3.451 1.00 0.41 H new ATOM 0 HG2 LYS A 60 1.683 8.170 -3.101 1.00 0.45 H new ATOM 0 HG3 LYS A 60 1.208 6.660 -3.853 1.00 0.45 H new ATOM 0 HD2 LYS A 60 3.212 7.338 -4.961 1.00 1.22 H new ATOM 0 HD3 LYS A 60 1.910 7.655 -6.092 1.00 1.22 H new ATOM 0 HE2 LYS A 60 1.900 10.025 -5.527 1.00 2.18 H new ATOM 0 HE3 LYS A 60 3.024 9.769 -4.207 1.00 2.18 H new ATOM 0 HZ1 LYS A 60 4.527 10.375 -5.730 1.00 3.14 H new ATOM 0 HZ2 LYS A 60 4.417 8.767 -6.264 1.00 3.14 H new ATOM 0 HZ3 LYS A 60 3.534 9.984 -7.051 1.00 3.14 H new ATOM 878 N ILE A 61 -0.818 5.009 -4.637 1.00 0.37 N ATOM 879 CA ILE A 61 -1.030 3.818 -3.819 1.00 0.38 C ATOM 880 C ILE A 61 0.230 2.953 -3.764 1.00 0.38 C ATOM 881 O ILE A 61 0.842 2.666 -4.790 1.00 0.45 O ATOM 882 CB ILE A 61 -2.217 2.960 -4.326 1.00 0.45 C ATOM 883 CG1 ILE A 61 -2.051 2.585 -5.803 1.00 0.49 C ATOM 884 CG2 ILE A 61 -3.535 3.689 -4.112 1.00 0.47 C ATOM 885 CD1 ILE A 61 -3.205 1.776 -6.352 1.00 0.55 C ATOM 0 H ILE A 61 -0.281 4.846 -5.489 1.00 0.37 H new ATOM 0 HA ILE A 61 -1.269 4.175 -2.817 1.00 0.38 H new ATOM 0 HB ILE A 61 -2.226 2.037 -3.746 1.00 0.45 H new ATOM 0 HG12 ILE A 61 -1.944 3.496 -6.391 1.00 0.49 H new ATOM 0 HG13 ILE A 61 -1.129 2.017 -5.924 1.00 0.49 H new ATOM 0 HG21 ILE A 61 -4.356 3.070 -4.474 1.00 0.47 H new ATOM 0 HG22 ILE A 61 -3.672 3.888 -3.049 1.00 0.47 H new ATOM 0 HG23 ILE A 61 -3.522 4.632 -4.659 1.00 0.47 H new ATOM 0 HD11 ILE A 61 -3.021 1.546 -7.401 1.00 0.55 H new ATOM 0 HD12 ILE A 61 -3.300 0.848 -5.788 1.00 0.55 H new ATOM 0 HD13 ILE A 61 -4.127 2.350 -6.263 1.00 0.55 H new ATOM 897 N THR A 62 0.632 2.566 -2.561 1.00 0.39 N ATOM 898 CA THR A 62 1.748 1.646 -2.397 1.00 0.45 C ATOM 899 C THR A 62 1.257 0.201 -2.468 1.00 0.50 C ATOM 900 O THR A 62 0.459 -0.217 -1.636 1.00 0.62 O ATOM 901 CB THR A 62 2.485 1.871 -1.060 1.00 0.56 C ATOM 902 OG1 THR A 62 3.188 3.117 -1.079 1.00 0.84 O ATOM 903 CG2 THR A 62 3.456 0.744 -0.781 1.00 0.84 C ATOM 0 H THR A 62 0.204 2.874 -1.688 1.00 0.39 H new ATOM 0 HA THR A 62 2.449 1.839 -3.209 1.00 0.45 H new ATOM 0 HB THR A 62 1.738 1.893 -0.267 1.00 0.56 H new ATOM 0 HG1 THR A 62 3.733 3.198 -0.268 1.00 0.84 H new ATOM 0 HG21 THR A 62 3.963 0.926 0.167 1.00 0.84 H new ATOM 0 HG22 THR A 62 2.913 -0.199 -0.726 1.00 0.84 H new ATOM 0 HG23 THR A 62 4.193 0.692 -1.582 1.00 0.84 H new ATOM 911 N ASN A 63 1.738 -0.534 -3.479 1.00 0.52 N ATOM 912 CA ASN A 63 1.329 -1.924 -3.752 1.00 0.61 C ATOM 913 C ASN A 63 1.617 -2.319 -5.201 1.00 0.76 C ATOM 914 O ASN A 63 2.296 -3.316 -5.449 1.00 1.31 O ATOM 915 CB ASN A 63 -0.170 -2.146 -3.500 1.00 1.03 C ATOM 916 CG ASN A 63 -0.657 -3.520 -3.942 1.00 1.80 C ATOM 917 OD1 ASN A 63 -1.066 -3.711 -5.085 1.00 2.50 O ATOM 918 ND2 ASN A 63 -0.638 -4.480 -3.030 1.00 2.26 N ATOM 0 H ASN A 63 2.430 -0.179 -4.139 1.00 0.52 H new ATOM 0 HA ASN A 63 1.912 -2.541 -3.068 1.00 0.61 H new ATOM 0 HB2 ASN A 63 -0.375 -2.020 -2.437 1.00 1.03 H new ATOM 0 HB3 ASN A 63 -0.738 -1.380 -4.028 1.00 1.03 H new ATOM 0 HD21 ASN A 63 -0.970 -5.415 -3.267 1.00 2.26 H new ATOM 0 HD22 ASN A 63 -0.291 -4.284 -2.091 1.00 2.26 H new ATOM 925 N PRO A 64 1.115 -1.538 -6.182 1.00 0.64 N ATOM 926 CA PRO A 64 1.033 -1.970 -7.574 1.00 0.97 C ATOM 927 C PRO A 64 2.356 -1.856 -8.315 1.00 1.15 C ATOM 928 O PRO A 64 3.256 -1.122 -7.909 1.00 1.75 O ATOM 929 CB PRO A 64 -0.012 -1.013 -8.185 1.00 0.91 C ATOM 930 CG PRO A 64 -0.458 -0.120 -7.072 1.00 0.85 C ATOM 931 CD PRO A 64 0.629 -0.163 -6.047 1.00 0.60 C ATOM 0 HA PRO A 64 0.768 -3.025 -7.649 1.00 0.97 H new ATOM 0 HB2 PRO A 64 0.420 -0.433 -9.000 1.00 0.91 H new ATOM 0 HB3 PRO A 64 -0.853 -1.568 -8.600 1.00 0.91 H new ATOM 0 HG2 PRO A 64 -0.618 0.898 -7.429 1.00 0.85 H new ATOM 0 HG3 PRO A 64 -1.404 -0.463 -6.652 1.00 0.85 H new ATOM 0 HD2 PRO A 64 1.411 0.569 -6.250 1.00 0.60 H new ATOM 0 HD3 PRO A 64 0.254 0.041 -5.044 1.00 0.60 H new ATOM 939 N PHE A 65 2.456 -2.580 -9.421 1.00 1.16 N ATOM 940 CA PHE A 65 3.659 -2.566 -10.241 1.00 1.47 C ATOM 941 C PHE A 65 3.305 -2.401 -11.717 1.00 1.30 C ATOM 942 O PHE A 65 4.176 -2.452 -12.584 1.00 1.80 O ATOM 943 CB PHE A 65 4.472 -3.852 -10.026 1.00 2.09 C ATOM 944 CG PHE A 65 3.686 -5.121 -10.219 1.00 2.12 C ATOM 945 CD1 PHE A 65 3.566 -5.688 -11.477 1.00 2.65 C ATOM 946 CD2 PHE A 65 3.062 -5.741 -9.148 1.00 2.10 C ATOM 947 CE1 PHE A 65 2.843 -6.850 -11.665 1.00 3.23 C ATOM 948 CE2 PHE A 65 2.339 -6.903 -9.328 1.00 2.47 C ATOM 949 CZ PHE A 65 2.242 -7.470 -10.564 1.00 3.09 C ATOM 0 H PHE A 65 1.715 -3.187 -9.772 1.00 1.16 H new ATOM 0 HA PHE A 65 4.269 -1.715 -9.937 1.00 1.47 H new ATOM 0 HB2 PHE A 65 5.317 -3.853 -10.715 1.00 2.09 H new ATOM 0 HB3 PHE A 65 4.884 -3.843 -9.017 1.00 2.09 H new ATOM 0 HD1 PHE A 65 4.044 -5.215 -12.322 1.00 2.65 H new ATOM 0 HD2 PHE A 65 3.142 -5.310 -8.161 1.00 2.10 H new ATOM 0 HE1 PHE A 65 2.743 -7.276 -12.652 1.00 3.23 H new ATOM 0 HE2 PHE A 65 1.847 -7.366 -8.485 1.00 2.47 H new ATOM 0 HZ PHE A 65 1.702 -8.396 -10.693 1.00 3.09 H new ATOM 959 N GLY A 66 2.027 -2.176 -11.996 1.00 0.85 N ATOM 960 CA GLY A 66 1.574 -2.063 -13.371 1.00 0.86 C ATOM 961 C GLY A 66 1.418 -0.623 -13.795 1.00 0.86 C ATOM 962 O GLY A 66 0.519 -0.281 -14.563 1.00 1.21 O ATOM 0 H GLY A 66 1.295 -2.069 -11.294 1.00 0.85 H new ATOM 0 HA2 GLY A 66 2.286 -2.560 -14.030 1.00 0.86 H new ATOM 0 HA3 GLY A 66 0.621 -2.580 -13.483 1.00 0.86 H new ATOM 966 N GLY A 67 2.283 0.225 -13.268 1.00 0.70 N ATOM 967 CA GLY A 67 2.236 1.634 -13.552 1.00 0.70 C ATOM 968 C GLY A 67 3.547 2.274 -13.190 1.00 0.65 C ATOM 969 O GLY A 67 4.598 1.636 -13.288 1.00 0.67 O ATOM 0 H GLY A 67 3.033 -0.050 -12.634 1.00 0.70 H new ATOM 0 HA2 GLY A 67 2.023 1.794 -14.609 1.00 0.70 H new ATOM 0 HA3 GLY A 67 1.427 2.100 -12.990 1.00 0.70 H new ATOM 973 N GLU A 68 3.499 3.505 -12.735 1.00 0.63 N ATOM 974 CA GLU A 68 4.695 4.170 -12.263 1.00 0.64 C ATOM 975 C GLU A 68 4.905 3.866 -10.788 1.00 0.58 C ATOM 976 O GLU A 68 4.262 4.465 -9.927 1.00 0.59 O ATOM 977 CB GLU A 68 4.557 5.668 -12.474 1.00 0.73 C ATOM 978 CG GLU A 68 4.417 6.067 -13.928 1.00 1.36 C ATOM 979 CD GLU A 68 5.527 5.510 -14.793 1.00 1.84 C ATOM 980 OE1 GLU A 68 6.648 6.058 -14.756 1.00 1.99 O ATOM 981 OE2 GLU A 68 5.287 4.514 -15.510 1.00 2.78 O ATOM 0 H GLU A 68 2.649 4.066 -12.681 1.00 0.63 H new ATOM 0 HA GLU A 68 5.558 3.808 -12.822 1.00 0.64 H new ATOM 0 HB2 GLU A 68 3.687 6.025 -11.923 1.00 0.73 H new ATOM 0 HB3 GLU A 68 5.429 6.167 -12.052 1.00 0.73 H new ATOM 0 HG2 GLU A 68 3.456 5.717 -14.306 1.00 1.36 H new ATOM 0 HG3 GLU A 68 4.413 7.154 -14.004 1.00 1.36 H new ATOM 988 N LEU A 69 5.801 2.936 -10.505 1.00 0.57 N ATOM 989 CA LEU A 69 6.049 2.506 -9.134 1.00 0.57 C ATOM 990 C LEU A 69 7.417 2.960 -8.636 1.00 0.55 C ATOM 991 O LEU A 69 8.396 2.978 -9.387 1.00 0.60 O ATOM 992 CB LEU A 69 5.929 0.978 -8.996 1.00 0.69 C ATOM 993 CG LEU A 69 7.102 0.137 -9.539 1.00 0.83 C ATOM 994 CD1 LEU A 69 7.032 -1.278 -8.995 1.00 1.15 C ATOM 995 CD2 LEU A 69 7.109 0.096 -11.061 1.00 1.17 C ATOM 0 H LEU A 69 6.371 2.462 -11.205 1.00 0.57 H new ATOM 0 HA LEU A 69 5.284 2.978 -8.517 1.00 0.57 H new ATOM 0 HB2 LEU A 69 5.802 0.741 -7.940 1.00 0.69 H new ATOM 0 HB3 LEU A 69 5.019 0.661 -9.506 1.00 0.69 H new ATOM 0 HG LEU A 69 8.024 0.613 -9.207 1.00 0.83 H new ATOM 0 HD11 LEU A 69 7.866 -1.860 -9.387 1.00 1.15 H new ATOM 0 HD12 LEU A 69 7.087 -1.253 -7.907 1.00 1.15 H new ATOM 0 HD13 LEU A 69 6.093 -1.739 -9.300 1.00 1.15 H new ATOM 0 HD21 LEU A 69 7.950 -0.506 -11.405 1.00 1.17 H new ATOM 0 HD22 LEU A 69 6.178 -0.344 -11.417 1.00 1.17 H new ATOM 0 HD23 LEU A 69 7.204 1.109 -11.452 1.00 1.17 H new ATOM 1007 N ASN A 70 7.462 3.334 -7.366 1.00 0.52 N ATOM 1008 CA ASN A 70 8.706 3.681 -6.694 1.00 0.53 C ATOM 1009 C ASN A 70 9.103 2.546 -5.757 1.00 0.49 C ATOM 1010 O ASN A 70 8.240 1.923 -5.140 1.00 0.51 O ATOM 1011 CB ASN A 70 8.539 4.977 -5.892 1.00 0.59 C ATOM 1012 CG ASN A 70 9.827 5.421 -5.223 1.00 0.65 C ATOM 1013 OD1 ASN A 70 10.918 5.208 -5.747 1.00 0.92 O ATOM 1014 ND2 ASN A 70 9.711 6.041 -4.056 1.00 0.73 N ATOM 0 H ASN A 70 6.636 3.406 -6.771 1.00 0.52 H new ATOM 0 HA ASN A 70 9.484 3.833 -7.442 1.00 0.53 H new ATOM 0 HB2 ASN A 70 8.188 5.767 -6.555 1.00 0.59 H new ATOM 0 HB3 ASN A 70 7.771 4.833 -5.132 1.00 0.59 H new ATOM 0 HD21 ASN A 70 10.545 6.359 -3.562 1.00 0.73 H new ATOM 0 HD22 ASN A 70 8.788 6.200 -3.652 1.00 0.73 H new ATOM 1021 N VAL A 71 10.395 2.281 -5.653 1.00 0.51 N ATOM 1022 CA VAL A 71 10.880 1.171 -4.842 1.00 0.52 C ATOM 1023 C VAL A 71 11.407 1.659 -3.493 1.00 0.49 C ATOM 1024 O VAL A 71 12.012 2.726 -3.400 1.00 0.58 O ATOM 1025 CB VAL A 71 11.987 0.376 -5.572 1.00 0.68 C ATOM 1026 CG1 VAL A 71 11.434 -0.284 -6.828 1.00 0.97 C ATOM 1027 CG2 VAL A 71 13.165 1.278 -5.921 1.00 1.02 C ATOM 0 H VAL A 71 11.127 2.817 -6.118 1.00 0.51 H new ATOM 0 HA VAL A 71 10.030 0.510 -4.672 1.00 0.52 H new ATOM 0 HB VAL A 71 12.342 -0.404 -4.898 1.00 0.68 H new ATOM 0 HG11 VAL A 71 12.228 -0.839 -7.327 1.00 0.97 H new ATOM 0 HG12 VAL A 71 10.630 -0.968 -6.556 1.00 0.97 H new ATOM 0 HG13 VAL A 71 11.047 0.481 -7.501 1.00 0.97 H new ATOM 0 HG21 VAL A 71 13.930 0.695 -6.434 1.00 1.02 H new ATOM 0 HG22 VAL A 71 12.826 2.084 -6.572 1.00 1.02 H new ATOM 0 HG23 VAL A 71 13.583 1.701 -5.007 1.00 1.02 H new ATOM 1037 N GLY A 72 11.148 0.880 -2.450 1.00 0.44 N ATOM 1038 CA GLY A 72 11.655 1.205 -1.132 1.00 0.46 C ATOM 1039 C GLY A 72 11.360 0.109 -0.127 1.00 0.44 C ATOM 1040 O GLY A 72 10.357 -0.586 -0.252 1.00 0.48 O ATOM 0 H GLY A 72 10.593 0.025 -2.495 1.00 0.44 H new ATOM 0 HA2 GLY A 72 12.731 1.367 -1.187 1.00 0.46 H new ATOM 0 HA3 GLY A 72 11.209 2.139 -0.792 1.00 0.46 H new ATOM 1044 N PRO A 73 12.242 -0.102 0.858 1.00 0.53 N ATOM 1045 CA PRO A 73 12.041 -1.090 1.910 1.00 0.54 C ATOM 1046 C PRO A 73 11.490 -0.489 3.200 1.00 0.49 C ATOM 1047 O PRO A 73 11.161 0.697 3.265 