USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1017 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 100 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 102 THR OG1 : rot 180:sc= 0.0351 USER MOD Set 1.3: A 111 ASN : amide:sc= 0.0348 X(o=0.07,f=0.46) USER MOD Set 1.4: A 113 MET CE :methyl 148:sc= 0 (180deg=0) USER MOD Set 2.1: A 105 ASN : amide:sc= 0.0106 X(o=0.011,f=0) USER MOD Set 2.2: A 110 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 49 LYS NZ :NH3+ -143:sc= 0.125 (180deg=0) USER MOD Set 3.2: A 51 THR OG1 : rot -177:sc= 0.128 USER MOD Set 4.1: A 47 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD Set 4.2: A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 27:sc= 0.00305 USER MOD Single : A 4 SER OG : rot 172:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.176) USER MOD Single : A 7 TYR OH : rot 150:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0.0675 K(o=0.068,f=-0.55) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.0062) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0.0304 X(o=0.03,f=0) USER MOD Single : A 14 ASN : amide:sc= 0.0128 X(o=0.013,f=0) USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.687) USER MOD Single : A 39 SER OG : rot 80:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.083) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 40:sc= 0.279 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= -0.551 K(o=-0.55,f=-1.7) USER MOD Single : A 69 CYS SG : rot -8:sc= -0.578 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0.0788 USER MOD Single : A 74 MET CE :methyl 174:sc= 0 (180deg=-0.0339) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 169:sc= 0.082 USER MOD Single : A 84 GLN : amide:sc= -0.015 X(o=-0.015,f=-0.027) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.088) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 38:sc= 0.0882 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 50:sc= -0.0344 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot -150:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 12.402 -9.551 -3.710 1.00 0.00 N ATOM 2 CA SER A 2 11.870 -10.155 -2.481 1.00 0.00 C ATOM 3 C SER A 2 10.857 -9.185 -1.824 1.00 0.00 C ATOM 4 O SER A 2 11.221 -8.089 -1.383 1.00 0.00 O ATOM 5 CB SER A 2 13.012 -10.532 -1.510 1.00 0.00 C ATOM 6 OG SER A 2 13.825 -11.568 -2.048 1.00 0.00 O ATOM 0 HA SER A 2 11.350 -11.079 -2.732 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.625 -9.654 -1.307 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.591 -10.854 -0.557 1.00 0.00 H new ATOM 0 HG SER A 2 13.794 -11.533 -3.027 1.00 0.00 H new ATOM 12 N PHE A 3 9.585 -9.615 -1.752 1.00 0.00 N ATOM 13 CA PHE A 3 8.469 -8.789 -1.197 1.00 0.00 C ATOM 14 C PHE A 3 8.448 -8.539 0.341 1.00 0.00 C ATOM 15 O PHE A 3 7.827 -7.554 0.748 1.00 0.00 O ATOM 16 CB PHE A 3 7.106 -9.388 -1.640 1.00 0.00 C ATOM 17 CG PHE A 3 6.703 -9.113 -3.094 1.00 0.00 C ATOM 18 CD1 PHE A 3 6.073 -7.908 -3.429 1.00 0.00 C ATOM 19 CD2 PHE A 3 6.942 -10.065 -4.090 1.00 0.00 C ATOM 20 CE1 PHE A 3 5.692 -7.662 -4.744 1.00 0.00 C ATOM 21 CE2 PHE A 3 6.549 -9.818 -5.401 1.00 0.00 C ATOM 22 CZ PHE A 3 5.925 -8.618 -5.725 1.00 0.00 C ATOM 0 H PHE A 3 9.290 -10.538 -2.072 1.00 0.00 H new ATOM 0 HA PHE A 3 8.653 -7.800 -1.617 1.00 0.00 H new ATOM 0 HB2 PHE A 3 7.137 -10.467 -1.488 1.00 0.00 H new ATOM 0 HB3 PHE A 3 6.327 -8.996 -0.986 1.00 0.00 H new ATOM 0 HD1 PHE A 3 5.883 -7.169 -2.665 1.00 0.00 H new ATOM 0 HD2 PHE A 3 7.433 -10.994 -3.841 1.00 0.00 H new ATOM 0 HE1 PHE A 3 5.215 -6.728 -5.002 1.00 0.00 H new ATOM 0 HE2 PHE A 3 6.728 -10.558 -6.167 1.00 0.00 H new ATOM 0 HZ PHE A 3 5.620 -8.428 -6.744 1.00 0.00 H new ATOM 32 N SER A 4 9.096 -9.371 1.188 1.00 0.00 N ATOM 33 CA SER A 4 9.166 -9.136 2.656 1.00 0.00 C ATOM 34 C SER A 4 10.067 -7.907 2.980 1.00 0.00 C ATOM 35 O SER A 4 11.289 -7.962 2.804 1.00 0.00 O ATOM 36 CB SER A 4 9.660 -10.410 3.378 1.00 0.00 C ATOM 37 OG SER A 4 8.730 -11.480 3.232 1.00 0.00 O ATOM 0 H SER A 4 9.581 -10.215 0.882 1.00 0.00 H new ATOM 0 HA SER A 4 8.165 -8.908 3.022 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.627 -10.708 2.974 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.809 -10.196 4.436 1.00 0.00 H new ATOM 0 HG SER A 4 9.125 -12.307 3.580 1.00 0.00 H new ATOM 43 N GLY A 5 9.434 -6.796 3.396 1.00 0.00 N ATOM 44 CA GLY A 5 10.130 -5.505 3.574 1.00 0.00 C ATOM 45 C GLY A 5 9.194 -4.319 3.892 1.00 0.00 C ATOM 46 O GLY A 5 7.981 -4.347 3.648 1.00 0.00 O ATOM 0 H GLY A 5 8.439 -6.764 3.616 1.00 0.00 H new ATOM 0 HA2 GLY A 5 10.857 -5.605 4.380 1.00 0.00 H new ATOM 0 HA3 GLY A 5 10.689 -5.278 2.666 1.00 0.00 H new ATOM 50 N LYS A 6 9.817 -3.253 4.419 1.00 0.00 N ATOM 51 CA LYS A 6 9.124 -1.989 4.789 1.00 0.00 C ATOM 52 C LYS A 6 9.477 -0.924 3.717 1.00 0.00 C ATOM 53 O LYS A 6 10.643 -0.547 3.573 1.00 0.00 O ATOM 54 CB LYS A 6 9.550 -1.502 6.203 1.00 0.00 C ATOM 55 CG LYS A 6 9.022 -2.312 7.410 1.00 0.00 C ATOM 56 CD LYS A 6 9.835 -3.577 7.771 1.00 0.00 C ATOM 57 CE LYS A 6 9.378 -4.297 9.056 1.00 0.00 C ATOM 58 NZ LYS A 6 8.096 -5.009 8.898 1.00 0.00 N ATOM 0 H LYS A 6 10.820 -3.234 4.605 1.00 0.00 H new ATOM 0 HA LYS A 6 8.047 -2.156 4.823 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.639 -1.499 6.247 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.223 -0.469 6.319 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.996 -1.657 8.281 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.994 -2.609 7.204 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.777 -4.278 6.939 1.00 0.00 H new ATOM 0 HD3 LYS A 6 10.883 -3.299 7.881 1.00 0.00 H new ATOM 0 HE2 LYS A 6 10.146 -5.008 9.359 1.00 0.00 H new ATOM 0 HE3 LYS A 6 9.284 -3.567 9.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 7.966 -5.670 9.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 7.316 -4.321 8.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 8.101 -5.538 8.003 1.00 0.00 H new ATOM 72 N TYR A 7 8.470 -0.459 2.960 1.00 0.00 N ATOM 73 CA TYR A 7 8.683 0.379 1.747 1.00 0.00 C ATOM 74 C TYR A 7 8.111 1.794 2.029 1.00 0.00 C ATOM 75 O TYR A 7 6.899 2.006 1.912 1.00 0.00 O ATOM 76 CB TYR A 7 8.024 -0.270 0.489 1.00 0.00 C ATOM 77 CG TYR A 7 8.508 -1.679 0.087 1.00 0.00 C ATOM 78 CD1 TYR A 7 9.586 -1.847 -0.791 1.00 0.00 C ATOM 79 CD2 TYR A 7 7.856 -2.808 0.592 1.00 0.00 C ATOM 80 CE1 TYR A 7 10.006 -3.128 -1.145 1.00 0.00 C ATOM 81 CE2 TYR A 7 8.288 -4.085 0.250 1.00 0.00 C ATOM 82 CZ TYR A 7 9.367 -4.245 -0.615 1.00 0.00 C ATOM 83 OH TYR A 7 9.809 -5.501 -0.928 1.00 0.00 O ATOM 0 H TYR A 7 7.488 -0.646 3.161 1.00 0.00 H new ATOM 0 HA TYR A 7 9.748 0.455 1.530 1.00 0.00 H new ATOM 0 HB2 TYR A 7 6.948 -0.318 0.658 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.184 0.397 -0.358 1.00 0.00 H new ATOM 0 HD1 TYR A 7 10.093 -0.983 -1.194 1.00 0.00 H new ATOM 0 HD2 TYR A 7 7.010 -2.688 1.253 1.00 0.00 H new ATOM 0 HE1 TYR A 7 10.829 -3.254 -1.832 1.00 0.00 H new ATOM 0 HE2 TYR A 7 7.787 -4.952 0.655 1.00 0.00 H new ATOM 0 HH TYR A 7 9.626 -6.108 -0.181 1.00 0.00 H new ATOM 93 N GLN A 8 8.973 2.764 2.402 1.00 0.00 N ATOM 94 CA GLN A 8 8.526 4.146 2.743 1.00 0.00 C ATOM 95 C GLN A 8 8.600 5.078 1.504 1.00 0.00 C ATOM 96 O GLN A 8 9.566 5.042 0.739 1.00 0.00 O ATOM 97 CB GLN A 8 9.321 4.700 3.955 1.00 0.00 C ATOM 98 CG GLN A 8 8.709 5.999 4.542 1.00 0.00 C ATOM 99 CD GLN A 8 9.354 6.540 5.825 1.00 0.00 C ATOM 100 OE1 GLN A 8 10.401 6.094 6.297 1.00 0.00 O ATOM 101 NE2 GLN A 8 8.714 7.533 6.420 1.00 0.00 N ATOM 0 H GLN A 8 9.981 2.624 2.477 1.00 0.00 H new ATOM 0 HA GLN A 8 7.479 4.108 3.042 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.360 3.939 4.735 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.349 4.896 3.649 1.00 0.00 H new ATOM 0 HG2 GLN A 8 8.762 6.776 3.779 1.00 0.00 H new ATOM 0 HG3 GLN A 8 7.653 5.819 4.741 1.00 0.00 H new ATOM 0 HE21 GLN A 8 7.848 7.894 6.020 1.00 0.00 H new ATOM 0 HE22 GLN A 8 9.087 7.938 7.279 1.00 0.00 H new ATOM 110 N LEU A 9 7.570 5.933 1.346 1.00 0.00 N ATOM 111 CA LEU A 9 7.370 6.768 0.131 1.00 0.00 C ATOM 112 C LEU A 9 8.503 7.811 -0.106 1.00 0.00 C ATOM 113 O LEU A 9 9.003 8.452 0.823 1.00 0.00 O ATOM 114 CB LEU A 9 5.959 7.421 0.219 1.00 0.00 C ATOM 115 CG LEU A 9 5.421 8.145 -1.052 1.00 0.00 C ATOM 116 CD1 LEU A 9 5.256 7.205 -2.257 1.00 0.00 C ATOM 117 CD2 LEU A 9 4.074 8.827 -0.739 1.00 0.00 C ATOM 0 H LEU A 9 6.849 6.069 2.055 1.00 0.00 H new ATOM 0 HA LEU A 9 7.424 6.125 -0.748 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.245 6.644 0.491 1.00 0.00 H new ATOM 0 HB3 LEU A 9 5.972 8.142 1.037 1.00 0.00 H new ATOM 0 HG LEU A 9 6.168 8.890 -1.328 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.878 7.769 -3.110 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.221 6.766 -2.511 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.552 6.412 -2.006 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.705 9.331 -1.632 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.351 8.076 -0.421 1.00 0.00 H new ATOM 0 HD23 LEU A 9 4.213 9.557 0.058 1.00 0.00 H new ATOM 129 N GLN A 10 8.898 7.926 -1.380 1.00 0.00 N ATOM 130 CA GLN A 10 10.020 8.784 -1.833 1.00 0.00 C ATOM 131 C GLN A 10 9.499 9.814 -2.876 1.00 0.00 C ATOM 132 O GLN A 10 9.542 11.017 -2.603 1.00 0.00 O ATOM 133 CB GLN A 10 11.191 7.932 -2.395 1.00 0.00 C ATOM 134 CG GLN A 10 11.715 6.782 -1.516 1.00 0.00 C ATOM 135 CD GLN A 10 12.420 7.178 -0.209 1.00 0.00 C ATOM 136 OE1 GLN A 10 11.802 7.246 0.853 1.00 0.00 O ATOM 137 NE2 GLN A 10 13.720 7.427 -0.251 1.00 0.00 N ATOM 0 H GLN A 10 8.446 7.422 -2.143 1.00 0.00 H new ATOM 0 HA GLN A 10 10.417 9.331 -0.978 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.873 7.510 -3.348 1.00 0.00 H new ATOM 0 HB3 GLN A 10 12.025 8.602 -2.605 1.00 0.00 H new ATOM 0 HG2 GLN A 10 10.875 6.134 -1.266 1.00 0.00 H new ATOM 0 HG3 GLN A 10 12.409 6.188 -2.111 1.00 0.00 H new ATOM 0 HE21 GLN A 10 14.222 7.368 -1.137 1.00 0.00 H new ATOM 0 HE22 GLN A 10 14.219 7.678 0.602 1.00 0.00 H new ATOM 146 N SER A 11 9.030 9.342 -4.056 1.00 0.00 N ATOM 147 CA SER A 11 8.613 10.215 -5.184 1.00 0.00 C ATOM 148 C SER A 11 7.195 9.799 -5.656 1.00 0.00 C ATOM 149 O SER A 11 6.995 8.697 -6.178 1.00 0.00 O ATOM 150 CB SER A 11 9.658 10.125 -6.320 1.00 0.00 C ATOM 151 OG SER A 11 9.333 11.020 -7.378 1.00 0.00 O ATOM 0 H SER A 11 8.930 8.347 -4.254 1.00 0.00 H new ATOM 0 HA SER A 11 8.565 11.256 -4.865 1.00 0.00 H new ATOM 0 HB2 SER A 11 10.648 10.361 -5.929 1.00 0.00 H new ATOM 0 HB3 SER A 11 9.701 9.105 -6.701 1.00 0.00 H new ATOM 0 HG SER A 11 10.007 10.949 -8.086 1.00 0.00 H new ATOM 157 N GLN A 12 6.228 10.717 -5.487 1.00 0.00 N ATOM 158 CA GLN A 12 4.832 10.549 -5.965 1.00 0.00 C ATOM 159 C GLN A 12 4.600 11.433 -7.223 1.00 0.00 C ATOM 160 O GLN A 12 4.880 12.637 -7.237 1.00 0.00 O ATOM 161 CB GLN A 12 3.817 10.827 -4.825 1.00 0.00 C ATOM 162 CG GLN A 12 3.825 12.239 -4.181 1.00 0.00 C ATOM 163 CD GLN A 12 3.756 12.224 -2.644 1.00 0.00 C ATOM 164 OE1 GLN A 12 4.778 12.168 -1.959 1.00 0.00 O ATOM 165 NE2 GLN A 12 2.566 12.254 -2.071 1.00 0.00 N ATOM 0 H GLN A 12 6.388 11.605 -5.012 1.00 0.00 H new ATOM 0 HA GLN A 12 4.668 9.513 -6.263 1.00 0.00 H new ATOM 0 HB2 GLN A 12 2.816 10.642 -5.215 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.992 10.097 -4.035 1.00 0.00 H new ATOM 0 HG2 GLN A 12 4.730 12.763 -4.489 1.00 0.00 H new ATOM 0 HG3 GLN A 12 2.980 12.809 -4.567 1.00 0.00 H new ATOM 0 HE21 GLN A 12 1.724 12.300 -2.645 1.00 0.00 H new ATOM 0 HE22 GLN A 12 2.489 12.231 -1.054 1.00 0.00 H new ATOM 174 N GLU A 13 4.075 10.790 -8.271 1.00 0.00 N ATOM 175 CA GLU A 13 3.814 11.424 -9.592 1.00 0.00 C ATOM 176 C GLU A 13 2.392 12.062 -9.623 1.00 0.00 C ATOM 177 O GLU A 13 2.293 13.293 -9.634 1.00 0.00 O ATOM 178 CB GLU A 13 4.097 10.380 -10.709 1.00 0.00 C ATOM 179 CG GLU A 13 4.035 10.921 -12.155 1.00 0.00 C ATOM 180 CD GLU A 13 4.267 9.825 -13.200 1.00 0.00 C ATOM 181 OE1 GLU A 13 3.290 9.159 -13.607 1.00 0.00 O ATOM 182 OE2 GLU A 13 5.429 9.620 -13.613 1.00 0.00 O ATOM 0 H GLU A 13 3.813 9.805 -8.238 1.00 0.00 H new ATOM 0 HA GLU A 13 4.489 12.261 -9.774 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.086 9.953 -10.541 1.00 0.00 H new ATOM 0 HB3 GLU A 13 3.378 9.566 -10.613 1.00 0.00 H new ATOM 0 HG2 GLU A 13 3.062 11.382 -12.326 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.784 11.703 -12.280 1.00 0.00 H new ATOM 189 N ASN A 14 1.322 11.241 -9.635 1.00 0.00 N ATOM 190 CA ASN A 14 -0.083 11.731 -9.666 1.00 0.00 C ATOM 191 C ASN A 14 -0.821 11.348 -8.348 1.00 0.00 C ATOM 192 O ASN A 14 -1.768 10.557 -8.357 1.00 0.00 O ATOM 193 CB ASN A 14 -0.765 11.185 -10.958 1.00 0.00 C ATOM 194 CG ASN A 14 -0.554 12.029 -12.228 1.00 0.00 C ATOM 195 OD1 ASN A 14 -1.131 13.105 -12.379 1.00 0.00 O ATOM 196 ND2 ASN A 14 0.252 11.558 -13.167 1.00 0.00 N ATOM 0 H ASN A 14 1.400 10.224 -9.624 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.122 12.819 -9.711 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.393 10.178 -11.146 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -1.836 11.099 -10.774 1.00 0.00 H new ATOM 0 HD21 ASN A 14 0.399 12.088 -14.026 1.00 0.00 H new ATOM 0 HD22 ASN A 14 0.726 10.665 -13.032 1.00 0.00 H new ATOM 203 N PHE A 15 -0.425 11.967 -7.214 1.00 0.00 N ATOM 204 CA PHE A 15 -1.183 11.880 -5.932 1.00 0.00 C ATOM 205 C PHE A 15 -2.481 12.747 -5.947 1.00 0.00 C ATOM 206 O PHE A 15 -3.544 12.219 -5.619 1.00 0.00 O ATOM 207 CB PHE A 15 -0.239 12.212 -4.739 1.00 0.00 C ATOM 208 CG PHE A 15 -0.798 11.911 -3.331 1.00 0.00 C ATOM 209 CD1 PHE A 15 -1.614 12.844 -2.678 1.00 0.00 C ATOM 210 CD2 PHE A 15 -0.466 10.720 -2.676 1.00 0.00 C ATOM 211 CE1 PHE A 15 -2.095 12.581 -1.398 1.00 0.00 C ATOM 212 CE2 PHE A 15 -0.936 10.468 -1.389 1.00 0.00 C ATOM 213 CZ PHE A 15 -1.751 11.400 -0.752 1.00 0.00 C ATOM 0 H PHE A 15 0.419 12.537 -7.154 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.533 10.856 -5.805 1.00 0.00 H new ATOM 0 HB2 PHE A 15 0.688 11.653 -4.868 1.00 0.00 H new ATOM 0 HB3 PHE A 15 0.018 13.270 -4.788 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -1.871 13.771 -3.169 1.00 0.00 H new ATOM 0 HD2 PHE A 15 0.159 9.991 -3.171 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -2.737 13.297 -0.906 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -0.668 9.551 -0.886 1.00 0.00 H new ATOM 0 HZ PHE A 15 -2.116 11.205 0.245 1.00 0.00 H new ATOM 223 N GLU A 16 -2.404 14.052 -6.292 1.00 0.00 N ATOM 224 CA GLU A 16 -3.560 14.993 -6.207 1.00 0.00 C ATOM 225 C GLU A 16 -4.772 14.659 -7.132 1.00 0.00 C ATOM 226 O GLU A 16 -5.906 14.638 -6.643 1.00 0.00 O ATOM 227 CB GLU A 16 -3.093 16.466 -6.388 1.00 0.00 C ATOM 228 CG GLU A 16 -2.156 17.010 -5.283 1.00 0.00 C ATOM 229 CD GLU A 16 -1.723 18.458 -5.526 1.00 0.00 C ATOM 230 OE1 GLU A 16 -2.435 19.385 -5.081 1.00 0.00 O ATOM 231 OE2 GLU A 16 -0.668 18.675 -6.162 1.00 0.00 O ATOM 0 H GLU A 16 -1.548 14.487 -6.636 1.00 0.00 H new ATOM 0 HA GLU A 16 -3.952 14.858 -5.199 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.582 16.551 -7.347 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -3.975 17.105 -6.439 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -2.663 16.945 -4.320 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -1.271 16.377 -5.221 1.00 0.00 H new ATOM 238 N ALA A 17 -4.538 14.368 -8.430 1.00 0.00 N ATOM 239 CA ALA A 17 -5.595 13.865 -9.352 1.00 0.00 