USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1309 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 82 GLN : amide:sc= -5.62! K(o=-9.8!,f=-4.5) USER MOD Set 1.2: A 109 ASN : amide:sc= -4.18! C(o=-9.8!,f=-4.5!) USER MOD Set 2.1: A 78 GLN : amide:sc= 0.389 K(o=1.6,f=-7.4!) USER MOD Set 2.2: A 107 LYS NZ :NH3+ 151:sc= 1.16 (180deg=-0.441) USER MOD Set 3.1: A 62 ASN : amide:sc= 0.896 K(o=1.1,f=-1.2) USER MOD Set 3.2: A 65 LYS NZ :NH3+ 147:sc= 0.201 (180deg=0) USER MOD Set 4.1: A 42 ASN : amide:sc= -4.87! C(o=-5!,f=-17!) USER MOD Set 4.2: A 76 SER OG : rot -119:sc= -0.0844 USER MOD Set 5.1: A 28 TYR OH : rot -143:sc= 1.28 USER MOD Set 5.2: A 29 ASN : amide:sc= -7.21! C(o=-15!,f=-10!) USER MOD Set 5.3: A 32 GLN : amide:sc= -2.94! C(o=-15!,f=-11!) USER MOD Set 5.4: A 33 HIS : no HE2:sc= -5.64! C(o=-15!,f=-21!) USER MOD Single : A 11 MET CE :methyl -143:sc= -0.125 (180deg=-0.638) USER MOD Single : A 13 SER OG : rot -24:sc= 0.545 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -2.7! K(o=-2.7!,f=-1.3) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 136:sc= 0.368 USER MOD Single : A 41 TYR OH : rot 15:sc= -0.996 USER MOD Single : A 45 SER OG : rot 180:sc= 0.104 USER MOD Single : A 46 LYS NZ :NH3+ -172:sc= 1.97 (180deg=1.68) USER MOD Single : A 47 CYS SG : rot 180:sc=-0.00168 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot -160:sc= 0.185 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 76:sc= 0.404 USER MOD Single : A 56 THR OG1 : rot 76:sc= -1.25! USER MOD Single : A 58 THR OG1 : rot 88:sc= 0.439 USER MOD Single : A 59 THR OG1 : rot 96:sc= 1.28 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -170:sc= 1.2 (180deg=1.12) USER MOD Single : A 64 TYR OH : rot 177:sc= 1.2 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -1.1 K(o=-1.1,f=-0.24) USER MOD Single : A 70 THR OG1 : rot 62:sc= -0.144! USER MOD Single : A 77 ASN : amide:sc= -2.66! K(o=-2.7!,f=-1.7) USER MOD Single : A 86 ASN : amide:sc= -0.958 X(o=-0.96,f=-1) USER MOD Single : A 91 LYS NZ :NH3+ 172:sc= 0.984 (180deg=0.95) USER MOD Single : A 95 CYS SG : rot 180:sc= -0.562 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0181 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 MET CE :methyl 147:sc= -2.9 (180deg=-5.79!) USER MOD Single : A 111 ASN : amide:sc= -0.731 K(o=-0.73,f=-3.6!) USER MOD Single : A 114 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 116 HIS : no HD1:sc= -6.41! C(o=-6.4!,f=-12!) USER MOD Single : A 119 TYR OH : rot 150:sc= -7! USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 MET CE :methyl -108:sc= -7.25! (180deg=-16.7!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0233) USER MOD Single : A 125 THR OG1 : rot 54:sc= 1.28 USER MOD Single : A 126 LYS NZ :NH3+ -162:sc= -0.143 (180deg=-0.712) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0794) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 ASN : amide:sc= -1.26 K(o=-1.3,f=-9.4!) USER MOD Single : A 140 THR OG1 : rot 79:sc= -5.67! USER MOD Single : A 141 SER OG : rot -92:sc= 1.97 USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 161 LYS NZ :NH3+ 162:sc= 1.18 (180deg=0.823) USER MOD Single : A 166 LYS NZ :NH3+ -151:sc= 0.241 (180deg=0.0707) USER MOD Single : A 173 SER OG : rot -54:sc= 0.208 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 -10.418 17.654 -5.179 1.00 5.22 N ATOM 2 CA GLY A 10 -10.659 18.470 -3.965 1.00 4.42 C ATOM 3 C GLY A 10 -9.373 18.786 -3.232 1.00 3.29 C ATOM 4 O GLY A 10 -8.319 18.945 -3.849 1.00 3.60 O ATOM 0 HA2 GLY A 10 -11.155 19.399 -4.245 1.00 4.42 H new ATOM 0 HA3 GLY A 10 -11.336 17.936 -3.297 1.00 4.42 H new ATOM 10 N MET A 11 -9.451 18.871 -1.911 1.00 2.49 N ATOM 11 CA MET A 11 -8.274 19.128 -1.091 1.00 1.84 C ATOM 12 C MET A 11 -7.836 17.844 -0.410 1.00 1.40 C ATOM 13 O MET A 11 -6.858 17.815 0.341 1.00 2.20 O ATOM 14 CB MET A 11 -8.563 20.206 -0.042 1.00 2.43 C ATOM 15 CG MET A 11 -8.842 21.578 -0.632 1.00 3.11 C ATOM 16 SD MET A 11 -7.472 22.200 -1.625 1.00 4.02 S ATOM 17 CE MET A 11 -6.161 22.255 -0.401 1.00 4.85 C ATOM 0 H MET A 11 -10.318 18.766 -1.383 1.00 2.49 H new ATOM 0 HA MET A 11 -7.473 19.488 -1.737 1.00 1.84 H new ATOM 0 HB2 MET A 11 -9.420 19.897 0.556 1.00 2.43 H new ATOM 0 HB3 MET A 11 -7.712 20.278 0.635 1.00 2.43 H new ATOM 0 HG2 MET A 11 -9.739 21.528 -1.249 1.00 3.11 H new ATOM 0 HG3 MET A 11 -9.049 22.281 0.175 1.00 3.11 H new ATOM 0 HE1 MET A 11 -5.535 23.130 -0.577 1.00 4.85 H new ATOM 0 HE2 MET A 11 -6.597 22.316 0.596 1.00 4.85 H new ATOM 0 HE3 MET A 11 -5.554 21.353 -0.477 1.00 4.85 H new ATOM 27 N GLY A 12 -8.576 16.784 -0.684 1.00 0.92 N ATOM 28 CA GLY A 12 -8.291 15.499 -0.098 1.00 0.85 C ATOM 29 C GLY A 12 -9.533 14.875 0.494 1.00 0.79 C ATOM 30 O GLY A 12 -9.790 15.002 1.692 1.00 1.55 O ATOM 0 H GLY A 12 -9.380 16.795 -1.312 1.00 0.92 H new ATOM 0 HA2 GLY A 12 -7.875 14.836 -0.856 1.00 0.85 H new ATOM 0 HA3 GLY A 12 -7.533 15.611 0.678 1.00 0.85 H new ATOM 34 N SER A 13 -10.316 14.222 -0.347 1.00 0.52 N ATOM 35 CA SER A 13 -11.533 13.565 0.104 1.00 0.53 C ATOM 36 C SER A 13 -11.462 12.071 -0.183 1.00 0.41 C ATOM 37 O SER A 13 -12.399 11.322 0.110 1.00 0.53 O ATOM 38 CB SER A 13 -12.753 14.186 -0.581 1.00 0.79 C ATOM 39 OG SER A 13 -13.957 13.578 -0.143 1.00 1.58 O ATOM 0 H SER A 13 -10.132 14.132 -1.346 1.00 0.52 H new ATOM 0 HA SER A 13 -11.631 13.706 1.180 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.786 15.255 -0.370 1.00 0.79 H new ATOM 0 HB3 SER A 13 -12.660 14.077 -1.662 1.00 0.79 H new ATOM 0 HG SER A 13 -13.766 12.677 0.191 1.00 1.58 H new ATOM 45 N SER A 14 -10.335 11.648 -0.739 1.00 0.32 N ATOM 46 CA SER A 14 -10.107 10.297 -1.132 1.00 0.22 C ATOM 47 C SER A 14 -8.746 10.274 -1.736 1.00 0.21 C ATOM 48 O SER A 14 -8.219 11.302 -2.164 1.00 0.35 O ATOM 49 CB SER A 14 -11.131 9.815 -2.153 1.00 0.25 C ATOM 50 OG SER A 14 -11.011 10.531 -3.374 1.00 1.17 O ATOM 0 H SER A 14 -9.544 12.264 -0.927 1.00 0.32 H new ATOM 0 HA SER A 14 -10.195 9.634 -0.271 1.00 0.22 H new ATOM 0 HB2 SER A 14 -10.992 8.750 -2.337 1.00 0.25 H new ATOM 0 HB3 SER A 14 -12.137 9.940 -1.751 1.00 0.25 H new ATOM 0 HG SER A 14 -11.677 10.202 -4.013 1.00 1.17 H new ATOM 56 N ILE A 15 -8.177 9.119 -1.749 1.00 0.18 N ATOM 57 CA ILE A 15 -6.867 8.932 -2.279 1.00 0.18 C ATOM 58 C ILE A 15 -6.859 9.149 -3.791 1.00 0.17 C ATOM 59 O ILE A 15 -5.818 9.397 -4.385 1.00 0.19 O ATOM 60 CB ILE A 15 -6.402 7.526 -1.938 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.378 6.505 -2.515 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.303 7.375 -0.429 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.737 5.188 -2.882 1.00 0.38 C ATOM 0 H ILE A 15 -8.610 8.268 -1.389 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.187 9.661 -1.839 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.418 7.351 -2.374 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.170 6.323 -1.789 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -7.850 6.928 -3.402 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -5.969 6.366 -0.185 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.588 8.098 -0.037 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.281 7.552 0.019 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.494 4.515 -3.285 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -5.964 5.356 -3.632 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.290 4.741 -1.994 1.00 0.38 H new ATOM 75 N PHE A 16 -8.044 9.102 -4.396 1.00 0.18 N ATOM 76 CA PHE A 16 -8.180 9.227 -5.842 1.00 0.19 C ATOM 77 C PHE A 16 -7.983 10.657 -6.299 1.00 0.21 C ATOM 78 O PHE A 16 -7.992 10.942 -7.497 1.00 0.30 O ATOM 79 CB PHE A 16 -9.535 8.746 -6.295 1.00 0.20 C ATOM 80 CG PHE A 16 -9.791 7.319 -5.980 1.00 0.19 C ATOM 81 CD1 PHE A 16 -8.953 6.346 -6.471 1.00 0.22 C ATOM 82 CD2 PHE A 16 -10.879 6.945 -5.232 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.201 5.019 -6.228 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.124 5.615 -4.979 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.283 4.652 -5.483 1.00 0.19 C ATOM 0 H PHE A 16 -8.928 8.977 -3.902 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.404 8.607 -6.290 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.305 9.358 -5.825 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.623 8.894 -7.371 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.090 6.630 -7.055 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.546 7.698 -4.840 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.539 4.264 -6.627 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -11.978 5.327 -4.384 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.478 3.608 -5.290 1.00 0.19 H new ATOM 95 N ASP A 17 -7.798 11.551 -5.342 1.00 0.21 N ATOM 96 CA ASP A 17 -7.399 12.910 -5.645 1.00 0.26 C ATOM 97 C ASP A 17 -5.995 12.871 -6.202 1.00 0.25 C ATOM 98 O ASP A 17 -5.494 13.846 -6.765 1.00 0.32 O ATOM 99 CB ASP A 17 -7.418 13.794 -4.394 1.00 0.32 C ATOM 100 CG ASP A 17 -8.776 14.410 -4.103 1.00 1.13 C ATOM 101 OD1 ASP A 17 -9.160 15.367 -4.808 1.00 1.30 O ATOM 102 OD2 ASP A 17 -9.456 13.961 -3.152 1.00 2.11 O ATOM 0 H ASP A 17 -7.919 11.357 -4.348 1.00 0.21 H new ATOM 0 HA ASP A 17 -8.101 13.333 -6.364 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -7.107 13.200 -3.535 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.685 14.592 -4.512 1.00 0.32 H new ATOM 107 N PHE A 18 -5.368 11.715 -6.047 1.00 0.22 N ATOM 108 CA PHE A 18 -4.005 11.535 -6.433 1.00 0.23 C ATOM 109 C PHE A 18 -3.874 10.325 -7.291 1.00 0.26 C ATOM 110 O PHE A 18 -4.042 9.195 -6.834 1.00 0.29 O ATOM 111 CB PHE A 18 -3.125 11.394 -5.218 1.00 0.21 C ATOM 112 CG PHE A 18 -3.246 12.568 -4.315 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.813 13.804 -4.730 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.765 12.427 -3.045 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.903 14.890 -3.902 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.854 13.511 -2.203 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.518 14.749 -2.641 1.00 0.31 C ATOM 0 H PHE A 18 -5.803 10.883 -5.648 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.687 12.413 -6.996 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.395 10.488 -4.676 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -2.087 11.281 -5.531 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.397 13.920 -5.720 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -4.104 11.458 -2.709 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.507 15.846 -4.211 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -4.194 13.375 -1.187 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.719 15.617 -2.031 1.00 0.31 H new ATOM 127 N GLU A 19 -3.607 10.583 -8.534 1.00 0.35 N ATOM 128 CA GLU A 19 -3.324 9.528 -9.477 1.00 0.43 C ATOM 129 C GLU A 19 -2.165 8.686 -8.964 1.00 0.34 C ATOM 130 O GLU A 19 -1.335 9.142 -8.167 1.00 0.37 O ATOM 131 CB GLU A 19 -2.977 10.103 -10.849 1.00 0.63 C ATOM 132 CG GLU A 19 -3.334 9.172 -11.998 1.00 1.08 C ATOM 133 CD GLU A 19 -4.806 8.801 -12.007 1.00 2.04 C ATOM 134 OE1 GLU A 19 -5.618 9.594 -12.533 1.00 2.30 O ATOM 135 OE2 GLU A 19 -5.157 7.722 -11.483 1.00 2.86 O ATOM 0 H GLU A 19 -3.577 11.523 -8.929 1.00 0.35 H new ATOM 0 HA GLU A 19 -4.213 8.906 -9.581 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -3.500 11.050 -10.982 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -1.910 10.321 -10.885 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -3.077 9.651 -12.943 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -2.734 8.265 -11.927 1.00 1.08 H new ATOM 142 N VAL A 20 -2.097 7.477 -9.449 1.00 0.29 N ATOM 143 CA VAL A 20 -1.044 6.564 -9.081 1.00 0.26 C ATOM 144 C VAL A 20 -0.150 6.391 -10.273 1.00 0.25 C ATOM 145 O VAL A 20 -0.528 6.739 -11.379 1.00 0.28 O ATOM 146 CB VAL A 20 -1.625 5.199 -8.640 1.00 0.31 C ATOM 147 CG1 VAL A 20 -0.572 4.114 -8.557 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.307 5.355 -7.307 1.00 0.49 C ATOM 0 H VAL A 20 -2.771 7.094 -10.112 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.482 6.965 -8.238 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.341 4.887 -9.400 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.037 3.179 -8.243 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.110 3.979 -9.535 1.00 0.67 H new ATOM 0 HG13 VAL A 20 0.190 4.401 -7.833 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -2.717 4.395 -6.994 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.585 5.700 -6.567 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.113 6.083 -7.394 1.00 0.49 H new ATOM 158 N LEU A 21 1.050 5.922 -10.051 1.00 0.28 N ATOM 159 CA LEU A 21 1.977 5.757 -11.128 1.00 0.35 C ATOM 160 C LEU A 21 2.495 4.341 -11.147 1.00 0.38 C ATOM 161 O LEU A 21 3.054 3.875 -10.156 1.00 0.58 O ATOM 162 CB LEU A 21 3.110 6.765 -10.980 1.00 0.45 C ATOM 163 CG LEU A 21 2.638 8.219 -10.876 1.00 0.46 C ATOM 164 CD1 LEU A 21 3.791 9.142 -10.546 1.00 0.69 C ATOM 165 CD2 LEU A 21 1.972 8.643 -12.169 1.00 0.68 C ATOM 0 H LEU A 21 1.403 5.649 -9.134 1.00 0.28 H new ATOM 0 HA LEU A 21 1.478 5.941 -12.079 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.690 6.517 -10.091 1.00 0.45 H new ATOM 0 HB3 LEU A 21 3.780 6.671 -11.834 1.00 0.45 H new ATOM 0 HG LEU A 21 1.912 8.287 -10.066 1.00 0.46 H new ATOM 0 HD11 LEU A 21 3.428 10.168 -10.478 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.230 8.849 -9.593 1.00 0.69 H new ATOM 0 HD13 LEU A 21 4.546 9.075 -11.329 1.00 0.69 H new ATOM 0 HD21 LEU A 21 1.640 9.678 -12.085 1.00 0.68 H new ATOM 0 HD22 LEU A 21 2.683 8.556 -12.990 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.113 8.001 -12.363 1.00 0.68 H new ATOM 177 N ASP A 22 2.296 3.670 -12.284 1.00 0.33 N ATOM 178 CA ASP A 22 2.719 2.284 -12.465 1.00 0.37 C ATOM 179 C ASP A 22 4.218 2.184 -12.270 1.00 0.35 C ATOM 180 O ASP A 22 4.865 3.181 -11.966 1.00 0.40 O ATOM 181 CB ASP A 22 2.324 1.773 -13.860 1.00 0.50 C ATOM 182 CG ASP A 22 3.359 2.071 -14.935 1.00 1.16 C ATOM 183 OD1 ASP A 22 3.837 3.219 -15.025 1.00 1.48 O ATOM 184 OD2 ASP A 22 3.705 1.136 -15.693 1.00 1.87 O ATOM 0 H ASP A 22 1.838 4.073 -13.102 1.00 0.33 H new ATOM 0 HA ASP A 22 2.218 1.661 -11.724 1.00 0.37 H new ATOM 0 HB2 ASP A 22 2.163 0.696 -13.811 1.00 0.50 H new ATOM 0 HB3 ASP A 22 1.374 2.224 -14.147 1.00 0.50 H new ATOM 189 N ALA A 23 4.784 1.013 -12.480 1.00 0.39 N ATOM 190 CA ALA A 23 6.177 0.783 -12.130 1.00 0.42 C ATOM 191 C ALA A 23 7.153 1.681 -12.908 1.00 0.47 C ATOM 192 O ALA A 23 8.360 1.636 -12.661 1.00 0.59 O ATOM 193 CB ALA A 23 6.533 -0.684 -12.316 1.00 0.52 C ATOM 0 H ALA A 23 4.308 0.209 -12.888 1.00 0.39 H new ATOM 0 HA ALA A 23 6.284 1.052 -11.079 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.578 -0.841 -12.050 1.00 0.52 H new ATOM 0 HB2 ALA A 23 5.899 -1.296 -11.674 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.377 -0.967 -13.357 1.00 0.52 H new ATOM 199 N ASP A 24 6.652 2.485 -13.843 1.00 0.46 N ATOM 200 CA ASP A 24 7.510 3.431 -14.541 1.00 0.54 C ATOM 201 C ASP A 24 7.068 4.875 -14.307 1.00 0.51 C ATOM 202 O ASP A 24 7.514 5.784 -15.003 1.00 0.62 O ATOM 203 CB ASP A 24 7.555 3.119 -16.036 1.00 0.69 C ATOM 204 CG ASP A 24 8.751 3.758 -16.724 1.00 1.43 C ATOM 205 OD1 ASP A 24 9.899 3.530 -16.285 1.00 1.51 O ATOM 206 OD2 ASP A 24 8.545 4.490 -17.719 1.00 2.34 O ATOM 0 H ASP A 24 5.673 2.499 -14.129 1.00 0.46 H new ATOM 0 HA ASP A 24 8.515 3.324 -14.132 1.00 0.54 H new ATOM 0 HB2 ASP A 24 7.591 2.039 -16.178 1.00 0.69 H new ATOM 0 HB3 ASP A 24 6.637 3.472 -16.506 1.00 0.69 H new ATOM 211 N HIS A 25 6.177 5.080 -13.334 1.00 0.43 N ATOM 212 CA HIS A 25 5.762 6.422 -12.935 1.00 0.44 C ATOM 213 C HIS A 25 4.872 7.036 -14.001 1.00 0.47 C ATOM 214 O HIS A 25 4.777 8.255 -14.140 1.00 0.54 O ATOM 215 CB HIS A 25 6.967 7.327 -12.599 1.00 0.54 C ATOM 216 CG HIS A 25 7.375 7.241 -11.154 1.00 0.64 C ATOM 217 ND1 HIS A 25 8.676 7.338 -10.706 1.00 0.73 N ATOM 218 CD2 HIS A 25 6.617 7.072 -10.051 1.00 1.47 C ATOM 219 CE1 HIS A 25 8.691 7.231 -9.385 1.00 0.59 C ATOM 220 NE2 HIS A 25 7.454 7.078 -8.962 1.00 1.26 N ATOM 0 H HIS A 25 5.729 4.329 -12.808 1.00 0.43 H new ATOM 0 HA HIS A 25 5.182 6.335 -12.016 1.00 0.44 H new ATOM 0 HB2 HIS A 25 7.812 7.047 -13.228 1.00 0.54 H new ATOM 0 HB3 HIS A 25 6.718 8.360 -12.841 1.00 0.54 H new ATOM 0 HD2 HIS A 25 5.544 6.953 -10.028 1.00 1.47 H new ATOM 0 HE1 HIS A 25 9.571 7.264 -8.760 1.00 0.59 H new ATOM 0 HE2 HIS A 25 7.165 6.980 -7.989 1.00 1.26 H new ATOM 229 N LYS A 26 4.216 6.158 -14.745 1.00 0.48 N ATOM 230 CA LYS A 26 3.193 6.546 -15.694 1.00 0.53 C ATOM 231 C LYS A 26 1.847 6.251 -15.072 1.00 0.41 C ATOM 232 O LYS A 26 1.653 5.182 -14.494 1.00 0.38 O ATOM 233 CB LYS A 26 3.376 5.779 -16.998 1.00 0.67 C ATOM 234 CG LYS A 26 4.762 5.956 -17.579 1.00 1.00 C ATOM 235 CD LYS A 26 5.034 7.415 -17.896 1.00 2.12 C ATOM 236 CE LYS A 26 6.521 7.711 -17.910 1.00 3.15 C ATOM 237 NZ LYS A 26 6.794 9.159 -18.098 1.00 4.25 N ATOM 0 H LYS A 26 4.382 5.152 -14.704 1.00 0.48 H new ATOM 0 HA LYS A 26 3.263 7.609 -15.926 1.00 0.53 H new ATOM 0 HB2 LYS A 26 3.191 4.719 -16.823 1.00 0.67 H new ATOM 0 HB3 LYS A 26 2.635 6.117 -17.723 1.00 0.67 H new ATOM 0 HG2 LYS A 26 5.506 5.588 -16.873 1.00 1.00 H new ATOM 0 HG3 LYS A 26 4.860 5.358 -18.485 1.00 1.00 H new ATOM 0 HD2 LYS A 26 4.603 7.665 -18.865 1.00 2.12 H new ATOM 0 HD3 LYS A 26 4.543 8.047 -17.156 1.00 2.12 H new ATOM 0 HE2 LYS A 26 6.967 7.376 -16.974 1.00 3.15 H new ATOM 0 HE3 LYS A 26 6.997 7.145 -18.711 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 7.821 9.321 -18.102 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 6.390 9.474 -19.003 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 6.362 9.698 -17.320 1.00 4.25 H new ATOM 251 N PRO A 27 0.913 7.203 -15.143 1.00 0.41 N ATOM 252 CA PRO A 27 -0.306 7.157 -14.338 1.00 0.37 C ATOM 253 C PRO A 27 -1.067 5.838 -14.430 1.00 0.32 C ATOM 254 O PRO A 27 -1.626 5.481 -15.468 1.00 0.36 O ATOM 255 CB PRO A 27 -1.139 8.303 -14.913 1.00 0.46 C ATOM 256 CG PRO A 27 -0.124 9.262 -15.428 1.00 0.54 C ATOM 257 CD PRO A 27 0.978 8.411 -15.986 1.00 0.50 C ATOM 0 HA PRO A 27 -0.080 7.247 -13.275 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.800 7.957 -15.707 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -1.769 8.760 -14.150 1.00 0.46 H new ATOM 0 HG2 PRO A 27 -0.548 9.909 -16.196 1.00 0.54 H new ATOM 0 HG3 PRO A 27 0.244 9.910 -14.633 1.00 0.54 H new ATOM 0 HD2 PRO A 27 0.817 8.179 -17.039 1.00 0.50 H new ATOM 0 HD3 PRO A 27 1.947 8.904 -15.913 1.00 0.50 H new ATOM 265 N TYR A 28 -1.072 5.145 -13.303 1.00 0.28 N ATOM 266 CA TYR A 28 -1.962 4.031 -13.041 1.00 0.26 C ATOM 267 C TYR A 28 -3.290 4.577 -12.550 1.00 0.25 C ATOM 268 O TYR A 28 -3.325 5.364 -11.605 1.00 0.37 O ATOM 269 CB TYR A 28 -1.335 3.124 -11.976 1.00 0.30 C ATOM 270 CG TYR A 28 -2.212 2.005 -11.462 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.649 0.978 -12.289 1.00 0.50 C ATOM 272 CD2 TYR A 28 -2.575 1.966 -10.126 1.00 0.82 C ATOM 273 CE1 TYR A 28 -3.427 -0.051 -11.794 1.00 0.64 C ATOM 274 CE2 TYR A 28 -3.350 0.948 -9.624 1.00 1.10 C ATOM 275 CZ TYR A 28 -3.775 -0.062 -10.459 1.00 0.92 C ATOM 276 OH TYR A 28 -4.544 -1.087 -9.954 1.00 1.20 O ATOM 0 H TYR A 28 -0.441 5.348 -12.528 1.00 0.28 H new ATOM 0 HA TYR A 28 -2.122 3.449 -13.949 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.426 2.687 -12.389 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -1.036 3.743 -11.130 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -2.377 0.984 -13.334 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -2.242 2.752 -9.465 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -3.761 -0.842 -12.449 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -3.625 0.940 -8.580 1.00 1.10 H new ATOM 0 HH TYR A 28 -5.160 -0.732 -9.279 1.00 1.20 H new ATOM 286 N ASN A 29 -4.369 4.181 -13.206 1.00 0.34 N ATOM 287 CA ASN A 29 -5.702 4.665 -12.861 1.00 0.42 C ATOM 288 C ASN A 29 -6.132 4.144 -11.489 1.00 0.34 C ATOM 289 O ASN A 29 -6.860 3.160 -11.366 1.00 0.44 O ATOM 290 CB ASN A 29 -6.724 4.299 -13.962 1.00 0.67 C ATOM 291 CG ASN A 29 -7.003 2.804 -14.121 1.00 0.73 C ATOM 292 OD1 ASN A 29 -8.035 2.413 -14.664 1.00 1.18 O ATOM 293 ND2 ASN A 29 -6.123 1.960 -13.609 1.00 1.51 N ATOM 0 H ASN A 29 -4.350 3.522 -13.985 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.667 5.753 -12.800 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -7.664 4.807 -13.746 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.363 4.688 -14.914 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -6.291 0.955 -13.659 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -5.276 2.314 -13.165 1.00 1.51 H new ATOM 300 N LEU A 30 -5.670 4.821 -10.452 1.00 0.25 N ATOM 301 CA LEU A 30 -6.007 4.453 -9.086 1.00 0.20 C ATOM 302 C LEU A 30 -7.514 4.331 -8.947 1.00 0.19 C ATOM 303 O LEU A 30 -8.026 3.409 -8.307 1.00 0.19 O ATOM 304 CB LEU A 30 -5.485 5.512 -8.111 1.00 0.22 C ATOM 305 CG LEU A 30 -5.932 5.350 -6.669 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.318 4.108 -6.055 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.562 6.585 -5.879 1.00 0.28 C ATOM 0 H LEU A 30 -5.057 5.633 -10.530 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.542 3.495 -8.852 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.395 5.501 -8.139 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -5.803 6.493 -8.463 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.015 5.231 -6.644 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.651 4.010 -5.022 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.630 3.230 -6.621 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.231 4.189 -6.080 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.884 6.465 -4.845 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.482 6.726 -5.908 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -6.053 7.456 -6.314 1.00 0.28 H new ATOM 319 N VAL A 31 -8.208 5.229 -9.633 1.00 0.20 N ATOM 320 CA VAL A 31 -9.656 5.368 -9.535 1.00 0.19 C ATOM 321 C VAL A 31 -10.410 4.173 -10.111 1.00 0.20 C ATOM 322 O VAL A 31 -11.637 4.162 -10.109 1.00 0.23 O ATOM 323 CB VAL A 31 -10.148 6.650 -10.233 1.00 0.22 C ATOM 324 CG1 VAL A 31 -10.306 7.791 -9.255 1.00 1.02 C ATOM 325 CG2 VAL A 31 -9.189 7.057 -11.326 1.00 0.87 C ATOM 0 H VAL A 31 -7.777 5.889 -10.281 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.870 5.423 -8.468 1.00 0.19 H new ATOM 0 HB VAL A 31 -11.124 6.429 -10.665 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -10.654 8.678 -9.784 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -11.032 7.516 -8.490 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -9.346 8.003 -8.785 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.552 7.964 -11.809 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.205 7.243 -10.896 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -9.117 6.257 -12.063 1.00 0.87 H new ATOM 335 N GLN A 32 -9.701 3.171 -10.618 1.00 0.21 N ATOM 336 CA GLN A 32 -10.373 1.957 -11.052 1.00 0.23 C ATOM 337 C GLN A 32 -10.830 1.180 -9.827 1.00 0.22 C ATOM 338 O GLN A 32 -11.710 0.327 -9.900 1.00 0.28 O ATOM 339 CB GLN A 32 -9.475 1.080 -11.929 1.00 0.26 C ATOM 340 CG GLN A 32 -8.319 0.439 -11.183 1.00 0.29 C ATOM 341 CD GLN A 32 -7.606 -0.620 -12.001 1.00 0.35 C ATOM 342 OE1 GLN A 32 -7.053 -1.572 -11.451 1.00 1.02 O ATOM 343 NE2 GLN A 32 -7.614 -0.468 -13.316 1.00 0.75 N ATOM 0 H GLN A 32 -8.688 3.174 -10.736 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.231 2.242 -11.661 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.081 0.295 -12.382 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.077 1.685 -12.743 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.605 1.211 -10.896 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -8.691 -0.010 -10.262 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -8.084 0.335 -13.734 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -7.151 -1.154 -13.912 1.00 0.75 H new ATOM 352 N HIS A 33 -10.226 1.501 -8.688 1.00 0.17 N ATOM 353 CA HIS A 33 -10.624 0.904 -7.414 1.00 0.16 C ATOM 354 C HIS A 33 -11.658 1.777 -6.742 1.00 0.16 C ATOM 355 O HIS A 33 -11.750 1.840 -5.522 1.00 0.17 O ATOM 356 CB HIS A 33 -9.399 0.691 -6.519 1.00 0.16 C ATOM 357 CG HIS A 33 -8.364 -0.112 -7.193 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.609 -1.372 -7.669 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.100 0.195 -7.539 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.546 -1.817 -8.286 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.607 -0.884 -8.237 1.00 0.28 N ATOM 0 H HIS A 33 -9.459 2.170 -8.619 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.071 -0.073 -7.596 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -8.983 1.658 -6.236 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.703 0.193 -5.598 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.484 -1.884 -7.559 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.574 1.111 -7.313 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.449 -2.784 -8.757 1.00 0.27 H new ATOM 370 N LYS A 34 -12.427 2.463 -7.567 1.00 0.19 N ATOM 371 CA LYS A 34 -13.552 3.223 -7.089 1.00 0.19 C ATOM 372 C LYS A 34 -14.802 2.367 -7.140 1.00 0.21 C ATOM 373 O LYS A 34 -15.290 2.026 -8.218 1.00 0.33 O ATOM 374 CB LYS A 34 -13.764 4.475 -7.925 1.00 0.22 C ATOM 375 CG LYS A 34 -12.864 5.615 -7.527 1.00 0.28 C ATOM 376 CD LYS A 34 -13.549 6.952 -7.710 1.00 0.69 C ATOM 377 CE LYS A 34 -13.837 7.205 -9.167 1.00 1.01 C ATOM 378 NZ LYS A 34 -14.382 8.566 -9.401 1.00 1.56 N ATOM 0 H LYS A 34 -12.286 2.505 -8.576 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.347 3.525 -6.062 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -13.594 4.236 -8.975 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -14.803 4.792 -7.835 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -12.565 5.498 -6.485 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -11.953 5.587 -8.125 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -14.479 6.971 -7.141 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -12.917 7.748 -7.315 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -12.921 7.078 -9.744 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -14.548 6.463 -9.530 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -14.565 8.697 -10.416 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -15.270 8.680 -8.871 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -13.693 9.276 -9.080 1.00 1.56 H new ATOM 392 N GLY A 35 -15.305 2.014 -5.981 1.00 0.18 N ATOM 393 CA GLY A 35 -16.456 1.148 -5.903 1.00 0.20 C ATOM 394 C GLY A 35 -16.203 0.009 -4.953 1.00 0.17 C ATOM 395 O GLY A 35 -17.095 -0.417 -4.216 1.00 0.20 O ATOM 0 H GLY A 35 -14.935 2.313 -5.079 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.324 1.718 -5.572 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.690 0.757 -6.893 1.00 0.20 H new ATOM 399 N SER A 36 -14.983 -0.498 -4.973 1.00 0.16 N ATOM 400 CA SER A 36 -14.536 -1.425 -3.973 1.00 0.16 C ATOM 401 C SER A 36 -13.180 -0.990 -3.465 1.00 0.14 C ATOM 402 O SER A 36 -12.314 -0.596 -4.244 1.00 0.16 O ATOM 403 CB SER A 36 -14.449 -2.827 -4.543 1.00 0.20 C ATOM 404 OG SER A 36 -15.657 -3.183 -5.192 1.00 0.29 O ATOM 0 H SER A 36 -14.285 -0.274 -5.682 1.00 0.16 H new ATOM 0 HA SER A 36 -15.252 -1.435 -3.152 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.621 -2.886 -5.249 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.238 -3.537 -3.743 1.00 0.20 H new ATOM 0 HG SER A 36 -15.453 -3.625 -6.043 1.00 0.29 H new ATOM 410 N PRO A 37 -13.010 -1.040 -2.148 1.00 0.12 N ATOM 411 CA PRO A 37 -11.772 -0.692 -1.462 1.00 0.12 C ATOM 412 C PRO A 37 -10.544 -1.319 -2.080 1.00 0.12 C ATOM 413 O PRO A 37 -10.618 -2.337 -2.761 1.00 0.15 O ATOM 414 CB PRO A 37 -11.989 -1.254 -0.044 1.00 0.15 C ATOM 415 CG PRO A 37 -13.193 -2.104 -0.149 1.00 0.18 C ATOM 416 CD PRO A 37 -14.025 -1.447 -1.190 1.00 0.15 C ATOM 0 HA PRO A 37 -11.585 0.381 -1.505 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.126 -1.831 0.288 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.134 -0.452 0.680 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -12.935 -3.124 -0.433 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -13.721 -2.162 0.803 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -14.753 -2.131 -1.627 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.583 -0.598 -0.795 1.00 0.15 H new ATOM 424 N LEU A 38 -9.424 -0.689 -1.825 1.00 0.14 N ATOM 425 CA LEU A 38 -8.134 -1.201 -2.205 1.00 0.13 C ATOM 426 C LEU A 38 -7.223 -1.054 -0.994 1.00 0.13 C ATOM 427 O LEU A 38 -7.448 -0.208 -0.152 1.00 0.20 O ATOM 428 CB LEU A 38 -7.546 -0.451 -3.402 1.00 0.16 C ATOM 429 CG LEU A 38 -7.425 1.062 -3.280 1.00 0.20 C ATOM 430 CD1 LEU A 38 -6.325 1.565 -4.182 1.00 0.31 C ATOM 431 CD2 LEU A 38 -8.713 1.749 -3.670 1.00 0.26 C ATOM 0 H LEU A 38 -9.384 0.207 -1.340 