1.00 0.59 O ATOM 1048 CB PRO A 73 13.461 -1.574 2.135 1.00 0.72 C ATOM 1049 CG PRO A 73 14.296 -0.349 1.953 1.00 1.00 C ATOM 1050 CD PRO A 73 13.545 0.560 1.005 1.00 0.76 C ATOM 0 HA PRO A 73 11.316 -1.856 1.634 1.00 0.54 H new ATOM 0 HB2 PRO A 73 13.585 -1.996 3.132 1.00 0.72 H new ATOM 0 HB3 PRO A 73 13.735 -2.352 1.423 1.00 0.72 H new ATOM 0 HG2 PRO A 73 14.467 0.147 2.909 1.00 1.00 H new ATOM 0 HG3 PRO A 73 15.275 -0.606 1.547 1.00 1.00 H new ATOM 0 HD2 PRO A 73 13.441 1.566 1.411 1.00 0.76 H new ATOM 0 HD3 PRO A 73 14.058 0.654 0.048 1.00 0.76 H new ATOM 1058 N ALA A 74 11.408 -1.318 4.228 1.00 0.51 N ATOM 1059 CA ALA A 74 10.984 -0.866 5.540 1.00 0.61 C ATOM 1060 C ALA A 74 12.143 -0.945 6.527 1.00 0.84 C ATOM 1061 O ALA A 74 13.278 -1.206 6.137 1.00 1.58 O ATOM 1062 CB ALA A 74 9.811 -1.696 6.030 1.00 0.86 C ATOM 0 H ALA A 74 11.631 -2.312 4.177 1.00 0.51 H new ATOM 0 HA ALA A 74 10.664 0.173 5.465 1.00 0.61 H new ATOM 0 HB1 ALA A 74 9.504 -1.346 7.015 1.00 0.86 H new ATOM 0 HB2 ALA A 74 8.979 -1.596 5.333 1.00 0.86 H new ATOM 0 HB3 ALA A 74 10.107 -2.743 6.093 1.00 0.86 H new ATOM 1068 N ASN A 75 11.852 -0.712 7.803 1.00 0.62 N ATOM 1069 CA ASN A 75 12.873 -0.775 8.846 1.00 0.74 C ATOM 1070 C ASN A 75 13.402 -2.197 9.035 1.00 0.76 C ATOM 1071 O ASN A 75 14.612 -2.412 9.076 1.00 0.85 O ATOM 1072 CB ASN A 75 12.328 -0.228 10.175 1.00 0.99 C ATOM 1073 CG ASN A 75 13.137 -0.691 11.377 1.00 1.38 C ATOM 1074 OD1 ASN A 75 12.752 -1.635 12.070 1.00 2.09 O ATOM 1075 ND2 ASN A 75 14.271 -0.055 11.621 1.00 1.58 N ATOM 0 H ASN A 75 10.918 -0.478 8.141 1.00 0.62 H new ATOM 0 HA ASN A 75 13.706 -0.150 8.523 1.00 0.74 H new ATOM 0 HB2 ASN A 75 12.326 0.861 10.141 1.00 0.99 H new ATOM 0 HB3 ASN A 75 11.292 -0.545 10.296 1.00 0.99 H new ATOM 0 HD21 ASN A 75 14.858 -0.342 12.404 1.00 1.58 H new ATOM 0 HD22 ASN A 75 14.558 0.722 11.026 1.00 1.58 H new ATOM 1082 N ASN A 76 12.502 -3.166 9.148 1.00 0.75 N ATOM 1083 CA ASN A 76 12.909 -4.539 9.412 1.00 0.82 C ATOM 1084 C ASN A 76 11.786 -5.517 9.073 1.00 0.77 C ATOM 1085 O ASN A 76 10.611 -5.144 9.060 1.00 0.81 O ATOM 1086 CB ASN A 76 13.315 -4.694 10.880 1.00 1.02 C ATOM 1087 CG ASN A 76 13.980 -6.028 11.168 1.00 1.32 C ATOM 1088 OD1 ASN A 76 13.783 -6.610 12.230 1.00 2.08 O ATOM 1089 ND2 ASN A 76 14.794 -6.506 10.236 1.00 1.38 N ATOM 0 H ASN A 76 11.495 -3.028 9.062 1.00 0.75 H new ATOM 0 HA ASN A 76 13.765 -4.769 8.778 1.00 0.82 H new ATOM 0 HB2 ASN A 76 13.996 -3.887 11.151 1.00 1.02 H new ATOM 0 HB3 ASN A 76 12.431 -4.590 11.510 1.00 1.02 H new ATOM 0 HD21 ASN A 76 15.283 -7.388 10.389 1.00 1.38 H new ATOM 0 HD22 ASN A 76 14.931 -5.992 9.366 1.00 1.38 H new ATOM 1096 N ASN A 77 12.163 -6.770 8.825 1.00 0.80 N ATOM 1097 CA ASN A 77 11.229 -7.814 8.396 1.00 0.86 C ATOM 1098 C ASN A 77 10.280 -8.218 9.522 1.00 0.95 C ATOM 1099 O ASN A 77 9.172 -8.692 9.277 1.00 1.05 O ATOM 1100 CB ASN A 77 12.014 -9.039 7.908 1.00 0.95 C ATOM 1101 CG ASN A 77 11.119 -10.156 7.401 1.00 1.40 C ATOM 1102 OD1 ASN A 77 10.723 -11.047 8.157 1.00 2.28 O ATOM 1103 ND2 ASN A 77 10.806 -10.126 6.115 1.00 1.72 N ATOM 0 H ASN A 77 13.126 -7.092 8.916 1.00 0.80 H new ATOM 0 HA ASN A 77 10.626 -7.413 7.581 1.00 0.86 H new ATOM 0 HB2 ASN A 77 12.692 -8.735 7.111 1.00 0.95 H new ATOM 0 HB3 ASN A 77 12.630 -9.417 8.724 1.00 0.95 H new ATOM 0 HD21 ASN A 77 10.217 -10.857 5.716 1.00 1.72 H new ATOM 0 HD22 ASN A 77 11.154 -9.372 5.523 1.00 1.72 H new ATOM 1110 N THR A 78 10.720 -8.023 10.757 1.00 1.02 N ATOM 1111 CA THR A 78 9.917 -8.357 11.921 1.00 1.22 C ATOM 1112 C THR A 78 8.781 -7.344 12.115 1.00 1.16 C ATOM 1113 O THR A 78 7.905 -7.518 12.961 1.00 1.41 O ATOM 1114 CB THR A 78 10.818 -8.411 13.168 1.00 1.44 C ATOM 1115 OG1 THR A 78 11.983 -9.195 12.872 1.00 1.95 O ATOM 1116 CG2 THR A 78 10.092 -9.027 14.351 1.00 1.88 C ATOM 0 H THR A 78 11.636 -7.632 10.978 1.00 1.02 H new ATOM 0 HA THR A 78 9.462 -9.335 11.766 1.00 1.22 H new ATOM 0 HB THR A 78 11.098 -7.391 13.432 1.00 1.44 H new ATOM 0 HG1 THR A 78 12.728 -8.601 12.644 1.00 1.95 H new ATOM 0 HG21 THR A 78 10.757 -9.050 15.214 1.00 1.88 H new ATOM 0 HG22 THR A 78 9.211 -8.431 14.587 1.00 1.88 H new ATOM 0 HG23 THR A 78 9.787 -10.043 14.101 1.00 1.88 H new ATOM 1124 N ALA A 79 8.794 -6.291 11.310 1.00 0.91 N ATOM 1125 CA ALA A 79 7.746 -5.286 11.355 1.00 0.86 C ATOM 1126 C ALA A 79 7.028 -5.209 10.015 1.00 0.73 C ATOM 1127 O ALA A 79 5.810 -5.356 9.937 1.00 0.77 O ATOM 1128 CB ALA A 79 8.330 -3.932 11.729 1.00 0.88 C ATOM 0 H ALA A 79 9.521 -6.112 10.617 1.00 0.91 H new ATOM 0 HA ALA A 79 7.020 -5.571 12.117 1.00 0.86 H new ATOM 0 HB1 ALA A 79 7.534 -3.188 11.759 1.00 0.88 H new ATOM 0 HB2 ALA A 79 8.802 -3.998 12.709 1.00 0.88 H new ATOM 0 HB3 ALA A 79 9.073 -3.639 10.987 1.00 0.88 H new ATOM 1134 N PHE A 80 7.802 -4.996 8.960 1.00 0.65 N ATOM 1135 CA PHE A 80 7.265 -4.876 7.615 1.00 0.60 C ATOM 1136 C PHE A 80 8.196 -5.576 6.631 1.00 0.72 C ATOM 1137 O PHE A 80 8.806 -6.585 6.967 1.00 1.37 O ATOM 1138 CB PHE A 80 7.108 -3.398 7.229 1.00 0.58 C ATOM 1139 CG PHE A 80 6.169 -2.630 8.113 1.00 0.58 C ATOM 1140 CD1 PHE A 80 4.798 -2.806 8.010 1.00 0.56 C ATOM 1141 CD2 PHE A 80 6.656 -1.730 9.051 1.00 0.72 C ATOM 1142 CE1 PHE A 80 3.932 -2.105 8.823 1.00 0.65 C ATOM 1143 CE2 PHE A 80 5.794 -1.025 9.866 1.00 0.82 C ATOM 1144 CZ PHE A 80 4.431 -1.212 9.752 1.00 0.77 C ATOM 0 H PHE A 80 8.816 -4.902 9.013 1.00 0.65 H new ATOM 0 HA PHE A 80 6.283 -5.347 7.583 1.00 0.60 H new ATOM 0 HB2 PHE A 80 8.088 -2.921 7.256 1.00 0.58 H new ATOM 0 HB3 PHE A 80 6.752 -3.338 6.200 1.00 0.58 H new ATOM 0 HD1 PHE A 80 4.403 -3.501 7.284 1.00 0.56 H new ATOM 0 HD2 PHE A 80 7.721 -1.580 9.144 1.00 0.72 H new ATOM 0 HE1 PHE A 80 2.866 -2.254 8.734 1.00 0.65 H new ATOM 0 HE2 PHE A 80 6.185 -0.328 10.592 1.00 0.82 H new ATOM 0 HZ PHE A 80 3.755 -0.661 10.389 1.00 0.77 H new ATOM 1154 N GLY A 81 8.306 -5.048 5.421 1.00 0.52 N ATOM 1155 CA GLY A 81 9.207 -5.631 4.447 1.00 0.57 C ATOM 1156 C GLY A 81 9.637 -4.628 3.402 1.00 0.50 C ATOM 1157 O GLY A 81 10.683 -3.996 3.528 1.00 0.54 O ATOM 0 H GLY A 81 7.790 -4.230 5.097 1.00 0.52 H new ATOM 0 HA2 GLY A 81 10.087 -6.023 4.957 1.00 0.57 H new ATOM 0 HA3 GLY A 81 8.718 -6.475 3.960 1.00 0.57 H new ATOM 1161 N TYR A 82 8.816 -4.476 2.380 1.00 0.45 N ATOM 1162 CA TYR A 82 9.091 -3.554 1.294 1.00 0.44 C ATOM 1163 C TYR A 82 7.814 -2.816 0.931 1.00 0.41 C ATOM 1164 O TYR A 82 6.724 -3.227 1.339 1.00 0.46 O ATOM 1165 CB TYR A 82 9.624 -4.310 0.071 1.00 0.54 C ATOM 1166 CG TYR A 82 8.654 -5.345 -0.469 1.00 0.84 C ATOM 1167 CD1 TYR A 82 8.535 -6.596 0.128 1.00 1.33 C ATOM 1168 CD2 TYR A 82 7.851 -5.066 -1.569 1.00 1.01 C ATOM 1169 CE1 TYR A 82 7.644 -7.533 -0.354 1.00 1.92 C ATOM 1170 CE2 TYR A 82 6.960 -6.001 -2.056 1.00 1.53 C ATOM 1171 CZ TYR A 82 6.860 -7.231 -1.444 1.00 1.98 C ATOM 1172 OH TYR A 82 5.967 -8.160 -1.920 1.00 2.58 O ATOM 0 H TYR A 82 7.940 -4.988 2.279 1.00 0.45 H new ATOM 0 HA TYR A 82 9.850 -2.840 1.614 1.00 0.44 H new ATOM 0 HB2 TYR A 82 9.855 -3.593 -0.717 1.00 0.54 H new ATOM 0 HB3 TYR A 82 10.559 -4.803 0.337 1.00 0.54 H new ATOM 0 HD1 TYR A 82 9.150 -6.838 0.982 1.00 1.33 H new ATOM 0 HD2 TYR A 82 7.926 -4.102 -2.050 1.00 1.01 H new ATOM 0 HE1 TYR A 82 7.562 -8.499 0.122 1.00 1.92 H new ATOM 0 HE2 TYR A 82 6.344 -5.769 -2.913 1.00 1.53 H new ATOM 0 HH TYR A 82 5.430 -8.508 -1.178 1.00 2.58 H new ATOM 1182 N TYR A 83 7.949 -1.740 0.181 1.00 0.36 N ATOM 1183 CA TYR A 83 6.804 -0.994 -0.295 1.00 0.38 C ATOM 1184 C TYR A 83 7.062 -0.498 -1.714 1.00 0.38 C ATOM 1185 O TYR A 83 8.202 -0.213 -2.087 1.00 0.43 O ATOM 1186 CB TYR A 83 6.483 0.175 0.655 1.00 0.39 C ATOM 1187 CG TYR A 83 7.460 1.334 0.612 1.00 0.39 C ATOM 1188 CD1 TYR A 83 7.394 2.291 -0.392 1.00 0.41 C ATOM 1189 CD2 TYR A 83 8.459 1.459 1.569 1.00 0.50 C ATOM 1190 CE1 TYR A 83 8.292 3.339 -0.435 1.00 0.49 C ATOM 1191 CE2 TYR A 83 9.358 2.506 1.533 1.00 0.58 C ATOM 1192 CZ TYR A 83 9.230 3.475 0.537 1.00 0.56 C ATOM 1193 OH TYR A 83 10.170 4.482 0.488 1.00 0.68 O ATOM 0 H TYR A 83 8.849 -1.361 -0.113 1.00 0.36 H new ATOM 0 HA TYR A 83 5.935 -1.651 -0.313 1.00 0.38 H new ATOM 0 HB2 TYR A 83 5.488 0.551 0.418 1.00 0.39 H new ATOM 0 HB3 TYR A 83 6.444 -0.208 1.675 1.00 0.39 H new ATOM 0 HD1 TYR A 83 6.629 2.214 -1.150 1.00 0.41 H new ATOM 0 HD2 TYR A 83 8.534 0.723 2.356 1.00 0.50 H new ATOM 0 HE1 TYR A 83 8.248 4.053 -1.244 1.00 0.49 H new ATOM 0 HE2 TYR A 83 10.149 2.574 2.265 1.00 0.58 H new ATOM 0 HH TYR A 83 9.793 5.259 0.024 1.00 0.68 H new ATOM 1203 N LEU A 84 6.011 -0.433 -2.509 1.00 0.40 N ATOM 1204 CA LEU A 84 6.105 0.083 -3.865 1.00 0.42 C ATOM 1205 C LEU A 84 5.059 1.169 -4.078 1.00 0.43 C ATOM 1206 O LEU A 84 3.896 0.873 -4.341 1.00 0.50 O ATOM 1207 CB LEU A 84 5.907 -1.045 -4.882 1.00 0.51 C ATOM 1208 CG LEU A 84 6.923 -2.186 -4.803 1.00 0.66 C ATOM 1209 CD1 LEU A 84 6.534 -3.310 -5.750 1.00 1.42 C ATOM 1210 CD2 LEU A 84 8.321 -1.679 -5.127 1.00 1.21 C ATOM 0 H LEU A 84 5.075 -0.733 -2.238 1.00 0.40 H new ATOM 0 HA LEU A 84 7.098 0.509 -4.010 1.00 0.42 H new ATOM 0 HB2 LEU A 84 4.908 -1.461 -4.748 1.00 0.51 H new ATOM 0 HB3 LEU A 84 5.943 -0.618 -5.884 1.00 0.51 H new ATOM 0 HG LEU A 84 6.925 -2.576 -3.785 1.00 0.66 H new ATOM 0 HD11 LEU A 84 7.267 -4.114 -5.681 1.00 1.42 H new ATOM 0 HD12 LEU A 84 5.550 -3.692 -5.477 1.00 1.42 H new ATOM 0 HD13 LEU A 84 6.505 -2.931 -6.772 1.00 1.42 H new ATOM 0 HD21 LEU A 84 9.031 -2.504 -5.066 1.00 1.21 H new ATOM 0 HD22 LEU A 84 8.333 -1.264 -6.135 1.00 1.21 H new ATOM 0 HD23 LEU A 84 8.602 -0.905 -4.413 1.00 1.21 H new ATOM 1222 N THR A 85 5.469 2.423 -3.960 1.00 0.43 N ATOM 1223 CA THR A 85 4.542 3.529 -4.062 1.00 0.47 C ATOM 1224 C THR A 85 4.326 3.886 -5.523 1.00 0.45 C ATOM 1225 O THR A 85 5.208 4.440 -6.179 1.00 0.50 O ATOM 1226 CB THR A 85 5.064 4.757 -3.303 1.00 