C ATOM 240 C ALA A 17 -6.197 12.466 -9.010 1.00 0.00 C ATOM 241 O ALA A 17 -7.413 12.296 -9.140 1.00 0.00 O ATOM 242 CB ALA A 17 -5.042 13.885 -10.791 1.00 0.00 C ATOM 0 H ALA A 17 -3.624 14.472 -8.870 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.441 14.542 -9.234 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.804 13.519 -11.479 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.768 14.905 -11.061 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.162 13.245 -10.851 1.00 0.00 H new ATOM 248 N PHE A 18 -5.377 11.487 -8.566 1.00 0.00 N ATOM 249 CA PHE A 18 -5.860 10.140 -8.139 1.00 0.00 C ATOM 250 C PHE A 18 -6.738 10.161 -6.851 1.00 0.00 C ATOM 251 O PHE A 18 -7.816 9.562 -6.852 1.00 0.00 O ATOM 252 CB PHE A 18 -4.633 9.189 -8.011 1.00 0.00 C ATOM 253 CG PHE A 18 -4.956 7.715 -7.698 1.00 0.00 C ATOM 254 CD1 PHE A 18 -5.047 7.286 -6.366 1.00 0.00 C ATOM 255 CD2 PHE A 18 -5.189 6.801 -8.729 1.00 0.00 C ATOM 256 CE1 PHE A 18 -5.385 5.969 -6.074 1.00 0.00 C ATOM 257 CE2 PHE A 18 -5.527 5.483 -8.433 1.00 0.00 C ATOM 258 CZ PHE A 18 -5.629 5.069 -7.107 1.00 0.00 C ATOM 0 H PHE A 18 -4.366 11.600 -8.491 1.00 0.00 H new ATOM 0 HA PHE A 18 -6.536 9.764 -8.907 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.069 9.228 -8.943 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -3.980 9.573 -7.227 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -4.854 7.982 -5.563 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.107 7.118 -9.758 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.458 5.645 -5.046 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -5.710 4.781 -9.233 1.00 0.00 H new ATOM 0 HZ PHE A 18 -5.898 4.048 -6.880 1.00 0.00 H new ATOM 268 N MET A 19 -6.257 10.807 -5.771 1.00 0.00 N ATOM 269 CA MET A 19 -6.934 10.825 -4.447 1.00 0.00 C ATOM 270 C MET A 19 -8.343 11.495 -4.423 1.00 0.00 C ATOM 271 O MET A 19 -9.258 10.921 -3.825 1.00 0.00 O ATOM 272 CB MET A 19 -5.983 11.396 -3.373 1.00 0.00 C ATOM 273 CG MET A 19 -4.788 10.489 -3.024 1.00 0.00 C ATOM 274 SD MET A 19 -5.319 8.812 -2.608 1.00 0.00 S ATOM 275 CE MET A 19 -3.726 8.019 -2.324 1.00 0.00 C ATOM 0 H MET A 19 -5.385 11.335 -5.786 1.00 0.00 H new ATOM 0 HA MET A 19 -7.156 9.785 -4.210 1.00 0.00 H new ATOM 0 HB2 MET A 19 -5.603 12.358 -3.718 1.00 0.00 H new ATOM 0 HB3 MET A 19 -6.555 11.586 -2.465 1.00 0.00 H new ATOM 0 HG2 MET A 19 -4.100 10.454 -3.868 1.00 0.00 H new ATOM 0 HG3 MET A 19 -4.240 10.916 -2.184 1.00 0.00 H new ATOM 0 HE1 MET A 19 -3.882 6.974 -2.057 1.00 0.00 H new ATOM 0 HE2 MET A 19 -3.125 8.075 -3.231 1.00 0.00 H new ATOM 0 HE3 MET A 19 -3.206 8.527 -1.512 1.00 0.00 H new ATOM 285 N LYS A 20 -8.540 12.644 -5.106 1.00 0.00 N ATOM 286 CA LYS A 20 -9.892 13.230 -5.351 1.00 0.00 C ATOM 287 C LYS A 20 -10.844 12.316 -6.192 1.00 0.00 C ATOM 288 O LYS A 20 -12.003 12.144 -5.803 1.00 0.00 O ATOM 289 CB LYS A 20 -9.723 14.651 -5.974 1.00 0.00 C ATOM 290 CG LYS A 20 -10.841 15.681 -5.685 1.00 0.00 C ATOM 291 CD LYS A 20 -12.130 15.533 -6.524 1.00 0.00 C ATOM 292 CE LYS A 20 -13.187 16.630 -6.289 1.00 0.00 C ATOM 293 NZ LYS A 20 -12.811 17.937 -6.862 1.00 0.00 N ATOM 0 H LYS A 20 -7.778 13.194 -5.503 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.397 13.312 -4.388 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.780 15.066 -5.620 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -9.636 14.539 -7.055 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -11.108 15.612 -4.630 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -10.438 16.681 -5.847 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -11.860 15.529 -7.580 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -12.579 14.564 -6.306 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.135 16.310 -6.723 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -13.349 16.744 -5.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -13.563 18.630 -6.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -11.922 18.262 -6.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -12.683 17.842 -7.890 1.00 0.00 H new ATOM 307 N ALA A 21 -10.356 11.717 -7.301 1.00 0.00 N ATOM 308 CA ALA A 21 -11.143 10.768 -8.135 1.00 0.00 C ATOM 309 C ALA A 21 -11.620 9.441 -7.462 1.00 0.00 C ATOM 310 O ALA A 21 -12.682 8.942 -7.847 1.00 0.00 O ATOM 311 CB ALA A 21 -10.326 10.471 -9.406 1.00 0.00 C ATOM 0 H ALA A 21 -9.409 11.874 -7.646 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.086 11.274 -8.342 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -10.878 9.776 -10.039 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.151 11.399 -9.951 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.370 10.028 -9.128 1.00 0.00 H new ATOM 317 N ILE A 22 -10.890 8.890 -6.466 1.00 0.00 N ATOM 318 CA ILE A 22 -11.377 7.748 -5.630 1.00 0.00 C ATOM 319 C ILE A 22 -12.430 8.203 -4.567 1.00 0.00 C ATOM 320 O ILE A 22 -13.530 7.643 -4.533 1.00 0.00 O ATOM 321 CB ILE A 22 -10.226 6.837 -5.062 1.00 0.00 C ATOM 322 CG1 ILE A 22 -9.209 7.533 -4.108 1.00 0.00 C ATOM 323 CG2 ILE A 22 -9.488 6.110 -6.215 1.00 0.00 C ATOM 324 CD1 ILE A 22 -8.297 6.597 -3.297 1.00 0.00 C ATOM 0 H ILE A 22 -9.956 9.213 -6.214 1.00 0.00 H new ATOM 0 HA ILE A 22 -11.914 7.082 -6.305 1.00 0.00 H new ATOM 0 HB ILE A 22 -10.740 6.117 -4.425 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.580 8.197 -4.701 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.765 8.160 -3.411 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -8.696 5.485 -5.803 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -10.194 5.486 -6.763 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -9.054 6.847 -6.891 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.632 7.191 -2.669 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -8.908 5.949 -2.668 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -7.704 5.987 -3.978 1.00 0.00 H new ATOM 336 N GLY A 23 -12.108 9.214 -3.736 1.00 0.00 N ATOM 337 CA GLY A 23 -13.065 9.825 -2.794 1.00 0.00 C ATOM 338 C GLY A 23 -12.375 10.374 -1.534 1.00 0.00 C ATOM 339 O GLY A 23 -12.614 9.845 -0.445 1.00 0.00 O ATOM 0 H GLY A 23 -11.177 9.629 -3.699 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -13.598 10.633 -3.295 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -13.809 9.083 -2.504 1.00 0.00 H new ATOM 343 N LEU A 24 -11.559 11.440 -1.674 1.00 0.00 N ATOM 344 CA LEU A 24 -10.920 12.126 -0.529 1.00 0.00 C ATOM 345 C LEU A 24 -11.151 13.674 -0.616 1.00 0.00 C ATOM 346 O LEU A 24 -11.042 14.234 -1.715 1.00 0.00 O ATOM 347 CB LEU A 24 -9.399 11.806 -0.468 1.00 0.00 C ATOM 348 CG LEU A 24 -9.011 10.477 0.239 1.00 0.00 C ATOM 349 CD1 LEU A 24 -7.554 10.089 -0.082 1.00 0.00 C ATOM 350 CD2 LEU A 24 -9.223 10.514 1.767 1.00 0.00 C ATOM 0 H LEU A 24 -11.325 11.848 -2.579 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.382 11.757 0.387 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.012 11.779 -1.487 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -8.895 12.627 0.043 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.686 9.718 -0.157 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -7.306 9.156 0.424 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.441 9.959 -1.158 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.884 10.877 0.261 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.933 9.556 2.198 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -8.612 11.306 2.200 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -10.274 10.706 1.984 1.00 0.00 H new ATOM 362 N PRO A 25 -11.401 14.410 0.511 1.00 0.00 N ATOM 363 CA PRO A 25 -11.473 15.897 0.517 1.00 0.00 C ATOM 364 C PRO A 25 -10.126 16.597 0.187 1.00 0.00 C ATOM 365 O PRO A 25 -9.055 16.079 0.513 1.00 0.00 O ATOM 366 CB PRO A 25 -11.922 16.211 1.962 1.00 0.00 C ATOM 367 CG PRO A 25 -11.512 15.009 2.808 1.00 0.00 C ATOM 368 CD PRO A 25 -11.570 13.819 1.854 1.00 0.00 C ATOM 0 HA PRO A 25 -12.145 16.268 -0.256 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.449 17.123 2.327 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -12.999 16.370 2.009 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.510 15.138 3.218 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -12.187 14.872 3.653 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -10.782 13.098 2.072 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -12.519 13.290 1.938 1.00 0.00 H new ATOM 376 N GLU A 26 -10.206 17.809 -0.392 1.00 0.00 N ATOM 377 CA GLU A 26 -9.023 18.690 -0.636 1.00 0.00 C ATOM 378 C GLU A 26 -8.066 18.931 0.584 1.00 0.00 C ATOM 379 O GLU A 26 -6.847 18.942 0.398 1.00 0.00 O ATOM 380 CB GLU A 26 -9.552 20.005 -1.275 1.00 0.00 C ATOM 381 CG GLU A 26 -8.473 20.926 -1.884 1.00 0.00 C ATOM 382 CD GLU A 26 -9.066 22.143 -2.600 1.00 0.00 C ATOM 383 OE1 GLU A 26 -9.384 22.039 -3.806 1.00 0.00 O ATOM 384 OE2 GLU A 26 -9.219 23.208 -1.960 1.00 0.00 O ATOM 0 H GLU A 26 -11.087 18.215 -0.708 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.353 18.164 -1.316 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.268 19.747 -2.055 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -10.097 20.565 -0.515 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -7.804 21.266 -1.094 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.869 20.354 -2.589 1.00 0.00 H new ATOM 391 N GLU A 27 -8.610 19.053 1.814 1.00 0.00 N ATOM 392 CA GLU A 27 -7.810 19.068 3.070 1.00 0.00 C ATOM 393 C GLU A 27 -7.021 17.749 3.359 1.00 0.00 C ATOM 394 O GLU A 27 -5.816 17.848 3.601 1.00 0.00 O ATOM 395 CB GLU A 27 -8.750 19.479 4.237 1.00 0.00 C ATOM 396 CG GLU A 27 -8.033 19.788 5.569 1.00 0.00 C ATOM 397 CD GLU A 27 -8.994 20.255 6.665 1.00 0.00 C ATOM 398 OE1 GLU A 27 -9.544 19.400 7.394 1.00 0.00 O ATOM 399 OE2 GLU A 27 -9.204 21.482 6.802 1.00 0.00 O ATOM 0 H GLU A 27 -9.614 19.144 1.970 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.014 19.803 2.955 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -9.318 20.358 3.934 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.469 18.677 4.405 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.507 18.896 5.909 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -7.279 20.557 5.401 1.00 0.00 H new ATOM 406 N LEU A 28 -7.648 16.547 3.326 1.00 0.00 N ATOM 407 CA LEU A 28 -6.905 15.254 3.486 1.00 0.00 C ATOM 408 C LEU A 28 -5.979 14.805 2.302 1.00 0.00 C ATOM 409 O LEU A 28 -5.128 13.937 2.517 1.00 0.00 O ATOM 410 CB LEU A 28 -7.859 14.096 3.896 1.00 0.00 C ATOM 411 CG LEU A 28 -8.616 14.228 5.252 1.00 0.00 C ATOM 412 CD1 LEU A 28 -9.593 13.051 5.442 1.00 0.00 C ATOM 413 CD2 LEU A 28 -7.681 14.325 6.476 1.00 0.00 C ATOM 0 H LEU A 28 -8.653 16.437 3.192 1.00 0.00 H new ATOM 0 HA LEU A 28 -6.207 15.481 4.291 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.602 13.978 3.107 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.276 13.175 3.925 1.00 0.00 H new ATOM 0 HG LEU A 28 -9.164 15.169 5.196 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -10.113 13.160 6.394 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -10.320 13.047 4.630 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -9.038 12.113 5.437 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.278 14.415 7.384 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.064 13.428 6.535 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -7.040 15.201 6.376 1.00 0.00 H new ATOM 425 N ILE A 29 -6.085 15.398 1.096 1.00 0.00 N ATOM 426 CA ILE A 29 -5.069 15.261 0.007 1.00 0.00 C ATOM 427 C ILE A 29 -3.770 16.055 0.374 1.00 0.00 C ATOM 428 O ILE A 29 -2.691 15.460 0.385 1.00 0.00 O ATOM 429 CB ILE A 29 -5.675 15.652 -1.390 1.00 0.00 C ATOM 430 CG1 ILE A 29 -6.936 14.817 -1.765 1.00 0.00 C ATOM 431 CG2 ILE A 29 -4.638 15.539 -2.539 1.00 0.00 C ATOM 432 CD1 ILE A 29 -7.760 15.343 -2.945 1.00 0.00 C ATOM 0 H ILE A 29 -6.876 15.989 0.839 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.778 14.214 -0.084 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.972 16.695 -1.278 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.619 13.799 -1.993 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.584 14.761 -0.890 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.107 15.820 -3.482 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -3.799 16.205 -2.339 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.278 14.512 -2.605 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.612 14.685 -3.116 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.117 16.348 -2.720 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.138 15.371 -3.839 1.00 0.00 H new ATOM 444 N GLN A 30 -3.871 17.364 0.684 1.00 0.00 N ATOM 445 CA GLN A 30 -2.718 18.181 1.162 1.00 0.00 C ATOM 446 C GLN A 30 -2.091 17.774 2.539 1.00 0.00 C ATOM 447 O GLN A 30 -0.900 18.024 2.742 1.00 0.00 O ATOM 448 CB GLN A 30 -3.102 19.691 1.170 1.00 0.00 C ATOM 449 CG GLN A 30 -3.045 20.439 -0.183 1.00 0.00 C ATOM 450 CD GLN A 30 -4.186 20.174 -1.179 1.00 0.00 C ATOM 451 OE1 GLN A 30 -5.226 20.827 -1.137 1.00 0.00 O ATOM 452 NE2 GLN A 30 -4.011 19.248 -2.110 1.00 0.00 N ATOM 0 H GLN A 30 -4.743 17.888 0.614 1.00 0.00 H new ATOM 0 HA GLN A 30 -1.927 17.974 0.442 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -4.114 19.781 1.564 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -2.441 20.204 1.869 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -3.018 21.509 0.023 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -2.104 20.184 -0.671 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -3.145 18.710 -2.138 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -4.743 19.073 -2.799 1.00 0.00 H new ATOM 461 N LYS A 31 -2.854 17.155 3.461 1.00 0.00 N ATOM 462 CA LYS A 31 -2.309 16.558 4.710 1.00 0.00 C ATOM 463 C LYS A 31 -1.669 15.154 4.474 1.00 0.00 C ATOM 464 O LYS A 31 -0.533 14.945 4.906 1.00 0.00 O ATOM 465 CB LYS A 31 -3.421 16.580 5.797 1.00 0.00 C ATOM 466 CG LYS A 31 -3.024 16.123 7.220 1.00 0.00 C ATOM 467 CD LYS A 31 -1.908 16.953 7.890 1.00 0.00 C ATOM 468 CE LYS A 31 -1.612 16.489 9.327 1.00 0.00 C ATOM 469 NZ LYS A 31 -0.505 17.253 9.928 1.00 0.00 N ATOM 0 H LYS A 31 -3.864 17.051 3.367 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.475 17.159 5.072 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.809 17.597 5.864 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -4.241 15.948 5.455 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.909 16.155 7.855 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -2.703 15.082 7.174 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -0.998 16.881 7.294 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -2.199 18.003 7.903 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -2.507 16.603 9.938 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -1.362 15.428 9.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -0.334 16.913 10.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 0.355 17.124 9.