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.229 -2.243 -2.511 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -6.553 -0.855 -3.600 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.160 -0.672 -4.275 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.199 1.291 -2.238 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -6.245 2.648 -4.089 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -5.380 1.105 -3.894 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -6.555 1.306 -5.215 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -8.594 2.828 -3.572 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -8.958 1.503 -4.703 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -9.518 1.412 -3.016 1.00 0.26 H new ATOM 443 N LEU A 39 -6.241 -1.895 -0.874 1.00 0.18 N ATOM 444 CA LEU A 39 -5.260 -1.765 0.172 1.00 0.19 C ATOM 445 C LEU A 39 -3.960 -1.376 -0.462 1.00 0.18 C ATOM 446 O LEU A 39 -3.422 -2.110 -1.289 1.00 0.21 O ATOM 447 CB LEU A 39 -5.058 -3.072 0.920 1.00 0.23 C ATOM 448 CG LEU A 39 -5.839 -3.282 2.224 1.00 0.35 C ATOM 449 CD1 LEU A 39 -5.171 -2.573 3.383 1.00 1.10 C ATOM 450 CD2 LEU A 39 -7.278 -2.824 2.088 1.00 1.19 C ATOM 0 H LEU A 39 -6.093 -2.691 -1.495 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.606 -1.016 0.884 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.313 -3.887 0.243 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -3.996 -3.166 1.147 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.840 -4.352 2.429 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -5.747 -2.740 4.293 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -4.162 -2.964 3.516 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -5.122 -1.504 3.176 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -7.802 -2.987 3.030 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -7.300 -1.763 1.839 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -7.767 -3.392 1.297 1.00 1.19 H new ATOM 462 N ILE A 40 -3.470 -0.222 -0.123 1.00 0.19 N ATOM 463 CA ILE A 40 -2.209 0.207 -0.671 1.00 0.20 C ATOM 464 C ILE A 40 -1.097 -0.050 0.317 1.00 0.18 C ATOM 465 O ILE A 40 -1.119 0.450 1.442 1.00 0.20 O ATOM 466 CB ILE A 40 -2.272 1.676 -1.075 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.481 1.854 -1.999 1.00 0.30 C ATOM 468 CG2 ILE A 40 -0.967 2.133 -1.733 1.00 0.37 C ATOM 469 CD1 ILE A 40 -3.492 3.174 -2.702 1.00 0.35 C ATOM 0 H ILE A 40 -3.912 0.434 0.520 1.00 0.19 H new ATOM 0 HA ILE A 40 -1.999 -0.372 -1.570 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.392 2.306 -0.194 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -3.486 1.054 -2.740 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.396 1.752 -1.415 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.047 3.185 -2.008 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.142 2.003 -1.033 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -0.782 1.537 -2.627 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -4.373 3.239 -3.341 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.518 3.978 -1.966 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -2.594 3.269 -3.312 1.00 0.35 H new ATOM 481 N TYR A 41 -0.150 -0.875 -0.095 1.00 0.18 N ATOM 482 CA TYR A 41 0.926 -1.270 0.774 1.00 0.19 C ATOM 483 C TYR A 41 2.207 -0.545 0.377 1.00 0.20 C ATOM 484 O TYR A 41 2.605 -0.558 -0.792 1.00 0.27 O ATOM 485 CB TYR A 41 1.190 -2.798 0.722 1.00 0.20 C ATOM 486 CG TYR A 41 0.036 -3.719 1.092 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.262 -3.462 0.692 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.273 -4.892 1.811 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.284 -4.337 0.991 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.755 -5.767 2.121 1.00 0.35 C ATOM 491 CZ TYR A 41 -2.029 -5.481 1.704 1.00 0.33 C ATOM 492 OH TYR A 41 -3.056 -6.352 1.978 1.00 0.42 O ATOM 0 H TYR A 41 -0.111 -1.281 -1.030 1.00 0.18 H new ATOM 0 HA TYR A 41 0.630 -1.005 1.789 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.512 -3.050 -0.288 1.00 0.20 H new ATOM 0 HB3 TYR A 41 2.025 -3.019 1.387 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.479 -2.561 0.137 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.278 -5.122 2.132 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.290 -4.121 0.663 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.555 -6.666 2.686 1.00 0.35 H new ATOM 0 HH TYR A 41 -3.825 -6.141 1.408 1.00 0.42 H new ATOM 502 N ASN A 42 2.828 0.100 1.343 1.00 0.28 N ATOM 503 CA ASN A 42 4.194 0.574 1.193 1.00 0.34 C ATOM 504 C ASN A 42 5.087 -0.636 1.392 1.00 0.37 C ATOM 505 O ASN A 42 5.210 -1.156 2.489 1.00 0.54 O ATOM 506 CB ASN A 42 4.469 1.684 2.226 1.00 0.46 C ATOM 507 CG ASN A 42 5.688 1.472 3.105 1.00 1.50 C ATOM 508 OD1 ASN A 42 6.785 1.914 2.787 1.00 2.27 O ATOM 509 ND2 ASN A 42 5.494 0.819 4.234 1.00 2.35 N ATOM 0 H ASN A 42 2.407 0.311 2.248 1.00 0.28 H new ATOM 0 HA ASN A 42 4.381 1.011 0.212 1.00 0.34 H new ATOM 0 HB2 ASN A 42 4.585 2.629 1.695 1.00 0.46 H new ATOM 0 HB3 ASN A 42 3.593 1.784 2.867 1.00 0.46 H new ATOM 0 HD21 ASN A 42 6.272 0.668 4.876 1.00 2.35 H new ATOM 0 HD22 ASN A 42 4.566 0.465 4.465 1.00 2.35 H new ATOM 516 N VAL A 43 5.636 -1.159 0.326 1.00 0.36 N ATOM 517 CA VAL A 43 6.337 -2.413 0.445 1.00 0.38 C ATOM 518 C VAL A 43 7.826 -2.221 0.329 1.00 0.42 C ATOM 519 O VAL A 43 8.317 -1.506 -0.551 1.00 0.50 O ATOM 520 CB VAL A 43 5.849 -3.467 -0.575 1.00 0.39 C ATOM 521 CG1 VAL A 43 4.345 -3.542 -0.563 1.00 1.03 C ATOM 522 CG2 VAL A 43 6.333 -3.182 -1.976 1.00 0.98 C ATOM 0 H VAL A 43 5.614 -0.752 -0.609 1.00 0.36 H new ATOM 0 HA VAL A 43 6.110 -2.796 1.440 1.00 0.38 H new ATOM 0 HB VAL A 43 6.272 -4.425 -0.271 1.00 0.39 H new ATOM 0 HG11 VAL A 43 4.012 -4.287 -1.285 1.00 1.03 H new ATOM 0 HG12 VAL A 43 4.003 -3.823 0.433 1.00 1.03 H new ATOM 0 HG13 VAL A 43 3.930 -2.570 -0.828 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.962 -3.952 -2.653 1.00 0.98 H new ATOM 0 HG22 VAL A 43 5.964 -2.208 -2.297 1.00 0.98 H new ATOM 0 HG23 VAL A 43 7.423 -3.180 -1.991 1.00 0.98 H new ATOM 532 N ALA A 44 8.537 -2.836 1.252 1.00 0.50 N ATOM 533 CA ALA A 44 9.967 -2.895 1.170 1.00 0.59 C ATOM 534 C ALA A 44 10.343 -3.945 0.146 1.00 0.58 C ATOM 535 O ALA A 44 10.208 -5.144 0.398 1.00 0.88 O ATOM 536 CB ALA A 44 10.578 -3.203 2.526 1.00 0.83 C ATOM 0 H ALA A 44 8.138 -3.301 2.067 1.00 0.50 H new ATOM 0 HA ALA A 44 10.360 -1.927 0.860 1.00 0.59 H new ATOM 0 HB1 ALA A 44 11.664 -3.242 2.436 1.00 0.83 H new ATOM 0 HB2 ALA A 44 10.301 -2.423 3.236 1.00 0.83 H new ATOM 0 HB3 ALA A 44 10.209 -4.165 2.881 1.00 0.83 H new ATOM 542 N SER A 45 10.721 -3.464 -1.024 1.00 0.57 N ATOM 543 CA SER A 45 11.217 -4.287 -2.125 1.00 0.63 C ATOM 544 C SER A 45 12.460 -5.092 -1.729 1.00 1.01 C ATOM 545 O SER A 45 13.546 -4.879 -2.260 1.00 1.78 O ATOM 546 CB SER A 45 11.545 -3.378 -3.310 1.00 0.73 C ATOM 547 OG SER A 45 11.636 -2.020 -2.896 1.00 1.62 O ATOM 0 H SER A 45 10.693 -2.469 -1.246 1.00 0.57 H new ATOM 0 HA SER A 45 10.440 -5.003 -2.393 1.00 0.63 H new ATOM 0 HB2 SER A 45 12.487 -3.689 -3.762 1.00 0.73 H new ATOM 0 HB3 SER A 45 10.775 -3.479 -4.075 1.00 0.73 H new ATOM 0 HG SER A 45 11.848 -1.456 -3.669 1.00 1.62 H new ATOM 553 N LYS A 46 12.284 -6.012 -0.799 1.00 1.32 N ATOM 554 CA LYS A 46 13.375 -6.822 -0.292 1.00 1.69 C ATOM 555 C LYS A 46 13.536 -8.084 -1.127 1.00 1.14 C ATOM 556 O LYS A 46 12.739 -8.353 -2.025 1.00 1.47 O ATOM 557 CB LYS A 46 13.109 -7.200 1.166 1.00 2.68 C ATOM 558 CG LYS A 46 12.983 -6.006 2.102 1.00 3.45 C ATOM 559 CD LYS A 46 12.919 -6.446 3.557 1.00 4.39 C ATOM 560 CE LYS A 46 12.839 -5.257 4.503 1.00 5.19 C ATOM 561 NZ LYS A 46 13.086 -5.651 5.918 1.00 5.84 N ATOM 0 H LYS A 46 11.380 -6.219 -0.374 1.00 1.32 H new ATOM 0 HA LYS A 46 14.295 -6.241 -0.354 1.00 1.69 H new ATOM 0 HB2 LYS A 46 12.192 -7.787 1.217 1.00 2.68 H new ATOM 0 HB3 LYS A 46 13.918 -7.841 1.518 1.00 2.68 H new ATOM 0 HG2 LYS A 46 13.833 -5.338 1.959 1.00 3.45 H new ATOM 0 HG3 LYS A 46 12.086 -5.439 1.852 1.00 3.45 H new ATOM 0 HD2 LYS A 46 12.050 -7.088 3.705 1.00 4.39 H new ATOM 0 HD3 LYS A 46 13.800 -7.042 3.796 1.00 4.39 H new ATOM 0 HE2 LYS A 46 13.570 -4.506 4.203 1.00 5.19 H new ATOM 0 HE3 LYS A 46 11.855 -4.795 4.422 1.00 5.19 H new ATOM 0 HZ1 LYS A 46 12.890 -4.843 6.543 1.00 5.84 H new ATOM 0 HZ2 LYS A 46 12.463 -6.444 6.171 1.00 5.84 H new ATOM 0 HZ3 LYS A 46 14.078 -5.942 6.029 1.00 5.84 H new ATOM 575 N CYS A 47 14.568 -8.850 -0.827 1.00 1.21 N ATOM 576 CA CYS A 47 14.833 -10.077 -1.548 1.00 1.53 C ATOM 577 C CYS A 47 14.600 -11.280 -0.638 1.00 1.99 C ATOM 578 O CYS A 47 15.273 -11.434 0.384 1.00 2.46 O ATOM 579 CB CYS A 47 16.273 -10.060 -2.061 1.00 2.04 C ATOM 580 SG CYS A 47 16.634 -11.319 -3.306 1.00 3.55 S ATOM 0 H CYS A 47 15.237 -8.642 -0.086 1.00 1.21 H new ATOM 0 HA CYS A 47 14.154 -10.156 -2.397 1.00 1.53 H new ATOM 0 HB2 CYS A 47 16.484 -9.077 -2.483 1.00 2.04 H new ATOM 0 HB3 CYS A 47 16.949 -10.196 -1.217 1.00 2.04 H new ATOM 0 HG CYS A 47 17.876 -11.219 -3.677 1.00 3.55 H new ATOM 586 N GLY A 48 13.630 -12.116 -1.006 1.00 2.39 N ATOM 587 CA GLY A 48 13.315 -13.302 -0.223 1.00 2.91 C ATOM 588 C GLY A 48 12.564 -12.992 1.063 1.00 2.40 C ATOM 589 O GLY A 48 12.120 -13.902 1.767 1.00 2.46 O ATOM 0 H GLY A 48 13.053 -11.992 -1.838 1.00 2.39 H new ATOM 0 HA2 GLY A 48 12.717 -13.981 -0.830 1.00 2.91 H new ATOM 0 HA3 GLY A 48 14.240 -13.824 0.021 1.00 2.91 H new ATOM 593 N TYR A 49 12.400 -11.710 1.357 1.00 2.15 N ATOM 594 CA TYR A 49 11.804 -11.284 2.617 1.00 1.79 C ATOM 595 C TYR A 49 10.301 -11.062 2.505 1.00 1.42 C ATOM 596 O TYR A 49 9.772 -10.763 1.435 1.00 1.67 O ATOM 597 CB TYR A 49 12.460 -10.002 3.123 1.00 2.10 C ATOM 598 CG TYR A 49 13.774 -10.209 3.843 1.00 2.40 C ATOM 599 CD1 TYR A 49 13.833 -10.918 5.036 1.00 2.66 C ATOM 600 CD2 TYR A 49 14.959 -9.723 3.309 1.00 3.01 C ATOM 601 CE1 TYR A 49 15.036 -11.129 5.679 1.00 3.26 C ATOM 602 CE2 TYR A 49 16.166 -9.936 3.942 1.00 3.74 C ATOM 603 CZ TYR A 49 16.173 -10.540 5.202 1.00 3.76 C ATOM 604 OH TYR A 49 17.405 -10.863 5.751 1.00 4.63 O ATOM 0 H TYR A 49 12.672 -10.945 0.739 1.00 2.15 H new ATOM 0 HA TYR A 49 11.977 -12.094 3.326 1.00 1.79 H new ATOM 0 HB2 TYR A 49 12.626 -9.336 2.276 1.00 2.10 H new ATOM 0 HB3 TYR A 49 11.768 -9.496 3.796 1.00 2.10 H new ATOM 0 HD1 TYR A 49 12.924 -11.310 5.467 1.00 2.66 H new ATOM 0 HD2 TYR A 49 14.936 -9.169 2.382 1.00 3.01 H new ATOM 0 HE1 TYR A 49 15.079 -11.758 6.556 1.00 3.26 H new ATOM 0 HE2 TYR A 49 17.092 -9.640 3.471 1.00 3.74 H new ATOM 0 HH TYR A 49 18.109 -10.356 5.296 1.00 4.63 H new ATOM 614 N THR A 50 9.637 -11.202 3.640 1.00 1.05 N ATOM 615 CA THR A 50 8.215 -10.949 3.773 1.00 0.81 C ATOM 616 C THR A 50 7.866 -10.934 5.266 1.00 0.77 C ATOM 617 O THR A 50 8.454 -11.688 6.043 1.00 1.44 O ATOM 618 CB THR A 50 7.370 -12.017 3.044 1.00 1.09 C ATOM 619 OG1 THR A 50 5.979 -11.862 3.368 1.00 1.93 O ATOM 620 CG2 THR A 50 7.829 -13.421 3.402 1.00 1.87 C ATOM 0 H THR A 50 10.080 -11.500 4.509 1.00 1.05 H new ATOM 0 HA THR A 50 7.984 -9.988 3.313 1.00 0.81 H new ATOM 0 HB THR A 50 7.507 -11.874 1.972 1.00 1.09 H new ATOM 0 HG1 THR A 50 5.503 -12.697 3.176 1.00 1.93 H new ATOM 0 HG21 THR A 50 7.215 -14.150 2.873 1.00 1.87 H new ATOM 0 HG22 THR A 50 8.872 -13.547 3.113 1.00 1.87 H new ATOM 0 HG23 THR A 50 7.729 -13.574 4.477 1.00 1.87 H new ATOM 628 N LYS A 51 6.959 -10.057 5.685 1.00 0.61 N ATOM 629 CA LYS A 51 6.519 -10.033 7.072 1.00 0.56 C ATOM 630 C LYS A 51 5.137 -10.661 7.179 1.00 0.76 C ATOM 631 O LYS A 51 4.515 -10.654 8.234 1.00 1.55 O ATOM 632 CB LYS A 51 6.496 -8.586 7.577 1.00 0.59 C ATOM 633 CG LYS A 51 7.877 -7.983 7.776 1.00 1.22 C ATOM 634 CD LYS A 51 8.528 -8.492 9.054 1.00 1.39 C ATOM 635 CE LYS A 51 7.809 -7.963 10.287 1.00 1.46 C ATOM 636 NZ LYS A 51 8.408 -8.473 11.549 1.00 2.01 N ATOM 0 H LYS A 51 6.518 -9.358 5.087 1.00 0.61 H new ATOM 0 HA LYS A 51 7.211 -10.607 7.689 1.00 0.56 H new ATOM 0 HB2 LYS A 51 5.941 -7.972 6.868 1.00 0.59 H new ATOM 0 HB3 LYS A 51 5.954 -8.550 8.522 1.00 0.59 H new ATOM 0 HG2 LYS A 51 8.509 -8.228 6.922 1.00 1.22 H new ATOM 0 HG3 LYS A 51 7.799 -6.896 7.814 1.00 1.22 H new ATOM 0 HD2 LYS A 51 8.516 -9.582 9.062 1.00 1.39 H new ATOM 0 HD3 LYS A 51 9.574 -8.185 9.080 1.00 1.39 H new ATOM 0 HE2 LYS A 51 7.842 -6.874 10.285 1.00 1.46 H new ATOM 0 HE3 LYS A 51 6.758 -8.250 10.244 1.00 1.46 H new ATOM 0 HZ1 LYS A 51 7.886 -8.087 12.362 1.00 2.01 H new ATOM 0 HZ2 LYS A 51 8.353 -9.511 11.564 1.00 2.01 H new ATOM 0 HZ3 LYS A 51 9.404 -8.178 11.605 1.00 2.01 H new ATOM 650 N GLY A 52 4.683 -11.231 6.071 1.00 0.45 N ATOM 651 CA GLY A 52 3.318 -11.705 5.975 1.00 0.51 C ATOM 652 C GLY A 52 2.532 -10.859 5.000 1.00 0.41 C ATOM 653 O GLY A 52 1.683 -11.359 4.267 1.00 0.41 O ATOM 0 H GLY A 52 5.242 -11.374 5.230 1.00 0.45 H new ATOM 0 HA2 GLY A 52 3.310 -12.746 5.651 1.00 0.51 H new ATOM 0 HA3 GLY A 52 2.846 -11.673 6.957 1.00 0.51 H new ATOM 657 N GLY A 53 2.857 -9.568 4.998 1.00 0.44 N ATOM 658 CA GLY A 53 2.268 -8.605 4.083 1.00 0.50 C ATOM 659 C GLY A 53 2.218 -9.096 2.657 1.00 0.36 C ATOM 660 O GLY A 53 1.237 -8.885 1.971 1.00 0.32 O ATOM 0 H GLY A 53 3.541 -9.163 5.637 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.257 -8.369 4.415 1.00 0.50 H new ATOM 0 HA3 GLY A 53 2.841 -7.679 4.122 1.00 0.50 H new ATOM 664 N TYR A 54 3.279 -9.750 2.210 1.00 0.37 N ATOM 665 CA TYR A 54 3.361 -10.239 0.848 1.00 0.36 C ATOM 666 C TYR A 54 2.312 -11.310 0.589 1.00 0.26 C ATOM 667 O TYR A 54 1.531 -11.216 -0.360 1.00 0.25 O ATOM 668 CB TYR A 54 4.754 -10.799 0.620 1.00 0.45 C ATOM 669 CG TYR A 54 5.083 -11.112 -0.814 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.229 -10.695 -1.809 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.214 -11.842 -1.171 1.00 0.53 C ATOM 672 CE1 TYR A 54 4.477 -10.980 -3.124 1.00 0.46 C ATOM 673 CE2 TYR A 54 6.480 -12.139 -2.496 1.00 0.65 C ATOM 674 CZ TYR A 54 5.779 -11.674 -3.439 1.00 0.56 C ATOM 675 OH TYR A 54 5.855 -11.980 -4.799 1.00 0.70 O ATOM 0 H TYR A 54 4.101 -9.954 2.779 1.00 0.37 H new ATOM 0 HA TYR A 54 3.170 -9.418 0.157 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.484 -10.083 0.997 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.865 -11.709 1.210 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.346 -10.132 -1.547 1.00 0.45 H new ATOM 0 HD2 TYR A 54 6.893 -12.181 -0.403 1.00 0.53 H new ATOM 0 HE1 TYR A 54 3.773 -10.720 -3.901 1.00 0.46 H new ATOM 0 HE2 TYR