0.58 C ATOM 1227 OG1 THR A 85 5.692 4.346 -2.083 1.00 0.75 O ATOM 1228 CG2 THR A 85 3.929 5.706 -2.979 1.00 0.98 C ATOM 0 H THR A 85 6.438 2.695 -3.794 1.00 0.43 H new ATOM 0 HA THR A 85 3.596 3.224 -3.615 1.00 0.47 H new ATOM 0 HB THR A 85 5.787 5.269 -3.938 1.00 0.58 H new ATOM 0 HG1 THR A 85 5.048 3.852 -1.534 1.00 0.75 H new ATOM 0 HG21 THR A 85 4.319 6.570 -2.441 1.00 0.98 H new ATOM 0 HG22 THR A 85 3.457 6.037 -3.904 1.00 0.98 H new ATOM 0 HG23 THR A 85 3.193 5.195 -2.359 1.00 0.98 H new ATOM 1236 N LEU A 86 3.157 3.542 -6.028 1.00 0.43 N ATOM 1237 CA LEU A 86 2.858 3.689 -7.437 1.00 0.43 C ATOM 1238 C LEU A 86 1.737 4.697 -7.651 1.00 0.45 C ATOM 1239 O LEU A 86 0.821 4.804 -6.836 1.00 0.50 O ATOM 1240 CB LEU A 86 2.481 2.316 -8.007 1.00 0.46 C ATOM 1241 CG LEU A 86 2.028 2.288 -9.467 1.00 0.63 C ATOM 1242 CD1 LEU A 86 2.505 1.015 -10.136 1.00 1.23 C ATOM 1243 CD2 LEU A 86 0.515 2.376 -9.553 1.00 1.35 C ATOM 0 H LEU A 86 2.392 3.155 -5.475 1.00 0.43 H new ATOM 0 HA LEU A 86 3.736 4.068 -7.959 1.00 0.43 H new ATOM 0 HB2 LEU A 86 3.341 1.655 -7.903 1.00 0.46 H new ATOM 0 HB3 LEU A 86 1.683 1.899 -7.393 1.00 0.46 H new ATOM 0 HG LEU A 86 2.461 3.146 -9.980 1.00 0.63 H new ATOM 0 HD11 LEU A 86 2.177 1.005 -11.175 1.00 1.23 H new ATOM 0 HD12 LEU A 86 3.593 0.970 -10.099 1.00 1.23 H new ATOM 0 HD13 LEU A 86 2.088 0.152 -9.616 1.00 1.23 H new ATOM 0 HD21 LEU A 86 0.208 2.355 -10.599 1.00 1.35 H new ATOM 0 HD22 LEU A 86 0.071 1.531 -9.027 1.00 1.35 H new ATOM 0 HD23 LEU A 86 0.178 3.306 -9.095 1.00 1.35 H new ATOM 1255 N THR A 87 1.817 5.448 -8.739 1.00 0.48 N ATOM 1256 CA THR A 87 0.752 6.358 -9.092 1.00 0.55 C ATOM 1257 C THR A 87 -0.216 5.685 -10.058 1.00 0.55 C ATOM 1258 O THR A 87 0.191 5.244 -11.136 1.00 0.56 O ATOM 1259 CB THR A 87 1.320 7.631 -9.750 1.00 0.61 C ATOM 1260 OG1 THR A 87 2.253 7.275 -10.778 1.00 1.21 O ATOM 1261 CG2 THR A 87 2.013 8.512 -8.727 1.00 1.26 C ATOM 0 H THR A 87 2.606 5.442 -9.386 1.00 0.48 H new ATOM 0 HA THR A 87 0.225 6.633 -8.178 1.00 0.55 H new ATOM 0 HB THR A 87 0.488 8.187 -10.182 1.00 0.61 H new ATOM 0 HG1 THR A 87 1.854 6.596 -11.361 1.00 1.21 H new ATOM 0 HG21 THR A 87 2.404 9.403 -9.219 1.00 1.26 H new ATOM 0 HG22 THR A 87 1.299 8.806 -7.957 1.00 1.26 H new ATOM 0 HG23 THR A 87 2.834 7.961 -8.269 1.00 1.26 H new ATOM 1269 N ARG A 88 -1.493 5.650 -9.666 1.00 0.60 N ATOM 1270 CA ARG A 88 -2.581 5.077 -10.471 1.00 0.67 C ATOM 1271 C ARG A 88 -3.740 4.712 -9.556 1.00 0.71 C ATOM 1272 O ARG A 88 -3.694 3.691 -8.877 1.00 1.02 O ATOM 1273 CB ARG A 88 -2.152 3.814 -11.240 1.00 0.71 C ATOM 1274 CG ARG A 88 -3.167 3.371 -12.282 1.00 0.93 C ATOM 1275 CD ARG A 88 -2.791 2.031 -12.886 1.00 1.05 C ATOM 1276 NE ARG A 88 -2.973 0.937 -11.933 1.00 0.86 N ATOM 1277 CZ ARG A 88 -1.991 0.161 -11.481 1.00 0.99 C ATOM 1278 NH1 ARG A 88 -0.727 0.415 -11.818 1.00 1.06 N ATOM 1279 NH2 ARG A 88 -2.274 -0.844 -10.666 1.00 1.34 N ATOM 0 H ARG A 88 -1.806 6.023 -8.770 1.00 0.60 H new ATOM 0 HA ARG A 88 -2.870 5.832 -11.202 1.00 0.67 H new ATOM 0 HB2 ARG A 88 -1.197 4.002 -11.730 1.00 0.71 H new ATOM 0 HB3 ARG A 88 -1.992 3.002 -10.531 1.00 0.71 H new ATOM 0 HG2 ARG A 88 -4.154 3.302 -11.824 1.00 0.93 H new ATOM 0 HG3 ARG A 88 -3.233 4.121 -13.070 1.00 0.93 H new ATOM 0 HD2 ARG A 88 -3.400 1.847 -13.771 1.00 1.05 H new ATOM 0 HD3 ARG A 88 -1.752 2.059 -13.214 1.00 1.05 H new ATOM 0 HE ARG A 88 -3.917 0.756 -11.591 1.00 0.86 H new ATOM 0 HH11 ARG A 88 -0.510 1.206 -12.424 1.00 1.06 H new ATOM 0 HH12 ARG A 88 0.023 -0.182 -11.470 1.00 1.06 H new ATOM 0 HH21 ARG A 88 -3.240 -1.019 -10.389 1.00 1.34 H new ATOM 0 HH22 ARG A 88 -1.526 -1.443 -10.316 1.00 1.34 H new ATOM 1293 N LEU A 89 -4.770 5.542 -9.527 1.00 0.56 N ATOM 1294 CA LEU A 89 -5.916 5.287 -8.668 1.00 0.55 C ATOM 1295 C LEU A 89 -7.144 6.017 -9.197 1.00 0.55 C ATOM 1296 O LEU A 89 -7.136 7.236 -9.372 1.00 0.77 O ATOM 1297 CB LEU A 89 -5.603 5.716 -7.225 1.00 0.62 C ATOM 1298 CG LEU A 89 -6.433 5.043 -6.116 1.00 0.82 C ATOM 1299 CD1 LEU A 89 -7.873 5.535 -6.114 1.00 1.71 C ATOM 1300 CD2 LEU A 89 -6.398 3.531 -6.259 1.00 1.06 C ATOM 0 H LEU A 89 -4.837 6.393 -10.085 1.00 0.56 H new ATOM 0 HA LEU A 89 -6.128 4.218 -8.669 1.00 0.55 H new ATOM 0 HB2 LEU A 89 -4.549 5.518 -7.031 1.00 0.62 H new ATOM 0 HB3 LEU A 89 -5.744 6.794 -7.151 1.00 0.62 H new ATOM 0 HG LEU A 89 -5.982 5.319 -5.163 1.00 0.82 H new ATOM 0 HD11 LEU A 89 -8.426 5.037 -5.318 1.00 1.71 H new ATOM 0 HD12 LEU A 89 -7.889 6.612 -5.949 1.00 1.71 H new ATOM 0 HD13 LEU A 89 -8.336 5.308 -7.074 1.00 1.71 H new ATOM 0 HD21 LEU A 89 -6.991 3.077 -5.465 1.00 1.06 H new ATOM 0 HD22 LEU A 89 -6.810 3.247 -7.227 1.00 1.06 H new ATOM 0 HD23 LEU A 89 -5.368 3.182 -6.187 1.00 1.06 H new ATOM 1312 N ASP A 90 -8.190 5.253 -9.457 1.00 0.47 N ATOM 1313 CA ASP A 90 -9.447 5.791 -9.953 1.00 0.52 C ATOM 1314 C ASP A 90 -10.562 5.548 -8.945 1.00 0.53 C ATOM 1315 O ASP A 90 -10.352 4.898 -7.918 1.00 0.51 O ATOM 1316 CB ASP A 90 -9.811 5.166 -11.302 1.00 0.68 C ATOM 1317 CG ASP A 90 -9.820 3.655 -11.278 1.00 1.40 C ATOM 1318 OD1 ASP A 90 -8.744 3.052 -11.449 1.00 1.74 O ATOM 1319 OD2 ASP A 90 -10.899 3.064 -11.073 1.00 2.21 O ATOM 0 H ASP A 90 -8.193 4.241 -9.331 1.00 0.47 H new ATOM 0 HA ASP A 90 -9.326 6.865 -10.092 1.00 0.52 H new ATOM 0 HB2 ASP A 90 -10.795 5.523 -11.607 1.00 0.68 H new ATOM 0 HB3 ASP A 90 -9.101 5.506 -12.056 1.00 0.68 H new ATOM 1324 N LYS A 91 -11.749 6.056 -9.240 1.00 0.63 N ATOM 1325 CA LYS A 91 -12.865 5.971 -8.307 1.00 0.75 C ATOM 1326 C LYS A 91 -13.346 4.529 -8.164 1.00 0.79 C ATOM 1327 O LYS A 91 -13.711 4.095 -7.069 1.00 0.85 O ATOM 1328 CB LYS A 91 -14.005 6.890 -8.751 1.00 0.89 C ATOM 1329 CG LYS A 91 -15.194 6.911 -7.798 1.00 1.15 C ATOM 1330 CD LYS A 91 -14.765 7.188 -6.364 1.00 1.38 C ATOM 1331 CE LYS A 91 -15.962 7.421 -5.449 1.00 1.71 C ATOM 1332 NZ LYS A 91 -17.032 6.407 -5.650 1.00 2.24 N ATOM 0 H LYS A 91 -11.965 6.531 -10.116 1.00 0.63 H new ATOM 0 HA LYS A 91 -12.521 6.305 -7.328 1.00 0.75 H new ATOM 0 HB2 LYS A 91 -13.620 7.904 -8.857 1.00 0.89 H new ATOM 0 HB3 LYS A 91 -14.348 6.575 -9.736 1.00 0.89 H new ATOM 0 HG2 LYS A 91 -15.903 7.674 -8.119 1.00 1.15 H new ATOM 0 HG3 LYS A 91 -15.713 5.954 -7.844 1.00 1.15 H new ATOM 0 HD2 LYS A 91 -14.181 6.347 -5.991 1.00 1.38 H new ATOM 0 HD3 LYS A 91 -14.115 8.063 -6.342 1.00 1.38 H new ATOM 0 HE2 LYS A 91 -15.633 7.397 -4.410 1.00 1.71 H new ATOM 0 HE3 LYS A 91 -16.368 8.416 -5.632 1.00 1.71 H new ATOM 0 HZ1 LYS A 91 -17.736 6.490 -4.889 1.00 2.24 H new ATOM 0 HZ2 LYS A 91 -17.494 6.567 -6.568 1.00 2.24 H new ATOM 0 HZ3 LYS A 91 -16.615 5.454 -5.634 1.00 2.24 H new ATOM 1346 N ALA A 92 -13.323 3.786 -9.260 1.00 0.81 N ATOM 1347 CA ALA A 92 -13.703 2.382 -9.223 1.00 0.94 C ATOM 1348 C ALA A 92 -12.628 1.569 -8.515 1.00 0.81 C ATOM 1349 O ALA A 92 -12.926 0.607 -7.805 1.00 0.81 O ATOM 1350 CB ALA A 92 -13.946 1.850 -10.627 1.00 1.13 C ATOM 0 H ALA A 92 -13.047 4.129 -10.180 1.00 0.81 H new ATOM 0 HA ALA A 92 -14.635 2.288 -8.665 1.00 0.94 H new ATOM 0 HB1 ALA A 92 -14.229 0.799 -10.574 1.00 1.13 H new ATOM 0 HB2 ALA A 92 -14.748 2.418 -11.098 1.00 1.13 H new ATOM 0 HB3 ALA A 92 -13.035 1.951 -11.217 1.00 1.13 H new ATOM 1356 N ALA A 93 -11.374 1.968 -8.707 1.00 0.73 N ATOM 1357 CA ALA A 93 -10.253 1.338 -8.027 1.00 0.67 C ATOM 1358 C ALA A 93 -10.400 1.460 -6.516 1.00 0.57 C ATOM 1359 O ALA A 93 -10.049 0.543 -5.775 1.00 0.57 O ATOM 1360 CB ALA A 93 -8.937 1.942 -8.478 1.00 0.69 C ATOM 0 H ALA A 93 -11.111 2.730 -9.332 1.00 0.73 H new ATOM 0 HA ALA A 93 -10.254 0.280 -8.291 1.00 0.67 H new ATOM 0 HB1 ALA A 93 -8.115 1.454 -7.955 1.00 0.69 H new ATOM 0 HB2 ALA A 93 -8.820 1.799 -9.552 1.00 0.69 H new ATOM 0 HB3 ALA A 93 -8.929 3.008 -8.251 1.00 0.69 H new ATOM 1366 N CYS A 94 -10.927 2.596 -6.071 1.00 0.55 N ATOM 1367 CA CYS A 94 -11.185 2.825 -4.654 1.00 0.58 C ATOM 1368 C CYS A 94 -12.083 1.723 -4.100 1.00 0.60 C ATOM 1369 O CYS A 94 -11.759 1.089 -3.098 1.00 0.63 O ATOM 1370 CB CYS A 94 -11.840 4.199 -4.445 1.00 0.67 C ATOM 1371 SG CYS A 94 -12.106 4.655 -2.699 1.00 1.02 S ATOM 0 H CYS A 94 -11.185 3.376 -6.675 1.00 0.55 H new ATOM 0 HA CYS A 94 -10.236 2.808 -4.119 1.00 0.58 H new ATOM 0 HB2 CYS A 94 -11.216 4.960 -4.915 1.00 0.67 H new ATOM 0 HB3 CYS A 94 -12.800 4.211 -4.961 1.00 0.67 H new ATOM 1376 N VAL A 95 -13.196 1.475 -4.785 1.00 0.64 N ATOM 1377 CA VAL A 95 -14.150 0.462 -4.350 1.00 0.71 C ATOM 1378 C VAL A 95 -13.543 -0.929 -4.469 1.00 0.65 C ATOM 1379 O VAL A 95 -13.828 -1.816 -3.667 1.00 0.67 O ATOM 1380 CB VAL A 95 -15.461 0.535 -5.164 1.00 0.83 C ATOM 1381 CG1 VAL A 95 -16.481 -0.469 -4.649 1.00 0.96 C ATOM 1382 CG2 VAL A 95 -16.035 1.945 -5.125 1.00 1.04 C ATOM 0 H VAL A 95 -13.458 1.961 -5.642 1.00 0.64 H new ATOM 0 HA VAL A 95 -14.387 0.661 -3.305 1.00 0.71 H new ATOM 0 HB VAL A 95 -15.230 0.281 -6.199 1.00 0.83 H new ATOM 0 HG11 VAL A 95 -17.394 -0.396 -5.240 1.00 0.96 H new ATOM 0 HG12 VAL A 95 -16.074 -1.477 -4.733 1.00 0.96 H new ATOM 0 HG13 VAL A 95 -16.707 -0.255 -3.604 1.00 0.96 H new ATOM 0 HG21 VAL A 95 -16.958 1.978 -5.704 1.00 1.04 H new ATOM 0 HG22 VAL A 95 -16.244 2.224 -4.092 1.00 1.04 H new ATOM 0 HG23 VAL A 95 -15.315 2.643 -5.551 1.00 1.04 H new ATOM 1392 N SER A 96 -12.695 -1.105 -5.467 1.00 0.62 N ATOM 1393 CA SER A 96 -12.006 -2.366 -5.674 1.00 0.61 C ATOM 1394 C SER A 96 -11.125 -2.703 -4.472 1.00 0.55 C ATOM 1395 O SER A 96 -11.182 -3.810 -3.943 1.00 0.58 O ATOM 1396 CB SER A 96 -11.159 -2.288 -6.942 1.00 0.68 C ATOM 1397 OG SER A 96 -10.589 -3.547 -7.260 1.00 1.00 O ATOM 0 H SER A 96 -12.466 -0.384 -6.151 1.00 0.62 H new ATOM 0 HA SER A 96 -12.748 -3.156 -5.786 1.00 0.61 H new ATOM 0 HB2 SER A 96 -11.776 -1.945 -7.773 1.00 0.68 H new ATOM 0 HB3 SER A 96 -10.367 -1.551 -6.808 1.00 0.68 H new ATOM 0 HG SER A 96 -9.629 -3.440 -7.423 