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -0.754 18.262 9.955 1.00 0.00 H new ATOM 483 N GLY A 32 -2.361 14.217 3.790 1.00 0.00 N ATOM 484 CA GLY A 32 -1.795 12.899 3.418 1.00 0.00 C ATOM 485 C GLY A 32 -0.585 12.848 2.449 1.00 0.00 C ATOM 486 O GLY A 32 0.168 11.873 2.526 1.00 0.00 O ATOM 0 H GLY A 32 -3.324 14.351 3.481 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -1.501 12.395 4.339 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.597 12.309 2.974 1.00 0.00 H new ATOM 490 N LYS A 33 -0.359 13.860 1.577 1.00 0.00 N ATOM 491 CA LYS A 33 0.914 13.993 0.814 1.00 0.00 C ATOM 492 C LYS A 33 2.171 14.268 1.706 1.00 0.00 C ATOM 493 O LYS A 33 3.203 13.620 1.515 1.00 0.00 O ATOM 494 CB LYS A 33 0.728 15.002 -0.357 1.00 0.00 C ATOM 495 CG LYS A 33 0.701 16.500 0.002 1.00 0.00 C ATOM 496 CD LYS A 33 0.378 17.401 -1.201 1.00 0.00 C ATOM 497 CE LYS A 33 0.576 18.903 -0.925 1.00 0.00 C ATOM 498 NZ LYS A 33 1.994 19.308 -0.879 1.00 0.00 N ATOM 0 H LYS A 33 -1.037 14.596 1.382 1.00 0.00 H new ATOM 0 HA LYS A 33 1.140 13.020 0.377 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.534 14.841 -1.073 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -0.205 14.760 -0.867 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.040 16.667 0.783 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.669 16.787 0.414 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.009 17.109 -2.041 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.655 17.230 -1.504 1.00 0.00 H new ATOM 0 HE2 LYS A 33 0.067 19.477 -1.699 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.102 19.156 0.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.058 20.329 -0.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 2.480 18.785 -0.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 2.445 19.096 -1.792 1.00 0.00 H new ATOM 512 N ASP A 34 2.056 15.187 2.692 1.00 0.00 N ATOM 513 CA ASP A 34 3.094 15.436 3.733 1.00 0.00 C ATOM 514 C ASP A 34 3.334 14.273 4.747 1.00 0.00 C ATOM 515 O ASP A 34 4.475 14.120 5.194 1.00 0.00 O ATOM 516 CB ASP A 34 2.760 16.743 4.506 1.00 0.00 C ATOM 517 CG ASP A 34 2.922 18.041 3.700 1.00 0.00 C ATOM 518 OD1 ASP A 34 4.042 18.598 3.673 1.00 0.00 O ATOM 519 OD2 ASP A 34 1.935 18.504 3.089 1.00 0.00 O ATOM 0 H ASP A 34 1.235 15.784 2.793 1.00 0.00 H new ATOM 0 HA ASP A 34 4.029 15.524 3.179 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.732 16.682 4.863 1.00 0.00 H new ATOM 0 HB3 ASP A 34 3.400 16.799 5.386 1.00 0.00 H new ATOM 524 N ILE A 35 2.313 13.452 5.098 1.00 0.00 N ATOM 525 CA ILE A 35 2.497 12.227 5.932 1.00 0.00 C ATOM 526 C ILE A 35 3.133 11.148 4.999 1.00 0.00 C ATOM 527 O ILE A 35 2.467 10.612 4.106 1.00 0.00 O ATOM 528 CB ILE A 35 1.162 11.737 6.604 1.00 0.00 C ATOM 529 CG1 ILE A 35 0.433 12.812 7.471 1.00 0.00 C ATOM 530 CG2 ILE A 35 1.410 10.474 7.474 1.00 0.00 C ATOM 531 CD1 ILE A 35 -1.056 12.525 7.729 1.00 0.00 C ATOM 0 H ILE A 35 1.346 13.614 4.817 1.00 0.00 H new ATOM 0 HA ILE A 35 3.152 12.438 6.777 1.00 0.00 H new ATOM 0 HB ILE A 35 0.503 11.509 5.766 1.00 0.00 H new ATOM 0 HG12 ILE A 35 0.945 12.895 8.430 1.00 0.00 H new ATOM 0 HG13 ILE A 35 0.523 13.780 6.977 1.00 0.00 H new ATOM 0 HG21 ILE A 35 0.472 10.155 7.928 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.802 9.672 6.848 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.131 10.708 8.257 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.480 13.323 8.339 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.587 12.474 6.778 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.158 11.575 8.253 1.00 0.00 H new ATOM 543 N LYS A 36 4.432 10.868 5.215 1.00 0.00 N ATOM 544 CA LYS A 36 5.225 9.990 4.319 1.00 0.00 C ATOM 545 C LYS A 36 5.078 8.516 4.789 1.00 0.00 C ATOM 546 O LYS A 36 5.608 8.129 5.837 1.00 0.00 O ATOM 547 CB LYS A 36 6.688 10.499 4.264 1.00 0.00 C ATOM 548 CG LYS A 36 7.405 10.204 2.930 1.00 0.00 C ATOM 549 CD LYS A 36 6.927 10.952 1.656 1.00 0.00 C ATOM 550 CE LYS A 36 7.181 12.472 1.586 1.00 0.00 C ATOM 551 NZ LYS A 36 6.215 13.268 2.362 1.00 0.00 N ATOM 0 H LYS A 36 4.961 11.237 6.005 1.00 0.00 H new ATOM 0 HA LYS A 36 4.854 10.024 3.294 1.00 0.00 H new ATOM 0 HB2 LYS A 36 6.694 11.575 4.438 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.252 10.041 5.077 1.00 0.00 H new ATOM 0 HG2 LYS A 36 8.464 10.423 3.066 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.323 9.134 2.738 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.409 10.490 0.794 1.00 0.00 H new ATOM 0 HD3 LYS A 36 5.855 10.785 1.550 1.00 0.00 H new ATOM 0 HE2 LYS A 36 8.187 12.681 1.950 1.00 0.00 H new ATOM 0 HE3 LYS A 36 7.147 12.790 0.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 6.054 14.179 1.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 5.316 12.750 2.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 6.592 13.438 3.316 1.00 0.00 H new ATOM 565 N GLY A 37 4.287 7.732 4.040 1.00 0.00 N ATOM 566 CA GLY A 37 3.717 6.469 4.555 1.00 0.00 C ATOM 567 C GLY A 37 4.628 5.236 4.410 1.00 0.00 C ATOM 568 O GLY A 37 5.075 4.914 3.305 1.00 0.00 O ATOM 0 H GLY A 37 4.026 7.946 3.078 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.475 6.601 5.610 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.780 6.272 4.035 1.00 0.00 H new ATOM 572 N VAL A 38 4.828 4.524 5.535 1.00 0.00 N ATOM 573 CA VAL A 38 5.535 3.212 5.561 1.00 0.00 C ATOM 574 C VAL A 38 4.506 2.119 5.130 1.00 0.00 C ATOM 575 O VAL A 38 3.502 1.879 5.812 1.00 0.00 O ATOM 576 CB VAL A 38 6.176 2.895 6.957 1.00 0.00 C ATOM 577 CG1 VAL A 38 6.963 1.560 6.966 1.00 0.00 C ATOM 578 CG2 VAL A 38 7.128 3.994 7.490 1.00 0.00 C ATOM 0 H VAL A 38 4.509 4.833 6.453 1.00 0.00 H new ATOM 0 HA VAL A 38 6.376 3.237 4.868 1.00 0.00 H new ATOM 0 HB VAL A 38 5.308 2.834 7.614 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.384 1.393 7.957 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.291 0.740 6.714 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.768 1.607 6.233 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.526 3.692 8.459 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.950 4.135 6.788 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.579 4.930 7.598 1.00 0.00 H new ATOM 588 N SER A 39 4.798 1.475 3.993 1.00 0.00 N ATOM 589 CA SER A 39 3.927 0.433 3.397 1.00 0.00 C ATOM 590 C SER A 39 4.592 -0.946 3.618 1.00 0.00 C ATOM 591 O SER A 39 5.567 -1.305 2.950 1.00 0.00 O ATOM 592 CB SER A 39 3.696 0.703 1.896 1.00 0.00 C ATOM 593 OG SER A 39 3.135 1.990 1.672 1.00 0.00 O ATOM 0 H SER A 39 5.644 1.656 3.453 1.00 0.00 H new ATOM 0 HA SER A 39 2.950 0.449 3.880 1.00 0.00 H new ATOM 0 HB2 SER A 39 4.643 0.621 1.362 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.032 -0.059 1.487 1.00 0.00 H new ATOM 0 HG SER A 39 3.842 2.667 1.715 1.00 0.00 H new ATOM 599 N GLU A 40 4.038 -1.719 4.562 1.00 0.00 N ATOM 600 CA GLU A 40 4.488 -3.104 4.843 1.00 0.00 C ATOM 601 C GLU A 40 3.904 -4.090 3.809 1.00 0.00 C ATOM 602 O GLU A 40 2.758 -3.972 3.373 1.00 0.00 O ATOM 603 CB GLU A 40 4.056 -3.524 6.273 1.00 0.00 C ATOM 604 CG GLU A 40 5.104 -3.182 7.343 1.00 0.00 C ATOM 605 CD GLU A 40 4.541 -3.224 8.764 1.00 0.00 C ATOM 606 OE1 GLU A 40 4.042 -2.183 9.246 1.00 0.00 O ATOM 607 OE2 GLU A 40 4.586 -4.299 9.401 1.00 0.00 O ATOM 0 H GLU A 40 3.267 -1.410 5.155 1.00 0.00 H new ATOM 0 HA GLU A 40 5.575 -3.132 4.773 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.117 -3.031 6.522 1.00 0.00 H new ATOM 0 HB3 GLU A 40 3.866 -4.597 6.288 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.936 -3.883 7.266 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.505 -2.188 7.146 1.00 0.00 H new ATOM 614 N ILE A 41 4.738 -5.073 3.459 1.00 0.00 N ATOM 615 CA ILE A 41 4.324 -6.249 2.643 1.00 0.00 C ATOM 616 C ILE A 41 5.114 -7.433 3.276 1.00 0.00 C ATOM 617 O ILE A 41 6.346 -7.387 3.356 1.00 0.00 O ATOM 618 CB ILE A 41 4.601 -6.112 1.098 1.00 0.00 C ATOM 619 CG1 ILE A 41 4.018 -4.818 0.447 1.00 0.00 C ATOM 620 CG2 ILE A 41 4.088 -7.360 0.326 1.00 0.00 C ATOM 621 CD1 ILE A 41 4.481 -4.517 -0.987 1.00 0.00 C ATOM 0 H ILE A 41 5.722 -5.089 3.727 1.00 0.00 H new ATOM 0 HA ILE A 41 3.242 -6.380 2.673 1.00 0.00 H new ATOM 0 HB ILE A 41 5.685 -6.037 1.015 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.931 -4.893 0.448 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.280 -3.968 1.078 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.292 -7.239 -0.738 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.598 -8.250 0.694 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.014 -7.467 0.480 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.012 -3.596 -1.335 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.565 -4.401 -1.003 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.195 -5.340 -1.642 1.00 0.00 H new ATOM 633 N VAL A 42 4.400 -8.489 3.703 1.00 0.00 N ATOM 634 CA VAL A 42 5.015 -9.691 4.338 1.00 0.00 C ATOM 635 C VAL A 42 4.583 -10.895 3.452 1.00 0.00 C ATOM 636 O VAL A 42 3.443 -11.361 3.545 1.00 0.00 O ATOM 637 CB VAL A 42 4.612 -9.850 5.849 1.00 0.00 C ATOM 638 CG1 VAL A 42 5.258 -11.092 6.509 1.00 0.00 C ATOM 639 CG2 VAL A 42 4.953 -8.617 6.722 1.00 0.00 C ATOM 0 H VAL A 42 3.385 -8.544 3.623 1.00 0.00 H new ATOM 0 HA VAL A 42 6.101 -9.611 4.377 1.00 0.00 H new ATOM 0 HB VAL A 42 3.529 -9.965 5.814 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.946 -11.154 7.552 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.940 -11.991 5.981 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.344 -11.007 6.459 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.645 -8.803 7.751 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.027 -8.436 6.692 1.00 0.00 H new ATOM 0 HG23 VAL A 42 4.427 -7.743 6.338 1.00 0.00 H new ATOM 649 N GLN A 43 5.510 -11.402 2.620 1.00 0.00 N ATOM 650 CA GLN A 43 5.265 -12.595 1.768 1.00 0.00 C ATOM 651 C GLN A 43 5.659 -13.890 2.530 1.00 0.00 C ATOM 652 O GLN A 43 6.792 -14.036 3.001 1.00 0.00 O ATOM 653 CB GLN A 43 6.054 -12.447 0.441 1.00 0.00 C ATOM 654 CG GLN A 43 5.787 -13.559 -0.603 1.00 0.00 C ATOM 655 CD GLN A 43 6.552 -13.403 -1.930 1.00 0.00 C ATOM 656 OE1 GLN A 43 7.707 -12.974 -1.978 1.00 0.00 O ATOM 657 NE2 GLN A 43 5.939 -13.790 -3.036 1.00 0.00 N ATOM 0 H GLN A 43 6.444 -11.006 2.514 1.00 0.00 H new ATOM 0 HA GLN A 43 4.204 -12.669 1.530 1.00 0.00 H new ATOM 0 HB2 GLN A 43 5.809 -11.483 -0.005 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.120 -12.431 0.669 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.048 -14.521 -0.162 1.00 0.00 H new ATOM 0 HG3 GLN A 43 4.719 -13.586 -0.818 1.00 0.00 H new ATOM 0 HE21 GLN A 43 4.984 -14.144 -2.992 1.00 0.00 H new ATOM 0 HE22 GLN A 43 6.422 -13.734 -3.933 1.00 0.00 H new ATOM 666 N ASN A 44 4.714 -14.843 2.572 1.00 0.00 N ATOM 667 CA ASN A 44 4.995 -16.249 2.971 1.00 0.00 C ATOM 668 C ASN A 44 4.452 -17.159 1.832 1.00 0.00 C ATOM 669 O ASN A 44 3.329 -17.670 1.902 1.00 0.00 O ATOM 670 CB ASN A 44 4.381 -16.574 4.365 1.00 0.00 C ATOM 671 CG ASN A 44 4.977 -15.794 5.556 1.00 0.00 C ATOM 672 OD1 ASN A 44 4.456 -14.756 5.962 1.00 0.00 O ATOM 673 ND2 ASN A 44 6.075 -16.264 6.130 1.00 0.00 N ATOM 0 H ASN A 44 3.737 -14.672 2.334 1.00 0.00 H new ATOM 0 HA ASN A 44 6.064 -16.422 3.092 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.310 -16.377 4.325 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.502 -17.640 4.555 1.00 0.00 H new ATOM 0 HD21 ASN A 44 6.494 -15.765 6.914 1.00 0.00 H new ATOM 0 HD22 ASN A 44 6.501 -17.125 5.788 1.00 0.00 H new ATOM 680 N GLY A 45 5.257 -17.322 0.758 1.00 0.00 N ATOM 681 CA GLY A 45 4.863 -18.094 -0.444 1.00 0.00 C ATOM 682 C GLY A 45 3.781 -17.403 -1.307 1.00 0.00 C ATOM 683 O GLY A 45 3.945 -16.252 -1.725 1.00 0.00 O ATOM 0 H GLY A 45 6.194 -16.924 0.699 1.00 0.00 H new ATOM 0 HA2 GLY A 45 5.747 -18.268 -1.058 1.00 0.00 H new ATOM 0 HA3 GLY A 45 4.495 -19.071 -0.131 1.00 0.00 H new ATOM 687 N LYS A 46 2.666 -18.118 -1.529 1.00 0.00 N ATOM 688 CA LYS A 46 1.434 -17.536 -2.139 1.00 0.00 C ATOM 689 C LYS A 46 0.618 -16.596 -1.194 1.00 0.00 C ATOM 690 O LYS A 46 0.044 -15.618 -1.681 1.00 0.00 O ATOM 691 CB LYS A 46 0.517 -18.666 -2.678 1.00 0.00 C ATOM 692 CG LYS A 46 1.039 -19.401 -3.935 1.00 0.00 C ATOM 693 CD LYS A 46 0.114 -20.521 -4.454 1.00 0.00 C ATOM 694 CE LYS A 46 -1.218 -20.028 -5.055 1.00 0.00 C ATOM 695 NZ LYS A 46 -2.044 -21.150 -5.532 1.00 0.00 N ATOM 0 H LYS A 46 2.581 -19.108 -1.297 1.00 0.00 H new ATOM 0 HA LYS A 46 1.786 -16.904 -2.954 1.00 0.00 H new ATOM 0 HB2 LYS A 46 0.368 -19.399 -1.885 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.460 -18.240 -2.906 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.187 -18.671 -4.731 1.00 0.00 H new ATOM 0 HG3 LYS A 46 2.016 -19.829 -3.710 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.649 -21.094 -5.211 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.104 -21.204 -3.633 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.770 -19.462 -4.304 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.015 -19.347 -5.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -2.932 -20.783 -5.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -1.527 -21.675 -6.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.258 -21.786 -4.737 1.00 0.00 H new ATOM 709 N HIS A 47 0.556 -16.876 0.127 1.00 0.00 N ATOM 710 CA HIS A 47 -0.131 -16.007 1.117 1.00 0.00 C ATOM 711 C HIS A 47 0.677 -14.710 1.403 1.00 0.00 C ATOM 712 O HIS A 47 1.911 -14.668 1.357 1.00 0.00 O ATOM 713 CB HIS A 47 -0.403 -16.798 2.433 1.00 0.00 C ATOM 714 CG HIS A 47 -1.651 -17.690 2.417 1.00 0.00 C ATOM 715 ND1 HIS A 47 -2.693 -17.599 3.324 1.00 0.00 N ATOM 716 CD2 HIS A 47 -1.929 -18.703 1.483 1.00 0.00 C ATOM 717 CE1 HIS A 47 -3.517 -18.579 2.839 1.00 0.00 C ATOM 718 NE2 HIS A 47 -3.152 -19.308 1.734 1.00 0.00 N ATOM 0 H HIS A 47 0.979 -17.708 0.539 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.086 -15.702 0.689 1.00 0.00 H new ATOM 0 HB2 HIS A 47 0.465 -17.420 2.649 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -0.496 -16.086 3.253 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -1.272 -18.976 0.671 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.459 -18.780 3.328 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -3.633 -20.064 1.246 1.00 0.00 H new ATOM 726 N PHE A 48 -0.090 -13.653 1.686 1.00 0.00 N ATOM 727 CA PHE A 48 0.434 -12.286 1.940 1.00 0.00 C ATOM 728 C PHE A 48 -0.327 -11.653 3.139 1.00 0.00 C ATOM 729 O PHE A 48 -1.524 -11.884 3.345 1.00 0.00 O ATOM 730 CB PHE A 48 0.262 -11.384 0.684 1.00 0.00 C ATOM 731 CG PHE A 48 1.299 -11.561 -0.439 1.00 0.00 C ATOM 732 CD1 PHE A 48 1.062 -12.450 -1.493 1.00 0.00 C ATOM 733 CD2 PHE A 48 2.443 -10.754 -0.468 1.00 0.00 C ATOM 734 CE1 PHE A 48 1.958 -12.534 -2.557 1.00 0.00 C ATOM 735 CE2 PHE A 48 3.325 -10.825 -1.543 1.00 0.00 C ATOM 736 CZ PHE A 48 3.082 -11.714 -2.586 1.00 0.00 C ATOM 0 H PHE A 48 -1.106 -13.712 1.749 1.00 0.00 H new ATOM 0 HA PHE A 48 1.497 -12.361 2.171 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.728 -11.568 0.266 1.00 0.00 H new ATOM 0 HB3 PHE A 48 0.284 -10.343 1.007 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.181 -13.074 -1.482 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.642 -10.074 0.347 1.00 0.00 H new ATOM 0 HE1 PHE A 48 1.780 -13.235 -3.359 1.00 0.00 H new ATOM 0 HE2 PHE A 48 4.198 -10.190 -1.568 1.00 0.00 H new ATOM 0 HZ PHE A 48 3.767 -11.768 -3.419 1.00 0.00 H new ATOM 746 N LYS A 49 0.386 -10.791 3.882 1.00 0.00 N ATOM 747 CA LYS A 49 -0.226 -9.840 4.844 1.00 0.00 C ATOM 748 C LYS A 49 0.501 -8.491 4.623 1.00 0.00 C ATOM 749 O LYS A 49 1.675 -8.334 4.974 1.00 0.00 O ATOM 750 CB LYS A 49 -0.090 -10.353 6.299 1.00 0.00 C ATOM 751 CG LYS A 49 -0.840 -9.563 7.406 1.00 0.00 C ATOM 752 CD LYS A 49 -0.215 -8.242 7.913 1.00 0.00 C ATOM 753 CE LYS A 49 1.178 -8.392 8.559 1.00 0.00 C ATOM 754 NZ LYS A 49 1.677 -7.112 9.090 1.00 0.00 N ATOM 0 H LYS A 49 1.403 -10.728 3.838 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.298 -9.729 4.680 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.438 -11.385 6.327 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.970 -10.367 6.554 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.840 -9.337 7.035 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.961 -10.225 8.264 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.139 -7.548 7.076 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.891 -7.792 8.640 1.00 0.00 H new ATOM 0 HE2 LYS A 49 1.128 -9.125 9.365 1.00 0.00 H new ATOM 0 HE3 LYS A 49 1.881 -8.778 7.