A 54 7.311 -12.787 -2.731 1.00 0.65 H new ATOM 0 HH TYR A 54 6.060 -11.167 -5.306 1.00 0.70 H new ATOM 685 N GLU A 55 2.288 -12.310 1.453 1.00 0.25 N ATOM 686 CA GLU A 55 1.356 -13.419 1.326 1.00 0.27 C ATOM 687 C GLU A 55 -0.076 -12.914 1.460 1.00 0.22 C ATOM 688 O GLU A 55 -1.009 -13.457 0.859 1.00 0.25 O ATOM 689 CB GLU A 55 1.653 -14.456 2.407 1.00 0.36 C ATOM 690 CG GLU A 55 1.115 -15.836 2.096 1.00 1.14 C ATOM 691 CD GLU A 55 1.487 -16.847 3.158 1.00 1.92 C ATOM 692 OE1 GLU A 55 0.771 -16.941 4.176 1.00 2.61 O ATOM 693 OE2 GLU A 55 2.495 -17.562 2.979 1.00 2.39 O ATOM 0 H GLU A 55 2.910 -12.377 2.259 1.00 0.25 H new ATOM 0 HA GLU A 55 1.472 -13.880 0.345 1.00 0.27 H new ATOM 0 HB2 GLU A 55 2.732 -14.521 2.548 1.00 0.36 H new ATOM 0 HB3 GLU A 55 1.228 -14.115 3.351 1.00 0.36 H new ATOM 0 HG2 GLU A 55 0.030 -15.789 2.006 1.00 1.14 H new ATOM 0 HG3 GLU A 55 1.501 -16.166 1.132 1.00 1.14 H new ATOM 700 N THR A 56 -0.226 -11.838 2.217 1.00 0.25 N ATOM 701 CA THR A 56 -1.512 -11.243 2.461 1.00 0.24 C ATOM 702 C THR A 56 -1.951 -10.493 1.231 1.00 0.21 C ATOM 703 O THR A 56 -2.991 -10.768 0.660 1.00 0.22 O ATOM 704 CB THR A 56 -1.440 -10.275 3.653 1.00 0.26 C ATOM 705 OG1 THR A 56 -1.082 -10.997 4.834 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.765 -9.567 3.856 1.00 0.25 C ATOM 0 H THR A 56 0.548 -11.359 2.676 1.00 0.25 H new ATOM 0 HA THR A 56 -2.229 -12.031 2.694 1.00 0.24 H new ATOM 0 HB THR A 56 -0.682 -9.520 3.444 1.00 0.26 H new ATOM 0 HG1 THR A 56 -0.124 -11.201 4.815 1.00 0.33 H new ATOM 0 HG21 THR A 56 -2.688 -8.888 4.705 1.00 0.25 H new ATOM 0 HG22 THR A 56 -3.016 -9.000 2.959 1.00 0.25 H new ATOM 0 HG23 THR A 56 -3.545 -10.303 4.050 1.00 0.25 H new ATOM 714 N ALA A 57 -1.101 -9.585 0.813 1.00 0.19 N ATOM 715 CA ALA A 57 -1.343 -8.743 -0.328 1.00 0.20 C ATOM 716 C ALA A 57 -1.674 -9.565 -1.563 1.00 0.19 C ATOM 717 O ALA A 57 -2.608 -9.243 -2.301 1.00 0.22 O ATOM 718 CB ALA A 57 -0.112 -7.900 -0.572 1.00 0.22 C ATOM 0 H ALA A 57 -0.205 -9.410 1.268 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.202 -8.104 -0.125 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.278 -7.255 -1.435 1.00 0.22 H new ATOM 0 HB2 ALA A 57 0.089 -7.287 0.306 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.742 -8.550 -0.764 1.00 0.22 H new ATOM 724 N THR A 58 -0.915 -10.634 -1.772 1.00 0.17 N ATOM 725 CA THR A 58 -1.098 -11.476 -2.941 1.00 0.17 C ATOM 726 C THR A 58 -2.498 -12.091 -2.933 1.00 0.17 C ATOM 727 O THR A 58 -3.275 -11.935 -3.881 1.00 0.19 O ATOM 728 CB THR A 58 -0.056 -12.610 -2.986 1.00 0.20 C ATOM 729 OG1 THR A 58 1.267 -12.073 -2.865 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.167 -13.398 -4.282 1.00 0.26 C ATOM 0 H THR A 58 -0.168 -10.936 -1.146 1.00 0.17 H new ATOM 0 HA THR A 58 -0.970 -10.846 -3.822 1.00 0.17 H new ATOM 0 HB THR A 58 -0.253 -13.281 -2.150 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.503 -11.996 -1.917 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.579 -14.193 -4.290 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.163 -13.834 -4.358 1.00 0.26 H new ATOM 0 HG23 THR A 58 0.003 -12.732 -5.128 1.00 0.26 H new ATOM 738 N THR A 59 -2.817 -12.760 -1.829 1.00 0.16 N ATOM 739 CA THR A 59 -4.085 -13.467 -1.683 1.00 0.17 C ATOM 740 C THR A 59 -5.267 -12.495 -1.607 1.00 0.16 C ATOM 741 O THR A 59 -6.341 -12.765 -2.139 1.00 0.19 O ATOM 742 CB THR A 59 -4.063 -14.342 -0.415 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.824 -15.062 -0.348 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.230 -15.322 -0.404 1.00 0.46 C ATOM 0 H THR A 59 -2.207 -12.827 -1.014 1.00 0.16 H new ATOM 0 HA THR A 59 -4.213 -14.096 -2.564 1.00 0.17 H new ATOM 0 HB THR A 59 -4.157 -13.690 0.454 1.00 0.20 H new ATOM 0 HG1 THR A 59 -2.192 -14.574 0.221 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.189 -15.926 0.502 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.169 -14.770 -0.430 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.167 -15.972 -1.277 1.00 0.46 H new ATOM 752 N LEU A 60 -5.040 -11.353 -0.973 1.00 0.13 N ATOM 753 CA LEU A 60 -6.068 -10.351 -0.752 1.00 0.13 C ATOM 754 C LEU A 60 -6.548 -9.803 -2.066 1.00 0.13 C ATOM 755 O LEU A 60 -7.740 -9.798 -2.369 1.00 0.15 O ATOM 756 CB LEU A 60 -5.497 -9.228 0.064 1.00 0.13 C ATOM 757 CG LEU A 60 -5.784 -9.311 1.547 1.00 0.14 C ATOM 758 CD1 LEU A 60 -7.117 -8.660 1.866 1.00 0.43 C ATOM 759 CD2 LEU A 60 -5.789 -10.741 2.031 1.00 0.35 C ATOM 0 H LEU A 60 -4.128 -11.096 -0.595 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.905 -10.811 -0.226 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.417 -9.204 -0.082 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -5.891 -8.285 -0.316 1.00 0.13 H new ATOM 0 HG LEU A 60 -4.987 -8.777 2.065 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -7.308 -8.728 2.937 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -7.090 -7.612 1.568 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -7.911 -9.172 1.322 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -5.998 -10.762 3.100 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -6.557 -11.302 1.499 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -4.815 -11.192 1.843 1.00 0.35 H new ATOM 771 N TYR A 61 -5.579 -9.363 -2.846 1.00 0.14 N ATOM 772 CA TYR A 61 -5.832 -8.822 -4.153 1.00 0.15 C ATOM 773 C TYR A 61 -6.604 -9.811 -4.998 1.00 0.17 C ATOM 774 O TYR A 61 -7.615 -9.480 -5.561 1.00 0.22 O ATOM 775 CB TYR A 61 -4.524 -8.486 -4.841 1.00 0.17 C ATOM 776 CG TYR A 61 -4.756 -7.820 -6.163 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.830 -6.973 -6.329 1.00 0.16 C ATOM 778 CD2 TYR A 61 -3.904 -8.016 -7.225 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.052 -6.335 -7.527 1.00 0.18 C ATOM 780 CE2 TYR A 61 -4.116 -7.386 -8.435 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.194 -6.543 -8.581 1.00 0.23 C ATOM 782 OH TYR A 61 -5.409 -5.900 -9.779 1.00 0.28 O ATOM 0 H TYR A 61 -4.593 -9.374 -2.583 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.425 -7.915 -4.037 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.932 -7.831 -4.201 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.944 -9.397 -4.988 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.508 -6.807 -5.505 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -3.055 -8.674 -7.110 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -6.898 -5.673 -7.639 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.441 -7.553 -9.261 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.711 -6.156 -10.418 1.00 0.28 H new ATOM 792 N ASN A 62 -6.146 -11.033 -5.034 1.00 0.18 N ATOM 793 CA ASN A 62 -6.710 -12.033 -5.912 1.00 0.22 C ATOM 794 C ASN A 62 -8.060 -12.478 -5.412 1.00 0.20 C ATOM 795 O ASN A 62 -8.899 -12.929 -6.191 1.00 0.24 O ATOM 796 CB ASN A 62 -5.766 -13.222 -6.064 1.00 0.27 C ATOM 797 CG ASN A 62 -4.666 -12.931 -7.061 1.00 0.75 C ATOM 798 OD1 ASN A 62 -4.811 -13.195 -8.251 1.00 1.21 O ATOM 799 ND2 ASN A 62 -3.567 -12.372 -6.592 1.00 1.12 N ATOM 0 H ASN A 62 -5.373 -11.367 -4.458 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.842 -11.584 -6.896 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.327 -13.466 -5.097 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.330 -14.097 -6.387 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -2.801 -12.144 -7.225 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -3.484 -12.168 -5.596 1.00 1.12 H new ATOM 806 N LYS A 63 -8.289 -12.334 -4.117 1.00 0.18 N ATOM 807 CA LYS A 63 -9.533 -12.768 -3.557 1.00 0.20 C ATOM 808 C LYS A 63 -10.571 -11.700 -3.800 1.00 0.18 C ATOM 809 O LYS A 63 -11.756 -11.997 -3.959 1.00 0.22 O ATOM 810 CB LYS A 63 -9.385 -13.043 -2.057 1.00 0.26 C ATOM 811 CG LYS A 63 -10.641 -13.596 -1.402 1.00 0.29 C ATOM 812 CD LYS A 63 -10.407 -13.928 0.061 1.00 0.64 C ATOM 813 CE LYS A 63 -9.284 -14.933 0.254 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.065 -15.233 1.692 1.00 1.54 N ATOM 0 H LYS A 63 -7.633 -11.925 -3.452 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.843 -13.698 -4.034 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.568 -13.749 -1.906 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -9.103 -12.118 -1.555 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.447 -12.867 -1.486 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -10.964 -14.492 -1.932 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -10.170 -13.014 0.605 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -11.326 -14.326 0.492 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -9.522 -15.854 -0.279 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -8.365 -14.541 -0.181 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -8.191 -15.785 1.802 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -8.982 -14.343 2.224 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -9.869 -15.781 2.059 1.00 1.54 H new ATOM 828 N TYR A 64 -10.124 -10.444 -3.868 1.00 0.16 N ATOM 829 CA TYR A 64 -11.072 -9.360 -3.838 1.00 0.16 C ATOM 830 C TYR A 64 -10.993 -8.367 -4.988 1.00 0.17 C ATOM 831 O TYR A 64 -11.839 -7.474 -5.078 1.00 0.17 O ATOM 832 CB TYR A 64 -11.001 -8.682 -2.491 1.00 0.15 C ATOM 833 CG TYR A 64 -11.531 -9.571 -1.400 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.819 -10.070 -1.440 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.723 -9.911 -0.324 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.288 -10.892 -0.436 1.00 0.23 C ATOM 837 CE2 TYR A 64 -11.180 -10.725 0.682 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.552 -11.200 0.596 1.00 0.24 C ATOM 839 OH TYR A 64 -12.930 -12.041 1.623 1.00 0.31 O ATOM 0 H TYR A 64 -9.144 -10.171 -3.941 1.00 0.16 H new ATOM 0 HA TYR A 64 -12.052 -9.812 -3.988 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.968 -8.412 -2.272 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.574 -7.755 -2.518 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.466 -9.814 -2.266 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.715 -9.527 -0.277 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.289 -11.290 -0.506 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.543 -11.003 1.509 1.00 0.23 H new ATOM 0 HH TYR A 64 -12.185 -12.145 2.251 1.00 0.31 H new ATOM 849 N LYS A 65 -10.040 -8.523 -5.892 1.00 0.20 N ATOM 850 CA LYS A 65 -10.050 -7.726 -7.111 1.00 0.23 C ATOM 851 C LYS A 65 -11.262 -8.113 -7.905 1.00 0.20 C ATOM 852 O LYS A 65 -11.799 -7.325 -8.682 1.00 0.22 O ATOM 853 CB LYS A 65 -8.781 -7.910 -7.950 1.00 0.34 C ATOM 854 CG LYS A 65 -8.416 -9.349 -8.252 1.00 0.29 C ATOM 855 CD LYS A 65 -7.113 -9.422 -9.028 1.00 0.38 C ATOM 856 CE LYS A 65 -6.651 -10.860 -9.209 1.00 0.80 C ATOM 857 NZ LYS A 65 -5.512 -10.984 -10.159 1.00 1.35 N ATOM 0 H LYS A 65 -9.264 -9.180 -5.810 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.081 -6.671 -6.837 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -8.906 -7.377 -8.893 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -7.947 -7.441 -7.428 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.322 -9.908 -7.321 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -9.214 -9.819 -8.827 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -7.243 -8.955 -10.004 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.344 -8.855 -8.504 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -6.357 -11.267 -8.241 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -7.485 -11.462 -9.568 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -4.896 -11.768 -9.862 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -5.876 -11.173 -11.115 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -4.967 -10.098 -10.165 1.00 1.35 H new ATOM 871 N SER A 66 -11.703 -9.336 -7.649 1.00 0.23 N ATOM 872 CA SER A 66 -12.951 -9.835 -8.201 1.00 0.26 C ATOM 873 C SER A 66 -14.084 -8.813 -7.983 1.00 0.25 C ATOM 874 O SER A 66 -14.924 -8.613 -8.862 1.00 0.31 O ATOM 875 CB SER A 66 -13.302 -11.180 -7.559 1.00 0.32 C ATOM 876 OG SER A 66 -14.321 -11.847 -8.284 1.00 1.28 O ATOM 0 H SER A 66 -11.209 -10.005 -7.058 1.00 0.23 H new ATOM 0 HA SER A 66 -12.831 -9.981 -9.274 1.00 0.26 H new ATOM 0 HB2 SER A 66 -12.412 -11.808 -7.517 1.00 0.32 H new ATOM 0 HB3 SER A 66 -13.629 -11.021 -6.531 1.00 0.32 H new ATOM 0 HG SER A 66 -14.523 -12.703 -7.852 1.00 1.28 H new ATOM 882 N GLN A 67 -14.099 -8.160 -6.816 1.00 0.21 N ATOM 883 CA GLN A 67 -15.047 -7.071 -6.562 1.00 0.20 C ATOM 884 C GLN A 67 -14.509 -5.719 -7.055 1.00 0.20 C ATOM 885 O GLN A 67 -15.272 -4.894 -7.557 1.00 0.27 O ATOM 886 CB GLN A 67 -15.380 -6.982 -5.071 1.00 0.21 C ATOM 887 CG GLN A 67 -16.279 -8.104 -4.582 1.00 0.38 C ATOM 888 CD GLN A 67 -16.530 -8.054 -3.090 1.00 0.52 C ATOM 889 OE1 GLN A 67 -17.474 -7.415 -2.624 1.00 1.11 O ATOM 890 NE2 GLN A 67 -15.693 -8.741 -2.330 1.00 0.46 N ATOM 0 H GLN A 67 -13.471 -8.364 -6.039 1.00 0.21 H new ATOM 0 HA GLN A 67 -15.955 -7.298 -7.121 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.453 -6.995 -4.499 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -15.864 -6.026 -4.872 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -17.233 -8.053 -5.107 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.826 -9.062 -4.837 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -14.923 -9.257 -2.756 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -15.817 -8.755 -1.318 1.00 0.46 H new ATOM 899 N GLY A 68 -13.201 -5.508 -6.925 1.00 0.17 N ATOM 900 CA GLY A 68 -12.598 -4.231 -7.270 1.00 0.18 C ATOM 901 C GLY A 68 -11.376 -3.932 -6.416 1.00 0.15 C ATOM 902 O GLY A 68 -10.646 -2.967 -6.666 1.00 0.17 O ATOM 0 H GLY A 68 -12.542 -6.207 -6.583 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.313 -4.236 -8.322 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.333 -3.436 -7.143 1.00 0.18 H new ATOM 906 N PHE A 69 -11.155 -4.781 -5.417 1.00 0.14 N ATOM 907 CA PHE A 69 -10.059 -4.620 -4.461 1.00 0.13 C ATOM 908 C PHE A 69 -8.703 -4.763 -5.135 1.00 0.14 C ATOM 909 O PHE A 69 -8.546 -5.570 -6.037 1.00 0.18 O ATOM 910 CB PHE A 69 -10.181 -5.677 -3.357 1.00 0.14 C ATOM 911 CG PHE A 69 -9.148 -5.561 -2.288 1.00 0.12 C ATOM 912 CD1 PHE A 69 -8.866 -4.332 -1.774 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.468 -6.668 -1.796 1.00 0.14 C ATOM 914 CE1 PHE A 69 -7.935 -4.173 -0.803 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.519 -6.521 -0.802 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.250 -5.266 -0.307 1.00 0.14 C ATOM 0 H