1.00 1.00 H new ATOM 1403 N LEU A 97 -10.328 -1.738 -4.039 1.00 0.56 N ATOM 1404 CA LEU A 97 -9.419 -1.944 -2.920 1.00 0.61 C ATOM 1405 C LEU A 97 -10.191 -2.055 -1.612 1.00 0.63 C ATOM 1406 O LEU A 97 -9.796 -2.788 -0.712 1.00 0.70 O ATOM 1407 CB LEU A 97 -8.407 -0.806 -2.856 1.00 0.69 C ATOM 1408 CG LEU A 97 -7.497 -0.699 -4.079 1.00 0.78 C ATOM 1409 CD1 LEU A 97 -6.696 0.590 -4.034 1.00 0.86 C ATOM 1410 CD2 LEU A 97 -6.565 -1.898 -4.150 1.00 0.89 C ATOM 0 H LEU A 97 -10.292 -0.803 -4.446 1.00 0.56 H new ATOM 0 HA LEU A 97 -8.882 -2.880 -3.072 1.00 0.61 H new ATOM 0 HB2 LEU A 97 -8.944 0.135 -2.735 1.00 0.69 H new ATOM 0 HB3 LEU A 97 -7.788 -0.936 -1.968 1.00 0.69 H new ATOM 0 HG LEU A 97 -8.120 -0.688 -4.974 1.00 0.78 H new ATOM 0 HD11 LEU A 97 -6.053 0.650 -4.912 1.00 0.86 H new ATOM 0 HD12 LEU A 97 -7.377 1.441 -4.024 1.00 0.86 H new ATOM 0 HD13 LEU A 97 -6.082 0.606 -3.134 1.00 0.86 H new ATOM 0 HD21 LEU A 97 -5.923 -1.808 -5.026 1.00 0.89 H new ATOM 0 HD22 LEU A 97 -5.950 -1.934 -3.251 1.00 0.89 H new ATOM 0 HD23 LEU A 97 -7.154 -2.812 -4.224 1.00 0.89 H new ATOM 1422 N ALA A 98 -11.312 -1.349 -1.538 1.00 0.64 N ATOM 1423 CA ALA A 98 -12.173 -1.392 -0.360 1.00 0.75 C ATOM 1424 C ALA A 98 -12.963 -2.699 -0.299 1.00 0.71 C ATOM 1425 O ALA A 98 -13.682 -2.959 0.667 1.00 0.85 O ATOM 1426 CB ALA A 98 -13.118 -0.202 -0.358 1.00 0.92 C ATOM 0 H ALA A 98 -11.648 -0.737 -2.282 1.00 0.64 H new ATOM 0 HA ALA A 98 -11.539 -1.343 0.525 1.00 0.75 H new ATOM 0 HB1 ALA A 98 -13.755 -0.245 0.525 1.00 0.92 H new ATOM 0 HB2 ALA A 98 -12.540 0.722 -0.344 1.00 0.92 H new ATOM 0 HB3 ALA A 98 -13.738 -0.228 -1.254 1.00 0.92 H new ATOM 1432 N THR A 99 -12.843 -3.509 -1.342 1.00 0.66 N ATOM 1433 CA THR A 99 -13.483 -4.812 -1.373 1.00 0.71 C ATOM 1434 C THR A 99 -12.443 -5.908 -1.580 1.00 0.66 C ATOM 1435 O THR A 99 -12.777 -7.076 -1.783 1.00 0.77 O ATOM 1436 CB THR A 99 -14.569 -4.887 -2.469 1.00 0.81 C ATOM 1437 OG1 THR A 99 -14.031 -4.500 -3.738 1.00 0.82 O ATOM 1438 CG2 THR A 99 -15.747 -3.988 -2.123 1.00 0.92 C ATOM 0 H THR A 99 -12.306 -3.283 -2.179 1.00 0.66 H new ATOM 0 HA THR A 99 -13.973 -4.964 -0.411 1.00 0.71 H new ATOM 0 HB THR A 99 -14.915 -5.919 -2.526 1.00 0.81 H new ATOM 0 HG1 THR A 99 -13.816 -3.544 -3.724 1.00 0.82 H new ATOM 0 HG21 THR A 99 -16.500 -4.056 -2.908 1.00 0.92 H new ATOM 0 HG22 THR A 99 -16.181 -4.306 -1.175 1.00 0.92 H new ATOM 0 HG23 THR A 99 -15.405 -2.957 -2.037 1.00 0.92 H new ATOM 1446 N LEU A 100 -11.175 -5.513 -1.518 1.00 0.59 N ATOM 1447 CA LEU A 100 -10.062 -6.443 -1.629 1.00 0.61 C ATOM 1448 C LEU A 100 -9.360 -6.530 -0.276 1.00 0.66 C ATOM 1449 O LEU A 100 -9.128 -5.511 0.371 1.00 0.93 O ATOM 1450 CB LEU A 100 -9.091 -5.954 -2.714 1.00 0.60 C ATOM 1451 CG LEU A 100 -8.192 -7.016 -3.361 1.00 0.69 C ATOM 1452 CD1 LEU A 100 -7.577 -6.466 -4.638 1.00 1.08 C ATOM 1453 CD2 LEU A 100 -7.089 -7.468 -2.412 1.00 0.73 C ATOM 0 H LEU A 100 -10.893 -4.541 -1.390 1.00 0.59 H new ATOM 0 HA LEU A 100 -10.421 -7.433 -1.910 1.00 0.61 H new ATOM 0 HB2 LEU A 100 -9.673 -5.475 -3.501 1.00 0.60 H new ATOM 0 HB3 LEU A 100 -8.452 -5.186 -2.278 1.00 0.60 H new ATOM 0 HG LEU A 100 -8.812 -7.881 -3.595 1.00 0.69 H new ATOM 0 HD11 LEU A 100 -6.940 -7.225 -5.092 1.00 1.08 H new ATOM 0 HD12 LEU A 100 -8.369 -6.193 -5.335 1.00 1.08 H new ATOM 0 HD13 LEU A 100 -6.980 -5.585 -4.404 1.00 1.08 H new ATOM 0 HD21 LEU A 100 -6.472 -8.220 -2.903 1.00 0.73 H new ATOM 0 HD22 LEU A 100 -6.471 -6.613 -2.139 1.00 0.73 H new ATOM 0 HD23 LEU A 100 -7.534 -7.895 -1.513 1.00 0.73 H new ATOM 1465 N ASN A 101 -9.026 -7.731 0.165 1.00 0.60 N ATOM 1466 CA ASN A 101 -8.444 -7.890 1.485 1.00 0.66 C ATOM 1467 C ASN A 101 -6.948 -7.614 1.481 1.00 0.70 C ATOM 1468 O ASN A 101 -6.130 -8.511 1.268 1.00 0.79 O ATOM 1469 CB ASN A 101 -8.723 -9.278 2.064 1.00 0.80 C ATOM 1470 CG ASN A 101 -8.097 -9.461 3.434 1.00 0.93 C ATOM 1471 OD1 ASN A 101 -6.999 -9.992 3.562 1.00 1.29 O ATOM 1472 ND2 ASN A 101 -8.774 -8.981 4.465 1.00 1.12 N ATOM 0 H ASN A 101 -9.145 -8.596 -0.362 1.00 0.60 H new ATOM 0 HA ASN A 101 -8.924 -7.150 2.125 1.00 0.66 H new ATOM 0 HB2 ASN A 101 -9.800 -9.431 2.135 1.00 0.80 H new ATOM 0 HB3 ASN A 101 -8.337 -10.038 1.385 1.00 0.80 H new ATOM 0 HD21 ASN A 101 -8.385 -9.046 5.406 1.00 1.12 H new ATOM 0 HD22 ASN A 101 -9.685 -8.546 4.319 1.00 1.12 H new ATOM 1479 N LEU A 102 -6.596 -6.355 1.689 1.00 0.76 N ATOM 1480 CA LEU A 102 -5.212 -5.984 1.940 1.00 0.88 C ATOM 1481 C LEU A 102 -4.881 -6.236 3.406 1.00 0.99 C ATOM 1482 O LEU A 102 -4.636 -5.309 4.172 1.00 1.50 O ATOM 1483 CB LEU A 102 -4.931 -4.522 1.566 1.00 1.07 C ATOM 1484 CG LEU A 102 -4.848 -4.215 0.064 1.00 1.01 C ATOM 1485 CD1 LEU A 102 -3.923 -5.200 -0.638 1.00 1.55 C ATOM 1486 CD2 LEU A 102 -6.229 -4.224 -0.575 1.00 1.47 C ATOM 0 H LEU A 102 -7.250 -5.572 1.689 1.00 0.76 H new ATOM 0 HA LEU A 102 -4.573 -6.601 1.307 1.00 0.88 H new ATOM 0 HB2 LEU A 102 -5.713 -3.900 2.001 1.00 1.07 H new ATOM 0 HB3 LEU A 102 -3.991 -4.223 2.030 1.00 1.07 H new ATOM 0 HG LEU A 102 -4.432 -3.214 -0.050 1.00 1.01 H new ATOM 0 HD11 LEU A 102 -3.879 -4.964 -1.701 1.00 1.55 H new ATOM 0 HD12 LEU A 102 -2.923 -5.129 -0.209 1.00 1.55 H new ATOM 0 HD13 LEU A 102 -4.303 -6.213 -0.507 1.00 1.55 H new ATOM 0 HD21 LEU A 102 -6.139 -4.004 -1.639 1.00 1.47 H new ATOM 0 HD22 LEU A 102 -6.684 -5.206 -0.445 1.00 1.47 H new ATOM 0 HD23 LEU A 102 -6.855 -3.469 -0.100 1.00 1.47 H new ATOM 1498 N GLY A 103 -4.926 -7.504 3.789 1.00 0.92 N ATOM 1499 CA GLY A 103 -4.606 -7.896 5.146 1.00 1.04 C ATOM 1500 C GLY A 103 -3.881 -9.222 5.181 1.00 1.12 C ATOM 1501 O GLY A 103 -2.809 -9.338 5.765 1.00 1.70 O ATOM 0 H GLY A 103 -5.182 -8.277 3.175 1.00 0.92 H new ATOM 0 HA2 GLY A 103 -3.987 -7.129 5.611 1.00 1.04 H new ATOM 0 HA3 GLY A 103 -5.522 -7.965 5.732 1.00 1.04 H new ATOM 1505 N THR A 104 -4.464 -10.227 4.543 1.00 1.03 N ATOM 1506 CA THR A 104 -3.825 -11.527 4.424 1.00 1.28 C ATOM 1507 C THR A 104 -2.701 -11.472 3.387 1.00 1.06 C ATOM 1508 O THR A 104 -1.765 -12.265 3.421 1.00 1.25 O ATOM 1509 CB THR A 104 -4.855 -12.611 4.033 1.00 1.73 C ATOM 1510 OG1 THR A 104 -5.958 -12.579 4.952 1.00 2.31 O ATOM 1511 CG2 THR A 104 -4.229 -13.999 4.042 1.00 2.21 C ATOM 0 H THR A 104 -5.380 -10.165 4.099 1.00 1.03 H new ATOM 0 HA THR A 104 -3.401 -11.789 5.393 1.00 1.28 H new ATOM 0 HB THR A 104 -5.203 -12.400 3.022 1.00 1.73 H new ATOM 0 HG1 THR A 104 -6.524 -11.803 4.756 1.00 2.31 H new ATOM 0 HG21 THR A 104 -4.980 -14.738 3.763 1.00 2.21 H new ATOM 0 HG22 THR A 104 -3.405 -14.031 3.329 1.00 2.21 H new ATOM 0 HG23 THR A 104 -3.854 -14.222 5.041 1.00 2.21 H new ATOM 1519 N SER A 105 -2.788 -10.512 2.478 1.00 0.97 N ATOM 1520 CA SER A 105 -1.786 -10.359 1.436 1.00 1.06 C ATOM 1521 C SER A 105 -1.095 -9.004 1.563 1.00 1.02 C ATOM 1522 O SER A 105 -0.496 -8.502 0.614 1.00 1.48 O ATOM 1523 CB SER A 105 -2.443 -10.505 0.062 1.00 1.35 C ATOM 1524 OG SER A 105 -1.477 -10.627 -0.965 1.00 2.06 O ATOM 0 H SER A 105 -3.543 -9.827 2.442 1.00 0.97 H new ATOM 0 HA SER A 105 -1.031 -11.138 1.547 1.00 1.06 H new ATOM 0 HB2 SER A 105 -3.091 -11.381 0.059 1.00 1.35 H new ATOM 0 HB3 SER A 105 -3.076 -9.639 -0.134 1.00 1.35 H new ATOM 0 HG SER A 105 -0.698 -10.073 -0.749 1.00 2.06 H new ATOM 1530 N ALA A 106 -1.159 -8.428 2.751 1.00 0.76 N ATOM 1531 CA ALA A 106 -0.533 -7.145 3.007 1.00 0.73 C ATOM 1532 C ALA A 106 -0.020 -7.092 4.431 1.00 0.59 C ATOM 1533 O ALA A 106 -0.488 -7.833 5.285 1.00 0.67 O ATOM 1534 CB ALA A 106 -1.510 -6.007 2.748 1.00 0.90 C ATOM 0 H ALA A 106 -1.640 -8.831 3.555 1.00 0.76 H new ATOM 0 HA ALA A 106 0.310 -7.028 2.326 1.00 0.73 H new ATOM 0 HB1 ALA A 106 -1.019 -5.054 2.946 1.00 0.90 H new ATOM 0 HB2 ALA A 106 -1.837 -6.038 1.709 1.00 0.90 H new ATOM 0 HB3 ALA A 106 -2.374 -6.113 3.403 1.00 0.90 H new ATOM 1540 N LYS A 107 0.957 -6.236 4.681 1.00 0.51 N ATOM 1541 CA LYS A 107 1.418 -6.025 6.037 1.00 0.47 C ATOM 1542 C LYS A 107 0.449 -5.089 6.744 1.00 0.51 C ATOM 1543 O LYS A 107 0.074 -5.306 7.896 1.00 0.70 O ATOM 1544 CB LYS A 107 2.835 -5.442 6.084 1.00 0.58 C ATOM 1545 CG LYS A 107 3.957 -6.469 5.969 1.00 0.99 C ATOM 1546 CD LYS A 107 4.241 -6.859 4.527 1.00 0.67 C ATOM 1547 CE LYS A 107 5.521 -7.682 4.421 1.00 1.07 C ATOM 1548 NZ LYS A 107 5.943 -7.907 3.007 1.00 1.69 N ATOM 0 H LYS A 107 1.439 -5.684 3.971 1.00 0.51 H new ATOM 0 HA LYS A 107 1.453 -6.992 6.539 1.00 0.47 H new ATOM 0 HB2 LYS A 107 2.941 -4.718 5.276 1.00 0.58 H new ATOM 0 HB3 LYS A 107 2.957 -4.896 7.020 1.00 0.58 H new ATOM 0 HG2 LYS A 107 4.864 -6.064 6.418 1.00 0.99 H new ATOM 0 HG3 LYS A 107 3.690 -7.360 6.538 1.00 0.99 H new ATOM 0 HD2 LYS A 107 3.403 -7.432 4.131 1.00 0.67 H new ATOM 0 HD3 LYS A 107 4.331 -5.961 3.915 1.00 0.67 H new ATOM 0 HE2 LYS A 107 6.321 -7.173 4.959 1.00 1.07 H new ATOM 0 HE3 LYS A 107 5.371 -8.645 4.909 1.00 1.07 H new ATOM 0 HZ1 LYS A 107 5.713 -8.882 2.727 1.00 1.69 H new ATOM 0 HZ2 LYS A 107 5.442 -7.241 2.385 1.00 1.69 H new ATOM 0 HZ3 LYS A 107 6.968 -7.755 2.922 1.00 1.69 H new ATOM 1562 N GLY A 108 0.037 -4.056 6.022 1.00 0.50 N ATOM 1563 CA GLY A 108 -0.925 -3.109 6.534 1.00 0.61 C ATOM 1564 C GLY A 108 -1.315 -2.103 5.485 1.00 0.58 C ATOM 1565 O GLY A 108 -0.545 -1.821 4.570 1.00 0.81 O ATOM 0 H GLY A 108 0.360 -3.858 5.075 1.00 0.50 H new ATOM 0 HA2 GLY A 108 -1.812 -3.640 6.879 1.00 0.61 H new ATOM 0 HA3 GLY A 108 -0.506 -2.593 7.398 1.00 0.61 H new ATOM 1569 N TYR A 109 -2.492 -1.544 5.633 1.00 0.52 N ATOM 1570 CA TYR A 109 -3.033 -0.651 4.637 1.00 0.49 C ATOM 1571 C TYR A 109 -3.326 0.710 5.277 1.00 0.47 C ATOM 1572 O TYR A 109 -4.050 0.792 6.268 1.00 0.51 O ATOM 1573 CB TYR A 109 -4.280 -1.328 4.055 1.00 0.58 C ATOM 1574 CG TYR A 109 -4.948 -0.615 2.911 1.00 0.57 C ATOM 1575 CD1 TYR A 109 -5.722 0.508 3.120 1.00 1.25 C ATOM 1576 CD2 TYR A 109 -4.818 -1.093 1.624 