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 2.703 -7.049 8.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.204 -6.325 8.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 1.476 -7.057 10.109 1.00 0.00 H new ATOM 768 N PHE A 50 -0.239 -7.522 4.077 1.00 0.00 N ATOM 769 CA PHE A 50 0.238 -6.116 3.939 1.00 0.00 C ATOM 770 C PHE A 50 -0.422 -5.196 5.001 1.00 0.00 C ATOM 771 O PHE A 50 -1.583 -5.394 5.374 1.00 0.00 O ATOM 772 CB PHE A 50 0.088 -5.595 2.481 1.00 0.00 C ATOM 773 CG PHE A 50 -1.311 -5.248 1.949 1.00 0.00 C ATOM 774 CD1 PHE A 50 -1.831 -3.953 2.075 1.00 0.00 C ATOM 775 CD2 PHE A 50 -2.033 -6.210 1.246 1.00 0.00 C ATOM 776 CE1 PHE A 50 -3.050 -3.626 1.486 1.00 0.00 C ATOM 777 CE2 PHE A 50 -3.235 -5.876 0.636 1.00 0.00 C ATOM 778 CZ PHE A 50 -3.745 -4.586 0.755 1.00 0.00 C ATOM 0 H PHE A 50 -1.181 -7.674 3.716 1.00 0.00 H new ATOM 0 HA PHE A 50 1.308 -6.096 4.143 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.706 -4.702 2.387 1.00 0.00 H new ATOM 0 HB3 PHE A 50 0.514 -6.348 1.818 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -1.284 -3.206 2.631 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.656 -7.220 1.175 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -3.455 -2.631 1.596 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -3.775 -6.619 0.068 1.00 0.00 H new ATOM 0 HZ PHE A 50 -4.680 -4.330 0.280 1.00 0.00 H new ATOM 788 N THR A 51 0.327 -4.174 5.451 1.00 0.00 N ATOM 789 CA THR A 51 -0.191 -3.155 6.409 1.00 0.00 C ATOM 790 C THR A 51 0.266 -1.758 5.896 1.00 0.00 C ATOM 791 O THR A 51 1.359 -1.288 6.223 1.00 0.00 O ATOM 792 CB THR A 51 0.244 -3.515 7.865 1.00 0.00 C ATOM 793 OG1 THR A 51 -0.289 -4.784 8.231 1.00 0.00 O ATOM 794 CG2 THR A 51 -0.228 -2.519 8.933 1.00 0.00 C ATOM 0 H THR A 51 1.296 -4.023 5.172 1.00 0.00 H new ATOM 0 HA THR A 51 -1.280 -3.136 6.456 1.00 0.00 H new ATOM 0 HB THR A 51 1.334 -3.502 7.842 1.00 0.00 H new ATOM 0 HG1 THR A 51 -0.051 -4.983 9.161 1.00 0.00 H new ATOM 0 HG21 THR A 51 0.118 -2.846 9.914 1.00 0.00 H new ATOM 0 HG22 THR A 51 0.179 -1.532 8.715 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.317 -2.471 8.930 1.00 0.00 H new ATOM 802 N ILE A 52 -0.596 -1.101 5.091 1.00 0.00 N ATOM 803 CA ILE A 52 -0.291 0.215 4.461 1.00 0.00 C ATOM 804 C ILE A 52 -0.883 1.363 5.326 1.00 0.00 C ATOM 805 O ILE A 52 -2.083 1.383 5.617 1.00 0.00 O ATOM 806 CB ILE A 52 -0.708 0.253 2.947 1.00 0.00 C ATOM 807 CG1 ILE A 52 -0.219 1.548 2.230 1.00 0.00 C ATOM 808 CG2 ILE A 52 -2.216 0.013 2.668 1.00 0.00 C ATOM 809 CD1 ILE A 52 -0.082 1.442 0.703 1.00 0.00 C ATOM 0 H ILE A 52 -1.521 -1.461 4.856 1.00 0.00 H new ATOM 0 HA ILE A 52 0.788 0.367 4.442 1.00 0.00 H new ATOM 0 HB ILE A 52 -0.191 -0.606 2.520 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -0.914 2.356 2.461 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.748 1.831 2.646 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -2.399 0.059 1.595 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -2.504 -0.969 3.043 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.806 0.780 3.170 1.00 0.00 H new ATOM 0 HD11 ILE A 52 0.264 2.395 0.302 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.638 0.662 0.456 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.050 1.194 0.267 1.00 0.00 H new ATOM 821 N THR A 53 -0.024 2.334 5.683 1.00 0.00 N ATOM 822 CA THR A 53 -0.443 3.561 6.418 1.00 0.00 C ATOM 823 C THR A 53 -0.963 4.608 5.392 1.00 0.00 C ATOM 824 O THR A 53 -0.174 5.293 4.730 1.00 0.00 O ATOM 825 CB THR A 53 0.691 4.127 7.325 1.00 0.00 C ATOM 826 OG1 THR A 53 1.870 4.398 6.574 1.00 0.00 O ATOM 827 CG2 THR A 53 1.071 3.228 8.514 1.00 0.00 C ATOM 0 H THR A 53 0.974 2.300 5.477 1.00 0.00 H new ATOM 0 HA THR A 53 -1.252 3.306 7.103 1.00 0.00 H new ATOM 0 HB THR A 53 0.270 5.046 7.733 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.624 4.784 5.707 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.867 3.702 9.089 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.200 3.082 9.153 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.416 2.262 8.144 1.00 0.00 H new ATOM 835 N ALA A 54 -2.301 4.700 5.260 1.00 0.00 N ATOM 836 CA ALA A 54 -2.960 5.633 4.310 1.00 0.00 C ATOM 837 C ALA A 54 -3.282 6.972 5.024 1.00 0.00 C ATOM 838 O ALA A 54 -4.368 7.159 5.586 1.00 0.00 O ATOM 839 CB ALA A 54 -4.209 4.935 3.739 1.00 0.00 C ATOM 0 H ALA A 54 -2.956 4.136 5.802 1.00 0.00 H new ATOM 0 HA ALA A 54 -2.303 5.882 3.477 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -4.710 5.602 3.038 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -3.912 4.022 3.222 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -4.890 4.686 4.552 1.00 0.00 H new ATOM 845 N GLY A 55 -2.283 7.877 5.043 1.00 0.00 N ATOM 846 CA GLY A 55 -2.323 9.101 5.871 1.00 0.00 C ATOM 847 C GLY A 55 -2.206 8.791 7.380 1.00 0.00 C ATOM 848 O GLY A 55 -1.197 8.237 7.830 1.00 0.00 O ATOM 0 H GLY A 55 -1.431 7.782 4.490 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.511 9.765 5.574 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.255 9.634 5.683 1.00 0.00 H new ATOM 852 N SER A 56 -3.272 9.110 8.129 1.00 0.00 N ATOM 853 CA SER A 56 -3.387 8.751 9.569 1.00 0.00 C ATOM 854 C SER A 56 -3.879 7.288 9.803 1.00 0.00 C ATOM 855 O SER A 56 -3.204 6.543 10.518 1.00 0.00 O ATOM 856 CB SER A 56 -4.272 9.785 10.306 1.00 0.00 C ATOM 857 OG SER A 56 -3.695 11.086 10.260 1.00 0.00 O ATOM 0 H SER A 56 -4.078 9.620 7.767 1.00 0.00 H new ATOM 0 HA SER A 56 -2.383 8.786 9.992 1.00 0.00 H new ATOM 0 HB2 SER A 56 -5.263 9.808 9.852 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.404 9.480 11.344 1.00 0.00 H new ATOM 0 HG SER A 56 -4.276 11.718 10.732 1.00 0.00 H new ATOM 863 N LYS A 57 -5.033 6.881 9.225 1.00 0.00 N ATOM 864 CA LYS A 57 -5.663 5.561 9.501 1.00 0.00 C ATOM 865 C LYS A 57 -4.983 4.428 8.679 1.00 0.00 C ATOM 866 O LYS A 57 -4.898 4.493 7.447 1.00 0.00 O ATOM 867 CB LYS A 57 -7.192 5.685 9.235 1.00 0.00 C ATOM 868 CG LYS A 57 -8.084 4.541 9.776 1.00 0.00 C ATOM 869 CD LYS A 57 -8.298 3.354 8.815 1.00 0.00 C ATOM 870 CE LYS A 57 -9.133 2.229 9.453 1.00 0.00 C ATOM 871 NZ LYS A 57 -9.370 1.120 8.512 1.00 0.00 N ATOM 0 H LYS A 57 -5.553 7.451 8.558 1.00 0.00 H new ATOM 0 HA LYS A 57 -5.519 5.280 10.544 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -7.539 6.622 9.670 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -7.346 5.757 8.158 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -7.642 4.164 10.698 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -9.058 4.955 10.036 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.797 3.706 7.912 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -7.330 2.957 8.510 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -8.619 1.852 10.337 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -10.089 2.632 9.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -9.936 0.383 8.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -9.883 1.475 7.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -8.459 0.719 8.212 1.00 0.00 H new ATOM 885 N VAL A 58 -4.521 3.387 9.395 1.00 0.00 N ATOM 886 CA VAL A 58 -3.831 2.209 8.799 1.00 0.00 C ATOM 887 C VAL A 58 -4.863 1.146 8.301 1.00 0.00 C ATOM 888 O VAL A 58 -5.814 0.801 9.010 1.00 0.00 O ATOM 889 CB VAL A 58 -2.753 1.666 9.800 1.00 0.00 C ATOM 890 CG1 VAL A 58 -3.297 1.042 11.107 1.00 0.00 C ATOM 891 CG2 VAL A 58 -1.777 0.678 9.129 1.00 0.00 C ATOM 0 H VAL A 58 -4.612 3.331 10.409 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.287 2.503 7.901 1.00 0.00 H new ATOM 0 HB VAL A 58 -2.225 2.572 10.097 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -2.464 0.701 11.722 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.871 1.789 11.656 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -3.940 0.196 10.866 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.050 0.330 9.863 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -2.333 -0.174 8.737 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -1.257 1.178 8.312 1.00 0.00 H new ATOM 901 N ILE A 59 -4.649 0.645 7.071 1.00 0.00 N ATOM 902 CA ILE A 59 -5.575 -0.303 6.389 1.00 0.00 C ATOM 903 C ILE A 59 -4.716 -1.568 6.094 1.00 0.00 C ATOM 904 O ILE A 59 -3.781 -1.515 5.287 1.00 0.00 O ATOM 905 CB ILE A 59 -6.222 0.342 5.106 1.00 0.00 C ATOM 906 CG1 ILE A 59 -7.093 1.595 5.436 1.00 0.00 C ATOM 907 CG2 ILE A 59 -7.072 -0.682 4.307 1.00 0.00 C ATOM 908 CD1 ILE A 59 -7.443 2.496 4.244 1.00 0.00 C ATOM 0 H ILE A 59 -3.829 0.882 6.513 1.00 0.00 H new ATOM 0 HA ILE A 59 -6.435 -0.566 7.005 1.00 0.00 H new ATOM 0 HB ILE A 59 -5.383 0.664 4.489 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -8.021 1.258 5.898 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -6.567 2.195 6.179 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.499 -0.195 3.431 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.439 -1.511 3.989 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.875 -1.060 4.939 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -8.049 3.334 4.587 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.526 2.873 3.791 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -8.003 1.922 3.506 1.00 0.00 H new ATOM 920 N GLN A 60 -5.066 -2.697 6.738 1.00 0.00 N ATOM 921 CA GLN A 60 -4.368 -3.995 6.547 1.00 0.00 C ATOM 922 C GLN A 60 -5.331 -5.073 5.979 1.00 0.00 C ATOM 923 O GLN A 60 -6.478 -5.206 6.419 1.00 0.00 O ATOM 924 CB GLN A 60 -3.642 -4.441 7.842 1.00 0.00 C ATOM 925 CG GLN A 60 -4.469 -4.704 9.121 1.00 0.00 C ATOM 926 CD GLN A 60 -3.568 -5.054 10.317 1.00 0.00 C ATOM 927 OE1 GLN A 60 -3.127 -4.177 11.061 1.00 0.00 O ATOM 928 NE2 GLN A 60 -3.261 -6.329 10.518 1.00 0.00 N ATOM 0 H GLN A 60 -5.837 -2.742 7.404 1.00 0.00 H new ATOM 0 HA GLN A 60 -3.589 -3.859 5.797 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -3.095 -5.355 7.612 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -2.902 -3.678 8.082 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -5.063 -3.821 9.358 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -5.169 -5.520 8.941 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -3.632 -7.047 9.896 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -2.654 -6.591 11.295 1.00 0.00 H new ATOM 937 N ASN A 61 -4.822 -5.843 5.001 1.00 0.00 N ATOM 938 CA ASN A 61 -5.577 -6.960 4.364 1.00 0.00 C ATOM 939 C ASN A 61 -4.643 -8.184 4.174 1.00 0.00 C ATOM 940 O ASN A 61 -3.454 -8.057 3.857 1.00 0.00 O ATOM 941 CB ASN A 61 -6.186 -6.582 2.985 1.00 0.00 C ATOM 942 CG ASN A 61 -7.275 -5.501 3.004 1.00 0.00 C ATOM 943 OD1 ASN A 61 -8.401 -5.737 3.439 1.00 0.00 O ATOM 944 ND2 ASN A 61 -6.960 -4.307 2.524 1.00 0.00 N ATOM 0 H ASN A 61 -3.882 -5.718 4.625 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.403 -7.194 5.036 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -5.379 -6.246 2.334 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.604 -7.483 2.535 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -7.657 -3.563 2.510 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -6.020 -4.132 2.168 1.00 0.00 H new ATOM 951 N GLU A 62 -5.248 -9.378 4.308 1.00 0.00 N ATOM 952 CA GLU A 62 -4.597 -10.664 3.955 1.00 0.00 C ATOM 953 C GLU A 62 -5.228 -11.182 2.635 1.00 0.00 C ATOM 954 O GLU A 62 -6.455 -11.293 2.515 1.00 0.00 O ATOM 955 CB GLU A 62 -4.762 -11.718 5.083 1.00 0.00 C ATOM 956 CG GLU A 62 -3.897 -11.450 6.330 1.00 0.00 C ATOM 957 CD GLU A 62 -4.000 -12.548 7.389 1.00 0.00 C ATOM 958 OE1 GLU A 62 -3.213 -13.520 7.331 1.00 0.00 O ATOM 959 OE2 GLU A 62 -4.865 -12.445 8.287 1.00 0.00 O ATOM 0 H GLU A 62 -6.199 -9.484 4.662 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.527 -10.500 3.827 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.810 -11.753 5.382 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.511 -12.701 4.685 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.856 -11.346 6.025 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.196 -10.500 6.773 1.00 0.00 H new ATOM 966 N PHE A 63 -4.364 -11.508 1.658 1.00 0.00 N ATOM 967 CA PHE A 63 -4.789 -12.027 0.331 1.00 0.00 C ATOM 968 C PHE A 63 -3.929 -13.251 -0.105 1.00 0.00 C ATOM 969 O PHE A 63 -2.795 -13.441 0.345 1.00 0.00 O ATOM 970 CB PHE A 63 -4.821 -10.874 -0.718 1.00 0.00 C ATOM 971 CG PHE A 63 -3.483 -10.383 -1.308 1.00 0.00 C ATOM 972 CD1 PHE A 63 -2.712 -9.417 -0.656 1.00 0.00 C ATOM 973 CD2 PHE A 63 -3.020 -10.937 -2.506 1.00 0.00 C ATOM 974 CE1 PHE A 63 -1.487 -9.018 -1.193 1.00 0.00 C ATOM 975 CE2 PHE A 63 -1.797 -10.539 -3.032 1.00 0.00 C ATOM 976 CZ PHE A 63 -1.028 -9.590 -2.376 1.00 0.00 C ATOM 0 H PHE A 63 -3.353 -11.422 1.758 1.00 0.00 H new ATOM 0 HA PHE A 63 -5.809 -12.405 0.406 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -5.451 -11.196 -1.547 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.314 -10.019 -0.256 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -3.065 -8.978 0.266 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.614 -11.676 -3.023 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.896 -8.266 -0.691 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.444 -10.971 -3.957 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.072 -9.294 -2.783 1.00 0.00 H new ATOM 986 N THR A 64 -4.479 -14.044 -1.041 1.00 0.00 N ATOM 987 CA THR A 64 -3.751 -15.171 -1.689 1.00 0.00 C ATOM 988 C THR A 64 -3.802 -14.938 -3.228 1.00 0.00 C ATOM 989 O THR A 64 -4.866 -14.685 -3.808 1.00 0.00 O ATOM 990 CB THR A 64 -4.351 -16.536 -1.236 1.00 0.00 C ATOM 991 OG1 THR A 64 -4.269 -16.645 0.181 1.00 0.00 O ATOM 992 CG2 THR A 64 -3.646 -17.773 -1.822 1.00 0.00 C ATOM 0 H THR A 64 -5.436 -13.930 -1.375 1.00 0.00 H new ATOM 0 HA THR A 64 -2.705 -15.206 -1.386 1.00 0.00 H new ATOM 0 HB THR A 64 -5.377 -16.531 -1.605 1.00 0.00 H new ATOM 0 HG1 THR A 64 -4.648 -17.503 0.466 1.00 0.00 H new ATOM 0 HG21 THR A 64 -4.130 -18.677 -1.453 1.00 0.00 H new ATOM 0 HG22 THR A 64 -3.709 -17.746 -2.910 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.599 -17.773 -1.519 1.00 0.00 H new ATOM 1000 N VAL A 65 -2.630 -15.058 -3.883 1.00 0.00 N ATOM 1001 CA VAL A 65 -2.481 -14.850 -5.353 1.00 0.00 C ATOM 1002 C VAL A 65 -3.072 -16.044 -6.168 1.00 0.00 C ATOM 1003 O VAL A 65 -2.797 -17.210 -5.864 1.00 0.00 O ATOM 1004 CB VAL A 65 -1.000 -14.525 -5.761 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -0.570 -13.122 -5.296 1.00 0.00 C ATOM 1006 CG2 VAL A 65 0.071 -15.548 -5.324 1.00 0.00 C ATOM 0 H VAL A 65 -1.756 -15.301 -3.416 1.00 0.00 H new ATOM 0 HA VAL A 65 -3.069 -13.969 -5.610 1.00 0.00 H new ATOM 0 HB VAL A 65 -1.038 -14.579 -6.849 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.461 -12.938 -5.599 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.220 -12.373 -5.749 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.646 -13.059 -4.210 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.052 -15.215 -5.663 1.00 0.00 H new ATOM 0 HG22 VAL A 65 0.072 -15.632 -4.237 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.154 -16.520 -5.763 1.00 0.00 H new ATOM 1016 N GLY A 66 -3.914 -15.732 -7.172 1.00 0.00 N ATOM 1017 CA GLY A 66 -4.743 -16.753 -7.870 1.00 0.00 C ATOM 1018 C GLY A 66 -6.194 -16.888 -7.344 1.00 0.00 C ATOM 1019 O GLY A 66 -7.139 -16.896 -8.137 1.00 0.00 O ATOM 0 H GLY A 66 -4.043 -14.783 -7.523 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.779 -16.507 -8.931 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.249 -17.721 -7.784 1.00 0.00 H new ATOM 1023 N GLU A 67 -6.360 -16.989 -6.012 1.00 0.00 N ATOM 1024 CA GLU A 67 -7.678 -16.965 -5.322 1.00 0.00 C ATOM 1025 C GLU A 67 -8.371 -15.566 -5.422 1.00 0.00 C ATOM 1026 O GLU A 67 -7.706 -14.524 -5.430 1.00 0.00 O ATOM 1027 CB GLU A 67 -7.366 -17.411 -3.861 1.00 0.00 C ATOM 1028 CG GLU A 67 -8.547 -17.651 -2.892 1.00 0.00 C ATOM 1029 CD GLU A 67 -9.062 -16.410 -2.151 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -8.250 -15.672 -1.548 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -10.290 -16.180 -2.150 1.00 0.00 O ATOM 0 H GLU A 67 -5.575 -17.091 -5.369 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.404 -17.634 -5.784 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.788 -18.334 -3.913 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -6.720 -16.655 -3.415 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.373 -18.084 -3.456 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -8.242 -18.392 -2.153 1.00 0.00 H new ATOM 1038 N GLU A 68 -9.717 -15.570 -5.496 1.00 0.00 N ATOM 1039 CA GLU A 68 -10.546 -14.337 -5.654 1.00 0.00 C ATOM 1040 C GLU A 68 -10.680 -13.616 -4.277 1.00 0.00 C ATOM 1041 O GLU A 68 -11.544 -13.956 -3.461 1.00 0.00 O ATOM 1042 CB GLU A 68 -11.942 -14.712 -6.245 1.00 0.00 C ATOM 1043 CG GLU A 68 -12.039 -15.098 -7.741 1.00 0.00 C ATOM 1044 CD GLU A 68 -11.318 -16.386 -8.160 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -11.862 -17.488 -7.929 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -10.201 -16.300 -8.717 1.00 0.00 O ATOM 0 H GLU A 68 -10.270 -16.426 -5.449 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.062 -13.650 -6.348 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.334 -15.546 -5.663 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -12.609 -13.866 -6.078 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.093 -15.196 -8.001 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -11.640 -14.275 -8.333 1.00 0.00 H new ATOM 1053 N CYS A 69 -9.763 -12.668 -4.005 1.00 0.00 N ATOM 1054 CA CYS A 69 -9.402 -12.287 -2.616 1.00 0.00 C ATOM 1055 C CYS A 69 -9.946 -10.907 -2.182 1.00 0.00 C ATOM 1056 O CYS A 69 -9.896 -9.923 -2.929 1.00 0.00 O ATOM 1057 CB CYS A 69 -7.871 -12.317 -2.462 1.00 0.00 C ATOM 1058 SG CYS A 69 -7.034 -11.208 -3.652 1.00 0.00 S ATOM 0 H CYS A 69 -9.257 -12.150 -4.723 1.00 0.00 H new ATOM 0 HA CYS A 69 -9.875 -13.017 -1.959 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -7.604 -12.025 -1.446 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -7.513 -13.337 -2.605 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.905 -10.743 -4.498 1.00 0.00 H new ATOM 1064 N GLU A 70 -10.401 -10.861 -0.918 1.00 0.00 N ATOM 1065 CA GLU A 70 -10.967 -9.639 -0.283 1.00 0.00 C ATOM 1066 C GLU A 70 -9.904 -8.526 -0.076 1.00 0.00 C ATOM 1067 O GLU A 70 -8.837 -8.781 0.491 1.00 0.00 O ATOM 1068 CB GLU A 70 -11.734 -9.986 1.025 1.00 0.00 C ATOM 1069 CG GLU A 70 -10.929 -10.496 2.237 1.00 0.00 C ATOM 1070 CD GLU A 70 -10.320 -9.424 3.159 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -11.059 -8.539 3.643 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -9.093 -9.469 3.409 1.00 0.00 O ATOM 0 H GLU A 70 -10.390 -11.670 -0.298 1.00 0.00 H new ATOM 0 HA GLU A 70 -11.694 -9.223 -0.980 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.275 -9.093 1.339 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -12.480 -10.742 0.781 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -11.581 -11.131 2.837 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -10.121 -11.128 1.868 1.00 0.00 H new ATOM 1079 N LEU A 71 -10.207 -7.310 -0.561 1.00 0.00 N ATOM 1080 CA LEU A 71 -9.280 -6.152 -0.476 1.00 0.00 C ATOM 1081 C LEU A 71 -10.153 -4.893 -0.233 1.00 0.00 C ATOM 1082 O LEU A 71 -10.891 -4.453 -1.121 1.00 0.00 O ATOM 1083 CB LEU A 71 -8.401 -6.027 -1.758 1.00 0.00 C ATOM 1084 CG LEU A 71 -7.326 -7.131 -1.991 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -6.623 -6.948 -3.349 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -6.273 -7.183 -0.868 1.00 0.00 C ATOM 0 H LEU A 71 -11.092 -7.096 -1.021 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.573 -6.280 0.344 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.064 -6.012 -2.623 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.895 -5.062 -1.728 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.864 -8.079 -1.987 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.879 -7.733 -3.482 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.359 -7.006 -4.151 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.133 -5.975 -3.377 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.550 -7.970 -1.083 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -5.758 -6.224 -0.807 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -6.764 -7.392 0.082 1.00 0.00 H new ATOM 1098 N GLU A 72 -10.067 -4.328 0.988 1.00 0.00 N ATOM 1099 CA GLU A 72 -10.924 -3.191 1.415 1.00 0.00 C ATOM 1100 C GLU A 72 -10.369 -1.813 0.948 1.00 0.00 C ATOM 1101 O GLU A 72 -9.155 -1.579 0.940 1.00 0.00 O ATOM 1102 CB GLU A 72 -11.208 -3.263 2.945 1.00 0.00 C ATOM 1103 CG GLU A 72 -10.112 -2.751 3.906 1.00 0.00 C ATOM 1104 CD GLU A 72 -10.375 -3.085 5.375 1.00 0.00 C ATOM 1105 OE1 GLU A 72 -11.137 -2.346 6.037 1.00 0.00 O ATOM 1106 OE2 GLU A 72 -9.814 -4.084 5.878 1.00 0.00 O ATOM 0 H GLU A 72 -9.410 -4.639 1.704 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.885 -3.285 0.909 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -12.118 -2.697 3.144 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -11.417 -4.302 3.198 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -9.154 -3.180 3.611 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -10.024 -1.670 3.799 1.00 0.00 H new ATOM 1113 N THR A 73 -11.296 -0.898 0.624 1.00 0.00 N ATOM 1114 CA THR A 73 -10.976 0.534 0.360 1.00 0.00 C ATOM 1115 C THR A 73 -10.955 1.372 1.685 1.00 0.00 C ATOM 1116 O THR A 73 -11.100 0.848 2.798 1.00 0.00 O ATOM 1117 CB THR A 73 -11.923 1.051 -0.776 1.00 0.00 C ATOM 1118 OG1 THR A 73 -11.491 2.322 -1.253 1.00 0.00 O ATOM 1119 CG2 THR A 73 -13.421 1.154 -0.426 1.00 0.00 C ATOM 0 H THR A 73 -12.288 -1.118 0.535 1.00 0.00 H new ATOM 0 HA THR A 73 -9.960 0.655 -0.015 1.00 0.00 H new ATOM 0 HB THR A 73 -11.844 0.275 -1.537 1.00 0.00 H new ATOM 0 HG1 THR A 73 -12.094 2.627 -1.963 1.00 0.00 H new ATOM 0 HG21 THR A 73 -13.972 1.523 -1.291 1.00 0.00 H new ATOM 0 HG22 THR A 73 -13.798 0.170 -0.148 1.00 0.00 H new ATOM 0 HG23 THR A 73 -13.553 1.842 0.409 1.00 0.00 H new ATOM 1127 N MET A 74 -10.763 2.693 1.535 1.00 0.00 N ATOM 1128 CA MET A 74 -10.802 3.670 2.668 1.00 0.00 C ATOM 1129 C MET A 74 -12.230 4.204 3.035 1.00 0.00 C ATOM 1130 O MET A 74 -12.451 5.411 3.173 1.00 0.00 O ATOM 1131 CB MET A 74 -9.720 4.763 2.452 1.00 0.00 C ATOM 1132 CG MET A 74 -9.862 5.647 1.203 1.00 0.00 C ATOM 1133 SD MET A 74 -8.526 6.862 1.144 1.00 0.00 S ATOM 1134 CE MET A 74 -7.122 5.875 0.575 1.00 0.00 C ATOM 0 H MET A 74 -10.576 3.127 0.631 1.00 0.00 H new ATOM 0 HA MET A 74 -10.543 3.131 3.579 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.714 5.412 3.328 1.00 0.00 H new ATOM 0 HB3 MET A 74 -8.747 4.273 2.412 1.00 0.00 H new ATOM 0 HG2 MET A 74 -9.840 5.028 0.306 1.00 0.00 H new ATOM 0 HG3 MET A 74 -10.826 6.156 1.216 1.00 0.00 H new ATOM 0 HE1 MET A 74 -6.267 6.527 0.396 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.863 5.138 1.335 1.00 0.00 H new ATOM 0 HE3 MET A 74 -7.388 5.364 -0.350 1.00 0.00 H new ATOM 1144 N THR A 75 -13.178 3.272 3.253 1.00 0.00 N ATOM 1145 CA THR A 75 -14.555 3.550 3.746 1.00 0.00 C ATOM 1146 C THR A 75 -15.145 2.188 4.228 1.00 0.00 C ATOM 1147 O THR A 75 -15.262 1.985 5.441 1.00 0.00 O ATOM 1148 CB THR A 75 -15.462 4.421 2.812 1.00 0.00 C ATOM 1149 OG1 THR A 75 -16.748 4.580 3.404 1.00 0.00 O ATOM 1150 CG2 THR A 75 -15.650 3.955 1.357 1.00 0.00 C ATOM 0 H THR A 75 -13.011 2.279 3.089 1.00 0.00 H new ATOM 0 HA THR A 75 -14.511 4.237 4.591 1.00 0.00 H new ATOM 0 HB THR A 75 -14.905 5.354 2.729 1.00 0.00 H new ATOM 0 HG1 THR A 75 -17.312 5.127 2.818 1.00 0.00 H new ATOM 0 HG21 THR A 75 -16.301 4.654 0.832 1.00 0.00 H new ATOM 0 HG22 THR A 75 -14.681 3.917 0.859 1.00 0.00 H new ATOM 0 HG23 THR A 75 -16.101 2.963 1.348 1.00 0.00 H new ATOM 1158 N GLY A 76 -15.476 1.258 3.309 1.00 0.00 N ATOM 1159 CA GLY A 76 -15.862 -0.121 3.674 1.00 0.00 C ATOM 1160 C GLY A 76 -16.508 -0.853 2.490 1.00 0.00 C ATOM 1161 O GLY A 76 -17.738 -0.873 2.382 1.00 0.00 O ATOM 0 H GLY A 76 -15.484 1.438 2.305 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -14.982 -0.671 4.007 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -16.558 -0.096 4.512 1.00 0.00 H new ATOM 1165 N GLU A 77 -15.679 -1.465 1.623 1.00 0.00 N ATOM 1166 CA GLU A 77 -16.167 -2.338 0.524 1.00 0.00 C ATOM 1167 C GLU A 77 -15.039 -3.353 0.200 1.00 0.00 C ATOM 1168 O GLU A 77 -13.984 -2.984 -0.326 1.00 0.00 O ATOM 1169 CB GLU A 77 -16.610 -1.528 -0.730 1.00 0.00 C ATOM 1170 CG GLU A 77 -17.265 -2.351 -1.864 1.00 0.00 C ATOM 1171 CD GLU A 77 -18.613 -2.986 -1.504 1.00 0.00 C ATOM 1172 OE1 GLU A 77 -19.656 -2.307 -1.629 1.00 0.00 O ATOM 1173 OE2 GLU A 77 -18.633 -4.167 -1.091 1.00 0.00 O ATOM 0 H GLU A 77 -14.664 -1.374 1.658 1.00 0.00 H new ATOM 0 HA GLU A 77 -17.065 -2.866 0.844 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -17.313 -0.758 -0.412 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -15.738 -1.016 -1.135 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -17.404 -1.703 -2.729 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -16.576 -3.141 -2.165 1.00 0.00 H new ATOM 1180 N LYS A 78 -15.307 -4.635 0.499 1.00 0.00 N ATOM 1181 CA LYS A 78 -14.337 -5.743 0.300 1.00 0.00 C ATOM 1182 C LYS A 78 -14.592 -6.359 -1.101 1.00 0.00 C ATOM 1183 O LYS A 78 -15.537 -7.132 -1.297 1.00 0.00 O ATOM 1184 CB LYS A 78 -14.477 -6.801 1.434 1.00 0.00 C ATOM 1185 CG LYS A 78 -13.788 -6.488 2.783 1.00 0.00 C ATOM 1186 CD LYS A 78 -14.397 -5.321 3.589 1.00 0.00 C ATOM 1187 CE LYS A 78 -13.829 -5.200 5.014 1.00 0.00 C ATOM 1188 NZ LYS A 78 -14.343 -3.994 5.687 1.00 0.00 N ATOM 0 H LYS A 78 -16.200 -4.940 0.886 1.00 0.00 H new ATOM 0 HA LYS A 78 -13.314 -5.370 0.346 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -15.539 -6.953 1.625 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -14.081 -7.747 1.064 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.815 -7.386 3.401 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.739 -6.265 2.591 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -14.219 -4.388 3.054 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -15.477 -5.454 3.647 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -14.096 -6.085 5.592 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -12.740 -5.162 4.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -13.945 -3.935 6.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -14.067 -3.150 5.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -15.380 -4.044 5.745 1.00 0.00 H new ATOM 1202 N VAL A 79 -13.739 -5.982 -2.069 1.00 0.00 N ATOM 1203 CA VAL A 79 -13.867 -6.420 -3.487 1.00 0.00 C ATOM 1204 C VAL A 79 -13.015 -7.705 -3.710 1.00 0.00 C ATOM 1205 O VAL A 79 -11.811 -7.723 -3.429 1.00 0.00 O ATOM 1206 CB VAL A 79 -13.534 -5.278 -4.511 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -14.608 -4.169 -4.542 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -12.138 -4.625 -4.378 1.00 0.00 C ATOM 0 H VAL A 79 -12.942 -5.368 -1.901 1.00 0.00 H new ATOM 0 HA VAL A 79 -14.912 -6.663 -3.680 1.00 0.00 H new ATOM 0 HB VAL A 79 -13.527 -5.821 -5.456 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -14.324 -3.407 -5.268 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -15.568 -4.600 -4.826 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -14.692 -3.716 -3.554 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -12.024 -3.852 -5.138 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -12.038 -4.179 -3.389 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.367 -5.384 -4.514 1.00 0.00 H new ATOM 1218 N LYS A 80 -13.656 -8.767 -4.238 1.00 0.00 N ATOM 1219 CA LYS A 80 -12.975 -10.051 -4.559 1.00 0.00 C ATOM 1220 C LYS A 80 -12.329 -9.945 -5.970 1.00 0.00 C ATOM 1221 O LYS A 80 -13.002 -10.078 -6.997 1.00 0.00 O ATOM 1222 CB LYS A 80 -13.956 -11.246 -4.436 1.00 0.00 C ATOM 1223 CG LYS A 80 -14.341 -11.606 -2.980 1.00 0.00 C ATOM 1224 CD LYS A 80 -15.249 -12.846 -2.841 1.00 0.00 C ATOM 1225 CE LYS A 80 -16.700 -12.623 -3.311 1.00 0.00 C ATOM 1226 NZ LYS A 80 -17.516 -13.838 -3.144 1.00 0.00 N ATOM 0 H LYS A 80 -14.653 -8.766 -4.455 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.180 -10.240 -3.838 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -14.864 -11.015 -4.993 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -13.507 -12.120 -4.908 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -13.428 -11.775 -2.408 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -14.845 -10.751 -2.530 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -14.815 -13.666 -3.414 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -15.261 -13.158 -1.797 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.145 -11.804 -2.745 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -16.702 -12.324 -4.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -18.486 -13.652 -3.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -17.105 -14.612 -3.