PHE A 69 -11.732 -5.604 -5.245 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.130 -3.618 -4.039 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.169 -5.601 -2.903 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.113 -6.667 -3.807 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.395 -3.468 -2.148 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.682 -7.649 -2.193 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.727 -3.187 -0.414 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -6.994 -7.383 -0.418 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.507 -5.135 0.466 1.00 0.14 H new ATOM 926 N THR A 70 -7.726 -3.972 -4.718 1.00 0.13 N ATOM 927 CA THR A 70 -6.384 -4.172 -5.147 1.00 0.12 C ATOM 928 C THR A 70 -5.495 -4.090 -3.965 1.00 0.12 C ATOM 929 O THR A 70 -5.786 -3.393 -3.011 1.00 0.19 O ATOM 930 CB THR A 70 -5.946 -3.125 -6.170 1.00 0.15 C ATOM 931 OG1 THR A 70 -4.886 -3.633 -6.970 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.488 -1.838 -5.497 1.00 0.19 C ATOM 0 H THR A 70 -7.856 -3.187 -4.080 1.00 0.13 H new ATOM 0 HA THR A 70 -6.322 -5.150 -5.624 1.00 0.12 H new ATOM 0 HB THR A 70 -6.811 -2.900 -6.795 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.200 -4.414 -7.471 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.184 -1.118 -6.257 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.307 -1.423 -4.910 1.00 0.19 H new ATOM 0 HG23 THR A 70 -4.644 -2.051 -4.841 1.00 0.19 H new ATOM 940 N VAL A 71 -4.449 -4.827 -4.002 1.00 0.13 N ATOM 941 CA VAL A 71 -3.344 -4.501 -3.199 1.00 0.13 C ATOM 942 C VAL A 71 -2.352 -3.777 -4.056 1.00 0.13 C ATOM 943 O VAL A 71 -1.659 -4.373 -4.869 1.00 0.15 O ATOM 944 CB VAL A 71 -2.723 -5.728 -2.559 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.348 -5.390 -2.005 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.637 -6.245 -1.466 1.00 0.17 C ATOM 0 H VAL A 71 -4.339 -5.659 -4.581 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.669 -3.865 -2.375 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.601 -6.509 -3.310 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -0.912 -6.278 -1.548 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.704 -5.045 -2.814 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.441 -4.604 -1.255 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.191 -7.127 -1.006 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.774 -5.471 -0.710 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.604 -6.509 -1.895 1.00 0.17 H new ATOM 956 N LEU A 72 -2.326 -2.481 -3.913 1.00 0.17 N ATOM 957 CA LEU A 72 -1.381 -1.706 -4.654 1.00 0.22 C ATOM 958 C LEU A 72 -0.076 -1.720 -3.904 1.00 0.19 C ATOM 959 O LEU A 72 -0.003 -1.274 -2.765 1.00 0.28 O ATOM 960 CB LEU A 72 -1.851 -0.259 -4.821 1.00 0.43 C ATOM 961 CG LEU A 72 -2.498 0.097 -6.152 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.012 1.523 -6.121 1.00 1.04 C ATOM 963 CD2 LEU A 72 -1.486 -0.067 -7.266 1.00 1.00 C ATOM 0 H LEU A 72 -2.941 -1.948 -3.298 1.00 0.17 H new ATOM 0 HA LEU A 72 -1.270 -2.138 -5.649 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -2.563 -0.038 -4.026 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -0.993 0.397 -4.672 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.341 -0.571 -6.330 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -3.472 1.765 -7.079 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.751 1.626 -5.327 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -2.182 2.205 -5.935 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -1.949 0.188 -8.219 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -0.638 0.593 -7.087 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -1.141 -1.101 -7.295 1.00 1.00 H new ATOM 975 N ALA A 73 0.947 -2.228 -4.534 1.00 0.22 N ATOM 976 CA ALA A 73 2.250 -2.252 -3.928 1.00 0.30 C ATOM 977 C ALA A 73 3.046 -1.051 -4.398 1.00 0.23 C ATOM 978 O ALA A 73 3.396 -0.944 -5.570 1.00 0.32 O ATOM 979 CB ALA A 73 2.972 -3.539 -4.276 1.00 0.51 C ATOM 0 H ALA A 73 0.904 -2.632 -5.470 1.00 0.22 H new ATOM 0 HA ALA A 73 2.143 -2.207 -2.844 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.957 -3.541 -3.809 1.00 0.51 H new ATOM 0 HB2 ALA A 73 2.396 -4.389 -3.911 1.00 0.51 H new ATOM 0 HB3 ALA A 73 3.083 -3.613 -5.358 1.00 0.51 H new ATOM 985 N PHE A 74 3.296 -0.136 -3.491 1.00 0.29 N ATOM 986 CA PHE A 74 4.173 0.985 -3.760 1.00 0.33 C ATOM 987 C PHE A 74 5.525 0.671 -3.120 1.00 0.35 C ATOM 988 O PHE A 74 5.734 0.942 -1.941 1.00 0.37 O ATOM 989 CB PHE A 74 3.565 2.291 -3.202 1.00 0.44 C ATOM 990 CG PHE A 74 2.526 2.964 -4.092 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.596 2.232 -4.828 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.490 4.353 -4.192 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.672 2.870 -5.635 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.560 4.994 -5.010 1.00 0.43 C ATOM 995 CZ PHE A 74 0.655 4.243 -5.733 1.00 0.35 C ATOM 0 H PHE A 74 2.901 -0.145 -2.551 1.00 0.29 H new ATOM 0 HA PHE A 74 4.300 1.134 -4.832 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.106 2.074 -2.237 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.374 2.998 -3.019 1.00 0.44 H new ATOM 0 HD1 PHE A 74 1.597 1.154 -4.767 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.195 4.944 -3.626 1.00 0.41 H new ATOM 0 HE1 PHE A 74 -0.044 2.285 -6.194 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.548 6.072 -5.077 1.00 0.43 H new ATOM 0 HZ PHE A 74 -0.064 4.731 -6.374 1.00 0.35 H new ATOM 1005 N PRO A 75 6.449 0.054 -3.889 1.00 0.37 N ATOM 1006 CA PRO A 75 7.668 -0.552 -3.338 1.00 0.46 C ATOM 1007 C PRO A 75 8.754 0.436 -2.974 1.00 0.61 C ATOM 1008 O PRO A 75 9.769 0.524 -3.657 1.00 1.30 O ATOM 1009 CB PRO A 75 8.138 -1.475 -4.455 1.00 0.54 C ATOM 1010 CG PRO A 75 7.669 -0.817 -5.702 1.00 0.44 C ATOM 1011 CD PRO A 75 6.374 -0.115 -5.353 1.00 0.38 C ATOM 0 HA PRO A 75 7.454 -1.052 -2.394 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.222 -1.586 -4.448 1.00 0.54 H new ATOM 0 HB3 PRO A 75 7.714 -2.474 -4.350 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.410 -0.106 -6.068 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.512 -1.550 -6.493 1.00 0.44 H new ATOM 0 HD2 PRO A 75 6.289 0.845 -5.863 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.507 -0.708 -5.643 1.00 0.38 H new ATOM 1019 N SER A 76 8.534 1.065 -1.834 1.00 0.41 N ATOM 1020 CA SER A 76 9.380 2.095 -1.223 1.00 0.37 C ATOM 1021 C SER A 76 10.696 2.379 -1.919 1.00 0.50 C ATOM 1022 O SER A 76 11.530 1.497 -2.146 1.00 0.74 O ATOM 1023 CB SER A 76 9.606 1.658 0.220 1.00 0.53 C ATOM 1024 OG SER A 76 8.374 1.350 0.837 1.00 1.44 O ATOM 0 H SER A 76 7.710 0.863 -1.268 1.00 0.41 H new ATOM 0 HA SER A 76 8.858 3.048 -1.307 1.00 0.37 H new ATOM 0 HB2 SER A 76 10.261 0.787 0.245 1.00 0.53 H new ATOM 0 HB3 SER A 76 10.109 2.451 0.773 1.00 0.53 H new ATOM 0 HG SER A 76 8.236 1.943 1.605 1.00 1.44 H new ATOM 1030 N ASN A 77 10.871 3.660 -2.209 1.00 0.52 N ATOM 1031 CA ASN A 77 12.052 4.159 -2.870 1.00 0.72 C ATOM 1032 C ASN A 77 13.219 4.135 -1.899 1.00 0.70 C ATOM 1033 O ASN A 77 13.671 5.171 -1.406 1.00 0.75 O ATOM 1034 CB ASN A 77 11.787 5.569 -3.407 1.00 0.93 C ATOM 1035 CG ASN A 77 12.934 6.129 -4.229 1.00 0.96 C ATOM 1036 OD1 ASN A 77 13.027 5.884 -5.430 1.00 1.81 O ATOM 1037 ND2 ASN A 77 13.801 6.899 -3.592 1.00 1.46 N ATOM 0 H ASN A 77 10.187 4.383 -1.987 1.00 0.52 H new ATOM 0 HA ASN A 77 12.306 3.524 -3.719 1.00 0.72 H new ATOM 0 HB2 ASN A 77 10.886 5.553 -4.020 1.00 0.93 H new ATOM 0 HB3 ASN A 77 11.591 6.238 -2.569 1.00 0.93 H new ATOM 0 HD21 ASN A 77 14.583 7.314 -4.099 1.00 1.46 H new ATOM 0 HD22 ASN A 77 13.688 7.077 -2.594 1.00 1.46 H new ATOM 1044 N GLN A 78 13.675 2.914 -1.634 1.00 0.85 N ATOM 1045 CA GLN A 78 14.816 2.603 -0.769 1.00 0.98 C ATOM 1046 C GLN A 78 16.040 3.459 -1.061 1.00 0.98 C ATOM 1047 O GLN A 78 17.015 3.440 -0.311 1.00 1.12 O ATOM 1048 CB GLN A 78 15.164 1.117 -0.884 1.00 1.35 C ATOM 1049 CG GLN A 78 14.666 0.463 -2.166 1.00 2.07 C ATOM 1050 CD GLN A 78 15.413 0.909 -3.408 1.00 2.74 C ATOM 1051 OE1 GLN A 78 14.825 1.009 -4.483 1.00 3.34 O ATOM 1052 NE2 GLN A 78 16.712 1.133 -3.284 1.00 3.30 N ATOM 0 H GLN A 78 13.245 2.079 -2.030 1.00 0.85 H new ATOM 0 HA GLN A 78 14.515 2.837 0.252 1.00 0.98 H new ATOM 0 HB2 GLN A 78 16.246 1.002 -0.826 1.00 1.35 H new ATOM 0 HB3 GLN A 78 14.741 0.588 -0.030 1.00 1.35 H new ATOM 0 HG2 GLN A 78 14.754 -0.619 -2.069 1.00 2.07 H new ATOM 0 HG3 GLN A 78 13.607 0.687 -2.290 1.00 2.07 H new ATOM 0 HE21 GLN A 78 17.161 1.039 -2.373 1.00 3.30 H new ATOM 0 HE22 GLN A 78 17.264 1.400 -4.099 1.00 3.30 H new ATOM 1061 N PHE A 79 15.995 4.184 -2.162 1.00 0.98 N ATOM 1062 CA PHE A 79 17.102 5.048 -2.554 1.00 1.19 C ATOM 1063 C PHE A 79 17.275 6.187 -1.549 1.00 1.20 C ATOM 1064 O PHE A 79 18.302 6.869 -1.534 1.00 1.54 O ATOM 1065 CB PHE A 79 16.863 5.624 -3.948 1.00 1.32 C ATOM 1066 CG PHE A 79 16.831 4.590 -5.038 1.00 1.57 C ATOM 1067 CD1 PHE A 79 18.006 4.122 -5.601 1.00 1.82 C ATOM 1068 CD2 PHE A 79 15.626 4.096 -5.508 1.00 2.02 C ATOM 1069 CE1 PHE A 79 17.980 3.181 -6.612 1.00 2.25 C ATOM 1070 CE2 PHE A 79 15.592 3.154 -6.518 1.00 2.64 C ATOM 1071 CZ PHE A 79 16.771 2.697 -7.071 1.00 2.68 C ATOM 0 H PHE A 79 15.203 4.195 -2.805 1.00 0.98 H new ATOM 0 HA PHE A 79 18.012 4.448 -2.569 1.00 1.19 H new ATOM 0 HB2 PHE A 79 15.918 6.167 -3.949 1.00 1.32 H new ATOM 0 HB3 PHE A 79 17.647 6.348 -4.170 1.00 1.32 H new ATOM 0 HD1 PHE A 79 18.954 4.497 -5.246 1.00 1.82 H new ATOM 0 HD2 PHE A 79 14.701 4.452 -5.080 1.00 2.02 H new ATOM 0 HE1 PHE A 79 18.904 2.824 -7.043 1.00 2.25 H new ATOM 0 HE2 PHE A 79 14.645 2.776 -6.874 1.00 2.64 H new ATOM 0 HZ PHE A 79 16.748 1.962 -7.862 1.00 2.68 H new ATOM 1081 N GLY A 80 16.269 6.378 -0.707 1.00 1.10 N ATOM 1082 CA GLY A 80 16.344 7.380 0.337 1.00 1.22 C ATOM 1083 C GLY A 80 16.971 6.834 1.607 1.00 1.24 C ATOM 1084 O GLY A 80 17.353 5.664 1.663 1.00 1.98 O ATOM 0 H GLY A 80 15.395 5.852 -0.729 1.00 1.10 H new ATOM 0 HA2 GLY A 80 16.926 8.230 -0.018 1.00 1.22 H new ATOM 0 HA3 GLY A 80 15.342 7.749 0.557 1.00 1.22 H new ATOM 1088 N GLY A 81 17.072 7.672 2.628 1.00 1.18 N ATOM 1089 CA GLY A 81 17.695 7.259 3.873 1.00 1.21 C ATOM 1090 C GLY A 81 16.728 7.290 5.035 1.00 1.14 C ATOM 1091 O GLY A 81 17.121 7.529 6.174 1.00 1.49 O ATOM 0 H GLY A 81 16.733 8.634 2.618 1.00 1.18 H new ATOM 0 HA2 GLY A 81 18.093 6.250 3.761 1.00 1.21 H new ATOM 0 HA3 GLY A 81 18.540 7.913 4.089 1.00 1.21 H new ATOM 1095 N GLN A 82 15.459 7.061 4.738 1.00 0.86 N ATOM 1096 CA GLN A 82 14.413 7.043 5.755 1.00 0.82 C ATOM 1097 C GLN A 82 13.481 5.865 5.523 1.00 0.77 C ATOM 1098 O GLN A 82 12.629 5.568 6.357 1.00 0.91 O ATOM 1099 CB GLN A 82 13.587 8.345 5.732 1.00 0.80 C ATOM 1100 CG GLN A 82 12.881 8.608 4.407 1.00 0.75 C ATOM 1101 CD GLN A 82 13.838 8.929 3.284 1.00 1.09 C ATOM 1102 OE1 GLN A 82 14.844 9.618 3.480 1.00 1.74 O ATOM 1103 NE2 GLN A 82 13.575 8.371 2.123 1.00 1.14 N ATOM 0 H GLN A 82 15.123 6.883 3.791 1.00 0.86 H new ATOM 0 HA GLN A 82 14.898 6.951 6.727 1.00 0.82 H new ATOM 0 HB2 GLN A 82 12.842 8.305 6.527 1.00 0.80 H new ATOM 0 HB3 GLN A 82 14.245 9.185 5.954 1.00 0.80 H new ATOM 0 HG2 GLN A 82 12.291 7.733 4.136 1.00 0.75 H new ATOM 0 HG3 GLN A 82 12.184 9.436 4.531 1.00 0.75 H new ATOM 0 HE21 GLN A 82 12.731 7.810 2.006 1.00 1.14 H new ATOM 0 HE22 GLN A 82 14.215 8.500 1.339 1.00 1.14 H new ATOM 1112 N GLU A 83 13.687 5.174 4.408 1.00 0.75 N ATOM 1113 CA GLU A 83 12.733 4.181 3.929 1.00 0.74 C ATOM 1114 C GLU A 83 12.558 3.052 4.932 1.00 0.72 C ATOM 1115 O GLU A 83 13.515 2.584 5.539 1.00 0.88 O ATOM 1116 CB GLU A 83 13.185 3.633 2.579 1.00 0.87 C ATOM 1117 CG GLU A 83 13.212 4.688 1.491 1.00 1.16 C ATOM 1118 CD GLU A 83 11.888 5.417 1.353 1.00 2.33 C ATOM 1119 OE1 GLU A 83 11.705 6.440 2.048 1.00 2.83 O ATOM 1120 OE2 GLU A 83 11.038 4.973 0.552 1.00 3.07 O ATOM 0 H GLU A 83 14.510 5.284 3.816 1.00 0.75 H new ATOM 0 HA GLU A 83 11.765 4.668 3.809 1.00 0.74 H new ATOM 0 HB2 GLU A 83 14.180 3.201 2.683 1.00 0.87 H new ATOM 0 HB3 GLU A 83 12.517 2.826 2.278 1.00 0.87 H new ATOM 0 HG2 GLU A 83 13.999 5.410 1.709 1.00 1.16 H new ATOM 0 HG3 GLU A 83 13.465 4.218 0.540 1.00 1.16 H new ATOM 1127 N PRO A 84 11.316 2.594 5.096 1.00 0.63 N ATOM 1128 CA PRO A 84 10.936 1.711 6.187 1.00 0.75 C ATOM 1129 C PRO A 84 11.276 0.249 5.916 1.00 1.00 C ATOM 1130 O PRO A 84 11.806 -0.100 4.860 1.00 1.75 O ATOM 1131 CB PRO A 84 9.430 1.926 6.249 1.00 1.02 C ATOM 1132 CG PRO A 84 9.026 2.153 4.844 1.00 0.72 C ATOM 1133 CD PRO A 84 10.178 2.870 4.194 1.00 0.61 C ATOM 0 HA PRO A 84 11.464 1.931 7.115 1.00 0.75 H new ATOM 0 HB2 PRO A 84 8.923 1.059 6.672 1.00 1.02 H new ATOM 0 HB3 PRO A 84 9.177 2.780 6.877 1.00 1.02 H new ATOM 0 HG2 PRO A 84 8.819 1.209 4.340 1.00 0.72 H new ATOM 0 HG3 PRO A 84 8.115 2.749 4.791 1.00 0.72 H new ATOM 0 HD2 PRO A 84 10.365 2.497 3.187 1.00 0.61 H new ATOM 0 HD3 PRO A 84 9.986 3.939 4.107 1.00 0.61 H new ATOM 1141 N GLY A 85 10.994 -0.604 6.888 1.00 1.45 N ATOM 1142 CA GLY A 85 11.246 -2.018 6.722 1.00 1.82 C ATOM 1143 C GLY A 85 12.585 -2.437 7.289 1.00 1.61 C ATOM 1144 O GLY A 85 12.697 -3.514 7.875 1.00 2.20 O ATOM 0 H GLY A 85 10.595 -0.342 7.789 1.00 1.45 H new ATOM 0 HA2 GLY A 85 10.454 -2.585 7.211 1.00 1.82 H new ATOM 0 HA3 GLY A 85 11.209 -2.269 5.662 1.00 1.82 H new ATOM 1148 N ASN A 86 13.592 -1.584 7.108 1.00 1.49 N ATOM 1149 CA ASN A 86 14.952 -1.846 7.596 1.00 2.04 C ATOM 1150 C ASN A 86 15.899 -0.737 7.131 1.00 1.94 C ATOM 1151 O ASN A 86 17.031 -0.634 7.603 1.00 2.70 O ATOM 1152 CB ASN A 86 15.461 -3.213 7.111 1.00 2.78 C ATOM 1153 CG ASN A 86 16.738 -3.660 7.808 1.00 3.58 C ATOM 1154 OD1 ASN A 86 17.022 -3.258 8.938 1.00 4.07 O ATOM 1155 ND2 ASN A 86 17.492 -4.534 7.159 1.00 4.20 N ATOM 0 H ASN A 86 13.492 -0.693 6.621 1.00 1.49 H new ATOM 0 HA ASN A 86 14.925 -1.862 8.686 1.00 2.04 H new ATOM 0 HB2 ASN A 86 14.685 -3.961 7.274 1.00 2.78 H new ATOM 0 HB3 ASN A 86 15.638 -3.167 6.037 1.00 2.78 H new ATOM 0 HD21 ASN A 86 18.340 -4.898 7.593 1.00 4.20 H new ATOM 0 HD22 ASN A 86 17.225 -4.844 6.225 1.00 4.20 H new ATOM 1162 N GLU A 87 15.417 0.079 6.188 1.00 1.52 N ATOM 1163 CA GLU A 87 16.132 1.265 5.699 1.00 1.46 C ATOM 1164 C GLU A 87 17.288 0.895 4.766 1.00 1.60 C ATOM 1165 O GLU A 87 17.232 1.157 3.565 1.00 2.15 O ATOM 1166 CB GLU A 87 16.618 2.143 6.870 1.00 1.61 C ATOM 1167 CG GLU A 87 15.493 2.559 7.810 1.00 2.19 C ATOM 1168 CD GLU A 87 