1.00 0.98 C ATOM 1577 CE1 TYR A 109 -6.356 1.140 2.069 1.00 1.39 C ATOM 1578 CE2 TYR A 109 -5.448 -0.473 0.562 1.00 1.13 C ATOM 1579 CZ TYR A 109 -6.215 0.648 0.789 1.00 0.99 C ATOM 1580 OH TYR A 109 -6.843 1.276 -0.262 1.00 1.28 O ATOM 0 H TYR A 109 -3.097 -1.693 6.440 1.00 0.52 H new ATOM 0 HA TYR A 109 -2.331 -0.459 3.825 1.00 0.49 H new ATOM 0 HB2 TYR A 109 -4.003 -2.328 3.721 1.00 0.58 H new ATOM 0 HB3 TYR A 109 -5.009 -1.450 4.856 1.00 0.58 H new ATOM 0 HD1 TYR A 109 -5.834 0.898 4.121 1.00 1.25 H new ATOM 0 HD2 TYR A 109 -4.212 -1.969 1.443 1.00 0.98 H new ATOM 0 HE1 TYR A 109 -6.960 2.017 2.249 1.00 1.39 H new ATOM 0 HE2 TYR A 109 -5.340 -0.865 -0.439 1.00 1.13 H new ATOM 0 HH TYR A 109 -6.197 1.435 -0.981 1.00 1.28 H new ATOM 1590 N GLY A 110 -2.744 1.778 4.730 1.00 0.45 N ATOM 1591 CA GLY A 110 -2.861 3.080 5.362 1.00 0.48 C ATOM 1592 C GLY A 110 -3.324 4.173 4.415 1.00 0.52 C ATOM 1593 O GLY A 110 -2.577 4.609 3.543 1.00 0.85 O ATOM 0 H GLY A 110 -2.199 1.764 3.868 1.00 0.45 H new ATOM 0 HA2 GLY A 110 -3.562 3.010 6.194 1.00 0.48 H new ATOM 0 HA3 GLY A 110 -1.895 3.359 5.782 1.00 0.48 H new ATOM 1597 N VAL A 111 -4.554 4.633 4.601 1.00 0.44 N ATOM 1598 CA VAL A 111 -5.129 5.668 3.747 1.00 0.50 C ATOM 1599 C VAL A 111 -4.771 7.055 4.264 1.00 0.50 C ATOM 1600 O VAL A 111 -4.974 7.349 5.439 1.00 0.52 O ATOM 1601 CB VAL A 111 -6.669 5.556 3.668 1.00 0.64 C ATOM 1602 CG1 VAL A 111 -7.241 6.572 2.690 1.00 1.25 C ATOM 1603 CG2 VAL A 111 -7.089 4.152 3.278 1.00 1.53 C ATOM 0 H VAL A 111 -5.177 4.305 5.339 1.00 0.44 H new ATOM 0 HA VAL A 111 -4.711 5.521 2.751 1.00 0.50 H new ATOM 0 HB VAL A 111 -7.069 5.773 4.658 1.00 0.64 H new ATOM 0 HG11 VAL A 111 -8.326 6.471 2.654 1.00 1.25 H new ATOM 0 HG12 VAL A 111 -6.981 7.579 3.017 1.00 1.25 H new ATOM 0 HG13 VAL A 111 -6.827 6.395 1.697 1.00 1.25 H new ATOM 0 HG21 VAL A 111 -8.177 4.098 3.229 1.00 1.53 H new ATOM 0 HG22 VAL A 111 -6.669 3.904 2.303 1.00 1.53 H new ATOM 0 HG23 VAL A 111 -6.724 3.443 4.021 1.00 1.53 H new ATOM 1613 N ASN A 112 -4.241 7.898 3.376 1.00 0.53 N ATOM 1614 CA ASN A 112 -3.877 9.276 3.709 1.00 0.60 C ATOM 1615 C ASN A 112 -2.748 9.297 4.743 1.00 0.56 C ATOM 1616 O ASN A 112 -2.698 10.158 5.621 1.00 0.69 O ATOM 1617 CB ASN A 112 -5.102 10.043 4.222 1.00 0.69 C ATOM 1618 CG ASN A 112 -4.996 11.542 4.013 1.00 0.79 C ATOM 1619 OD1 ASN A 112 -3.903 12.108 3.971 1.00 1.07 O ATOM 1620 ND2 ASN A 112 -6.135 12.196 3.892 1.00 1.16 N ATOM 0 H ASN A 112 -4.052 7.645 2.406 1.00 0.53 H new ATOM 0 HA ASN A 112 -3.519 9.770 2.806 1.00 0.60 H new ATOM 0 HB2 ASN A 112 -5.993 9.674 3.715 1.00 0.69 H new ATOM 0 HB3 ASN A 112 -5.232 9.839 5.285 1.00 0.69 H new ATOM 0 HD21 ASN A 112 -6.131 13.207 3.758 1.00 1.16 H new ATOM 0 HD22 ASN A 112 -7.020 11.691 3.932 1.00 1.16 H new ATOM 1627 N ILE A 113 -1.841 8.339 4.625 1.00 0.54 N ATOM 1628 CA ILE A 113 -0.680 8.266 5.500 1.00 0.54 C ATOM 1629 C ILE A 113 0.524 8.942 4.847 1.00 0.60 C ATOM 1630 O ILE A 113 0.716 8.857 3.635 1.00 0.73 O ATOM 1631 CB ILE A 113 -0.339 6.791 5.876 1.00 0.58 C ATOM 1632 CG1 ILE A 113 -0.994 6.411 7.211 1.00 0.77 C ATOM 1633 CG2 ILE A 113 1.165 6.551 5.947 1.00 0.76 C ATOM 1634 CD1 ILE A 113 -2.505 6.418 7.182 1.00 0.83 C ATOM 0 H ILE A 113 -1.887 7.597 3.927 1.00 0.54 H new ATOM 0 HA ILE A 113 -0.925 8.795 6.421 1.00 0.54 H new ATOM 0 HB ILE A 113 -0.739 6.157 5.084 1.00 0.58 H new ATOM 0 HG12 ILE A 113 -0.652 5.418 7.501 1.00 0.77 H new ATOM 0 HG13 ILE A 113 -0.653 7.103 7.981 1.00 0.77 H new ATOM 0 HG21 ILE A 113 1.355 5.511 6.212 1.00 0.76 H new ATOM 0 HG22 ILE A 113 1.614 6.767 4.977 1.00 0.76 H new ATOM 0 HG23 ILE A 113 1.602 7.204 6.703 1.00 0.76 H new ATOM 0 HD11 ILE A 113 -2.889 6.139 8.163 1.00 0.83 H new ATOM 0 HD12 ILE A 113 -2.859 7.416 6.924 1.00 0.83 H new ATOM 0 HD13 ILE A 113 -2.858 5.704 6.438 1.00 0.83 H new ATOM 1646 N SER A 114 1.303 9.650 5.652 1.00 0.60 N ATOM 1647 CA SER A 114 2.559 10.218 5.201 1.00 0.70 C ATOM 1648 C SER A 114 3.695 9.608 6.011 1.00 0.67 C ATOM 1649 O SER A 114 3.509 9.246 7.175 1.00 0.77 O ATOM 1650 CB SER A 114 2.545 11.744 5.347 1.00 0.83 C ATOM 1651 OG SER A 114 3.774 12.316 4.920 1.00 1.58 O ATOM 0 H SER A 114 1.082 9.844 6.629 1.00 0.60 H new ATOM 0 HA SER A 114 2.704 9.989 4.145 1.00 0.70 H new ATOM 0 HB2 SER A 114 1.725 12.160 4.761 1.00 0.83 H new ATOM 0 HB3 SER A 114 2.360 12.010 6.388 1.00 0.83 H new ATOM 0 HG SER A 114 3.735 13.290 5.023 1.00 1.58 H new ATOM 1657 N GLY A 115 4.863 9.484 5.395 1.00 0.70 N ATOM 1658 CA GLY A 115 5.976 8.835 6.056 1.00 0.70 C ATOM 1659 C GLY A 115 5.732 7.350 6.222 1.00 0.70 C ATOM 1660 O GLY A 115 5.814 6.823 7.329 1.00 0.75 O ATOM 0 H GLY A 115 5.059 9.820 4.452 1.00 0.70 H new ATOM 0 HA2 GLY A 115 6.886 8.993 5.478 1.00 0.70 H new ATOM 0 HA3 GLY A 115 6.136 9.290 7.033 1.00 0.70 H new ATOM 1664 N GLU A 116 5.434 6.690 5.106 1.00 0.73 N ATOM 1665 CA GLU A 116 5.102 5.266 5.094 1.00 0.77 C ATOM 1666 C GLU A 116 6.198 4.425 5.750 1.00 0.75 C ATOM 1667 O GLU A 116 5.905 3.420 6.393 1.00 0.84 O ATOM 1668 CB GLU A 116 4.858 4.809 3.654 1.00 0.82 C ATOM 1669 CG GLU A 116 4.634 3.316 3.507 1.00 0.97 C ATOM 1670 CD GLU A 116 4.178 2.927 2.119 1.00 1.60 C ATOM 1671 OE1 GLU A 116 4.775 3.405 1.131 1.00 2.05 O ATOM 1672 OE2 GLU A 116 3.218 2.144 2.010 1.00 2.30 O ATOM 0 H GLU A 116 5.416 7.126 4.184 1.00 0.73 H new ATOM 0 HA GLU A 116 4.193 5.121 5.678 1.00 0.77 H new ATOM 0 HB2 GLU A 116 3.990 5.336 3.259 1.00 0.82 H new ATOM 0 HB3 GLU A 116 5.712 5.099 3.042 1.00 0.82 H new ATOM 0 HG2 GLU A 116 5.559 2.789 3.742 1.00 0.97 H new ATOM 0 HG3 GLU A 116 3.889 2.991 4.234 1.00 0.97 H new ATOM 1679 N ASN A 117 7.450 4.863 5.608 1.00 0.67 N ATOM 1680 CA ASN A 117 8.597 4.175 6.210 1.00 0.67 C ATOM 1681 C ASN A 117 8.347 3.856 7.687 1.00 0.69 C ATOM 1682 O ASN A 117 8.777 2.817 8.188 1.00 0.75 O ATOM 1683 CB ASN A 117 9.862 5.028 6.056 1.00 0.71 C ATOM 1684 CG ASN A 117 11.089 4.389 6.685 1.00 1.03 C ATOM 1685 OD1 ASN A 117 11.420 4.656 7.841 1.00 1.95 O ATOM 1686 ND2 ASN A 117 11.775 3.544 5.927 1.00 0.96 N ATOM 0 H ASN A 117 7.698 5.698 5.077 1.00 0.67 H new ATOM 0 HA ASN A 117 8.736 3.230 5.685 1.00 0.67 H new ATOM 0 HB2 ASN A 117 10.051 5.199 4.996 1.00 0.71 H new ATOM 0 HB3 ASN A 117 9.693 6.004 6.512 1.00 0.71 H new ATOM 0 HD21 ASN A 117 12.610 3.089 6.297 1.00 0.96 H new ATOM 0 HD22 ASN A 117 11.468 3.349 4.974 1.00 0.96 H new ATOM 1693 N ASN A 118 7.634 4.743 8.373 1.00 0.70 N ATOM 1694 CA ASN A 118 7.249 4.515 9.760 1.00 0.80 C ATOM 1695 C ASN A 118 5.755 4.781 9.925 1.00 0.82 C ATOM 1696 O ASN A 118 5.335 5.628 10.716 1.00 1.00 O ATOM 1697 CB ASN A 118 8.059 5.407 10.705 1.00 0.90 C ATOM 1698 CG ASN A 118 7.824 5.078 12.173 1.00 1.75 C ATOM 1699 OD1 ASN A 118 7.563 3.929 12.535 1.00 2.60 O ATOM 1700 ND2 ASN A 118 7.903 6.086 13.023 1.00 2.33 N ATOM 0 H ASN A 118 7.310 5.630 7.988 1.00 0.70 H new ATOM 0 HA ASN A 118 7.460 3.477 10.017 1.00 0.80 H new ATOM 0 HB2 ASN A 118 9.120 5.299 10.479 1.00 0.90 H new ATOM 0 HB3 ASN A 118 7.799 6.450 10.525 1.00 0.90 H new ATOM 0 HD21 ASN A 118 7.746 5.927 14.018 1.00 2.33 H new ATOM 0 HD22 ASN A 118 8.121 7.023 12.684 1.00 2.33 H new ATOM 1707 N ILE A 119 4.962 4.075 9.128 1.00 0.78 N ATOM 1708 CA ILE A 119 3.509 4.199 9.165 1.00 0.87 C ATOM 1709 C ILE A 119 2.949 3.803 10.538 1.00 0.71 C ATOM 1710 O ILE A 119 3.502 2.942 11.228 1.00 0.73 O ATOM 1711 CB ILE A 119 2.854 3.348 8.041 1.00 1.22 C ATOM 1712 CG1 ILE A 119 1.327 3.504 8.045 1.00 1.45 C ATOM 1713 CG2 ILE A 119 3.242 1.883 8.176 1.00 1.38 C ATOM 1714 CD1 ILE A 119 0.642 2.813 6.883 1.00 2.02 C ATOM 0 H ILE A 119 5.305 3.404 8.441 1.00 0.78 H new ATOM 0 HA ILE A 119 3.262 5.247 8.993 1.00 0.87 H new ATOM 0 HB ILE A 119 3.228 3.716 7.086 1.00 1.22 H new ATOM 0 HG12 ILE A 119 0.932 3.104 8.979 1.00 1.45 H new ATOM 0 HG13 ILE A 119 1.079 4.565 8.023 1.00 1.45 H new ATOM 0 HG21 ILE A 119 2.772 1.307 7.379 1.00 1.38 H new ATOM 0 HG22 ILE A 119 4.325 1.785 8.104 1.00 1.38 H new ATOM 0 HG23 ILE A 119 2.907 1.505 9.142 1.00 1.38 H new ATOM 0 HD11 ILE A 119 -0.435 2.966 6.952 1.00 2.02 H new ATOM 0 HD12 ILE A 119 1.008 3.230 5.945 1.00 2.02 H new ATOM 0 HD13 ILE A 119 0.859 1.745 6.915 1.00 2.02 H new ATOM 1726 N THR A 120 1.862 4.455 10.932 1.00 0.70 N ATOM 1727 CA THR A 120 1.258 4.248 12.242 1.00 0.64 C ATOM 1728 C THR A 120 0.528 2.900 12.319 1.00 0.56 C ATOM 1729 O THR A 120 0.419 2.183 11.321 1.00 0.54 O ATOM 1730 CB THR A 120 0.288 5.403 12.581 1.00 0.79 C ATOM 1731 OG1 THR A 120 -0.199 5.275 13.922 1.00 1.59 O ATOM 1732 CG2 THR A 120 -0.886 5.439 11.608 1.00 1.33 C ATOM 0 H THR A 120 1.376 5.140 10.354 1.00 0.70 H new ATOM 0 HA THR A 120 2.062 4.235 12.977 1.00 0.64 H new ATOM 0 HB THR A 120 0.842 6.337 12.490 1.00 0.79 H new ATOM 0 HG1 THR A 120 -0.810 6.015 14.120 1.00 1.59 H new ATOM 0 HG21 THR A 120 -1.551 6.261 11.871 1.00 1.33 H new ATOM 0 HG22 THR A 120 -0.514 5.584 10.594 1.00 1.33 H new ATOM 0 HG23 THR A 120 -1.433 4.498 11.663 1.00 1.33 H new ATOM 1740 N SER A 121 0.038 2.569 13.513 1.00 0.57 N ATOM 1741 CA SER A 121 -0.612 1.290 13.764 1.00 0.55 C ATOM 1742 C SER A 121 -1.912 1.153 12.971 1.00 0.52 C ATOM 1743 O SER A 121 -2.520 2.148 12.562 1.00 0.57 O ATOM 1744 CB SER A 121 -0.875 1.131 15.258 1.00 0.65 C ATOM 1745 OG SER A 121 0.335 1.249 15.992 1.00 1.27 O ATOM 0 H SER A 121 0.082 3.180 14.329 1.00 0.57 H new ATOM 0 HA SER A 121 0.056 0.497 13.429 1.00 0.55 H new ATOM 0 HB2 SER A 121 -1.584 1.889 15.591 1.00 0.65 H new ATOM 0 HB3 SER A 121 -1.331 0.160 15.452 1.00 0.65 H new ATOM 0 HG SER A 121 0.149 1.146 16.949 1.00 1.27 H new ATOM 1751 N PHE A 122 -2.340 -0.087 12.781 1.00 0.49 N ATOM 1752 CA PHE A 122 -3.450 -0.394 11.893 1.00 0.50 C ATOM 1753 C PHE A 122 -4.682 -0.849 12.673 1.00 0.53 C ATOM 1754 O PHE A 122 -4.598 -1.751 13.507 1.00 0.68 O ATOM 