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -17.534 -14.109 -2.140 1.00 0.00 H new ATOM 1240 N THR A 81 -11.026 -9.616 -5.975 1.00 0.00 N ATOM 1241 CA THR A 81 -10.309 -9.096 -7.174 1.00 0.00 C ATOM 1242 C THR A 81 -8.922 -9.788 -7.216 1.00 0.00 C ATOM 1243 O THR A 81 -8.167 -9.773 -6.235 1.00 0.00 O ATOM 1244 CB THR A 81 -10.198 -7.538 -7.161 1.00 0.00 C ATOM 1245 OG1 THR A 81 -9.679 -7.058 -5.923 1.00 0.00 O ATOM 1246 CG2 THR A 81 -11.545 -6.851 -7.444 1.00 0.00 C ATOM 0 H THR A 81 -10.431 -9.700 -5.151 1.00 0.00 H new ATOM 0 HA THR A 81 -10.868 -9.329 -8.080 1.00 0.00 H new ATOM 0 HB THR A 81 -9.506 -7.284 -7.964 1.00 0.00 H new ATOM 0 HG1 THR A 81 -9.454 -6.108 -6.009 1.00 0.00 H new ATOM 0 HG21 THR A 81 -11.413 -5.769 -7.424 1.00 0.00 H new ATOM 0 HG22 THR A 81 -11.909 -7.154 -8.426 1.00 0.00 H new ATOM 0 HG23 THR A 81 -12.269 -7.143 -6.683 1.00 0.00 H new ATOM 1254 N VAL A 82 -8.614 -10.427 -8.359 1.00 0.00 N ATOM 1255 CA VAL A 82 -7.561 -11.479 -8.433 1.00 0.00 C ATOM 1256 C VAL A 82 -6.177 -10.804 -8.651 1.00 0.00 C ATOM 1257 O VAL A 82 -5.978 -10.051 -9.611 1.00 0.00 O ATOM 1258 CB VAL A 82 -7.845 -12.572 -9.526 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -6.933 -13.805 -9.321 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -9.299 -13.090 -9.582 1.00 0.00 C ATOM 0 H VAL A 82 -9.075 -10.239 -9.249 1.00 0.00 H new ATOM 0 HA VAL A 82 -7.564 -12.016 -7.484 1.00 0.00 H new ATOM 0 HB VAL A 82 -7.642 -12.055 -10.464 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.148 -14.548 -10.089 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -5.889 -13.501 -9.392 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.119 -14.236 -8.337 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -9.388 -13.839 -10.368 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.563 -13.537 -8.623 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -9.973 -12.260 -9.794 1.00 0.00 H new ATOM 1270 N VAL A 83 -5.233 -11.126 -7.753 1.00 0.00 N ATOM 1271 CA VAL A 83 -3.843 -10.606 -7.811 1.00 0.00 C ATOM 1272 C VAL A 83 -2.967 -11.738 -8.428 1.00 0.00 C ATOM 1273 O VAL A 83 -2.863 -12.825 -7.856 1.00 0.00 O ATOM 1274 CB VAL A 83 -3.329 -10.131 -6.407 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -1.987 -9.378 -6.541 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -4.294 -9.229 -5.597 1.00 0.00 C ATOM 0 H VAL A 83 -5.403 -11.752 -6.966 1.00 0.00 H new ATOM 0 HA VAL A 83 -3.790 -9.712 -8.433 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.230 -11.062 -5.850 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.649 -9.058 -5.555 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -1.241 -10.039 -6.983 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -2.122 -8.505 -7.180 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.832 -8.964 -4.646 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.505 -8.322 -6.163 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.224 -9.766 -5.411 1.00 0.00 H new ATOM 1286 N GLN A 84 -2.335 -11.468 -9.583 1.00 0.00 N ATOM 1287 CA GLN A 84 -1.403 -12.431 -10.240 1.00 0.00 C ATOM 1288 C GLN A 84 0.065 -12.043 -9.918 1.00 0.00 C ATOM 1289 O GLN A 84 0.474 -10.885 -10.047 1.00 0.00 O ATOM 1290 CB GLN A 84 -1.606 -12.498 -11.779 1.00 0.00 C ATOM 1291 CG GLN A 84 -2.636 -13.522 -12.306 1.00 0.00 C ATOM 1292 CD GLN A 84 -4.119 -13.308 -11.946 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -4.585 -12.208 -11.645 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -4.893 -14.381 -11.997 1.00 0.00 N ATOM 0 H GLN A 84 -2.446 -10.590 -10.091 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.625 -13.421 -9.842 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -1.905 -11.508 -12.125 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.643 -12.719 -12.239 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -2.556 -13.546 -13.393 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -2.343 -14.507 -11.943 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -4.494 -15.286 -12.248 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -5.888 -14.303 -11.786 1.00 0.00 H new ATOM 1303 N LEU A 85 0.847 -13.068 -9.553 1.00 0.00 N ATOM 1304 CA LEU A 85 2.284 -12.942 -9.226 1.00 0.00 C ATOM 1305 C LEU A 85 3.110 -13.426 -10.448 1.00 0.00 C ATOM 1306 O LEU A 85 3.108 -14.618 -10.776 1.00 0.00 O ATOM 1307 CB LEU A 85 2.534 -13.761 -7.931 1.00 0.00 C ATOM 1308 CG LEU A 85 3.992 -13.860 -7.415 1.00 0.00 C ATOM 1309 CD1 LEU A 85 4.638 -12.491 -7.128 1.00 0.00 C ATOM 1310 CD2 LEU A 85 4.065 -14.753 -6.160 1.00 0.00 C ATOM 0 H LEU A 85 0.499 -14.024 -9.474 1.00 0.00 H new ATOM 0 HA LEU A 85 2.593 -11.915 -9.033 1.00 0.00 H new ATOM 0 HB2 LEU A 85 1.925 -13.328 -7.137 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.167 -14.774 -8.098 1.00 0.00 H new ATOM 0 HG LEU A 85 4.566 -14.312 -8.223 1.00 0.00 H new ATOM 0 HD11 LEU A 85 5.657 -12.637 -6.770 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.656 -11.898 -8.043 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.058 -11.967 -6.368 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.097 -14.810 -5.813 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.441 -14.328 -5.374 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.709 -15.754 -6.404 1.00 0.00 H new ATOM 1322 N GLU A 86 3.816 -12.483 -11.098 1.00 0.00 N ATOM 1323 CA GLU A 86 4.669 -12.770 -12.280 1.00 0.00 C ATOM 1324 C GLU A 86 6.140 -12.414 -11.929 1.00 0.00 C ATOM 1325 O GLU A 86 6.472 -11.269 -11.602 1.00 0.00 O ATOM 1326 CB GLU A 86 4.162 -11.960 -13.496 1.00 0.00 C ATOM 1327 CG GLU A 86 4.736 -12.395 -14.860 1.00 0.00 C ATOM 1328 CD GLU A 86 4.214 -11.525 -16.007 1.00 0.00 C ATOM 1329 OE1 GLU A 86 4.771 -10.428 -16.234 1.00 0.00 O ATOM 1330 OE2 GLU A 86 3.244 -11.932 -16.684 1.00 0.00 O ATOM 0 H GLU A 86 3.816 -11.500 -10.824 1.00 0.00 H new ATOM 0 HA GLU A 86 4.619 -13.827 -12.543 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.075 -12.037 -13.536 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.402 -10.909 -13.338 1.00 0.00 H new ATOM 0 HG2 GLU A 86 5.824 -12.340 -14.829 1.00 0.00 H new ATOM 0 HG3 GLU A 86 4.475 -13.437 -15.047 1.00 0.00 H new ATOM 1337 N GLY A 87 7.004 -13.429 -12.035 1.00 0.00 N ATOM 1338 CA GLY A 87 8.474 -13.278 -11.849 1.00 0.00 C ATOM 1339 C GLY A 87 9.080 -12.977 -10.456 1.00 0.00 C ATOM 1340 O GLY A 87 10.245 -12.578 -10.379 1.00 0.00 O ATOM 0 H GLY A 87 6.716 -14.383 -12.252 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.936 -14.199 -12.205 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.799 -12.480 -12.517 1.00 0.00 H new ATOM 1344 N ASP A 88 8.285 -13.113 -9.383 1.00 0.00 N ATOM 1345 CA ASP A 88 8.565 -12.515 -8.043 1.00 0.00 C ATOM 1346 C ASP A 88 8.869 -10.976 -8.048 1.00 0.00 C ATOM 1347 O ASP A 88 9.837 -10.512 -7.436 1.00 0.00 O ATOM 1348 CB ASP A 88 9.541 -13.402 -7.218 1.00 0.00 C ATOM 1349 CG ASP A 88 9.525 -13.129 -5.705 1.00 0.00 C ATOM 1350 OD1 ASP A 88 8.550 -13.527 -5.031 1.00 0.00 O ATOM 1351 OD2 ASP A 88 10.479 -12.508 -5.187 1.00 0.00 O ATOM 0 H ASP A 88 7.416 -13.646 -9.409 1.00 0.00 H new ATOM 0 HA ASP A 88 7.624 -12.531 -7.494 1.00 0.00 H new ATOM 0 HB2 ASP A 88 9.292 -14.449 -7.388 1.00 0.00 H new ATOM 0 HB3 ASP A 88 10.554 -13.250 -7.591 1.00 0.00 H new ATOM 1356 N ASN A 89 8.010 -10.197 -8.733 1.00 0.00 N ATOM 1357 CA ASN A 89 8.127 -8.718 -8.820 1.00 0.00 C ATOM 1358 C ASN A 89 6.777 -8.003 -9.118 1.00 0.00 C ATOM 1359 O ASN A 89 6.518 -6.982 -8.480 1.00 0.00 O ATOM 1360 CB ASN A 89 9.289 -8.228 -9.729 1.00 0.00 C ATOM 1361 CG ASN A 89 9.204 -8.497 -11.248 1.00 0.00 C ATOM 1362 OD1 ASN A 89 8.940 -9.611 -11.699 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.448 -7.484 -12.066 1.00 0.00 N ATOM 0 H ASN A 89 7.211 -10.571 -9.245 1.00 0.00 H new ATOM 0 HA ASN A 89 8.406 -8.408 -7.813 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.388 -7.152 -9.589 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.210 -8.683 -9.363 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.418 -7.625 -13.076 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.666 -6.563 -11.686 1.00 0.00 H new ATOM 1370 N LYS A 90 5.933 -8.495 -10.049 1.00 0.00 N ATOM 1371 CA LYS A 90 4.675 -7.807 -10.450 1.00 0.00 C ATOM 1372 C LYS A 90 3.458 -8.432 -9.713 1.00 0.00 C ATOM 1373 O LYS A 90 3.182 -9.625 -9.865 1.00 0.00 O ATOM 1374 CB LYS A 90 4.470 -7.876 -11.986 1.00 0.00 C ATOM 1375 CG LYS A 90 5.504 -7.089 -12.824 1.00 0.00 C ATOM 1376 CD LYS A 90 5.267 -7.121 -14.347 1.00 0.00 C ATOM 1377 CE LYS A 90 4.107 -6.226 -14.822 1.00 0.00 C ATOM 1378 NZ LYS A 90 3.957 -6.265 -16.287 1.00 0.00 N ATOM 0 H LYS A 90 6.097 -9.372 -10.544 1.00 0.00 H new ATOM 0 HA LYS A 90 4.756 -6.758 -10.165 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.497 -8.921 -12.293 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.474 -7.500 -12.221 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.503 -6.051 -12.493 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.497 -7.489 -12.617 1.00 0.00 H new ATOM 0 HD2 LYS A 90 6.181 -6.811 -14.853 1.00 0.00 H new ATOM 0 HD3 LYS A 90 5.067 -8.148 -14.651 1.00 0.00 H new ATOM 0 HE2 LYS A 90 3.179 -6.552 -14.352 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.284 -5.199 -14.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 3.167 -5.651 -16.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.834 -5.931 -16.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.764 -7.241 -16.590 1.00 0.00 H new ATOM 1392 N LEU A 91 2.716 -7.600 -8.958 1.00 0.00 N ATOM 1393 CA LEU A 91 1.389 -7.969 -8.393 1.00 0.00 C ATOM 1394 C LEU A 91 0.323 -7.122 -9.145 1.00 0.00 C ATOM 1395 O LEU A 91 0.120 -5.942 -8.841 1.00 0.00 O ATOM 1396 CB LEU A 91 1.339 -7.742 -6.857 1.00 0.00 C ATOM 1397 CG LEU A 91 2.166 -8.702 -5.958 1.00 0.00 C ATOM 1398 CD1 LEU A 91 2.258 -8.156 -4.519 1.00 0.00 C ATOM 1399 CD2 LEU A 91 1.627 -10.145 -5.927 1.00 0.00 C ATOM 0 H LEU A 91 3.012 -6.654 -8.719 1.00 0.00 H new ATOM 0 HA LEU A 91 1.192 -9.032 -8.535 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.674 -6.724 -6.657 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.297 -7.802 -6.543 1.00 0.00 H new ATOM 0 HG LEU A 91 3.157 -8.745 -6.410 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.841 -8.843 -3.906 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.742 -7.180 -4.531 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.256 -8.059 -4.102 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.256 -10.755 -5.279 1.00 0.00 H new ATOM 0 HD22 LEU A 91 0.606 -10.144 -5.545 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.636 -10.559 -6.935 1.00 0.00 H new ATOM 1411 N VAL A 92 -0.329 -7.740 -10.148 1.00 0.00 N ATOM 1412 CA VAL A 92 -1.259 -7.042 -11.087 1.00 0.00 C ATOM 1413 C VAL A 92 -2.730 -7.372 -10.703 1.00 0.00 C ATOM 1414 O VAL A 92 -3.104 -8.548 -10.637 1.00 0.00 O ATOM 1415 CB VAL A 92 -0.945 -7.344 -12.596 1.00 0.00 C ATOM 1416 CG1 VAL A 92 0.413 -6.767 -13.048 1.00 0.00 C ATOM 1417 CG2 VAL A 92 -1.027 -8.828 -13.029 1.00 0.00 C ATOM 0 H VAL A 92 -0.233 -8.737 -10.339 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.107 -5.968 -10.981 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.763 -6.832 -13.102 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.578 -7.006 -14.099 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.410 -5.685 -12.918 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.211 -7.203 -12.447 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.790 -8.911 -14.090 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.314 -9.416 -12.451 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.035 -9.204 -12.852 1.00 0.00 H new ATOM 1427 N THR A 93 -3.561 -6.337 -10.461 1.00 0.00 N ATOM 1428 CA THR A 93 -4.989 -6.536 -10.067 1.00 0.00 C ATOM 1429 C THR A 93 -5.879 -5.380 -10.600 1.00 0.00 C ATOM 1430 O THR A 93 -5.575 -4.201 -10.404 1.00 0.00 O ATOM 1431 CB THR A 93 -5.153 -6.785 -8.535 1.00 0.00 C ATOM 1432 OG1 THR A 93 -6.507 -7.107 -8.235 1.00 0.00 O ATOM 1433 CG2 THR A 93 -4.708 -5.645 -7.599 1.00 0.00 C ATOM 0 H THR A 93 -3.280 -5.359 -10.528 1.00 0.00 H new ATOM 0 HA THR A 93 -5.342 -7.450 -10.544 1.00 0.00 H new ATOM 0 HB THR A 93 -4.470 -7.610 -8.335 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.600 -7.263 -7.272 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.872 -5.940 -6.563 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.649 -5.439 -7.754 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.288 -4.748 -7.817 1.00 0.00 H new ATOM 1441 N THR A 94 -7.016 -5.752 -11.218 1.00 0.00 N ATOM 1442 CA THR A 94 -8.071 -4.790 -11.642 1.00 0.00 C ATOM 1443 C THR A 94 -9.152 -4.736 -10.531 1.00 0.00 C ATOM 1444 O THR A 94 -9.789 -5.747 -10.213 1.00 0.00 O ATOM 1445 CB THR A 94 -8.705 -5.151 -13.019 1.00 0.00 C ATOM 1446 OG1 THR A 94 -9.166 -6.500 -13.052 1.00 0.00 O ATOM 1447 CG2 THR A 94 -7.770 -4.920 -14.216 1.00 0.00 C ATOM 0 H THR A 94 -7.236 -6.723 -11.440 1.00 0.00 H new ATOM 0 HA THR A 94 -7.612 -3.811 -11.778 1.00 0.00 H new ATOM 0 HB THR A 94 -9.546 -4.465 -13.118 1.00 0.00 H new ATOM 0 HG1 THR A 94 -9.553 -6.735 -12.183 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.284 -5.194 -15.137 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.486 -3.868 -14.258 1.00 0.00 H new ATOM 0 HG23 THR A 94 -6.876 -5.533 -14.103 1.00 0.00 H new ATOM 1455 N PHE A 95 -9.353 -3.536 -9.960 1.00 0.00 N ATOM 1456 CA PHE A 95 -10.349 -3.308 -8.880 1.00 0.00 C ATOM 1457 C PHE A 95 -11.752 -3.053 -9.499 1.00 0.00 C ATOM 1458 O PHE A 95 -12.531 -3.997 -9.668 1.00 0.00 O ATOM 1459 CB PHE A 95 -9.856 -2.251 -7.848 1.00 0.00 C ATOM 1460 CG PHE A 95 -8.638 -2.635 -6.989 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -8.780 -3.591 -5.978 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -7.407 -1.988 -7.150 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -7.718 -3.881 -5.130 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -6.347 -2.276 -6.294 1.00 0.00 C ATOM 1465 CZ PHE A 95 -6.502 -3.223 -5.286 1.00 0.00 C ATOM 0 H PHE A 95 -8.837 -2.697 -10.226 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.459 -4.209 -8.276 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -9.616 -1.335 -8.388 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -10.684 -2.018 -7.178 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -9.721 -4.107 -5.856 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -7.279 -1.263 -7.940 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -7.837 -4.618 -4.349 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -5.404 -1.764 -6.412 1.00 0.00 H new ATOM 0 HZ PHE A 95 -5.678 -3.447 -4.625 1.00 0.00 H new ATOM 1475 N LYS A 96 -12.028 -1.795 -9.870 1.00 0.00 N ATOM 1476 CA LYS A 96 -13.188 -1.406 -10.713 1.00 0.00 C ATOM 1477 C LYS A 96 -12.604 -0.691 -11.966 1.00 0.00 C ATOM 1478 O LYS A 96 -12.539 -1.308 -13.033 1.00 0.00 O ATOM 1479 CB LYS A 96 -14.224 -0.620 -9.856 1.00 0.00 C ATOM 1480 CG LYS A 96 -15.493 -0.085 -10.565 1.00 0.00 C ATOM 1481 CD LYS A 96 -16.529 -1.130 -11.038 1.00 0.00 C ATOM 1482 CE LYS A 96 -16.295 -1.681 -12.458 1.00 0.00 C ATOM 1483 NZ LYS A 96 -17.380 -2.592 -12.863 1.00 0.00 N ATOM 0 H LYS A 96 -11.449 -1.002 -9.594 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.775 -2.245 -11.087 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -14.545 -1.269 -9.041 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -13.710 0.229 -9.405 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -15.994 0.605 -9.886 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.177 0.495 -11.432 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.528 -1.964 -10.336 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -17.521 -0.680 -10.998 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -16.228 -0.854 -13.165 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -15.342 -2.208 -12.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.195 -2.947 -13.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.426 -3.393 -12.