15.921 3.551 8.874 1.00 2.58 C ATOM 1169 OE1 GLU A 87 16.516 3.124 9.884 1.00 2.84 O ATOM 1170 OE2 GLU A 87 15.702 4.767 8.688 1.00 3.02 O ATOM 0 H GLU A 87 14.513 -0.065 5.738 1.00 1.52 H new ATOM 0 HA GLU A 87 15.423 1.848 5.112 1.00 1.46 H new ATOM 0 HB2 GLU A 87 17.374 1.598 7.436 1.00 1.61 H new ATOM 0 HB3 GLU A 87 17.100 3.036 6.472 1.00 1.61 H new ATOM 0 HG2 GLU A 87 14.685 2.995 7.223 1.00 2.19 H new ATOM 0 HG3 GLU A 87 15.090 1.670 8.296 1.00 2.19 H new ATOM 1177 N GLU A 88 18.311 0.251 5.307 1.00 1.57 N ATOM 1178 CA GLU A 88 19.511 -0.066 4.540 1.00 1.77 C ATOM 1179 C GLU A 88 19.357 -1.387 3.779 1.00 1.62 C ATOM 1180 O GLU A 88 20.239 -1.785 3.017 1.00 1.62 O ATOM 1181 CB GLU A 88 20.716 -0.129 5.483 1.00 2.18 C ATOM 1182 CG GLU A 88 22.040 -0.340 4.773 1.00 2.68 C ATOM 1183 CD GLU A 88 23.211 -0.350 5.723 1.00 3.33 C ATOM 1184 OE1 GLU A 88 23.502 -1.423 6.291 1.00 3.92 O ATOM 1185 OE2 GLU A 88 23.842 0.713 5.911 1.00 3.66 O ATOM 0 H GLU A 88 18.336 -0.064 6.277 1.00 1.57 H new ATOM 0 HA GLU A 88 19.667 0.720 3.801 1.00 1.77 H new ATOM 0 HB2 GLU A 88 20.765 0.797 6.056 1.00 2.18 H new ATOM 0 HB3 GLU A 88 20.565 -0.938 6.197 1.00 2.18 H new ATOM 0 HG2 GLU A 88 22.010 -1.284 4.229 1.00 2.68 H new ATOM 0 HG3 GLU A 88 22.182 0.449 4.035 1.00 2.68 H new ATOM 1192 N GLU A 89 18.220 -2.042 3.970 1.00 1.62 N ATOM 1193 CA GLU A 89 17.968 -3.354 3.378 1.00 1.59 C ATOM 1194 C GLU A 89 18.235 -3.355 1.875 1.00 1.49 C ATOM 1195 O GLU A 89 19.129 -4.039 1.383 1.00 1.59 O ATOM 1196 CB GLU A 89 16.511 -3.747 3.607 1.00 1.70 C ATOM 1197 CG GLU A 89 16.199 -5.200 3.286 1.00 1.75 C ATOM 1198 CD GLU A 89 16.471 -6.111 4.460 1.00 2.11 C ATOM 1199 OE1 GLU A 89 15.740 -6.050 5.456 1.00 2.65 O ATOM 1200 OE2 GLU A 89 17.434 -6.898 4.377 1.00 2.45 O ATOM 0 H GLU A 89 17.450 -1.684 4.535 1.00 1.62 H new ATOM 0 HA GLU A 89 18.643 -4.065 3.855 1.00 1.59 H new ATOM 0 HB2 GLU A 89 16.254 -3.553 4.648 1.00 1.70 H new ATOM 0 HB3 GLU A 89 15.874 -3.107 2.997 1.00 1.70 H new ATOM 0 HG2 GLU A 89 15.153 -5.290 2.992 1.00 1.75 H new ATOM 0 HG3 GLU A 89 16.798 -5.519 2.433 1.00 1.75 H new ATOM 1207 N ILE A 90 17.487 -2.541 1.158 1.00 1.43 N ATOM 1208 CA ILE A 90 17.487 -2.594 -0.292 1.00 1.39 C ATOM 1209 C ILE A 90 18.473 -1.589 -0.872 1.00 1.49 C ATOM 1210 O ILE A 90 18.097 -0.593 -1.491 1.00 1.57 O ATOM 1211 CB ILE A 90 16.090 -2.309 -0.837 1.00 1.45 C ATOM 1212 CG1 ILE A 90 15.036 -2.996 0.030 1.00 1.74 C ATOM 1213 CG2 ILE A 90 15.978 -2.763 -2.288 1.00 1.76 C ATOM 1214 CD1 ILE A 90 13.671 -2.350 -0.052 1.00 2.15 C ATOM 0 H ILE A 90 16.870 -1.833 1.556 1.00 1.43 H new ATOM 0 HA ILE A 90 17.791 -3.598 -0.589 1.00 1.39 H new ATOM 0 HB ILE A 90 15.915 -1.234 -0.806 1.00 1.45 H new ATOM 0 HG12 ILE A 90 14.953 -4.040 -0.272 1.00 1.74 H new ATOM 0 HG13 ILE A 90 15.370 -2.990 1.067 1.00 1.74 H new ATOM 0 HG21 ILE A 90 14.975 -2.552 -2.659 1.00 1.76 H new ATOM 0 HG22 ILE A 90 16.709 -2.228 -2.894 1.00 1.76 H new ATOM 0 HG23 ILE A 90 16.169 -3.834 -2.350 1.00 1.76 H new ATOM 0 HD11 ILE A 90 12.974 -2.890 0.589 1.00 2.15 H new ATOM 0 HD12 ILE A 90 13.739 -1.313 0.278 1.00 2.15 H new ATOM 0 HD13 ILE A 90 13.315 -2.380 -1.082 1.00 2.15 H new ATOM 1226 N LYS A 91 19.733 -1.857 -0.624 1.00 1.71 N ATOM 1227 CA LYS A 91 20.843 -1.087 -1.157 1.00 1.89 C ATOM 1228 C LYS A 91 22.098 -1.846 -0.792 1.00 1.98 C ATOM 1229 O LYS A 91 23.031 -1.990 -1.583 1.00 2.17 O ATOM 1230 CB LYS A 91 20.868 0.347 -0.596 1.00 2.00 C ATOM 1231 CG LYS A 91 21.027 0.431 0.914 1.00 2.10 C ATOM 1232 CD LYS A 91 20.923 1.860 1.419 1.00 2.33 C ATOM 1233 CE LYS A 91 19.521 2.419 1.233 1.00 2.39 C ATOM 1234 NZ LYS A 91 19.396 3.797 1.778 1.00 2.79 N ATOM 0 H LYS A 91 20.027 -2.634 -0.032 1.00 1.71 H new ATOM 0 HA LYS A 91 20.752 -0.975 -2.237 1.00 1.89 H new ATOM 0 HB2 LYS A 91 21.686 0.893 -1.066 1.00 2.00 H new ATOM 0 HB3 LYS A 91 19.944 0.851 -0.880 1.00 2.00 H new ATOM 0 HG2 LYS A 91 20.262 -0.179 1.394 1.00 2.10 H new ATOM 0 HG3 LYS A 91 21.993 0.015 1.200 1.00 2.10 H new ATOM 0 HD2 LYS A 91 21.192 1.894 2.475 1.00 2.33 H new ATOM 0 HD3 LYS A 91 21.639 2.487 0.888 1.00 2.33 H new ATOM 0 HE2 LYS A 91 19.270 2.424 0.172 1.00 2.39 H new ATOM 0 HE3 LYS A 91 18.802 1.766 1.728 1.00 2.39 H new ATOM 0 HZ1 LYS A 91 18.471 4.193 1.513 1.00 2.79 H new ATOM 0 HZ2 LYS A 91 19.476 3.769 2.815 1.00 2.79 H new ATOM 0 HZ3 LYS A 91 20.153 4.394 1.388 1.00 2.79 H new ATOM 1248 N GLU A 92 22.069 -2.366 0.423 1.00 2.07 N ATOM 1249 CA GLU A 92 23.024 -3.347 0.873 1.00 2.27 C ATOM 1250 C GLU A 92 22.718 -4.685 0.206 1.00 2.10 C ATOM 1251 O GLU A 92 23.564 -5.255 -0.487 1.00 2.26 O ATOM 1252 CB GLU A 92 22.944 -3.459 2.401 1.00 2.54 C ATOM 1253 CG GLU A 92 23.377 -4.802 2.955 1.00 2.47 C ATOM 1254 CD GLU A 92 24.849 -5.084 2.743 1.00 2.96 C ATOM 1255 OE1 GLU A 92 25.684 -4.471 3.437 1.00 3.20 O ATOM 1256 OE2 GLU A 92 25.177 -5.926 1.881 1.00 3.29 O ATOM 0 H GLU A 92 21.374 -2.113 1.126 1.00 2.07 H new ATOM 0 HA GLU A 92 24.036 -3.049 0.600 1.00 2.27 H new ATOM 0 HB2 GLU A 92 23.565 -2.680 2.843 1.00 2.54 H new ATOM 0 HB3 GLU A 92 21.918 -3.264 2.714 1.00 2.54 H new ATOM 0 HG2 GLU A 92 23.156 -4.837 4.022 1.00 2.47 H new ATOM 0 HG3 GLU A 92 22.790 -5.590 2.482 1.00 2.47 H new ATOM 1263 N PHE A 93 21.484 -5.147 0.369 1.00 1.86 N ATOM 1264 CA PHE A 93 21.083 -6.448 -0.141 1.00 1.75 C ATOM 1265 C PHE A 93 20.665 -6.350 -1.592 1.00 1.59 C ATOM 1266 O PHE A 93 20.036 -5.371 -2.004 1.00 1.69 O ATOM 1267 CB PHE A 93 19.917 -7.013 0.670 1.00 1.73 C ATOM 1268 CG PHE A 93 20.262 -7.314 2.104 1.00 2.09 C ATOM 1269 CD1 PHE A 93 20.250 -6.317 3.066 1.00 2.65 C ATOM 1270 CD2 PHE A 93 20.600 -8.603 2.486 1.00 2.34 C ATOM 1271 CE1 PHE A 93 20.569 -6.599 4.381 1.00 3.40 C ATOM 1272 CE2 PHE A 93 20.920 -8.890 3.799 1.00 2.87 C ATOM 1273 CZ PHE A 93 20.903 -7.887 4.747 1.00 3.42 C ATOM 0 H PHE A 93 20.744 -4.637 0.852 1.00 1.86 H new ATOM 0 HA PHE A 93 21.943 -7.113 -0.054 1.00 1.75 H new ATOM 0 HB2 PHE A 93 19.092 -6.301 0.647 1.00 1.73 H new ATOM 0 HB3 PHE A 93 19.563 -7.927 0.192 1.00 1.73 H new ATOM 0 HD1 PHE A 93 19.988 -5.308 2.785 1.00 2.65 H new ATOM 0 HD2 PHE A 93 20.613 -9.392 1.749 1.00 2.34 H new ATOM 0 HE1 PHE A 93 20.557 -5.812 5.121 1.00 3.40 H new ATOM 0 HE2 PHE A 93 21.183 -9.898 4.083 1.00 2.87 H new ATOM 0 HZ PHE A 93 21.151 -8.110 5.774 1.00 3.42 H new ATOM 1283 N VAL A 94 21.024 -7.362 -2.362 1.00 1.62 N ATOM 1284 CA VAL A 94 20.565 -7.470 -3.732 1.00 1.68 C ATOM 1285 C VAL A 94 19.079 -7.778 -3.744 1.00 1.54 C ATOM 1286 O VAL A 94 18.665 -8.864 -3.350 1.00 1.74 O ATOM 1287 CB VAL A 94 21.317 -8.572 -4.500 1.00 2.11 C ATOM 1288 CG1 VAL A 94 20.687 -8.779 -5.863 1.00 2.63 C ATOM 1289 CG2 VAL A 94 22.793 -8.227 -4.633 1.00 2.56 C ATOM 0 H VAL A 94 21.634 -8.122 -2.059 1.00 1.62 H new ATOM 0 HA VAL A 94 20.761 -6.519 -4.226 1.00 1.68 H new ATOM 0 HB VAL A 94 21.241 -9.502 -3.937 1.00 2.11 H new ATOM 0 HG11 VAL A 94 21.226 -9.561 -6.398 1.00 2.63 H new ATOM 0 HG12 VAL A 94 19.645 -9.075 -5.741 1.00 2.63 H new ATOM 0 HG13 VAL A 94 20.736 -7.850 -6.431 1.00 2.63 H new ATOM 0 HG21 VAL A 94 23.304 -9.020 -5.179 1.00 2.56 H new ATOM 0 HG22 VAL A 94 22.900 -7.287 -5.174 1.00 2.56 H new ATOM 0 HG23 VAL A 94 23.234 -8.127 -3.641 1.00 2.56 H new ATOM 1299 N CYS A 95 18.281 -6.824 -4.197 1.00 1.47 N ATOM 1300 CA CYS A 95 16.837 -6.958 -4.134 1.00 1.46 C ATOM 1301 C CYS A 95 16.173 -6.468 -5.401 1.00 1.37 C ATOM 1302 O CYS A 95 16.417 -5.353 -5.867 1.00 1.52 O ATOM 1303 CB CYS A 95 16.287 -6.176 -2.941 1.00 1.77 C ATOM 1304 SG CYS A 95 17.091 -6.546 -1.365 1.00 2.83 S ATOM 0 H CYS A 95 18.609 -5.951 -4.611 1.00 1.47 H new ATOM 0 HA CYS A 95 16.613 -8.018 -4.019 1.00 1.46 H new ATOM 0 HB2 CYS A 95 16.388 -5.110 -3.144 1.00 1.77 H new ATOM 0 HB3 CYS A 95 15.221 -6.383 -2.848 1.00 1.77 H new ATOM 0 HG CYS A 95 16.552 -5.830 -0.424 1.00 2.83 H new ATOM 1310 N THR A 96 15.347 -7.332 -5.960 1.00 1.52 N ATOM 1311 CA THR A 96 14.427 -6.948 -7.004 1.00 1.59 C ATOM 1312 C THR A 96 13.423 -5.960 -6.433 1.00 1.08 C ATOM 1313 O THR A 96 13.244 -5.897 -5.215 1.00 1.31 O ATOM 1314 CB THR A 96 13.681 -8.184 -7.541 1.00 2.27 C ATOM 1315 OG1 THR A 96 13.265 -9.016 -6.446 1.00 2.76 O ATOM 1316 CG2 THR A 96 14.559 -8.993 -8.481 1.00 2.98 C ATOM 0 H THR A 96 15.298 -8.317 -5.701 1.00 1.52 H new ATOM 0 HA THR A 96 14.981 -6.491 -7.824 1.00 1.59 H new ATOM 0 HB THR A 96 12.810 -7.836 -8.096 1.00 2.27 H new ATOM 0 HG1 THR A 96 12.790 -9.800 -6.793 1.00 2.76 H new ATOM 0 HG21 THR A 96 14.004 -9.858 -8.843 1.00 2.98 H new ATOM 0 HG22 THR A 96 14.855 -8.372 -9.327 1.00 2.98 H new ATOM 0 HG23 THR A 96 15.449 -9.329 -7.949 1.00 2.98 H new ATOM 1324 N LYS A 97 12.772 -5.194 -7.290 1.00 1.14 N ATOM 1325 CA LYS A 97 11.785 -4.219 -6.829 1.00 1.11 C ATOM 1326 C LYS A 97 10.489 -4.917 -6.400 1.00 1.04 C ATOM 1327 O LYS A 97 9.393 -4.577 -6.855 1.00 1.76 O ATOM 1328 CB LYS A 97 11.507 -3.136 -7.890 1.00 1.47 C ATOM 1329 CG LYS A 97 10.842 -3.629 -9.167 1.00 1.47 C ATOM 1330 CD LYS A 97 10.102 -2.492 -9.857 1.00 1.89 C ATOM 1331 CE LYS A 97 9.210 -2.993 -10.982 1.00 2.34 C ATOM 1332 NZ LYS A 97 9.966 -3.261 -12.231 1.00 2.72 N ATOM 0 H LYS A 97 12.903 -5.223 -8.301 1.00 1.14 H new ATOM 0 HA LYS A 97 12.206 -3.715 -5.959 1.00 1.11 H new ATOM 0 HB2 LYS A 97 10.875 -2.368 -7.444 1.00 1.47 H new ATOM 0 HB3 LYS A 97 12.451 -2.658 -8.153 1.00 1.47 H new ATOM 0 HG2 LYS A 97 11.594 -4.042 -9.839 1.00 1.47 H new ATOM 0 HG3 LYS A 97 10.146 -4.435 -8.934 1.00 1.47 H new ATOM 0 HD2 LYS A 97 9.497 -1.957 -9.125 1.00 1.89 H new ATOM 0 HD3 LYS A 97 10.824 -1.779 -10.256 1.00 1.89 H new ATOM 0 HE2 LYS A 97 8.707 -3.906 -10.663 1.00 2.34 H new ATOM 0 HE3 LYS A 97 8.434 -2.254 -11.182 1.00 2.34 H new ATOM 0 HZ1 LYS A 97 9.313 -3.600 -12.966 1.00 2.72 H new ATOM 0 HZ2 LYS A 97 10.426 -2.386 -12.553 1.00 2.72 H new ATOM 0 HZ3 LYS A 97 10.690 -3.986 -12.050 1.00 2.72 H new ATOM 1346 N PHE A 98 10.642 -5.891 -5.504 1.00 0.89 N ATOM 1347 CA PHE A 98 9.534 -6.654 -4.952 1.00 0.92 C ATOM 1348 C PHE A 98 8.889 -7.560 -6.010 1.00 1.11 C ATOM 1349 O PHE A 98 9.288 -8.716 -6.152 1.00 2.12 O ATOM 1350 CB PHE A 98 8.510 -5.709 -4.307 1.00 1.15 C ATOM 1351 CG PHE A 98 7.232 -6.374 -3.916 1.00 0.75 C ATOM 1352 CD1 PHE A 98 7.235 -7.472 -3.079 1.00 1.02 C ATOM 1353 CD2 PHE A 98 6.027 -5.910 -4.408 1.00 0.96 C ATOM 1354 CE1 PHE A 98 6.054 -8.088 -2.740 1.00 0.94 C ATOM 1355 CE2 PHE A 98 4.847 -6.526 -4.068 1.00 0.87 C ATOM 1356 CZ PHE A 98 4.862 -7.611 -3.237 1.00 0.45 C ATOM 0 H PHE A 98 11.552 -6.172 -5.139 1.00 0.89 H new ATOM 0 HA PHE A 98 9.923 -7.312 -4.175 1.00 0.92 H new ATOM 0 HB2 PHE A 98 8.957 -5.255 -3.422 1.00 1.15 H new ATOM 0 HB3 PHE A 98 8.289 -4.900 -5.003 1.00 1.15 H new ATOM 0 HD1 PHE A 98 8.169 -7.848 -2.689 1.00 1.02 H new ATOM 0 HD2 PHE A 98 6.013 -5.054 -5.067 1.00 0.96 H new ATOM 0 HE1 PHE A 98 6.061 -8.946 -2.084 1.00 0.94 H new ATOM 0 HE2 PHE A 98 3.910 -6.154 -4.456 1.00 0.87 H new ATOM 0 HZ PHE A 98 3.935 -8.096 -2.969 1.00 0.45 H new ATOM 1366 N LYS A 99 7.918 -7.018 -6.754 1.00 0.80 N ATOM 1367 CA LYS A 99 7.144 -7.768 -7.750 1.00 0.78 C ATOM 1368 C LYS A 99 6.199 -8.763 -7.076 1.00 0.79 C ATOM 1369 O LYS A 99 6.490 -9.287 -6.001 1.00 1.43 O ATOM 1370 CB LYS A 99 8.048 -8.481 -8.765 1.00 1.02 C ATOM 1371 CG LYS A 99 8.865 -7.532 -9.630 1.00 1.34 C ATOM 1372 CD LYS A 99 9.546 -8.268 -10.771 1.00 1.63 C ATOM 1373 CE LYS A 99 10.513 -9.324 -10.262 1.00 2.05 C ATOM 1374 NZ LYS A 99 11.040 -10.164 -11.368 1.00 2.69 N ATOM 0 H LYS A 99 7.645 -6.038 -6.681 1.00 0.80 H new ATOM 0 HA LYS A 99 6.545 -7.042 -8.300 1.00 0.78 H new ATOM 0 HB2 LYS A 99 8.726 -9.146 -8.230 1.00 1.02 H new ATOM 0 HB3 LYS A 99 7.432 -9.107 -9.410 1.00 1.02 H new ATOM 0 HG2 LYS A 99 8.216 -6.755 -10.033 1.00 1.34 H new ATOM 0 HG3 LYS A 99 9.616 -7.034 -9.017 1.00 1.34 H new ATOM 0 HD2 LYS A 99 8.792 -8.739 -11.402 1.00 1.63 H new ATOM 0 HD3 LYS A 99 10.083 -7.554 -11.395 1.00 1.63 H new ATOM 0 HE2 LYS A 99 11.342 -8.840 -9.746 1.00 2.05 H new ATOM 0 HE3 LYS A 99 10.009 -9.957 -9.532 1.00 2.05 H new ATOM 0 HZ1 LYS A 99 11.696 -10.873 -10.983 1.00 2.69 H new ATOM 0 HZ2 LYS A 99 10.251 -10.645 -11.845 1.00 2.69 H new ATOM 0 HZ3 LYS A 99 11.542 -9.563 -12.052 1.00 2.69 H new ATOM 1388 N ALA A 100 5.063 -9.011 -7.718 1.00 0.51 N ATOM 1389 CA ALA A 100 3.989 -9.801 -7.130 1.00 0.43 C ATOM 1390 C ALA A 100 2.918 -10.095 -8.159 1.00 0.40 C ATOM 1391 O ALA A 100 3.139 -9.926 -9.357 1.00 0.55 O ATOM 1392 CB ALA A 100 3.354 -9.054 -5.974 1.00 0.43 C ATOM 0 H ALA A 100 4.861 -8.671 -8.658 1.00 0.51 H new ATOM 0 HA ALA A 100 4.422 -10.736 -6.774 1.00 0.43 H new ATOM 0 HB1 ALA A 100 2.554 -9.658 -5.546 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.107 -8.856 -5.211 1.00 0.43 H new ATOM 0 HB3 ALA A 100 2.944 -8.110 -6.332 1.00 0.43 H new ATOM 1398 N GLU A 101 1.753 -10.518 -7.687 1.00 0.34 N ATOM 1399 CA GLU A 101 0.617 -10.692 -8.567 1.00 0.40 C ATOM 1400 C GLU A 101 -0.222 -9.421 -8.638 1.00 0.43 C ATOM 1401 O GLU A 101 -0.980 -9.219 -9.584 1.00 0.67 O ATOM 1402 CB GLU A 101 -0.262 -11.862 -8.130 1.00 0.50 C ATOM 1403 CG GLU A 101 0.415 -13.213 -8.249 1.00 0.67 C ATOM 1404 CD GLU A 101 -0.584 -14.346 -8.325 1.00 1.24 C ATOM 1405 OE1 GLU A 101 -1.136 -14.726 -7.270 1.00 1.99 O ATOM 1406 OE2 GLU A 101 -0.812 -14.871 -9.430 1.00 1.57 O ATOM 0 H GLU A 101 1.575 -10.744 -6.708 1.00 0.34 H new ATOM 0 HA GLU A 101 1.016 -10.911 -9.557 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.567 -11.709 -7.095 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -1.170 -11.867 -8.732 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.045 -13.225 -9.139 1.00 0.67 H new ATOM 0 HG3 GLU A 101 1.071 -13.366 -7.392 1.00 0.67 H new ATOM 1413 N PHE A 102 -0.079 -8.560 -7.636 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.856 -7.346 -7.561 1.00 0.40 C ATOM 1415 C PHE A 102 -0.138 -6.211 -8.282 1.00 0.45 C ATOM 1416 O PHE A 102 0.966 -6.397 -8.785 1.00 0.80 O ATOM 1417 CB PHE A 102 -1.160 -6.990 -6.098 1.00 0.84 C ATOM 1418 CG PHE A 102 -0.137 -7.401 -5.114 1.00 0.45 C ATOM 1419 CD1 PHE A 102 -0.120 -8.687 -4.627 1.00 0.52 C ATOM 1420 CD2 PHE A 102 0.820 -6.507 -4.699 1.00 0.62 C ATOM 1421 CE1 PHE A 102 0.849 -9.080 -3.737 1.00 0.59 C ATOM 1422 CE2 PHE A 102 1.788 -6.888 -3.803 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.732 -8.160 -3.237 1.00 0.44 C ATOM 0 H PHE A 102 0.575 -8.689 -6.864 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.810 -7.505 -8.064 