1755 CB PHE A 122 -3.033 -1.498 10.918 1.00 0.52 C ATOM 1756 CG PHE A 122 -1.740 -1.227 10.202 1.00 0.52 C ATOM 1757 CD1 PHE A 122 -1.720 -0.466 9.049 1.00 0.53 C ATOM 1758 CD2 PHE A 122 -0.544 -1.735 10.686 1.00 0.61 C ATOM 1759 CE1 PHE A 122 -0.533 -0.215 8.389 1.00 0.59 C ATOM 1760 CE2 PHE A 122 0.645 -1.489 10.030 1.00 0.66 C ATOM 1761 CZ PHE A 122 0.651 -0.727 8.880 1.00 0.63 C ATOM 0 H PHE A 122 -1.930 -0.903 13.235 1.00 0.49 H new ATOM 0 HA PHE A 122 -3.708 0.514 11.348 1.00 0.50 H new ATOM 0 HB2 PHE A 122 -2.943 -2.436 11.465 1.00 0.52 H new ATOM 0 HB3 PHE A 122 -3.823 -1.634 10.180 1.00 0.52 H new ATOM 0 HD1 PHE A 122 -2.643 -0.063 8.659 1.00 0.53 H new ATOM 0 HD2 PHE A 122 -0.543 -2.330 11.587 1.00 0.61 H new ATOM 0 HE1 PHE A 122 -0.531 0.382 7.489 1.00 0.59 H new ATOM 0 HE2 PHE A 122 1.569 -1.892 10.416 1.00 0.66 H new ATOM 0 HZ PHE A 122 1.580 -0.532 8.365 1.00 0.63 H new ATOM 1771 N GLY A 123 -5.815 -0.218 12.396 1.00 0.53 N ATOM 1772 CA GLY A 123 -7.077 -0.651 12.969 1.00 0.60 C ATOM 1773 C GLY A 123 -8.034 -1.131 11.894 1.00 0.67 C ATOM 1774 O GLY A 123 -7.798 -2.163 11.262 1.00 1.24 O ATOM 0 H GLY A 123 -5.884 0.592 11.780 1.00 0.53 H new ATOM 0 HA2 GLY A 123 -6.898 -1.454 13.684 1.00 0.60 H new ATOM 0 HA3 GLY A 123 -7.530 0.173 13.521 1.00 0.60 H new ATOM 1778 N ASN A 124 -9.104 -0.382 11.670 1.00 0.58 N ATOM 1779 CA ASN A 124 -10.044 -0.692 10.595 1.00 0.60 C ATOM 1780 C ASN A 124 -10.540 0.580 9.904 1.00 0.61 C ATOM 1781 O ASN A 124 -11.185 0.515 8.858 1.00 0.99 O ATOM 1782 CB ASN A 124 -11.236 -1.508 11.114 1.00 0.81 C ATOM 1783 CG ASN A 124 -11.985 -0.812 12.232 1.00 1.83 C ATOM 1784 OD1 ASN A 124 -12.873 0.005 11.989 1.00 2.63 O ATOM 1785 ND2 ASN A 124 -11.651 -1.154 13.464 1.00 2.45 N ATOM 0 H ASN A 124 -9.345 0.445 12.216 1.00 0.58 H new ATOM 0 HA ASN A 124 -9.506 -1.294 9.863 1.00 0.60 H new ATOM 0 HB2 ASN A 124 -11.922 -1.703 10.290 1.00 0.81 H new ATOM 0 HB3 ASN A 124 -10.881 -2.475 11.469 1.00 0.81 H new ATOM 0 HD21 ASN A 124 -12.136 -0.736 14.258 1.00 2.45 H new ATOM 0 HD22 ASN A 124 -10.909 -1.836 13.621 1.00 2.45 H new ATOM 1792 N SER A 125 -10.201 1.734 10.469 1.00 0.51 N ATOM 1793 CA SER A 125 -10.642 3.016 9.929 1.00 0.55 C ATOM 1794 C SER A 125 -9.685 3.495 8.840 1.00 0.49 C ATOM 1795 O SER A 125 -8.659 2.867 8.590 1.00 0.64 O ATOM 1796 CB SER A 125 -10.724 4.044 11.058 1.00 0.73 C ATOM 1797 OG SER A 125 -9.531 4.037 11.827 1.00 1.33 O ATOM 0 H SER A 125 -9.620 1.808 11.304 1.00 0.51 H new ATOM 0 HA SER A 125 -11.629 2.895 9.483 1.00 0.55 H new ATOM 0 HB2 SER A 125 -10.889 5.038 10.641 1.00 0.73 H new ATOM 0 HB3 SER A 125 -11.577 3.822 11.699 1.00 0.73 H new ATOM 0 HG SER A 125 -9.600 4.702 12.544 1.00 1.33 H new ATOM 1803 N ALA A 126 -10.023 4.606 8.194 1.00 0.61 N ATOM 1804 CA ALA A 126 -9.226 5.112 7.086 1.00 0.57 C ATOM 1805 C ALA A 126 -9.053 6.628 7.164 1.00 0.73 C ATOM 1806 O ALA A 126 -9.512 7.255 8.116 1.00 1.25 O ATOM 1807 CB ALA A 126 -9.877 4.742 5.768 1.00 0.62 C ATOM 0 H ALA A 126 -10.842 5.171 8.419 1.00 0.61 H new ATOM 0 HA ALA A 126 -8.239 4.654 7.151 1.00 0.57 H new ATOM 0 HB1 ALA A 126 -9.274 5.124 4.944 1.00 0.62 H new ATOM 0 HB2 ALA A 126 -9.951 3.657 5.690 1.00 0.62 H new ATOM 0 HB3 ALA A 126 -10.875 5.178 5.720 1.00 0.62 H new ATOM 1813 N ASP A 127 -8.382 7.186 6.153 1.00 0.96 N ATOM 1814 CA ASP A 127 -8.173 8.636 6.014 1.00 1.08 C ATOM 1815 C ASP A 127 -7.418 9.214 7.208 1.00 0.90 C ATOM 1816 O ASP A 127 -8.008 9.559 8.235 1.00 1.34 O ATOM 1817 CB ASP A 127 -9.500 9.371 5.804 1.00 1.42 C ATOM 1818 CG ASP A 127 -9.297 10.839 5.494 1.00 1.53 C ATOM 1819 OD1 ASP A 127 -8.567 11.149 4.528 1.00 2.08 O ATOM 1820 OD2 ASP A 127 -9.878 11.687 6.206 1.00 1.40 O ATOM 0 H ASP A 127 -7.963 6.642 5.399 1.00 0.96 H new ATOM 0 HA ASP A 127 -7.557 8.788 5.128 1.00 1.08 H new ATOM 0 HB2 ASP A 127 -10.048 8.901 4.987 1.00 1.42 H new ATOM 0 HB3 ASP A 127 -10.114 9.272 6.699 1.00 1.42 H new ATOM 1825 N GLN A 128 -6.096 9.292 7.054 1.00 0.95 N ATOM 1826 CA GLN A 128 -5.177 9.703 8.116 1.00 0.92 C ATOM 1827 C GLN A 128 -5.157 8.661 9.224 1.00 0.83 C ATOM 1828 O GLN A 128 -4.655 8.901 10.325 1.00 1.02 O ATOM 1829 CB GLN A 128 -5.520 11.092 8.666 1.00 1.02 C ATOM 1830 CG GLN A 128 -5.173 12.218 7.703 1.00 1.17 C ATOM 1831 CD GLN A 128 -5.302 13.598 8.320 1.00 1.60 C ATOM 1832 OE1 GLN A 128 -5.579 14.580 7.629 1.00 1.72 O ATOM 1833 NE2 GLN A 128 -5.091 13.690 9.625 1.00 2.54 N ATOM 0 H GLN A 128 -5.627 9.068 6.176 1.00 0.95 H new ATOM 0 HA GLN A 128 -4.178 9.774 7.685 1.00 0.92 H new ATOM 0 HB2 GLN A 128 -6.585 11.133 8.895 1.00 1.02 H new ATOM 0 HB3 GLN A 128 -4.987 11.247 9.604 1.00 1.02 H new ATOM 0 HG2 GLN A 128 -4.152 12.081 7.348 1.00 1.17 H new ATOM 0 HG3 GLN A 128 -5.825 12.155 6.832 1.00 1.17 H new ATOM 0 HE21 GLN A 128 -4.864 12.855 10.165 1.00 2.54 H new ATOM 0 HE22 GLN A 128 -5.156 14.596 10.090 1.00 2.54 H new ATOM 1842 N ALA A 129 -5.677 7.491 8.893 1.00 0.65 N ATOM 1843 CA ALA A 129 -5.700 6.357 9.792 1.00 0.63 C ATOM 1844 C ALA A 129 -5.422 5.088 9.000 1.00 0.52 C ATOM 1845 O ALA A 129 -5.829 4.969 7.840 1.00 0.47 O ATOM 1846 CB ALA A 129 -7.043 6.263 10.506 1.00 0.69 C ATOM 0 H ALA A 129 -6.098 7.303 7.983 1.00 0.65 H new ATOM 0 HA ALA A 129 -4.929 6.484 10.552 1.00 0.63 H new ATOM 0 HB1 ALA A 129 -7.039 5.404 11.177 1.00 0.69 H new ATOM 0 HB2 ALA A 129 -7.213 7.173 11.082 1.00 0.69 H new ATOM 0 HB3 ALA A 129 -7.839 6.145 9.770 1.00 0.69 H new ATOM 1852 N ALA A 130 -4.708 4.164 9.609 1.00 0.54 N ATOM 1853 CA ALA A 130 -4.358 2.920 8.952 1.00 0.50 C ATOM 1854 C ALA A 130 -5.219 1.781 9.478 1.00 0.47 C ATOM 1855 O ALA A 130 -5.739 1.851 10.593 1.00 0.53 O ATOM 1856 CB ALA A 130 -2.886 2.620 9.161 1.00 0.58 C ATOM 0 H ALA A 130 -4.357 4.251 10.563 1.00 0.54 H new ATOM 0 HA ALA A 130 -4.544 3.021 7.883 1.00 0.50 H new ATOM 0 HB1 ALA A 130 -2.631 1.684 8.664 1.00 0.58 H new ATOM 0 HB2 ALA A 130 -2.287 3.428 8.741 1.00 0.58 H new ATOM 0 HB3 ALA A 130 -2.680 2.532 10.228 1.00 0.58 H new ATOM 1862 N LYS A 131 -5.368 0.734 8.683 1.00 0.43 N ATOM 1863 CA LYS A 131 -6.192 -0.395 9.074 1.00 0.44 C ATOM 1864 C LYS A 131 -5.510 -1.707 8.706 1.00 0.45 C ATOM 1865 O LYS A 131 -4.676 -1.755 7.797 1.00 0.49 O ATOM 1866 CB LYS A 131 -7.590 -0.310 8.437 1.00 0.49 C ATOM 1867 CG LYS A 131 -7.680 -0.819 7.006 1.00 0.58 C ATOM 1868 CD LYS A 131 -7.040 0.139 6.021 1.00 0.62 C ATOM 1869 CE LYS A 131 -7.623 1.537 6.136 1.00 0.89 C ATOM 1870 NZ LYS A 131 -9.103 1.525 6.063 1.00 1.43 N ATOM 0 H LYS A 131 -4.930 0.644 7.766 1.00 0.43 H new ATOM 0 HA LYS A 131 -6.317 -0.362 10.156 1.00 0.44 H new ATOM 0 HB2 LYS A 131 -8.288 -0.878 9.053 1.00 0.49 H new ATOM 0 HB3 LYS A 131 -7.919 0.729 8.458 1.00 0.49 H new ATOM 0 HG2 LYS A 131 -7.192 -1.791 6.936 1.00 0.58 H new ATOM 0 HG3 LYS A 131 -8.726 -0.968 6.739 1.00 0.58 H new ATOM 0 HD2 LYS A 131 -5.965 0.178 6.197 1.00 0.62 H new ATOM 0 HD3 LYS A 131 -7.184 -0.233 5.006 1.00 0.62 H new ATOM 0 HE2 LYS A 131 -7.309 1.985 7.079 1.00 0.89 H new ATOM 0 HE3 LYS A 131 -7.225 2.163 5.338 1.00 0.89 H new ATOM 0 HZ1 LYS A 131 -9.424 2.260 5.401 1.00 1.43 H new ATOM 0 HZ2 LYS A 131 -9.427 0.594 5.730 1.00 1.43 H new ATOM 0 HZ3 LYS A 131 -9.499 1.712 7.006 1.00 1.43 H new ATOM 1884 N SER A 132 -5.860 -2.761 9.427 1.00 0.49 N ATOM 1885 CA SER A 132 -5.245 -4.066 9.238 1.00 0.59 C ATOM 1886 C SER A 132 -5.722 -4.711 7.941 1.00 0.68 C ATOM 1887 O SER A 132 -4.937 -5.319 7.214 1.00 0.97 O ATOM 1888 CB SER A 132 -5.564 -4.964 10.437 1.00 0.69 C ATOM 1889 OG SER A 132 -4.988 -6.250 10.297 1.00 1.43 O ATOM 0 H SER A 132 -6.574 -2.737 10.155 1.00 0.49 H new ATOM 0 HA SER A 132 -4.165 -3.937 9.167 1.00 0.59 H new ATOM 0 HB2 SER A 132 -5.194 -4.497 11.350 1.00 0.69 H new ATOM 0 HB3 SER A 132 -6.645 -5.059 10.543 1.00 0.69 H new ATOM 0 HG SER A 132 -5.211 -6.795 11.080 1.00 1.43 H new ATOM 1895 N THR A 133 -7.008 -4.577 7.651 1.00 0.72 N ATOM 1896 CA THR A 133 -7.572 -5.164 6.448 1.00 0.93 C ATOM 1897 C THR A 133 -8.410 -4.154 5.677 1.00 0.69 C ATOM 1898 O THR A 133 -9.204 -3.417 6.264 1.00 1.11 O ATOM 1899 CB THR A 133 -8.452 -6.380 6.778 1.00 1.84 C ATOM 1900 OG1 THR A 133 -9.446 -6.019 7.749 1.00 2.38 O ATOM 1901 CG2 THR A 133 -7.618 -7.544 7.303 1.00 2.26 C ATOM 0 H THR A 133 -7.677 -4.069 8.230 1.00 0.72 H new ATOM 0 HA THR A 133 -6.730 -5.481 5.833 1.00 0.93 H new ATOM 0 HB THR A 133 -8.940 -6.699 5.857 1.00 1.84 H new ATOM 0 HG1 THR A 133 -10.003 -6.799 7.952 1.00 2.38 H new ATOM 0 HG21 THR A 133 -8.271 -8.388 7.527 1.00 2.26 H new ATOM 0 HG22 THR A 133 -6.889 -7.839 6.548 1.00 2.26 H new ATOM 0 HG23 THR A 133 -7.097 -7.238 8.210 1.00 2.26 H new ATOM 1909 N ALA A 134 -8.256 -4.151 4.361 1.00 0.82 N ATOM 1910 CA ALA A 134 -9.014 -3.244 3.508 1.00 1.50 C ATOM 1911 C ALA A 134 -10.244 -3.943 2.954 1.00 1.30 C ATOM 1912 O ALA A 134 -10.877 -3.476 2.016 1.00 1.86 O ATOM 1913 CB ALA A 134 -8.142 -2.712 2.384 1.00 2.33 C ATOM 0 H ALA A 134 -7.614 -4.765 3.860 1.00 0.82 H new ATOM 0 HA ALA A 134 -9.343 -2.397 4.109 1.00 1.50 H new ATOM 0 HB1 ALA A 134 -8.726 -2.037 1.759 1.00 2.33 H new ATOM 0 HB2 ALA A 134 -7.294 -2.173 2.806 1.00 2.33 H new ATOM 0 HB3 ALA A 134 -7.780 -3.544 1.780 1.00 2.33 H new ATOM 1919 N ILE A 135 -10.596 -5.046 3.587 1.00 0.99 N ATOM 1920 CA ILE A 135 -11.720 -5.863 3.158 1.00 0.96 C ATOM 1921 C ILE A 135 -13.003 -5.364 3.816 1.00 1.21 C ATOM 1922 O ILE A 135 -14.059 -5.993 3.736 1.00 2.09 O ATOM 1923 CB ILE A 135 -11.475 -7.341 3.536 1.00 1.26 C ATOM 1924 CG1 ILE A 135 -12.393 -8.259 2.736 1.00 1.57 C ATOM 1925 CG2 ILE A 135 -11.668 -7.564 5.033 1.00 1.67 C ATOM 1926 CD1 ILE A 135 -12.183 -8.148 1.245 1.00 1.72 C ATOM 0 H ILE A 135 -10.113 -5.402 4.412 1.00 0.99 H new ATOM 0 HA ILE A 135 -11.821 -5.787 2.075 1.00 0.96 H new ATOM 0 HB ILE A 135 -10.441 -7.584 3.289 1.00 1.26 H new ATOM 0 HG12 ILE A 135 -12.226 -9.291 3.045 1.00 1.57 H new ATOM 0 HG13 ILE A 135 -13.430 -8.020 2.970 1.00 1.57 H new ATOM 0 HG21 ILE A 135 -11.489 -8.613 5.271 1.00 1.67 H new ATOM 0 HG22 ILE A 135 -10.965 -6.942 5.587 1.00 1.67 H new ATOM 0 HG23 ILE A 135 -12.687 -7.297 5.312 1.00 1.67 H new ATOM 0 HD11 ILE A 135 -12.865 -8.825 0.730 1.00 1.72 H new ATOM 0 HD12 ILE A 135 -12.378 -7.124 0.925 1.00 1.72 H new ATOM 0 HD13 ILE A 135 -11.154 -8.414 1.002 1.00 1.72 H new ATOM 1938 N THR A 136 -12.898 -4.205 4.433 1.00 1.18 N ATOM 1939 CA THR A 136 -13.930 -3.703 5.311 1.00 1.62 C ATOM 1940 C THR A 136 -14.883 -2.766 4.576 1.00 1.09 C ATOM 1941 O THR A 136 -14.459 -1.782 3.979 1.00 1.00 O ATOM 1942 CB THR A 136 -13.286 -2.947 6.492 1.00 2.43 C ATOM 1943 OG1 THR A 136 -12.092 -3.631 6.916 1.00 3.11 O ATOM 1944 CG2 THR A 136 -14.251 -2.842 7.664 1.00 3.17 C ATOM 0 H THR A 136 -12.093 -3.585 4.339 1.00 1.18 H new ATOM 0 HA THR A 136 -14.501 -4.556 5.676 1.00 1.62 H new ATOM 0 HB THR A 136 -13.036 -1.941 6.156 1.00 2.43 H new ATOM 0 HG1 THR A 136 -11.314 -3.243 6.463 1.00 3.11 H new ATOM 0 HG21 THR A 136 -13.772 -2.305 8.483 1.00 3.17 H new ATOM 0 HG22 THR A 136 -15.146 -2.304 7.351 1.00 3.17 H new ATOM 0 HG23 THR A 136 -14.527 -3.842 7.999 1.00 3.17 H new ATOM 1952 N PRO A 137 -16.185 -3.080 4.591 1.00 1.02 N ATOM 1953 CA PRO A 137 -17.231 -2.178 4.091 1.00 1.06 C ATOM 1954 C PRO A 137 -17.070 -0.742 4.612 1.00 0.97 C ATOM 1955 O PRO A 137 -17.420 0.224 3.928 1.00 1.12 O ATOM 1956 CB PRO A 137 -18.511 -2.806 4.637 1.00 1.46 C ATOM 1957 CG PRO A 137 -18.209 -4.261 4.721 1.00 1.55 C ATOM 1958 CD PRO A 137 -16.742 -4.371 5.046 1.00 1.31 C ATOM 0 HA PRO A 137 -17.209 -2.083 3.005 1.00 1.06 H new ATOM 0 HB2 PRO A 137 -18.767 -2.397 5.614 1.00 1.46 H new ATOM 0 HB3 PRO A 137 -19.359 -2.614 3.979 1.00 1.46 H new ATOM 0 HG2 PRO A 137 -18.815 -4.740 5.490 1.00 1.55 H new ATOM 0 HG3 PRO A 137 -18.437 -4.760 3.779 1.00 1.55 H new ATOM 0 HD2 PRO A 137 -16.579 -4.524 6.113 1.00 1.31 H new ATOM 0 HD3 PRO A 137 -16.279 -5.211 4.529 1.00 1.31 H new ATOM 1966 N ALA A 138 -16.538 -0.611 5.827 1.00 1.04 N ATOM 1967 CA ALA A 138 -16.282 0.699 6.428 1.00 1.16 C ATOM 1968 C ALA A 138 -15.162 1.446 5.697 1.00 0.92 C ATOM 1969 O ALA A 138 -15.112 2.679 5.713 1.00 0.97 O ATOM 1970 CB ALA A 138 -15.939 0.542 7.900 1.00 1.54 C ATOM 0 H ALA A 138 -16.275 -1.400 6.417 1.00 1.04 H new ATOM 0 HA ALA A 138 -17.191 1.293 6.334 1.00 1.16 H new ATOM 0 HB1 ALA A 138 -15.751 1.523 8.336 1.00 1.54 H new ATOM 0 HB2 ALA A 138 -16.772 0.068 8.419 1.00 1.54 H new ATOM 0 HB3 ALA A 138 -15.048 -0.078 8.002 1.00 1.54 H new ATOM 1976 N GLU A 139 -14.268 0.695 5.059 1.00 0.82 N ATOM 1977 CA GLU A 139 -13.202 1.279 4.252 1.00 0.81 C ATOM 1978 C GLU A 139 -13.806 2.101 3.124 1.00 0.71 C ATOM 1979 O GLU A 139 -13.483 3.273 2.956 1.00 0.80 O ATOM 1980 CB GLU A 139 -12.302 0.179 3.676 1.00 0.97 C ATOM 1981 CG GLU A 139 -11.277 0.674 2.674 1.00 1.27 C ATOM 1982 CD GLU A 139 -10.138 1.391 3.343 1.00 1.55 C ATOM 1983 OE1 GLU A 139 -10.299 2.570 3.708 1.00 1.90 O ATOM 1984 OE2 GLU A 139 -9.091 0.759 3.565 1.00 2.13 O ATOM 0 H GLU A 139 -14.262 -0.325 5.086 1.00 0.82 H new ATOM 0 HA GLU A 139 -12.595 1.926 4.885 1.00 0.81 H new ATOM 0 HB2 GLU A 139 -11.782 -0.316 4.496 1.00 0.97 H new ATOM 0 HB3 GLU A 139 -12.928 -0.573 3.196 1.00 0.97 H new ATOM 0 HG2 GLU A 139 -10.889 -0.171 2.104 1.00 1.27 H new ATOM 0 HG3 GLU A 139 -11.759 1.344 1.962 1.00 1.27 H new ATOM 1991 N ALA A 140 -14.724 1.484 2.388 1.00 0.71 N ATOM 1992 CA ALA A 140 -15.389 2.147 1.272 1.00 0.90 C ATOM 1993 C ALA A 140 -16.096 3.418 1.728 1.00 0.85 C ATOM 1994 O ALA A 140 -16.191 4.391 0.983 1.00 1.08 O ATOM 1995 CB ALA A 140 -16.378 1.200 0.608 1.00 1.09 C ATOM 0 H ALA A 140 -15.025 0.522 2.545 1.00 0.71 H new ATOM 0 HA ALA A 140 -14.627 2.428 0.545 1.00 0.90 H new ATOM 0 HB1 ALA A 140 -16.867 1.708 -0.223 1.00 1.09 H new ATOM 0 HB2 ALA A 140 -15.848 0.323 0.236 1.00 1.09 H new ATOM 0 HB3 ALA A 140 -17.128 0.889 1.335 1.00 1.09 H new ATOM 2001 N ALA A 141 -16.573 3.410 2.966 1.00 0.71 N ATOM 2002 CA ALA A 141 -17.291 4.549 3.511 1.00 0.82 C ATOM 2003 C ALA A 141 -16.347 5.703 3.839 1.00 0.79 C ATOM 2004 O ALA A 141 -16.669 6.864 3.588 1.00 0.92 O ATOM 2005 CB ALA A 141 -18.073 4.134 4.747 1.00 0.95 C ATOM 0 H ALA A 141 -16.474 2.625 3.610 1.00 0.71 H new ATOM 0 HA ALA A 141 -17.988 4.900 2.750 1.00 0.82 H new ATOM 0 HB1 ALA A 141 -18.607 4.996 5.146 1.00 0.95 H new ATOM 0 HB2 ALA A 141 -18.788 3.356 4.481 1.00 0.95 H new ATOM 0 HB3 ALA A 141 -17.385 3.752 5.501 1.00 0.95 H new ATOM 2011 N THR A 142 -15.182 5.391 4.394 1.00 0.72 N ATOM 2012 CA THR A 142 -14.246 6.427 4.798 1.00 0.83 C ATOM 2013 C THR A 142 -13.323 6.849 3.645 1.00 0.97 C ATOM 2014 O THR A 142 -13.052 8.036 3.462 1.00 1.17 O ATOM 2015 CB THR A 142 -13.396 5.960 5.993 1.00 0.84 C ATOM 2016 OG1 THR A 142 -14.236 5.319 6.964 1.00 0.81 O ATOM 2017 CG2 THR A 142 -12.686 7.136 6.646 1.00 1.00 C ATOM 0 H THR A 142 -14.867 4.437 4.572 1.00 0.72 H new ATOM 0 HA THR A 142 -14.840 7.292 5.092 1.00 0.83 H new ATOM 0 HB THR A 142 -12.648 5.258 5.626 1.00 0.84 H new ATOM 0 HG1 THR A 142 -14.510 4.440 6.630 1.00 0.81 H new ATOM 0 HG21 THR A 142 -12.092 6.780 7.488 1.00 1.00 H new ATOM 0 HG22 THR A 142 -12.033 7.616 5.918 1.00 1.00 H new ATOM 0 HG23 THR A 142 -13.424 7.855 7.001 1.00 1.00 H new ATOM 2025 N ALA A 143 -12.853 5.882 2.865 1.00 0.97 N ATOM 2026 CA ALA A 143 -11.877 6.156 1.814 1.00 1.19 C ATOM 2027 C ALA A 143 -12.530 6.696 0.544 1.00 1.05 C ATOM 2028 O ALA A 143 -12.094 7.709 0.002 1.00 1.28 O ATOM 2029 CB ALA A 143 -11.080 4.900 1.498 1.00 1.42 C ATOM 0 H ALA A 143 -13.130 4.903 2.939 1.00 0.97 H new ATOM 0 HA ALA A 143 -11.207 6.929 2.189 1.00 1.19 H new ATOM 0 HB1 ALA A 143 -10.356 5.117 0.713 1.00 1.42 H new ATOM 0 HB2 ALA A 143 -10.556 4.567 2.394 1.00 1.42 H new ATOM 0 HB3 ALA A 143 -11.757 4.115 1.161 1.00 1.42 H new ATOM 2035 N CYS A 144 -13.586 6.037 0.083 1.00 0.87 N ATOM 2036 CA CYS A 144 -14.220 6.399 -1.186 1.00 0.96 C ATOM 2037 C CYS A 144 -15.179 7.581 -1.027 1.00 0.91 C ATOM 2038 O CYS A 144 -16.024 7.828 -1.891 1.00 1.26 O ATOM 2039 CB CYS A 144 -14.960 5.196 -1.775 1.00 1.28 C ATOM 2040 SG CYS A 144 -13.882 3.792 -2.214 1.00 1.45 S ATOM 0 H CYS A 144 -14.023 5.251 0.564 1.00 0.87 H new ATOM 0 HA CYS A 144 -13.429 6.704 -1.871 1.00 0.96 H new ATOM 0 HB2 CYS A 144 -15.705 4.856 -1.056 1.00 1.28 H new ATOM 0 HB3 CYS A 144 -15.500 5.517 -2.666 1.00 1.28 H new ATOM 2045 N LYS A 145 -15.037 8.310 0.070 1.00 1.09 N ATOM 2046 CA LYS A 145 -15.844 9.494 0.322 1.00 1.29 C ATOM 2047 C LYS A 145 -14.981 10.605 0.899 1.00 1.29 C ATOM 2048 O LYS A 145 -14.176 10.359 1.795 1.00 2.01 O ATOM 2049 CB LYS A 145 -16.996 9.178 1.282 1.00 1.65 C ATOM 2050 CG LYS A 145 -18.167 8.470 0.620 1.00 2.35 C ATOM 2051 CD LYS A 145 -18.821 9.364 -0.416 1.00 3.18 C ATOM 2052 CE LYS A 145 -19.943 8.652 -1.149 1.00 4.04 C ATOM 2053 NZ LYS A 145 -20.584 9.532 -2.158 1.00 4.87 N ATOM 0 H LYS A 145 -14.363 8.099 0.806 1.00 1.09 H new ATOM 0 HA LYS A 145 -16.266 9.824 -0.627 1.00 1.29 H new ATOM 0 HB2 LYS A 145 -16.620 8.557 2.095 1.00 1.65 H new ATOM 0 HB3 LYS A 145 -17.350 10.107 1.729 1.00 1.65 H new ATOM 0 HG2 LYS A 145 -17.822 7.550 0.147 1.00 2.35 H new ATOM 0 HG3 LYS A 145 -18.899 8.185 1.375 1.00 2.35 H new ATOM 0 HD2 LYS A 145 -19.214 10.257 0.071 1.00 3.18 H new ATOM 0 HD3 LYS A 145 -18.071 9.696 -1.134 1.00 3.18 H new ATOM 0 HE2 LYS A 145 -19.550 7.762 -1.640 1.00 4.04 H new ATOM 0 HE3 LYS A 145 -20.691 8.316 -0.431 1.00 4.04 H new ATOM 0 HZ1 LYS A 145 -21.346 9.012 -2.639 1.00 4.87 H new ATOM 0 HZ2 LYS A 145 -20.981 10.369 -1.686 1.00 4.87 H new ATOM 0 HZ3 LYS A 145 -19.875 9.832 -2.857 1.00 4.87 H new ATOM 2067 N ASN A 146 -15.138 11.815 0.350 1.00 1.10 N ATOM 2068 CA ASN A 146 -14.421 13.012 0.821 1.00 1.21 C ATOM 2069 C ASN A 146 -12.960 13.011 0.380 1.00 1.25 C ATOM 2070 O ASN A 146 -12.418 14.052 0.005 1.00 1.88 O ATOM 2071 CB ASN A 146 -14.506 13.160 2.347 1.00 1.56 C ATOM 2072 CG ASN A 146 -15.863 13.644 2.830 1.00 2.22 C ATOM 2073 OD1 ASN A 146 -15.960 14.306 3.864 1.00 2.76 O ATOM 2074 ND2 ASN A 146 -16.921 13.324 2.096 1.00 2.97 N ATOM 0 H ASN A 146 -15.765 11.995 -0.434 1.00 1.10 H new ATOM 0 HA ASN A 146 -14.916 13.867 0.362 1.00 1.21 H new ATOM 0 HB2 ASN A 146 -14.285 12.199 2.811 1.00 1.56 H new ATOM 0 HB3 ASN A 146 -13.739 13.859 2.680 1.00 1.56 H new ATOM 0 HD21 ASN A 146 -17.851 13.628 2.383 1.00 2.97 H new ATOM 0 HD22 ASN A 146 -16.804 12.774 1.245 1.00 2.97 H new ATOM 2081 N THR A 147 -12.326 11.849 0.438 1.00 1.03 N ATOM 2082 CA THR A 147 -10.942 11.701 0.026 1.00 1.07 C ATOM 2083 C THR A 147 -10.788 11.943 -1.479 1.00 1.14 C ATOM 2084 O THR A 147 -10.945 11.032 -2.292 1.00 2.01 O ATOM 2085 CB THR A 147 -10.424 10.298 0.389 1.00 1.20 C ATOM 2086 OG1 THR A 147 -10.816 9.978 1.730 1.00 1.79 O ATOM 2087 CG2 THR A 147 -8.910 10.225 0.279 1.00 1.52 C ATOM 0 H THR A 147 -12.756 10.986 0.771 1.00 1.03 H new ATOM 0 HA THR A 147 -10.351 12.448 0.556 1.00 1.07 H new ATOM 0 HB THR A 147 -10.855 9.583 -0.312 1.00 1.20 H new ATOM 0 HG1 THR A 147 -11.360 9.163 1.726 1.00 1.79 H new ATOM 0 HG21 THR A 147 -8.574 9.222 0.542 1.00 1.52 H new ATOM 0 HG22 THR A 147 -8.608 10.453 -0.743 1.00 1.52 H new ATOM 0 HG23 THR A 147 -8.460 10.948 0.960 1.00 1.52 H new ATOM 2095 N ASP A 148 -10.521 13.192 -1.838 1.00 0.94 N ATOM 2096 CA ASP A 148 -10.364 13.573 -3.233 1.00 1.01 C ATOM 2097 C ASP A 148 -8.951 14.077 -3.492 1.00 0.89 C ATOM 2098 O ASP A 148 -8.112 13.352 -4.020 1.00 0.88 O ATOM 2099 CB ASP A 148 -11.383 14.648 -3.607 1.00 1.33 C ATOM 2100 CG ASP A 148 -11.341 15.004 -5.078 1.00 1.89 C ATOM 2101 OD1 ASP A 148 -11.937 14.268 -5.889 1.00 2.20 O ATOM 2102 OD2 ASP A 148 -10.696 16.011 -5.427 1.00 2.54 O ATOM 0 H ASP A 148 -10.408 