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.285 -2.080 -12.852 1.00 0.00 H new ATOM 1497 N ASN A 97 -12.145 0.569 -11.826 1.00 0.00 N ATOM 1498 CA ASN A 97 -11.323 1.271 -12.857 1.00 0.00 C ATOM 1499 C ASN A 97 -9.783 1.310 -12.563 1.00 0.00 C ATOM 1500 O ASN A 97 -9.014 1.538 -13.502 1.00 0.00 O ATOM 1501 CB ASN A 97 -11.875 2.710 -13.057 1.00 0.00 C ATOM 1502 CG ASN A 97 -13.276 2.807 -13.696 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -13.485 2.414 -14.843 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -14.254 3.334 -12.976 1.00 0.00 N ATOM 0 H ASN A 97 -12.329 1.136 -10.999 1.00 0.00 H new ATOM 0 HA ASN A 97 -11.416 0.684 -13.771 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -11.903 3.206 -12.087 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -11.173 3.265 -13.679 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -15.191 3.417 -13.371 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -14.071 3.657 -12.026 1.00 0.00 H new ATOM 1511 N ILE A 98 -9.322 1.096 -11.308 1.00 0.00 N ATOM 1512 CA ILE A 98 -7.888 1.174 -10.917 1.00 0.00 C ATOM 1513 C ILE A 98 -7.210 -0.183 -11.286 1.00 0.00 C ATOM 1514 O ILE A 98 -7.529 -1.212 -10.681 1.00 0.00 O ATOM 1515 CB ILE A 98 -7.705 1.504 -9.384 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -8.446 2.768 -8.839 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -6.203 1.639 -9.021 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -9.927 2.568 -8.470 1.00 0.00 C ATOM 0 H ILE A 98 -9.938 0.862 -10.529 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.414 1.992 -11.459 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.176 0.649 -8.900 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -7.916 3.124 -7.956 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.381 3.556 -9.589 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.104 1.866 -7.960 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -5.690 0.703 -9.241 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -5.758 2.443 -9.607 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -10.341 3.508 -8.104 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -10.481 2.246 -9.352 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -10.009 1.808 -7.693 1.00 0.00 H new ATOM 1530 N LYS A 99 -6.239 -0.161 -12.220 1.00 0.00 N ATOM 1531 CA LYS A 99 -5.348 -1.329 -12.467 1.00 0.00 C ATOM 1532 C LYS A 99 -4.001 -1.082 -11.729 1.00 0.00 C ATOM 1533 O LYS A 99 -3.144 -0.328 -12.201 1.00 0.00 O ATOM 1534 CB LYS A 99 -5.191 -1.614 -13.982 1.00 0.00 C ATOM 1535 CG LYS A 99 -4.540 -2.984 -14.285 1.00 0.00 C ATOM 1536 CD LYS A 99 -4.499 -3.319 -15.791 1.00 0.00 C ATOM 1537 CE LYS A 99 -3.968 -4.729 -16.120 1.00 0.00 C ATOM 1538 NZ LYS A 99 -2.524 -4.887 -15.864 1.00 0.00 N ATOM 0 H LYS A 99 -6.046 0.644 -12.816 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.791 -2.239 -12.062 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.172 -1.574 -14.455 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.587 -0.826 -14.432 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.524 -2.991 -13.890 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.091 -3.765 -13.761 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -5.505 -3.219 -16.200 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.875 -2.583 -16.297 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -4.516 -5.462 -15.529 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.170 -4.949 -17.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.233 -5.856 -16.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.992 -4.210 -16.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -2.328 -4.707 -14.859 1.00 0.00 H new ATOM 1552 N SER A 100 -3.843 -1.741 -10.567 1.00 0.00 N ATOM 1553 CA SER A 100 -2.649 -1.600 -9.699 1.00 0.00 C ATOM 1554 C SER A 100 -1.529 -2.566 -10.158 1.00 0.00 C ATOM 1555 O SER A 100 -1.549 -3.759 -9.839 1.00 0.00 O ATOM 1556 CB SER A 100 -3.091 -1.858 -8.244 1.00 0.00 C ATOM 1557 OG SER A 100 -2.029 -1.601 -7.332 1.00 0.00 O ATOM 0 H SER A 100 -4.539 -2.389 -10.198 1.00 0.00 H new ATOM 0 HA SER A 100 -2.231 -0.596 -9.769 1.00 0.00 H new ATOM 0 HB2 SER A 100 -3.944 -1.224 -8.002 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.422 -2.891 -8.139 1.00 0.00 H new ATOM 0 HG SER A 100 -2.336 -1.771 -6.417 1.00 0.00 H new ATOM 1563 N VAL A 101 -0.564 -2.018 -10.912 1.00 0.00 N ATOM 1564 CA VAL A 101 0.577 -2.788 -11.478 1.00 0.00 C ATOM 1565 C VAL A 101 1.777 -2.518 -10.525 1.00 0.00 C ATOM 1566 O VAL A 101 2.438 -1.479 -10.625 1.00 0.00 O ATOM 1567 CB VAL A 101 0.830 -2.365 -12.969 1.00 0.00 C ATOM 1568 CG1 VAL A 101 2.120 -2.965 -13.575 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -0.352 -2.714 -13.906 1.00 0.00 C ATOM 0 H VAL A 101 -0.544 -1.027 -11.152 1.00 0.00 H new ATOM 0 HA VAL A 101 0.392 -3.861 -11.526 1.00 0.00 H new ATOM 0 HB VAL A 101 0.941 -1.282 -12.911 1.00 0.00 H new ATOM 0 HG11 VAL A 101 2.228 -2.629 -14.606 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.982 -2.636 -12.994 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.061 -4.053 -13.552 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.117 -2.397 -14.922 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.522 -3.791 -13.892 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.251 -2.200 -13.565 1.00 0.00 H new ATOM 1579 N THR A 102 2.028 -3.450 -9.589 1.00 0.00 N ATOM 1580 CA THR A 102 2.938 -3.203 -8.437 1.00 0.00 C ATOM 1581 C THR A 102 4.274 -3.959 -8.685 1.00 0.00 C ATOM 1582 O THR A 102 4.448 -5.098 -8.244 1.00 0.00 O ATOM 1583 CB THR A 102 2.187 -3.578 -7.124 1.00 0.00 C ATOM 1584 OG1 THR A 102 0.929 -2.911 -7.049 1.00 0.00 O ATOM 1585 CG2 THR A 102 2.956 -3.234 -5.841 1.00 0.00 C ATOM 0 H THR A 102 1.618 -4.384 -9.600 1.00 0.00 H new ATOM 0 HA THR A 102 3.213 -2.154 -8.330 1.00 0.00 H new ATOM 0 HB THR A 102 2.070 -4.660 -7.177 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.475 -3.162 -6.218 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.365 -3.527 -4.973 1.00 0.00 H new ATOM 0 HG22 THR A 102 3.905 -3.770 -5.831 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.145 -2.161 -5.807 1.00 0.00 H new ATOM 1593 N GLU A 103 5.200 -3.302 -9.409 1.00 0.00 N ATOM 1594 CA GLU A 103 6.454 -3.922 -9.908 1.00 0.00 C ATOM 1595 C GLU A 103 7.625 -3.602 -8.947 1.00 0.00 C ATOM 1596 O GLU A 103 7.860 -2.446 -8.589 1.00 0.00 O ATOM 1597 CB GLU A 103 6.748 -3.364 -11.322 1.00 0.00 C ATOM 1598 CG GLU A 103 7.875 -4.089 -12.089 1.00 0.00 C ATOM 1599 CD GLU A 103 8.021 -3.601 -13.532 1.00 0.00 C ATOM 1600 OE1 GLU A 103 8.607 -2.518 -13.749 1.00 0.00 O ATOM 1601 OE2 GLU A 103 7.549 -4.300 -14.456 1.00 0.00 O ATOM 0 H GLU A 103 5.104 -2.320 -9.669 1.00 0.00 H new ATOM 0 HA GLU A 103 6.342 -5.005 -9.956 1.00 0.00 H new ATOM 0 HB2 GLU A 103 5.834 -3.417 -11.914 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.010 -2.310 -11.233 1.00 0.00 H new ATOM 0 HG2 GLU A 103 8.819 -3.942 -11.564 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.675 -5.161 -12.091 1.00 0.00 H new ATOM 1608 N LEU A 104 8.378 -4.642 -8.585 1.00 0.00 N ATOM 1609 CA LEU A 104 9.481 -4.541 -7.597 1.00 0.00 C ATOM 1610 C LEU A 104 10.825 -4.499 -8.372 1.00 0.00 C ATOM 1611 O LEU A 104 11.281 -5.515 -8.910 1.00 0.00 O ATOM 1612 CB LEU A 104 9.367 -5.718 -6.585 1.00 0.00 C ATOM 1613 CG LEU A 104 9.960 -5.469 -5.173 1.00 0.00 C ATOM 1614 CD1 LEU A 104 9.746 -6.714 -4.298 1.00 0.00 C ATOM 1615 CD2 LEU A 104 11.445 -5.066 -5.159 1.00 0.00 C ATOM 0 H LEU A 104 8.250 -5.581 -8.961 1.00 0.00 H new ATOM 0 HA LEU A 104 9.424 -3.627 -7.006 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.313 -5.973 -6.474 1.00 0.00 H new ATOM 0 HB3 LEU A 104 9.862 -6.589 -7.015 1.00 0.00 H new ATOM 0 HG LEU A 104 9.422 -4.610 -4.771 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.163 -6.538 -3.306 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.679 -6.919 -4.212 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.244 -7.569 -4.754 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.771 -4.913 -4.130 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.041 -5.857 -5.615 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.577 -4.142 -5.722 1.00 0.00 H new ATOM 1627 N ASN A 105 11.442 -3.306 -8.422 1.00 0.00 N ATOM 1628 CA ASN A 105 12.652 -3.056 -9.252 1.00 0.00 C ATOM 1629 C ASN A 105 13.898 -2.961 -8.326 1.00 0.00 C ATOM 1630 O ASN A 105 14.288 -1.871 -7.893 1.00 0.00 O ATOM 1631 CB ASN A 105 12.439 -1.783 -10.124 1.00 0.00 C ATOM 1632 CG ASN A 105 11.303 -1.860 -11.169 1.00 0.00 C ATOM 1633 OD1 ASN A 105 10.168 -1.461 -10.907 1.00 0.00 O ATOM 1634 ND2 ASN A 105 11.576 -2.377 -12.357 1.00 0.00 N ATOM 0 H ASN A 105 11.127 -2.490 -7.897 1.00 0.00 H new ATOM 0 HA ASN A 105 12.825 -3.882 -9.942 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.239 -0.942 -9.461 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.371 -1.564 -10.645 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.843 -2.447 -13.063 1.00 0.00 H new ATOM 0 HD22 ASN A 105 12.519 -2.705 -12.566 1.00 0.00 H new ATOM 1641 N GLY A 106 14.516 -4.118 -8.015 1.00 0.00 N ATOM 1642 CA GLY A 106 15.712 -4.182 -7.142 1.00 0.00 C ATOM 1643 C GLY A 106 15.365 -4.096 -5.643 1.00 0.00 C ATOM 1644 O GLY A 106 14.805 -5.042 -5.083 1.00 0.00 O ATOM 0 H GLY A 106 14.206 -5.028 -8.357 1.00 0.00 H new ATOM 0 HA2 GLY A 106 16.246 -5.113 -7.333 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.388 -3.367 -7.401 1.00 0.00 H new ATOM 1648 N ASP A 107 15.687 -2.947 -5.019 1.00 0.00 N ATOM 1649 CA ASP A 107 15.233 -2.623 -3.631 1.00 0.00 C ATOM 1650 C ASP A 107 14.402 -1.298 -3.591 1.00 0.00 C ATOM 1651 O ASP A 107 14.651 -0.408 -2.770 1.00 0.00 O ATOM 1652 CB ASP A 107 16.450 -2.611 -2.662 1.00 0.00 C ATOM 1653 CG ASP A 107 17.114 -3.977 -2.422 1.00 0.00 C ATOM 1654 OD1 ASP A 107 16.603 -4.761 -1.593 1.00 0.00 O ATOM 1655 OD2 ASP A 107 18.143 -4.270 -3.070 1.00 0.00 O ATOM 0 H ASP A 107 16.260 -2.219 -5.446 1.00 0.00 H new ATOM 0 HA ASP A 107 14.554 -3.404 -3.289 1.00 0.00 H new ATOM 0 HB2 ASP A 107 17.200 -1.925 -3.056 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.125 -2.210 -1.702 1.00 0.00 H new ATOM 1660 N ILE A 108 13.360 -1.203 -4.441 1.00 0.00 N ATOM 1661 CA ILE A 108 12.266 -0.202 -4.319 1.00 0.00 C ATOM 1662 C ILE A 108 10.895 -0.957 -4.448 1.00 0.00 C ATOM 1663 O ILE A 108 10.824 -2.185 -4.324 1.00 0.00 O ATOM 1664 CB ILE A 108 12.459 1.015 -5.295 1.00 0.00 C ATOM 1665 CG1 ILE A 108 12.431 0.636 -6.803 1.00 0.00 C ATOM 1666 CG2 ILE A 108 13.679 1.909 -4.966 1.00 0.00 C ATOM 1667 CD1 ILE A 108 11.846 1.722 -7.711 1.00 0.00 C ATOM 0 H ILE A 108 13.247 -1.823 -5.243 1.00 0.00 H new ATOM 0 HA ILE A 108 12.285 0.272 -3.338 1.00 0.00 H new ATOM 0 HB ILE A 108 11.571 1.619 -5.108 1.00 0.00 H new ATOM 0 HG12 ILE A 108 13.447 0.413 -7.129 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.849 -0.277 -6.926 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.738 2.724 -5.688 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.569 2.320 -3.963 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.591 1.313 -5.016 1.00 0.00 H new ATOM 0 HD11 ILE A 108 11.863 1.379 -8.746 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.818 1.930 -7.414 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.441 2.631 -7.620 1.00 0.00 H new ATOM 1679 N ILE A 109 9.789 -0.234 -4.712 1.00 0.00 N ATOM 1680 CA ILE A 109 8.569 -0.828 -5.315 1.00 0.00 C ATOM 1681 C ILE A 109 7.795 0.306 -6.047 1.00 0.00 C ATOM 1682 O ILE A 109 7.369 1.289 -5.432 1.00 0.00 O ATOM 1683 CB ILE A 109 7.726 -1.698 -4.315 1.00 0.00 C ATOM 1684 CG1 ILE A 109 6.780 -2.677 -5.064 1.00 0.00 C ATOM 1685 CG2 ILE A 109 6.983 -0.901 -3.214 1.00 0.00 C ATOM 1686 CD1 ILE A 109 6.300 -3.865 -4.220 1.00 0.00 C ATOM 0 H ILE A 109 9.711 0.764 -4.518 1.00 0.00 H new ATOM 0 HA ILE A 109 8.845 -1.575 -6.059 1.00 0.00 H new ATOM 0 HB ILE A 109 8.465 -2.285 -3.769 1.00 0.00 H new ATOM 0 HG12 ILE A 109 5.910 -2.123 -5.418 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.295 -3.058 -5.946 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.431 -1.591 -2.576 1.00 0.00 H new ATOM 0 HG22 ILE A 109 7.706 -0.350 -2.613 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.288 -0.201 -3.678 1.00 0.00 H new ATOM 0 HD11 ILE A 109 5.645 -4.497 -4.820 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.160 -4.446 -3.888 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.753 -3.497 -3.352 1.00 0.00 H new ATOM 1698 N THR A 110 7.620 0.136 -7.370 1.00 0.00 N ATOM 1699 CA THR A 110 6.913 1.113 -8.238 1.00 0.00 C ATOM 1700 C THR A 110 5.430 0.649 -8.358 1.00 0.00 C ATOM 1701 O THR A 110 5.104 -0.263 -9.124 1.00 0.00 O ATOM 1702 CB THR A 110 7.635 1.239 -9.614 1.00 0.00 C ATOM 1703 OG1 THR A 110 9.022 1.516 -9.437 1.00 0.00 O ATOM 1704 CG2 THR A 110 7.072 2.365 -10.497 1.00 0.00 C ATOM 0 H THR A 110 7.963 -0.682 -7.874 1.00 0.00 H new ATOM 0 HA THR A 110 6.927 2.114 -7.808 1.00 0.00 H new ATOM 0 HB THR A 110 7.472 0.279 -10.105 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.455 1.589 -10.313 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.620 2.397 -11.439 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.017 2.178 -10.697 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.180 3.320 -9.982 1.00 0.00 H new ATOM 1712 N ASN A 111 4.548 1.301 -7.585 1.00 0.00 N ATOM 1713 CA ASN A 111 3.098 0.987 -7.534 1.00 0.00 C ATOM 1714 C ASN A 111 2.373 1.935 -8.523 1.00 0.00 C ATOM 1715 O ASN A 111 2.112 3.100 -8.214 1.00 0.00 O ATOM 1716 CB ASN A 111 2.647 1.099 -6.051 1.00 0.00 C ATOM 1717 CG ASN A 111 1.136 1.009 -5.763 1.00 0.00 C ATOM 1718 OD1 ASN A 111 0.454 2.026 -5.632 1.00 0.00 O ATOM 1719 ND2 ASN A 111 0.585 -0.187 -5.645 1.00 0.00 N ATOM 0 H ASN A 111 4.816 2.069 -6.970 1.00 0.00 H new ATOM 0 HA ASN A 111 2.850 -0.026 -7.853 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.145 0.311 -5.486 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.009 2.050 -5.659 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.411 -0.272 -5.444 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.156 -1.025 -5.755 1.00 0.00 H new ATOM 1726 N THR A 112 2.074 1.403 -9.718 1.00 0.00 N ATOM 1727 CA THR A 112 1.532 2.196 -10.854 1.00 0.00 C ATOM 1728 C THR A 112 0.000 1.935 -10.941 1.00 0.00 C ATOM 1729 O THR A 112 -0.459 1.002 -11.607 1.00 0.00 O ATOM 1730 CB THR A 112 2.311 1.858 -12.159 1.00 0.00 C ATOM 1731 OG1 THR A 112 3.716 2.005 -11.960 1.00 0.00 O ATOM 1732 CG2 THR A 112 1.939 2.753 -13.352 1.00 0.00 C ATOM 0 H THR A 112 2.198 0.414 -9.933 1.00 0.00 H new ATOM 0 HA THR A 112 1.671 3.266 -10.702 1.00 0.00 H new ATOM 0 HB THR A 112 2.034 0.829 -12.389 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.189 1.787 -12.790 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.522 2.458 -14.224 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.877 2.644 -13.572 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.154 3.793 -13.107 1.00 0.00 H new ATOM 1740 N MET A 113 -0.769 2.787 -10.245 1.00 0.00 N ATOM 1741 CA MET A 113 -2.246 2.660 -10.131 1.00 0.00 C ATOM 1742 C MET A 113 -2.919 3.511 -11.240 1.00 0.00 C ATOM 1743 O MET A 113 -2.984 4.742 -11.155 1.00 0.00 O ATOM 1744 CB MET A 113 -2.696 3.082 -8.709 1.00 0.00 C ATOM 1745 CG MET A 113 -2.438 2.041 -7.610 1.00 0.00 C ATOM 1746 SD MET A 113 -3.049 2.674 -6.035 1.00 0.00 S ATOM 1747 CE MET A 113 -3.199 1.143 -5.092 1.00 0.00 C ATOM 0 H MET A 113 -0.391 3.589 -9.741 1.00 0.00 H new ATOM 0 HA MET A 113 -2.554 1.624 -10.275 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.183 4.006 -8.441 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.763 3.306 -8.733 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.937 1.104 -7.857 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.372 