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -1.294 -5.911 -6.026 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -2.109 -7.449 -5.821 1.00 0.84 H new ATOM 0 HD1 PHE A 102 -0.873 -9.392 -4.946 1.00 0.52 H new ATOM 0 HD2 PHE A 102 0.811 -5.497 -5.081 1.00 0.62 H new ATOM 0 HE1 PHE A 102 0.915 -10.114 -3.431 1.00 0.59 H new ATOM 0 HE2 PHE A 102 2.585 -6.208 -3.539 1.00 0.58 H new ATOM 0 HZ PHE A 102 2.379 -8.418 -2.412 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.772 -5.040 -8.393 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.169 -3.866 -9.039 1.00 0.39 C ATOM 1435 C PRO A 103 0.982 -3.285 -8.228 1.00 0.41 C ATOM 1436 O PRO A 103 0.760 -2.610 -7.227 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.336 -2.880 -9.095 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.170 -3.273 -7.934 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.141 -4.752 -7.928 1.00 0.27 C ATOM 0 HA PRO A 103 0.265 -4.102 -10.010 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -0.995 -1.848 -9.014 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.887 -2.961 -10.032 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -1.771 -2.866 -7.005 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -3.189 -2.898 -8.034 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -2.327 -5.159 -6.934 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.894 -5.176 -8.592 1.00 0.27 H new ATOM 1447 N ILE A 104 2.211 -3.540 -8.650 1.00 0.35 N ATOM 1448 CA ILE A 104 3.350 -2.937 -7.987 1.00 0.35 C ATOM 1449 C ILE A 104 3.805 -1.781 -8.825 1.00 0.33 C ATOM 1450 O ILE A 104 4.138 -1.938 -10.000 1.00 0.44 O ATOM 1451 CB ILE A 104 4.554 -3.872 -7.753 1.00 0.41 C ATOM 1452 CG1 ILE A 104 4.121 -5.195 -7.126 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.589 -3.171 -6.874 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.806 -6.252 -8.155 1.00 1.34 C ATOM 0 H ILE A 104 2.440 -4.150 -9.435 1.00 0.35 H new ATOM 0 HA ILE A 104 3.007 -2.649 -6.993 1.00 0.35 H new ATOM 0 HB ILE A 104 5.002 -4.102 -8.720 1.00 0.41 H new ATOM 0 HG12 ILE A 104 4.912 -5.557 -6.470 1.00 0.52 H new ATOM 0 HG13 ILE A 104 3.242 -5.027 -6.503 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.438 -3.835 -6.711 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.930 -2.261 -7.368 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.139 -2.916 -5.915 1.00 0.45 H new ATOM 0 HD11 ILE A 104 3.504 -7.171 -7.652 1.00 1.34 H new ATOM 0 HD12 ILE A 104 2.995 -5.906 -8.796 1.00 1.34 H new ATOM 0 HD13 ILE A 104 4.691 -6.444 -8.762 1.00 1.34 H new ATOM 1466 N MET A 105 3.788 -0.625 -8.224 1.00 0.29 N ATOM 1467 CA MET A 105 3.987 0.602 -8.944 1.00 0.30 C ATOM 1468 C MET A 105 5.452 0.946 -9.056 1.00 0.27 C ATOM 1469 O MET A 105 6.310 0.098 -8.808 1.00 0.35 O ATOM 1470 CB MET A 105 3.212 1.699 -8.251 1.00 0.43 C ATOM 1471 CG MET A 105 1.730 1.411 -8.182 1.00 1.50 C ATOM 1472 SD MET A 105 0.908 1.383 -9.795 1.00 2.49 S ATOM 1473 CE MET A 105 1.219 -0.284 -10.369 1.00 3.03 C ATOM 0 H MET A 105 3.636 -0.506 -7.222 1.00 0.29 H new ATOM 0 HA MET A 105 3.619 0.487 -9.964 1.00 0.30 H new ATOM 0 HB2 MET A 105 3.600 1.830 -7.241 1.00 0.43 H new ATOM 0 HB3 MET A 105 3.371 2.640 -8.778 1.00 0.43 H new ATOM 0 HG2 MET A 105 1.580 0.449 -7.693 1.00 1.50 H new ATOM 0 HG3 MET A 105 1.253 2.165 -7.556 1.00 1.50 H new ATOM 0 HE1 MET A 105 0.374 -0.627 -10.966 1.00 3.03 H new ATOM 0 HE2 MET A 105 2.123 -0.296 -10.978 1.00 3.03 H new ATOM 0 HE3 MET A 105 1.350 -0.945 -9.512 1.00 3.03 H new ATOM 1483 N ALA A 106 5.750 2.181 -9.409 1.00 0.33 N ATOM 1484 CA ALA A 106 7.132 2.552 -9.696 1.00 0.52 C ATOM 1485 C ALA A 106 7.970 2.526 -8.446 1.00 0.66 C ATOM 1486 O ALA A 106 9.193 2.426 -8.519 1.00 1.46 O ATOM 1487 CB ALA A 106 7.212 3.922 -10.333 1.00 0.70 C ATOM 0 H ALA A 106 5.071 2.936 -9.504 1.00 0.33 H new ATOM 0 HA ALA A 106 7.523 1.817 -10.399 1.00 0.52 H new ATOM 0 HB1 ALA A 106 8.254 4.169 -10.534 1.00 0.70 H new ATOM 0 HB2 ALA A 106 6.652 3.922 -11.268 1.00 0.70 H new ATOM 0 HB3 ALA A 106 6.788 4.663 -9.656 1.00 0.70 H new ATOM 1493 N LYS A 107 7.256 2.517 -7.324 1.00 0.40 N ATOM 1494 CA LYS A 107 7.771 2.837 -6.004 1.00 0.36 C ATOM 1495 C LYS A 107 7.808 4.323 -5.860 1.00 0.38 C ATOM 1496 O LYS A 107 8.109 5.067 -6.795 1.00 0.59 O ATOM 1497 CB LYS A 107 9.167 2.265 -5.700 1.00 0.49 C ATOM 1498 CG LYS A 107 10.339 3.153 -6.105 1.00 0.84 C ATOM 1499 CD LYS A 107 11.681 2.479 -5.859 1.00 0.83 C ATOM 1500 CE LYS A 107 11.774 1.132 -6.559 1.00 0.95 C ATOM 1501 NZ LYS A 107 13.157 0.588 -6.529 1.00 1.76 N ATOM 0 H LYS A 107 6.265 2.277 -7.313 1.00 0.40 H new ATOM 0 HA LYS A 107 7.098 2.367 -5.287 1.00 0.36 H new ATOM 0 HB2 LYS A 107 9.235 2.067 -4.630 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.267 1.306 -6.208 1.00 0.49 H new ATOM 0 HG2 LYS A 107 10.251 3.409 -7.161 1.00 0.84 H new ATOM 0 HG3 LYS A 107 10.295 4.087 -5.545 1.00 0.84 H new ATOM 0 HD2 LYS A 107 12.483 3.128 -6.211 1.00 0.83 H new ATOM 0 HD3 LYS A 107 11.828 2.343 -4.788 1.00 0.83 H new ATOM 0 HE2 LYS A 107 11.095 0.426 -6.080 1.00 0.95 H new ATOM 0 HE3 LYS A 107 11.447 1.237 -7.594 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 13.122 -0.451 -6.544 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 13.682 0.928 -7.360 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 13.636 0.906 -5.663 1.00 1.76 H new ATOM 1515 N ILE A 108 7.441 4.747 -4.702 1.00 0.31 N ATOM 1516 CA ILE A 108 7.619 6.090 -4.322 1.00 0.35 C ATOM 1517 C ILE A 108 8.256 6.023 -2.970 1.00 0.36 C ATOM 1518 O ILE A 108 8.234 4.974 -2.326 1.00 0.42 O ATOM 1519 CB ILE A 108 6.293 6.900 -4.299 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.618 6.863 -2.917 1.00 0.82 C ATOM 1521 CG2 ILE A 108 5.343 6.386 -5.387 1.00 0.68 C ATOM 1522 CD1 ILE A 108 4.983 5.545 -2.552 1.00 0.64 C ATOM 0 H ILE A 108 7.005 4.160 -3.990 1.00 0.31 H new ATOM 0 HA ILE A 108 8.237 6.623 -5.045 1.00 0.35 H new ATOM 0 HB ILE A 108 6.536 7.942 -4.505 1.00 0.48 H new ATOM 0 HG12 ILE A 108 6.361 7.113 -2.160 1.00 0.82 H new ATOM 0 HG13 ILE A 108 4.854 7.639 -2.882 1.00 0.82 H new ATOM 0 HG21 ILE A 108 4.417 6.960 -5.362 1.00 0.68 H new ATOM 0 HG22 ILE A 108 5.814 6.498 -6.364 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.122 5.333 -5.210 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.534 5.619 -1.561 1.00 0.64 H new ATOM 0 HD12 ILE A 108 4.212 5.298 -3.282 1.00 0.64 H new ATOM 0 HD13 ILE A 108 5.743 4.764 -2.548 1.00 0.64 H new ATOM 1534 N ASN A 109 8.877 7.082 -2.585 1.00 0.38 N ATOM 1535 CA ASN A 109 9.486 7.181 -1.282 1.00 0.44 C ATOM 1536 C ASN A 109 8.428 7.118 -0.197 1.00 0.47 C ATOM 1537 O ASN A 109 8.024 8.166 0.314 1.00 0.76 O ATOM 1538 CB ASN A 109 10.161 8.512 -1.204 1.00 0.53 C ATOM 1539 CG ASN A 109 11.160 8.607 -0.086 1.00 0.98 C ATOM 1540 OD1 ASN A 109 12.355 8.413 -0.303 1.00 1.73 O ATOM 1541 ND2 ASN A 109 10.682 8.891 1.117 1.00 1.16 N ATOM 0 H ASN A 109 8.984 7.917 -3.161 1.00 0.38 H new ATOM 0 HA ASN A 109 10.189 6.360 -1.139 1.00 0.44 H new ATOM 0 HB2 ASN A 109 10.664 8.712 -2.150 1.00 0.53 H new ATOM 0 HB3 ASN A 109 9.406 9.287 -1.074 1.00 0.53 H new ATOM 0 HD21 ASN A 109 11.314 8.957 1.915 1.00 1.16 H new ATOM 0 HD22 ASN A 109 9.682 9.044 1.245 1.00 1.16 H new ATOM 1548 N VAL A 110 7.955 5.924 0.160 1.00 0.41 N ATOM 1549 CA VAL A 110 6.942 5.858 1.189 1.00 0.42 C ATOM 1550 C VAL A 110 7.622 6.010 2.532 1.00 0.44 C ATOM 1551 O VAL A 110 8.000 5.040 3.188 1.00 0.48 O ATOM 1552 CB VAL A 110 6.143 4.533 1.150 1.00 0.43 C ATOM 1553 CG1 VAL A 110 4.665 4.795 0.946 1.00 0.60 C ATOM 1554 CG2 VAL A 110 6.651 3.618 0.060 1.00 0.77 C ATOM 0 H VAL A 110 8.247 5.030 -0.234 1.00 0.41 H new ATOM 0 HA VAL A 110 6.225 6.661 1.019 1.00 0.42 H new ATOM 0 HB VAL A 110 6.286 4.042 2.113 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.127 3.847 0.922 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.287 5.406 1.766 1.00 0.60 H new ATOM 0 HG13 VAL A 110 4.515 5.320 0.003 1.00 0.60 H new ATOM 0 HG21 VAL A 110 6.070 2.696 0.059 1.00 0.77 H new ATOM 0 HG22 VAL A 110 6.550 4.112 -0.906 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.700 3.385 0.240 1.00 0.77 H new ATOM 1564 N ASN A 111 7.707 7.262 2.936 1.00 0.48 N ATOM 1565 CA ASN A 111 8.276 7.666 4.197 1.00 0.56 C ATOM 1566 C ASN A 111 8.255 9.180 4.242 1.00 0.62 C ATOM 1567 O ASN A 111 7.809 9.823 3.291 1.00 0.67 O ATOM 1568 CB ASN A 111 9.694 7.148 4.366 1.00 0.65 C ATOM 1569 CG ASN A 111 9.998 6.853 5.819 1.00 1.20 C ATOM 1570 OD1 ASN A 111 10.424 7.731 6.568 1.00 1.90 O ATOM 1571 ND2 ASN A 111 9.769 5.616 6.227 1.00 1.72 N ATOM 0 H ASN A 111 7.371 8.046 2.376 1.00 0.48 H new ATOM 0 HA ASN A 111 7.691 7.245 5.015 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.827 6.243 3.773 1.00 0.65 H new ATOM 0 HB3 ASN A 111 10.401 7.885 3.986 1.00 0.65 H new ATOM 0 HD21 ASN A 111 9.946 5.358 7.198 1.00 1.72 H new ATOM 0 HD22 ASN A 111 9.415 4.920 5.571 1.00 1.72 H new ATOM 1578 N GLY A 112 8.754 9.751 5.315 1.00 0.73 N ATOM 1579 CA GLY A 112 8.617 11.171 5.512 1.00 0.85 C ATOM 1580 C GLY A 112 9.727 12.028 4.922 1.00 0.93 C ATOM 1581 O GLY A 112 10.092 13.026 5.538 1.00 1.47 O ATOM 0 H GLY A 112 9.253 9.258 6.056 1.00 0.73 H new ATOM 0 HA2 GLY A 112 7.668 11.489 5.080 1.00 0.85 H new ATOM 0 HA3 GLY A 112 8.561 11.367 6.583 1.00 0.85 H new ATOM 1585 N GLU A 113 10.289 11.688 3.752 1.00 0.88 N ATOM 1586 CA GLU A 113 11.221 12.636 3.134 1.00 1.23 C ATOM 1587 C GLU A 113 10.575 13.347 1.946 1.00 1.10 C ATOM 1588 O GLU A 113 10.697 14.564 1.805 1.00 1.39 O ATOM 1589 CB GLU A 113 12.553 11.987 2.703 1.00 1.61 C ATOM 1590 CG GLU A 113 12.554 11.413 1.294 1.00 1.83 C ATOM 1591 CD GLU A 113 13.904 11.514 0.607 1.00 2.29 C ATOM 1592 OE1 GLU A 113 14.295 12.625 0.192 1.00 2.65 O ATOM 1593 OE2 GLU A 113 14.598 10.481 0.502 1.00 2.81 O ATOM 0 H GLU A 113 10.128 10.819 3.242 1.00 0.88 H new ATOM 0 HA GLU A 113 11.458 13.368 3.906 1.00 1.23 H new ATOM 0 HB2 GLU A 113 13.345 12.732 2.778 1.00 1.61 H new ATOM 0 HB3 GLU A 113 12.797 11.190 3.405 1.00 1.61 H new ATOM 0 HG2 GLU A 113 12.252 10.366 1.335 1.00 1.83 H new ATOM 0 HG3 GLU A 113 11.809 11.937 0.695 1.00 1.83 H new ATOM 1600 N ASN A 114 9.879 12.597 1.096 1.00 0.79 N ATOM 1601 CA ASN A 114 9.277 13.174 -0.092 1.00 0.79 C ATOM 1602 C ASN A 114 7.840 12.716 -0.197 1.00 0.79 C ATOM 1603 O ASN A 114 6.960 13.470 -0.619 1.00 1.22 O ATOM 1604 CB ASN A 114 10.071 12.767 -1.337 1.00 0.87 C ATOM 1605 CG ASN A 114 9.549 13.400 -2.611 1.00 1.45 C ATOM 1606 OD1 ASN A 114 8.986 14.496 -2.596 1.00 2.06 O ATOM 1607 ND2 ASN A 114 9.748 12.718 -3.726 1.00 2.16 N ATOM 0 H ASN A 114 9.721 11.596 1.210 1.00 0.79 H new ATOM 0 HA ASN A 114 9.297 14.261 -0.020 1.00 0.79 H new ATOM 0 HB2 ASN A 114 11.116 13.047 -1.201 1.00 0.87 H new ATOM 0 HB3 ASN A 114 10.042 11.682 -1.440 1.00 0.87 H new ATOM 0 HD21 ASN A 114 9.431 13.096 -4.619 1.00 2.16 H new ATOM 0 HD22 ASN A 114 10.219 11.814 -3.694 1.00 2.16 H new ATOM 1614 N ALA A 115 7.619 11.472 0.239 1.00 0.59 N ATOM 1615 CA ALA A 115 6.300 10.875 0.267 1.00 0.61 C ATOM 1616 C ALA A 115 5.661 10.908 -1.109 1.00 0.68 C ATOM 1617 O ALA A 115 6.344 11.090 -2.118 1.00 1.26 O ATOM 1618 CB ALA A 115 5.433 11.579 1.295 1.00 0.86 C ATOM 0 H ALA A 115 8.358 10.858 0.581 1.00 0.59 H new ATOM 0 HA ALA A 115 6.395 9.829 0.557 1.00 0.61 H new ATOM 0 HB1 ALA A 115 4.443 11.123 1.309 1.00 0.86 H new ATOM 0 HB2 ALA A 115 5.889 11.486 2.281 1.00 0.86 H new ATOM 0 HB3 ALA A 115 5.343 12.634 1.034 1.00 0.86 H new ATOM 1624 N HIS A 116 4.363 10.693 -1.164 1.00 0.42 N ATOM 1625 CA HIS A 116 3.651 10.802 -2.386 1.00 0.35 C ATOM 1626 C HIS A 116 2.255 11.228 -2.058 1.00 0.29 C ATOM 1627 O HIS A 116 1.561 10.513 -1.337 1.00 0.29 O ATOM 1628 CB HIS A 116 3.677 9.470 -3.145 1.00 0.35 C ATOM 1629 CG HIS A 116 2.768 9.461 -4.313 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.432 9.530 -4.132 1.00 0.33 N ATOM 1631 CD2 HIS A 116 2.976 9.514 -5.649 1.00 0.31 C ATOM 1632 CE1 HIS A 116 0.835 9.655 -5.271 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.737 9.644 -6.232 1.00 0.32 N ATOM 0 H HIS A 116 3.790 10.440 -0.359 1.00 0.42 H new ATOM 0 HA HIS A 116 4.114 11.540 -3.041 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.694 9.267 -3.480 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.398 8.664 -2.466 1.00 0.35 H new ATOM 0 HD2 HIS A 116 3.928 9.464 -6.157 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.231 9.753 -5.413 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.549 9.719 -7.232 1.00 0.32 H new ATOM 1642 N PRO A 117 1.834 12.377 -2.611 1.00 0.31 N ATOM 1643 CA PRO A 117 0.571 13.048 -2.311 1.00 0.31 C ATOM 1644 C PRO A 117 -0.577 12.097 -1.987 1.00 0.26 C ATOM 1645 O PRO A 117 -1.381 12.386 -1.125 1.00 0.27 O ATOM 1646 CB PRO A 117 0.277 13.838 -3.596 1.00 0.37 C ATOM 1647 CG PRO A 117 1.488 13.700 -4.468 1.00 0.40 C ATOM 1648 CD PRO A 117 2.582 13.145 -3.606 1.00 0.38 C ATOM 0 HA PRO A 117 0.657 13.663 -1.415 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.608 13.447 -4.097 1.00 0.37 H new ATOM 0 HB3 PRO A 117 0.079 14.886 -3.370 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.285 13.037 -5.309 1.00 0.40 H new ATOM 0 HG3 PRO A 117 1.776 14.665 -4.885 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.268 12.516 -4.174 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.178 13.934 -3.147 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.640 10.967 -2.680 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.682 9.965 -2.443 1.00 0.23 C ATOM 1658 C LEU A 118 -1.638 9.336 -1.044 1.00 0.27 C ATOM 1659 O LEU A 118 -2.578 9.466 -0.260 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.509 8.868 -3.466 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.158 7.550 -3.125 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.637 7.609 -3.429 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.459 6.434 -3.874 1.00 0.27 C ATOM 0 H LEU A 118 0.021 10.717 -3.416 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.643 10.474 -2.524 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.912 9.216 -4.417 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.442 8.700 -3.615 1.00 0.24 H new ATOM 0 HG LEU A 118 -2.057 7.346 -2.059 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.098 6.653 -3.180 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -4.099 8.400 -2.838 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.783 7.817 -4.489 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -1.928 