13.961 -1.178 1.00 0.94 H new ATOM 0 HA ASP A 148 -10.538 12.693 -3.852 1.00 1.01 H new ATOM 0 HB2 ASP A 148 -12.383 14.300 -3.350 1.00 1.33 H new ATOM 0 HB3 ASP A 148 -11.195 15.544 -3.015 1.00 1.33 H new ATOM 2107 N SER A 149 -8.681 15.314 -3.089 1.00 0.95 N ATOM 2108 CA SER A 149 -7.344 15.881 -3.207 1.00 1.01 C ATOM 2109 C SER A 149 -6.378 15.125 -2.300 1.00 0.85 C ATOM 2110 O SER A 149 -5.171 15.092 -2.533 1.00 1.07 O ATOM 2111 CB SER A 149 -7.372 17.361 -2.824 1.00 1.27 C ATOM 2112 OG SER A 149 -8.381 18.053 -3.544 1.00 1.53 O ATOM 0 H SER A 149 -9.371 15.943 -2.678 1.00 0.95 H new ATOM 0 HA SER A 149 -7.007 15.788 -4.239 1.00 1.01 H new ATOM 0 HB2 SER A 149 -7.551 17.460 -1.753 1.00 1.27 H new ATOM 0 HB3 SER A 149 -6.401 17.812 -3.028 1.00 1.27 H new ATOM 0 HG SER A 149 -8.381 18.997 -3.281 1.00 1.53 H new ATOM 2118 N THR A 150 -6.940 14.504 -1.278 1.00 0.63 N ATOM 2119 CA THR A 150 -6.176 13.740 -0.320 1.00 0.67 C ATOM 2120 C THR A 150 -6.153 12.255 -0.683 1.00 0.56 C ATOM 2121 O THR A 150 -5.811 11.416 0.149 1.00 0.64 O ATOM 2122 CB THR A 150 -6.776 13.922 1.087 1.00 0.92 C ATOM 2123 OG1 THR A 150 -8.209 13.871 1.011 1.00 1.15 O ATOM 2124 CG2 THR A 150 -6.343 15.246 1.697 1.00 1.26 C ATOM 0 H THR A 150 -7.943 14.518 -1.093 1.00 0.63 H new ATOM 0 HA THR A 150 -5.150 14.108 -0.334 1.00 0.67 H new ATOM 0 HB THR A 150 -6.412 13.115 1.723 1.00 0.92 H new ATOM 0 HG1 THR A 150 -8.588 13.985 1.907 1.00 1.15 H new ATOM 0 HG21 THR A 150 -6.780 15.349 2.690 1.00 1.26 H new ATOM 0 HG22 THR A 150 -5.256 15.273 1.775 1.00 1.26 H new ATOM 0 HG23 THR A 150 -6.682 16.066 1.064 1.00 1.26 H new ATOM 2132 N ASN A 151 -6.495 11.937 -1.930 1.00 0.49 N ATOM 2133 CA ASN A 151 -6.564 10.545 -2.365 1.00 0.47 C ATOM 2134 C ASN A 151 -5.175 9.965 -2.605 1.00 0.44 C ATOM 2135 O ASN A 151 -4.681 9.923 -3.733 1.00 0.59 O ATOM 2136 CB ASN A 151 -7.408 10.394 -3.632 1.00 0.57 C ATOM 2137 CG ASN A 151 -7.732 8.939 -3.936 1.00 0.69 C ATOM 2138 OD1 ASN A 151 -7.906 8.130 -3.029 1.00 1.21 O ATOM 2139 ND2 ASN A 151 -7.786 8.589 -5.213 1.00 0.79 N ATOM 0 H ASN A 151 -6.727 12.619 -2.652 1.00 0.49 H new ATOM 0 HA ASN A 151 -7.041 9.989 -1.558 1.00 0.47 H new ATOM 0 HB2 ASN A 151 -8.336 10.955 -3.518 1.00 0.57 H new ATOM 0 HB3 ASN A 151 -6.874 10.830 -4.476 1.00 0.57 H new ATOM 0 HD21 ASN A 151 -7.977 7.620 -5.469 1.00 0.79 H new ATOM 0 HD22 ASN A 151 -7.636 9.288 -5.940 1.00 0.79 H new ATOM 2146 N LYS A 152 -4.531 9.567 -1.523 1.00 0.41 N ATOM 2147 CA LYS A 152 -3.297 8.803 -1.595 1.00 0.41 C ATOM 2148 C LYS A 152 -3.262 7.809 -0.445 1.00 0.39 C ATOM 2149 O LYS A 152 -3.487 8.167 0.711 1.00 0.48 O ATOM 2150 CB LYS A 152 -2.036 9.696 -1.574 1.00 0.48 C ATOM 2151 CG LYS A 152 -1.836 10.501 -0.291 1.00 0.67 C ATOM 2152 CD LYS A 152 -2.715 11.740 -0.236 1.00 0.85 C ATOM 2153 CE LYS A 152 -2.847 12.273 1.183 1.00 0.82 C ATOM 2154 NZ LYS A 152 -1.544 12.695 1.767 1.00 1.35 N ATOM 0 H LYS A 152 -4.846 9.763 -0.573 1.00 0.41 H new ATOM 0 HA LYS A 152 -3.285 8.278 -2.550 1.00 0.41 H new ATOM 0 HB2 LYS A 152 -1.160 9.066 -1.730 1.00 0.48 H new ATOM 0 HB3 LYS A 152 -2.085 10.388 -2.415 1.00 0.48 H new ATOM 0 HG2 LYS A 152 -2.053 9.867 0.569 1.00 0.67 H new ATOM 0 HG3 LYS A 152 -0.790 10.798 -0.212 1.00 0.67 H new ATOM 0 HD2 LYS A 152 -2.294 12.514 -0.878 1.00 0.85 H new ATOM 0 HD3 LYS A 152 -3.704 11.503 -0.629 1.00 0.85 H new ATOM 0 HE2 LYS A 152 -3.532 13.121 1.185 1.00 0.82 H new ATOM 0 HE3 LYS A 152 -3.290 11.504 1.815 1.00 0.82 H new ATOM 0 HZ1 LYS A 152 -1.695 13.049 2.733 1.00 1.35 H new ATOM 0 HZ2 LYS A 152 -0.896 11.882 1.793 1.00 1.35 H new ATOM 0 HZ3 LYS A 152 -1.130 13.449 1.183 1.00 1.35 H new ATOM 2168 N VAL A 153 -3.017 6.560 -0.767 1.00 0.36 N ATOM 2169 CA VAL A 153 -2.963 5.521 0.236 1.00 0.37 C ATOM 2170 C VAL A 153 -1.769 4.603 -0.003 1.00 0.35 C ATOM 2171 O VAL A 153 -1.774 3.749 -0.891 1.00 0.43 O ATOM 2172 CB VAL A 153 -4.287 4.715 0.303 1.00 0.43 C ATOM 2173 CG1 VAL A 153 -4.805 4.385 -1.087 1.00 1.18 C ATOM 2174 CG2 VAL A 153 -4.107 3.445 1.116 1.00 1.32 C ATOM 0 H VAL A 153 -2.851 6.237 -1.720 1.00 0.36 H new ATOM 0 HA VAL A 153 -2.834 6.004 1.205 1.00 0.37 H new ATOM 0 HB VAL A 153 -5.028 5.342 0.799 1.00 0.43 H new ATOM 0 HG11 VAL A 153 -5.734 3.820 -1.005 1.00 1.18 H new ATOM 0 HG12 VAL A 153 -4.990 5.309 -1.635 1.00 1.18 H new ATOM 0 HG13 VAL A 153 -4.064 3.789 -1.620 1.00 1.18 H new ATOM 0 HG21 VAL A 153 -5.049 2.897 1.148 1.00 1.32 H new ATOM 0 HG22 VAL A 153 -3.341 2.823 0.654 1.00 1.32 H new ATOM 0 HG23 VAL A 153 -3.802 3.702 2.130 1.00 1.32 H new ATOM 2184 N THR A 154 -0.728 4.833 0.767 1.00 0.35 N ATOM 2185 CA THR A 154 0.433 3.967 0.768 1.00 0.38 C ATOM 2186 C THR A 154 0.197 2.789 1.712 1.00 0.37 C ATOM 2187 O THR A 154 -0.154 2.990 2.881 1.00 0.47 O ATOM 2188 CB THR A 154 1.670 4.757 1.223 1.00 0.52 C ATOM 2189 OG1 THR A 154 1.413 5.360 2.497 1.00 0.94 O ATOM 2190 CG2 THR A 154 2.027 5.839 0.217 1.00 0.96 C ATOM 0 H THR A 154 -0.661 5.623 1.409 1.00 0.35 H new ATOM 0 HA THR A 154 0.600 3.590 -0.241 1.00 0.38 H new ATOM 0 HB THR A 154 2.509 4.065 1.300 1.00 0.52 H new ATOM 0 HG1 THR A 154 0.760 4.820 2.989 1.00 0.94 H new ATOM 0 HG21 THR A 154 2.906 6.383 0.564 1.00 0.96 H new ATOM 0 HG22 THR A 154 2.241 5.381 -0.749 1.00 0.96 H new ATOM 0 HG23 THR A 154 1.190 6.530 0.114 1.00 0.96 H new ATOM 2198 N TYR A 155 0.337 1.557 1.224 1.00 0.35 N ATOM 2199 CA TYR A 155 0.132 0.416 2.101 1.00 0.38 C ATOM 2200 C TYR A 155 1.134 -0.712 1.874 1.00 0.38 C ATOM 2201 O TYR A 155 1.290 -1.221 0.764 1.00 0.61 O ATOM 2202 CB TYR A 155 -1.307 -0.098 1.993 1.00 0.41 C ATOM 2203 CG TYR A 155 -1.815 -0.351 0.589 1.00 0.43 C ATOM 2204 CD1 TYR A 155 -2.187 0.703 -0.235 1.00 0.50 C ATOM 2205 CD2 TYR A 155 -1.880 -1.640 0.072 1.00 0.53 C ATOM 2206 CE1 TYR A 155 -2.618 0.479 -1.527 1.00 0.61 C ATOM 2207 CE2 TYR A 155 -2.302 -1.872 -1.221 1.00 0.63 C ATOM 2208 CZ TYR A 155 -2.818 -0.818 -1.961 1.00 0.65 C ATOM 2209 OH TYR A 155 -3.093 -1.036 -3.306 1.00 0.79 O ATOM 0 H TYR A 155 0.583 1.332 0.260 1.00 0.35 H new ATOM 0 HA TYR A 155 0.307 0.774 3.116 1.00 0.38 H new ATOM 0 HB2 TYR A 155 -1.384 -1.026 2.559 1.00 0.41 H new ATOM 0 HB3 TYR A 155 -1.967 0.624 2.473 1.00 0.41 H new ATOM 0 HD1 TYR A 155 -2.138 1.714 0.141 1.00 0.50 H new ATOM 0 HD2 TYR A 155 -1.595 -2.475 0.694 1.00 0.53 H new ATOM 0 HE1 TYR A 155 -2.797 1.310 -2.193 1.00 0.61 H new ATOM 0 HE2 TYR A 155 -2.232 -2.860 -1.651 1.00 0.63 H new ATOM 0 HH TYR A 155 -3.209 -1.996 -3.465 1.00 0.79 H new ATOM 2219 N PHE A 156 1.803 -1.097 2.955 1.00 0.41 N ATOM 2220 CA PHE A 156 2.725 -2.224 2.940 1.00 0.44 C ATOM 2221 C PHE A 156 1.978 -3.516 2.668 1.00 0.46 C ATOM 2222 O PHE A 156 0.993 -3.830 3.331 1.00 0.46 O ATOM 2223 CB PHE A 156 3.453 -2.360 4.278 1.00 0.44 C ATOM 2224 CG PHE A 156 4.543 -1.357 4.497 1.00 0.45 C ATOM 2225 CD1 PHE A 156 5.809 -1.568 3.983 1.00 0.55 C ATOM 2226 CD2 PHE A 156 4.294 -0.192 5.204 1.00 0.53 C ATOM 2227 CE1 PHE A 156 6.806 -0.635 4.169 1.00 0.62 C ATOM 2228 CE2 PHE A 156 5.290 0.744 5.395 1.00 0.61 C ATOM 2229 CZ PHE A 156 6.580 0.478 4.925 1.00 0.62 C ATOM 0 H PHE A 156 1.721 -0.638 3.862 1.00 0.41 H new ATOM 0 HA PHE A 156 3.452 -2.037 2.150 1.00 0.44 H new ATOM 0 HB2 PHE A 156 2.725 -2.268 5.084 1.00 0.44 H new ATOM 0 HB3 PHE A 156 3.879 -3.361 4.345 1.00 0.44 H new ATOM 0 HD1 PHE A 156 6.018 -2.472 3.431 1.00 0.55 H new ATOM 0 HD2 PHE A 156 3.309 -0.014 5.610 1.00 0.53 H new ATOM 0 HE1 PHE A 156 7.773 -0.786 3.713 1.00 0.62 H new ATOM 0 HE2 PHE A 156 5.075 1.673 5.902 1.00 0.61 H new ATOM 0 HZ PHE A 156 7.393 1.150 5.159 1.00 0.62 H new ATOM 2239 N MET A 157 2.457 -4.282 1.715 1.00 0.59 N ATOM 2240 CA MET A 157 1.818 -5.536 1.374 1.00 0.68 C ATOM 2241 C MET A 157 2.793 -6.699 1.523 1.00 0.82 C ATOM 2242 O MET A 157 4.002 -6.523 1.372 1.00 1.12 O ATOM 2243 CB MET A 157 1.201 -5.456 -0.027 1.00 0.83 C ATOM 2244 CG MET A 157 1.878 -4.442 -0.946 1.00 1.47 C ATOM 2245 SD MET A 157 3.593 -4.842 -1.335 1.00 2.50 S ATOM 2246 CE MET A 157 3.372 -6.269 -2.393 1.00 3.27 C ATOM 0 H MET A 157 3.285 -4.061 1.162 1.00 0.59 H new ATOM 0 HA MET A 157 1.002 -5.723 2.072 1.00 0.68 H new ATOM 0 HB2 MET A 157 1.250 -6.441 -0.491 1.00 0.83 H new ATOM 0 HB3 MET A 157 0.146 -5.199 0.066 1.00 0.83 H new ATOM 0 HG2 MET A 157 1.311 -4.373 -1.875 1.00 1.47 H new ATOM 0 HG3 MET A 157 1.842 -3.459 -0.476 1.00 1.47 H new ATOM 0 HE1 MET A 157 4.115 -6.249 -3.190 1.00 3.27 H new ATOM 0 HE2 MET A 157 3.494 -7.179 -1.806 1.00 3.27 H new ATOM 0 HE3 MET A 157 2.373 -6.248 -2.828 1.00 3.27 H new ATOM 2256 N LYS A 158 2.263 -7.864 1.898 1.00 0.75 N ATOM 2257 CA LYS A 158 3.080 -9.034 2.207 1.00 0.96 C ATOM 2258 C LYS A 158 3.840 -9.532 0.985 1.00 1.43 C ATOM 2259 O LYS A 158 5.037 -9.192 0.864 1.00 1.89 O ATOM 2260 CB LYS A 158 2.216 -10.160 2.787 1.00 0.95 C ATOM 2261 CG LYS A 158 3.026 -11.344 3.296 1.00 1.11 C ATOM 2262 CD LYS A 158 2.138 -12.441 3.867 1.00 1.49 C ATOM 2263 CE LYS A 158 1.226 -13.035 2.807 1.00 1.88 C ATOM 2264 NZ LYS A 158 0.406 -14.152 3.344 1.00 2.24 N ATOM 2265 OXT LYS A 158 3.247 -10.257 0.172 1.00 2.11 O ATOM 0 H LYS A 158 1.260 -8.021 1.995 1.00 0.75 H new ATOM 0 HA LYS A 158 3.813 -8.728 2.954 1.00 0.96 H new ATOM 0 HB2 LYS A 158 1.615 -9.762 3.605 1.00 0.95 H new ATOM 0 HB3 LYS A 158 1.522 -10.507 2.021 1.00 0.95 H new ATOM 0 HG2 LYS A 158 3.625 -11.750 2.481 1.00 1.11 H new ATOM 0 HG3 LYS A 158 3.721 -11.004 4.064 1.00 1.11 H new ATOM 0 HD2 LYS A 158 2.760 -13.228 4.294 1.00 1.49 H new ATOM 0 HD3 LYS A 158 1.535 -12.035 4.680 1.00 1.49 H new ATOM 0 HE2 LYS A 158 0.569 -12.258 2.416 1.00 1.88 H new ATOM 0 HE3 LYS A 158 1.827 -13.395 1.971 1.00 1.88 H new ATOM 0 HZ1 LYS A 158 0.403 -14.939 2.664 1.00 2.24 H new ATOM 0 HZ2 LYS A 158 0.809 -14.476 4.246 1.00 2.24 H new ATOM 0 HZ3 LYS A 158 -0.569 -13.824 3.498 1.00 2.24 H new