1.826 -7.540 1.00 0.00 H new ATOM 0 HE1 MET A 113 -3.004 1.344 -4.039 1.00 0.00 H new ATOM 0 HE2 MET A 113 -4.207 0.744 -5.204 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.477 0.415 -5.462 1.00 0.00 H new ATOM 1757 N THR A 114 -3.399 2.820 -12.289 1.00 0.00 N ATOM 1758 CA THR A 114 -3.908 3.466 -13.529 1.00 0.00 C ATOM 1759 C THR A 114 -5.458 3.564 -13.464 1.00 0.00 C ATOM 1760 O THR A 114 -6.175 2.619 -13.807 1.00 0.00 O ATOM 1761 CB THR A 114 -3.403 2.746 -14.817 1.00 0.00 C ATOM 1762 OG1 THR A 114 -3.796 1.381 -14.837 1.00 0.00 O ATOM 1763 CG2 THR A 114 -1.882 2.798 -15.028 1.00 0.00 C ATOM 0 H THR A 114 -3.448 1.801 -12.309 1.00 0.00 H new ATOM 0 HA THR A 114 -3.506 4.477 -13.589 1.00 0.00 H new ATOM 0 HB THR A 114 -3.871 3.305 -15.627 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.754 1.314 -14.644 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.624 2.272 -15.947 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.560 3.837 -15.102 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.381 2.322 -14.185 1.00 0.00 H new ATOM 1771 N LEU A 115 -5.951 4.735 -13.027 1.00 0.00 N ATOM 1772 CA LEU A 115 -7.404 5.041 -12.948 1.00 0.00 C ATOM 1773 C LEU A 115 -7.844 5.758 -14.255 1.00 0.00 C ATOM 1774 O LEU A 115 -7.916 6.990 -14.313 1.00 0.00 O ATOM 1775 CB LEU A 115 -7.606 5.853 -11.632 1.00 0.00 C ATOM 1776 CG LEU A 115 -8.997 6.463 -11.304 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -10.169 5.472 -11.422 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -8.970 7.083 -9.893 1.00 0.00 C ATOM 0 H LEU A 115 -5.357 5.504 -12.716 1.00 0.00 H new ATOM 0 HA LEU A 115 -8.044 4.161 -12.891 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.334 5.200 -10.803 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.887 6.672 -11.642 1.00 0.00 H new ATOM 0 HG LEU A 115 -9.179 7.227 -12.060 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -11.101 5.980 -11.176 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -10.222 5.091 -12.442 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -10.015 4.643 -10.732 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -9.946 7.510 -9.665 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -8.731 6.311 -9.161 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.213 7.866 -9.854 1.00 0.00 H new ATOM 1790 N GLY A 116 -8.105 4.961 -15.313 1.00 0.00 N ATOM 1791 CA GLY A 116 -8.414 5.485 -16.664 1.00 0.00 C ATOM 1792 C GLY A 116 -7.179 6.071 -17.382 1.00 0.00 C ATOM 1793 O GLY A 116 -6.332 5.325 -17.884 1.00 0.00 O ATOM 0 H GLY A 116 -8.108 3.943 -15.258 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.834 4.683 -17.271 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.180 6.257 -16.582 1.00 0.00 H new ATOM 1797 N ASP A 117 -7.092 7.410 -17.384 1.00 0.00 N ATOM 1798 CA ASP A 117 -5.882 8.160 -17.847 1.00 0.00 C ATOM 1799 C ASP A 117 -4.911 8.637 -16.708 1.00 0.00 C ATOM 1800 O ASP A 117 -3.800 9.066 -17.029 1.00 0.00 O ATOM 1801 CB ASP A 117 -6.328 9.375 -18.708 1.00 0.00 C ATOM 1802 CG ASP A 117 -6.982 9.020 -20.054 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -6.246 8.730 -21.025 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -8.230 9.021 -20.142 1.00 0.00 O ATOM 0 H ASP A 117 -7.849 8.016 -17.068 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.301 7.448 -18.433 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -7.031 9.973 -18.127 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -5.458 10.003 -18.900 1.00 0.00 H new ATOM 1809 N ILE A 118 -5.298 8.574 -15.413 1.00 0.00 N ATOM 1810 CA ILE A 118 -4.502 9.116 -14.275 1.00 0.00 C ATOM 1811 C ILE A 118 -3.505 7.999 -13.834 1.00 0.00 C ATOM 1812 O ILE A 118 -3.907 7.018 -13.200 1.00 0.00 O ATOM 1813 CB ILE A 118 -5.462 9.592 -13.123 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -6.452 10.723 -13.551 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -4.675 10.056 -11.869 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -7.670 10.914 -12.630 1.00 0.00 C ATOM 0 H ILE A 118 -6.176 8.144 -15.121 1.00 0.00 H new ATOM 0 HA ILE A 118 -3.928 9.998 -14.560 1.00 0.00 H new ATOM 0 HB ILE A 118 -6.055 8.710 -12.881 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -5.904 11.664 -13.600 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -6.809 10.509 -14.558 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.375 10.376 -11.098 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.072 9.230 -11.491 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.023 10.888 -12.136 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -8.294 11.721 -13.014 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -8.250 9.992 -12.598 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -7.330 11.165 -11.625 1.00 0.00 H new ATOM 1828 N VAL A 119 -2.213 8.176 -14.161 1.00 0.00 N ATOM 1829 CA VAL A 119 -1.161 7.153 -13.896 1.00 0.00 C ATOM 1830 C VAL A 119 -0.432 7.583 -12.586 1.00 0.00 C ATOM 1831 O VAL A 119 0.519 8.370 -12.629 1.00 0.00 O ATOM 1832 CB VAL A 119 -0.210 6.989 -15.138 1.00 0.00 C ATOM 1833 CG1 VAL A 119 0.892 5.928 -14.911 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -0.941 6.631 -16.458 1.00 0.00 C ATOM 0 H VAL A 119 -1.861 9.020 -14.612 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.585 6.160 -13.748 1.00 0.00 H new ATOM 0 HB VAL A 119 0.233 7.979 -15.242 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.518 5.858 -15.801 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.505 6.217 -14.058 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.430 4.960 -14.715 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -0.212 6.537 -17.263 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.471 5.687 -16.336 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.654 7.418 -16.704 1.00 0.00 H new ATOM 1844 N PHE A 120 -0.879 7.042 -11.433 1.00 0.00 N ATOM 1845 CA PHE A 120 -0.258 7.317 -10.108 1.00 0.00 C ATOM 1846 C PHE A 120 0.980 6.405 -9.913 1.00 0.00 C ATOM 1847 O PHE A 120 0.866 5.283 -9.417 1.00 0.00 O ATOM 1848 CB PHE A 120 -1.338 7.166 -8.995 1.00 0.00 C ATOM 1849 CG PHE A 120 -0.915 7.315 -7.511 1.00 0.00 C ATOM 1850 CD1 PHE A 120 0.090 8.202 -7.095 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -1.581 6.548 -6.546 1.00 0.00 C ATOM 1852 CE1 PHE A 120 0.412 8.323 -5.747 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -1.261 6.676 -5.197 1.00 0.00 C ATOM 1854 CZ PHE A 120 -0.267 7.564 -4.799 1.00 0.00 C ATOM 0 H PHE A 120 -1.675 6.406 -11.388 1.00 0.00 H new ATOM 0 HA PHE A 120 0.109 8.342 -10.049 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.117 7.903 -9.191 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -1.794 6.182 -9.110 1.00 0.00 H new ATOM 0 HD1 PHE A 120 0.618 8.795 -7.827 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -2.349 5.852 -6.851 1.00 0.00 H new ATOM 0 HE1 PHE A 120 1.189 9.006 -5.436 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -1.785 6.086 -4.460 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.022 7.664 -3.752 1.00 0.00 H new ATOM 1864 N LYS A 121 2.153 6.936 -10.294 1.00 0.00 N ATOM 1865 CA LYS A 121 3.442 6.199 -10.202 1.00 0.00 C ATOM 1866 C LYS A 121 4.095 6.536 -8.832 1.00 0.00 C ATOM 1867 O LYS A 121 4.530 7.665 -8.584 1.00 0.00 O ATOM 1868 CB LYS A 121 4.323 6.560 -11.424 1.00 0.00 C ATOM 1869 CG LYS A 121 5.548 5.644 -11.624 1.00 0.00 C ATOM 1870 CD LYS A 121 6.482 6.143 -12.744 1.00 0.00 C ATOM 1871 CE LYS A 121 7.708 5.234 -12.937 1.00 0.00 C ATOM 1872 NZ LYS A 121 8.606 5.759 -13.980 1.00 0.00 N ATOM 0 H LYS A 121 2.244 7.879 -10.672 1.00 0.00 H new ATOM 0 HA LYS A 121 3.302 5.119 -10.237 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.708 6.523 -12.323 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.668 7.588 -11.316 1.00 0.00 H new ATOM 0 HG2 LYS A 121 6.107 5.581 -10.690 1.00 0.00 H new ATOM 0 HG3 LYS A 121 5.209 4.636 -11.861 1.00 0.00 H new ATOM 0 HD2 LYS A 121 5.925 6.200 -13.679 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.816 7.154 -12.511 1.00 0.00 H new ATOM 0 HE2 LYS A 121 8.251 5.148 -11.996 1.00 0.00 H new ATOM 0 HE3 LYS A 121 7.380 4.231 -13.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.423 5.124 -14.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.093 5.817 -14.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.937 6.707 -13.708 1.00 0.00 H new ATOM 1886 N ARG A 122 4.106 5.532 -7.943 1.00 0.00 N ATOM 1887 CA ARG A 122 4.361 5.718 -6.494 1.00 0.00 C ATOM 1888 C ARG A 122 5.648 4.920 -6.138 1.00 0.00 C ATOM 1889 O ARG A 122 5.623 3.689 -6.060 1.00 0.00 O ATOM 1890 CB ARG A 122 3.071 5.239 -5.766 1.00 0.00 C ATOM 1891 CG ARG A 122 3.066 5.425 -4.240 1.00 0.00 C ATOM 1892 CD ARG A 122 1.898 4.713 -3.530 1.00 0.00 C ATOM 1893 NE ARG A 122 1.877 5.027 -2.077 1.00 0.00 N ATOM 1894 CZ ARG A 122 2.498 4.307 -1.120 1.00 0.00 C ATOM 1895 NH1 ARG A 122 3.144 3.165 -1.347 1.00 0.00 N ATOM 1896 NH2 ARG A 122 2.465 4.764 0.119 1.00 0.00 N ATOM 0 H ARG A 122 3.938 4.560 -8.203 1.00 0.00 H new ATOM 0 HA ARG A 122 4.549 6.747 -6.189 1.00 0.00 H new ATOM 0 HB2 ARG A 122 2.219 5.775 -6.183 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.921 4.182 -5.986 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.007 5.052 -3.835 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.021 6.490 -4.013 1.00 0.00 H new ATOM 0 HD2 ARG A 122 0.955 5.017 -3.984 1.00 0.00 H new ATOM 0 HD3 ARG A 122 1.987 3.636 -3.670 1.00 0.00 H new ATOM 0 HE ARG A 122 1.353 5.850 -1.781 1.00 0.00 H new ATOM 0 HH11 ARG A 122 3.190 2.784 -2.292 1.00 0.00 H new ATOM 0 HH12 ARG A 122 3.593 2.671 -0.576 1.00 0.00 H new ATOM 0 HH21 ARG A 122 1.980 5.637 0.328 1.00 0.00 H new ATOM 0 HH22 ARG A 122 2.924 4.244 0.867 1.00 0.00 H new ATOM 1910 N ILE A 123 6.773 5.635 -5.938 1.00 0.00 N ATOM 1911 CA ILE A 123 8.118 5.013 -5.752 1.00 0.00 C ATOM 1912 C ILE A 123 8.357 4.986 -4.217 1.00 0.00 C ATOM 1913 O ILE A 123 8.458 6.046 -3.596 1.00 0.00 O ATOM 1914 CB ILE A 123 9.249 5.772 -6.546 1.00 0.00 C ATOM 1915 CG1 ILE A 123 9.120 5.700 -8.102 1.00 0.00 C ATOM 1916 CG2 ILE A 123 10.672 5.266 -6.179 1.00 0.00 C ATOM 1917 CD1 ILE A 123 8.122 6.671 -8.747 1.00 0.00 C ATOM 0 H ILE A 123 6.785 6.654 -5.899 1.00 0.00 H new ATOM 0 HA ILE A 123 8.152 4.004 -6.164 1.00 0.00 H new ATOM 0 HB ILE A 123 9.109 6.807 -6.236 1.00 0.00 H new ATOM 0 HG12 ILE A 123 10.103 5.882 -8.536 1.00 0.00 H new ATOM 0 HG13 ILE A 123 8.834 4.684 -8.375 1.00 0.00 H new ATOM 0 HG21 ILE A 123 11.415 5.820 -6.753 1.00 0.00 H new ATOM 0 HG22 ILE A 123 10.849 5.418 -5.114 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.752 4.204 -6.412 1.00 0.00 H new ATOM 0 HD11 ILE A 123 8.121 6.527 -9.827 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.123 6.480 -8.355 1.00 0.00 H new ATOM 0 HD13 ILE A 123 8.412 7.696 -8.518 1.00 0.00 H new ATOM 1929 N SER A 124 8.469 3.779 -3.635 1.00 0.00 N ATOM 1930 CA SER A 124 8.623 3.604 -2.168 1.00 0.00 C ATOM 1931 C SER A 124 9.818 2.652 -1.891 1.00 0.00 C ATOM 1932 O SER A 124 9.784 1.477 -2.263 1.00 0.00 O ATOM 1933 CB SER A 124 7.309 3.061 -1.564 1.00 0.00 C ATOM 1934 OG SER A 124 6.229 3.965 -1.760 1.00 0.00 O ATOM 0 H SER A 124 8.456 2.902 -4.156 1.00 0.00 H new ATOM 0 HA SER A 124 8.832 4.563 -1.694 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.068 2.101 -2.020 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.445 2.882 -0.497 1.00 0.00 H new ATOM 0 HG SER A 124 5.588 3.873 -1.024 1.00 0.00 H new ATOM 1940 N LYS A 125 10.884 3.170 -1.249 1.00 0.00 N ATOM 1941 CA LYS A 125 12.184 2.467 -1.135 1.00 0.00 C ATOM 1942 C LYS A 125 12.234 1.526 0.099 1.00 0.00 C ATOM 1943 O LYS A 125 11.830 1.898 1.206 1.00 0.00 O ATOM 1944 CB LYS A 125 13.314 3.528 -1.148 1.00 0.00 C ATOM 1945 CG LYS A 125 14.745 2.957 -1.223 1.00 0.00 C ATOM 1946 CD LYS A 125 15.813 3.992 -1.639 1.00 0.00 C ATOM 1947 CE LYS A 125 17.155 3.374 -2.081 1.00 0.00 C ATOM 1948 NZ LYS A 125 17.929 2.797 -0.966 1.00 0.00 N ATOM 0 H LYS A 125 10.872 4.084 -0.796 1.00 0.00 H new ATOM 0 HA LYS A 125 12.323 1.803 -1.988 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.159 4.191 -1.999 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.229 4.138 -0.249 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.012 2.545 -0.250 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.759 2.130 -1.933 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.418 4.597 -2.455 1.00 0.00 H new ATOM 0 HD3 LYS A 125 15.995 4.666 -0.802 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.963 2.597 -2.821 1.00 0.00 H new ATOM 0 HE3 LYS A 125 17.755 4.140 -2.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 18.818 2.399 -1.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 18.142 3.540 -0.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.374 2.045 -0.511 1.00 0.00 H new ATOM 1962 N ARG A 126 12.794 0.320 -0.117 1.00 0.00 N ATOM 1963 CA ARG A 126 12.990 -0.700 0.937 1.00 0.00 C ATOM 1964 C ARG A 126 14.047 -0.241 1.988 1.00 0.00 C ATOM 1965 O ARG A 126 15.180 0.116 1.646 1.00 0.00 O ATOM 1966 CB ARG A 126 13.371 -2.014 0.205 1.00 0.00 C ATOM 1967 CG ARG A 126 13.625 -3.227 1.119 1.00 0.00 C ATOM 1968 CD ARG A 126 13.654 -4.588 0.383 1.00 0.00 C ATOM 1969 NE ARG A 126 14.605 -5.590 0.938 1.00 0.00 N ATOM 1970 CZ ARG A 126 14.529 -6.158 2.158 1.00 0.00 C ATOM 1971 NH1 ARG A 126 13.609 -5.851 3.069 1.00 0.00 N ATOM 1972 NH2 ARG A 126 15.431 -7.067 2.474 1.00 0.00 N ATOM 0 H ARG A 126 13.126 0.022 -1.034 1.00 0.00 H new ATOM 0 HA ARG A 126 12.084 -0.857 1.522 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.572 -2.267 -0.493 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.267 -1.833 -0.388 1.00 0.00 H new ATOM 0 HG2 ARG A 126 14.575 -3.086 1.634 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.850 -3.258 1.884 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.651 -5.014 0.401 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.906 -4.412 -0.663 1.00 0.00 H new ATOM 0 HE ARG A 126 15.383 -5.872 0.342 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.902 -5.145 2.862 1.00 0.00 H new ATOM 0 HH12 ARG A 126 13.611 -6.321 3.974 1.00 0.00 H new ATOM 0 HH21 ARG A 126 16.157 -7.320 1.803 1.00 0.00 H new ATOM 0 HH22 ARG A 126 15.403 -7.517 3.389 1.00 0.00 H new ATOM 1986 N ILE A 127 13.622 -0.248 3.260 1.00 0.00 N ATOM 1987 CA ILE A 127 14.402 0.297 4.399 1.00 0.00 C ATOM 1988 C ILE A 127 14.360 -0.772 5.501 1.00 0.00 C ATOM 1989 O ILE A 127 15.223 -1.648 5.572 1.00 0.00 O ATOM 1990 CB ILE A 127 13.886 1.691 4.906 1.00 0.00 C ATOM 1991 CG1 ILE A 127 12.358 1.764 5.222 1.00 0.00 C ATOM 1992 CG2 ILE A 127 14.318 2.821 3.940 1.00 0.00 C ATOM 1993 CD1 ILE A 127 11.917 2.942 6.102 1.00 0.00 C ATOM 0 H ILE A 127 12.720 -0.634 3.538 1.00 0.00 H new ATOM 0 HA ILE A 127 15.425 0.501 4.082 1.00 0.00 H new ATOM 0 HB ILE A 127 14.367 1.835 5.873 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.813 1.814 4.280 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.062 0.837 5.713 1.00 0.00 H new ATOM 0 HG21 ILE A 127 13.950 3.777 4.311 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.406 2.850 3.878 1.00 0.00 H new ATOM 0 HG23 ILE A 127 13.903 2.632 2.950 1.00 0.00 H new ATOM 0 HD11 ILE A 127 10.839 2.896 6.258 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.426 2.888 7.064 1.00 0.00 H new ATOM 0 HD13 ILE A 127 12.172 3.880 5.609 1.00 0.00 H new TER 2005 ILE A 127