5.481 -3.628 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.538 6.611 -4.947 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.408 6.406 -3.587 1.00 0.27 H new ATOM 1675 N TYR A 119 -0.536 8.686 -0.705 1.00 0.32 N ATOM 1676 CA TYR A 119 -0.455 8.016 0.580 1.00 0.42 C ATOM 1677 C TYR A 119 -0.079 9.050 1.606 1.00 0.40 C ATOM 1678 O TYR A 119 -0.314 8.888 2.789 1.00 0.41 O ATOM 1679 CB TYR A 119 0.507 6.835 0.591 1.00 0.57 C ATOM 1680 CG TYR A 119 1.896 7.241 0.884 1.00 0.54 C ATOM 1681 CD1 TYR A 119 2.337 7.328 2.178 1.00 1.09 C ATOM 1682 CD2 TYR A 119 2.776 7.498 -0.150 1.00 0.92 C ATOM 1683 CE1 TYR A 119 3.629 7.665 2.449 1.00 1.88 C ATOM 1684 CE2 TYR A 119 4.075 7.825 0.103 1.00 1.74 C ATOM 1685 CZ TYR A 119 4.440 8.083 1.455 1.00 2.20 C ATOM 1686 OH TYR A 119 5.800 8.225 1.648 1.00 3.04 O ATOM 0 H TYR A 119 0.297 8.609 -1.288 1.00 0.32 H new ATOM 0 HA TYR A 119 -1.426 7.577 0.811 1.00 0.42 H new ATOM 0 HB2 TYR A 119 0.179 6.110 1.336 1.00 0.57 H new ATOM 0 HB3 TYR A 119 0.474 6.335 -0.377 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.654 7.128 2.991 1.00 1.09 H new ATOM 0 HD2 TYR A 119 2.430 7.439 -1.171 1.00 0.92 H new ATOM 0 HE1 TYR A 119 4.004 7.598 3.460 1.00 1.88 H new ATOM 0 HE2 TYR A 119 4.802 7.886 -0.694 1.00 1.74 H new ATOM 0 HH TYR A 119 6.270 8.054 0.805 1.00 3.04 H new ATOM 1696 N GLU A 120 0.586 10.084 1.127 1.00 0.40 N ATOM 1697 CA GLU A 120 0.881 11.241 1.930 1.00 0.42 C ATOM 1698 C GLU A 120 -0.431 11.810 2.395 1.00 0.37 C ATOM 1699 O GLU A 120 -0.583 12.201 3.545 1.00 0.43 O ATOM 1700 CB GLU A 120 1.651 12.241 1.087 1.00 0.50 C ATOM 1701 CG GLU A 120 2.353 13.310 1.876 1.00 0.76 C ATOM 1702 CD GLU A 120 1.491 14.530 2.120 1.00 1.58 C ATOM 1703 OE1 GLU A 120 1.328 15.340 1.185 1.00 2.44 O ATOM 1704 OE2 GLU A 120 0.967 14.682 3.242 1.00 1.93 O ATOM 0 H GLU A 120 0.934 10.139 0.170 1.00 0.40 H new ATOM 0 HA GLU A 120 1.494 10.990 2.795 1.00 0.42 H new ATOM 0 HB2 GLU A 120 2.388 11.703 0.491 1.00 0.50 H new ATOM 0 HB3 GLU A 120 0.962 12.716 0.389 1.00 0.50 H new ATOM 0 HG2 GLU A 120 2.669 12.898 2.834 1.00 0.76 H new ATOM 0 HG3 GLU A 120 3.256 13.611 1.345 1.00 0.76 H new ATOM 1711 N TYR A 121 -1.398 11.798 1.491 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.768 12.112 1.872 1.00 0.28 C ATOM 1713 C TYR A 121 -3.296 11.063 2.848 1.00 0.27 C ATOM 1714 O TYR A 121 -4.114 11.360 3.712 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.698 12.202 0.656 1.00 0.28 C ATOM 1716 CG TYR A 121 -5.153 12.099 1.028 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.823 13.175 1.584 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.844 10.909 0.856 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -7.145 13.070 1.955 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -7.161 10.795 1.228 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.810 11.878 1.778 1.00 0.46 C ATOM 1722 OH TYR A 121 -9.128 11.765 2.155 1.00 0.56 O ATOM 0 H TYR A 121 -1.265 11.578 0.504 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.755 13.090 2.353 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.525 13.147 0.141 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -3.450 11.406 -0.046 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -5.302 14.110 1.729 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -5.338 10.059 0.423 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.658 13.919 2.383 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.685 9.861 1.090 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.447 10.859 1.961 1.00 0.56 H new ATOM 1732 N MET A 122 -2.795 9.847 2.737 1.00 0.27 N ATOM 1733 CA MET A 122 -3.343 8.736 3.523 1.00 0.29 C ATOM 1734 C MET A 122 -2.935 8.851 4.968 1.00 0.33 C ATOM 1735 O MET A 122 -3.770 8.855 5.863 1.00 0.35 O ATOM 1736 CB MET A 122 -2.888 7.389 2.994 1.00 0.33 C ATOM 1737 CG MET A 122 -3.473 7.052 1.657 1.00 0.71 C ATOM 1738 SD MET A 122 -2.858 5.495 1.027 1.00 0.56 S ATOM 1739 CE MET A 122 -3.536 5.585 -0.607 1.00 0.55 C ATOM 0 H MET A 122 -2.021 9.596 2.122 1.00 0.27 H new ATOM 0 HA MET A 122 -4.428 8.798 3.437 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.801 7.384 2.919 1.00 0.33 H new ATOM 0 HB3 MET A 122 -3.162 6.614 3.709 1.00 0.33 H new ATOM 0 HG2 MET A 122 -4.559 7.006 1.738 1.00 0.71 H new ATOM 0 HG3 MET A 122 -3.239 7.847 0.949 1.00 0.71 H new ATOM 0 HE1 MET A 122 -4.358 4.875 -0.700 1.00 0.55 H new ATOM 0 HE2 MET A 122 -3.905 6.594 -0.793 1.00 0.55 H new ATOM 0 HE3 MET A 122 -2.763 5.342 -1.336 1.00 0.55 H new ATOM 1749 N LYS A 123 -1.640 8.935 5.178 1.00 0.37 N ATOM 1750 CA LYS A 123 -1.090 9.098 6.501 1.00 0.45 C ATOM 1751 C LYS A 123 -1.388 10.492 7.044 1.00 0.47 C ATOM 1752 O LYS A 123 -1.369 10.704 8.248 1.00 0.54 O ATOM 1753 CB LYS A 123 0.403 8.736 6.531 1.00 0.53 C ATOM 1754 CG LYS A 123 1.193 9.133 5.294 1.00 0.48 C ATOM 1755 CD LYS A 123 1.629 10.592 5.317 1.00 1.00 C ATOM 1756 CE LYS A 123 2.576 10.890 6.466 1.00 1.05 C ATOM 1757 NZ LYS A 123 3.054 12.296 6.432 1.00 1.46 N ATOM 0 H LYS A 123 -0.941 8.892 4.436 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.581 8.396 7.175 1.00 0.45 H new ATOM 0 HB2 LYS A 123 0.858 9.211 7.400 1.00 0.53 H new ATOM 0 HB3 LYS A 123 0.496 7.659 6.671 1.00 0.53 H new ATOM 0 HG2 LYS A 123 2.074 8.496 5.211 1.00 0.48 H new ATOM 0 HG3 LYS A 123 0.585 8.954 4.407 1.00 0.48 H new ATOM 0 HD2 LYS A 123 2.116 10.839 4.374 1.00 1.00 H new ATOM 0 HD3 LYS A 123 0.750 11.231 5.398 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.071 10.700 7.413 1.00 1.05 H new ATOM 0 HE3 LYS A 123 3.430 10.214 6.419 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 3.698 12.463 7.231 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 3.558 12.470 5.539 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 2.241 12.941 6.502 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.650 11.459 6.159 1.00 0.43 N ATOM 1772 CA LYS A 124 -2.124 12.752 6.626 1.00 0.50 C ATOM 1773 C LYS A 124 -3.582 12.628 7.083 1.00 0.49 C ATOM 1774 O LYS A 124 -4.054 13.403 7.916 1.00 0.57 O ATOM 1775 CB LYS A 124 -1.933 13.876 5.580 1.00 0.56 C ATOM 1776 CG LYS A 124 -3.067 14.067 4.574 1.00 0.59 C ATOM 1777 CD LYS A 124 -4.169 14.978 5.104 1.00 0.97 C ATOM 1778 CE LYS A 124 -3.646 16.368 5.446 1.00 1.41 C ATOM 1779 NZ LYS A 124 -3.187 17.111 4.243 1.00 1.99 N ATOM 0 H LYS A 124 -1.544 11.371 5.148 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.513 13.049 7.478 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.786 14.816 6.112 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -1.015 13.676 5.027 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -2.664 14.487 3.652 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.493 13.096 4.322 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -4.960 15.062 4.359 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -4.614 14.530 5.992 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -4.431 16.937 5.944 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -2.820 16.279 6.152 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -2.920 18.079 4.514 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -2.364 16.628 3.829 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -3.955 17.147 3.543 1.00 1.99 H new ATOM 1793 N THR A 125 -4.293 11.654 6.514 1.00 0.42 N ATOM 1794 CA THR A 125 -5.649 11.334 6.962 1.00 0.44 C ATOM 1795 C THR A 125 -5.598 10.581 8.293 1.00 0.44 C ATOM 1796 O THR A 125 -6.191 11.003 9.290 1.00 0.56 O ATOM 1797 CB THR A 125 -6.415 10.484 5.922 1.00 0.49 C ATOM 1798 OG1 THR A 125 -6.509 11.198 4.685 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.815 10.145 6.414 1.00 0.59 C ATOM 0 H THR A 125 -3.955 11.075 5.745 1.00 0.42 H new ATOM 0 HA THR A 125 -6.181 12.277 7.087 1.00 0.44 H new ATOM 0 HB THR A 125 -5.864 9.555 5.774 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.614 11.476 4.399 1.00 0.57 H new ATOM 0 HG21 THR A 125 -8.330 9.547 5.662 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.747 9.580 7.343 1.00 0.59 H new ATOM 0 HG23 THR A 125 -8.372 11.065 6.589 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.869 9.475 8.299 1.00 0.44 N ATOM 1808 CA LYS A 126 -4.668 8.678 9.494 1.00 0.54 C ATOM 1809 C LYS A 126 -3.209 8.238 9.571 1.00 0.57 C ATOM 1810 O LYS A 126 -2.795 7.293 8.895 1.00 0.68 O ATOM 1811 CB LYS A 126 -5.585 7.458 9.491 1.00 0.78 C ATOM 1812 CG LYS A 126 -5.461 6.624 10.750 1.00 1.26 C ATOM 1813 CD LYS A 126 -6.450 5.481 10.750 1.00 0.92 C ATOM 1814 CE LYS A 126 -7.852 5.960 11.090 1.00 1.27 C ATOM 1815 NZ LYS A 126 -7.906 6.582 12.437 1.00 1.85 N ATOM 0 H LYS A 126 -4.400 9.106 7.472 1.00 0.44 H new ATOM 0 HA LYS A 126 -4.912 9.284 10.367 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -6.618 7.787 9.379 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -5.353 6.837 8.626 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -4.447 6.231 10.830 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -5.629 7.253 11.624 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -6.455 5.002 9.771 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.137 4.727 11.472 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -8.182 6.681 10.342 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -8.544 5.119 11.049 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -8.893 6.619 12.763 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -7.342 6.017 13.103 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -7.521 7.547 12.389 1.00 1.85 H new ATOM 1829 N PRO A 127 -2.422 8.907 10.423 1.00 0.77 N ATOM 1830 CA PRO A 127 -0.964 8.750 10.474 1.00 1.04 C ATOM 1831 C PRO A 127 -0.550 7.392 11.017 1.00 1.27 C ATOM 1832 O PRO A 127 0.172 6.642 10.362 1.00 1.69 O ATOM 1833 CB PRO A 127 -0.508 9.879 11.416 1.00 1.28 C ATOM 1834 CG PRO A 127 -1.704 10.757 11.595 1.00 1.22 C ATOM 1835 CD PRO A 127 -2.893 9.860 11.426 1.00 0.95 C ATOM 0 HA PRO A 127 -0.513 8.806 9.483 1.00 1.04 H new ATOM 0 HB2 PRO A 127 -0.168 9.480 12.371 1.00 1.28 H new ATOM 0 HB3 PRO A 127 0.326 10.435 10.988 1.00 1.28 H new ATOM 0 HG2 PRO A 127 -1.703 11.225 12.580 1.00 1.22 H new ATOM 0 HG3 PRO A 127 -1.713 11.562 10.860 1.00 1.22 H new ATOM 0 HD2 PRO A 127 -3.167 9.367 12.359 1.00 0.95 H new ATOM 0 HD3 PRO A 127 -3.771 10.408 11.086 1.00 0.95 H new ATOM 1843 N GLY A 128 -1.028 7.072 12.209 1.00 1.55 N ATOM 1844 CA GLY A 128 -0.707 5.805 12.816 1.00 1.96 C ATOM 1845 C GLY A 128 -1.717 5.419 13.865 1.00 2.13 C ATOM 1846 O GLY A 128 -2.586 6.213 14.214 1.00 2.59 O ATOM 0 H GLY A 128 -1.635 7.673 12.767 1.00 1.55 H new ATOM 0 HA2 GLY A 128 -0.667 5.033 12.048 1.00 1.96 H new ATOM 0 HA3 GLY A 128 0.284 5.858 13.267 1.00 1.96 H new ATOM 1850 N ILE A 129 -1.625 4.196 14.352 1.00 2.17 N ATOM 1851 CA ILE A 129 -2.501 3.741 15.421 1.00 2.46 C ATOM 1852 C ILE A 129 -1.728 3.648 16.726 1.00 2.36 C ATOM 1853 O ILE A 129 -2.294 3.405 17.790 1.00 2.70 O ATOM 1854 CB ILE A 129 -3.165 2.380 15.090 1.00 2.91 C ATOM 1855 CG1 ILE A 129 -2.171 1.401 14.441 1.00 3.06 C ATOM 1856 CG2 ILE A 129 -4.371 2.589 14.187 1.00 3.44 C ATOM 1857 CD1 ILE A 129 -1.184 0.773 15.404 1.00 3.58 C ATOM 0 H ILE A 129 -0.955 3.499 14.027 1.00 2.17 H new ATOM 0 HA ILE A 129 -3.300 4.475 15.526 1.00 2.46 H new ATOM 0 HB ILE A 129 -3.495 1.936 16.029 1.00 2.91 H new ATOM 0 HG12 ILE A 129 -2.732 0.607 13.948 1.00 3.06 H new ATOM 0 HG13 ILE A 129 -1.616 1.928 13.665 1.00 3.06 H new ATOM 0 HG21 ILE A 129 -4.828 1.626 13.962 1.00 3.44 H new ATOM 0 HG22 ILE A 129 -5.097 3.226 14.692 1.00 3.44 H new ATOM 0 HG23 ILE A 129 -4.053 3.065 13.260 1.00 3.44 H new ATOM 0 HD11 ILE A 129 -0.524 0.098 14.859 1.00 3.58 H new ATOM 0 HD12 ILE A 129 -0.592 1.555 15.880 1.00 3.58 H new ATOM 0 HD13 ILE A 129 -1.726 0.213 16.167 1.00 3.58 H new ATOM 1869 N LEU A 130 -0.427 3.868 16.624 1.00 2.12 N ATOM 1870 CA LEU A 130 0.469 3.748 17.763 1.00 2.29 C ATOM 1871 C LEU A 130 1.297 5.007 17.891 1.00 2.20 C ATOM 1872 O LEU A 130 2.490 4.962 18.201 1.00 2.44 O ATOM 1873 CB LEU A 130 1.375 2.553 17.544 1.00 2.58 C ATOM 1874 CG LEU A 130 2.132 2.047 18.771 1.00 2.89 C ATOM 1875 CD1 LEU A 130 1.163 1.611 19.860 1.00 3.36 C ATOM 1876 CD2 LEU A 130 3.052 0.906 18.375 1.00 3.47 C ATOM 0 H LEU A 130 0.036 4.133 15.755 1.00 2.12 H new ATOM 0 HA LEU A 130 -0.106 3.611 18.679 1.00 2.29 H new ATOM 0 HB2 LEU A 130 0.773 1.734 17.151 1.00 2.58 H new ATOM 0 HB3 LEU A 130 2.103 2.811 16.775 1.00 2.58 H new ATOM 0 HG LEU A 130 2.737 2.860 19.171 1.00 2.89 H new ATOM 0 HD11 LEU A 130 1.723 1.254 20.724 1.00 3.36 H new ATOM 0 HD12 LEU A 130 0.542 2.457 20.154 1.00 3.36 H new ATOM 0 HD13 LEU A 130 0.529 0.809 19.483 1.00 3.36 H new ATOM 0 HD21 LEU A 130 3.589 0.550 19.254 1.00 3.47 H new ATOM 0 HD22 LEU A 130 2.462 0.091 17.955 1.00 3.47 H new ATOM 0 HD23 LEU A 130 3.767 1.257 17.631 1.00 3.47 H new ATOM 1888 N ALA A 131 0.644 6.126 17.636 1.00 2.45 N ATOM 1889 CA ALA A 131 1.310 7.407 17.530 1.00 2.67 C ATOM 1890 C ALA A 131 2.357 7.360 16.426 1.00 2.55 C ATOM 1891 O ALA A 131 3.466 7.874 16.564 1.00 3.21 O ATOM 1892 CB ALA A 131 1.921 7.835 18.860 1.00 3.28 C ATOM 0 H ALA A 131 -0.365 6.170 17.497 1.00 2.45 H new ATOM 0 HA ALA A 131 0.566 8.159 17.269 1.00 2.67 H new ATOM 0 HB1 ALA A 131 2.412 8.801 18.741 1.00 3.28 H new ATOM 0 HB2 ALA A 131 1.136 7.917 19.611 1.00 3.28 H new ATOM 0 HB3 ALA A 131 2.653 7.093 19.180 1.00 3.28 H new ATOM 1898 N THR A 132 1.984 6.710 15.338 1.00 2.02 N ATOM 1899 CA THR A 132 2.853 6.547 14.192 1.00 2.10 C ATOM 1900 C THR A 132 2.648 7.711 13.223 1.00 1.56 C ATOM 1901 O THR A 132 1.556 8.273 13.152 1.00 2.12 O ATOM 1902 CB THR A 132 2.532 5.214 13.489 1.00 2.73 C ATOM 1903 OG1 THR A 132 2.080 4.254 14.458 1.00 3.34 O ATOM 1904 CG2 THR A 132 3.753 4.670 12.768 1.00 3.56 C ATOM 0 H THR A 132 1.066 6.280 15.227 1.00 2.02 H new ATOM 0 HA THR A 132 3.892 6.537 14.521 1.00 2.10 H new ATOM 0 HB THR A 132 1.749 5.395 12.753 1.00 2.73 H new ATOM 0 HG1 THR A 132 1.875 3.408 14.009 1.00 3.34 H new ATOM 0 HG21 THR A 132 3.498 3.729 12.281 1.00 3.56 H new ATOM 0 HG22 THR A 132 4.083 5.389 12.018 1.00 3.56 H new ATOM 0 HG23 THR A 132 4.555 4.501 13.487 1.00 3.56 H new ATOM 1912 N LYS A 133 3.697 8.086 12.504 1.00 1.29 N ATOM 1913 CA LYS A 133 3.631 9.213 11.577 1.00 1.47 C ATOM 1914 C LYS A 133 3.272 8.747 10.177 1.00 1.14 C ATOM 1915 O LYS A 133 2.745 9.511 9.369 1.00 1.58 O ATOM 1916 CB LYS A 133 4.968 9.956 11.525 1.00 2.24 C ATOM 1917 CG LYS A 133 5.272 10.793 12.765 1.00 3.04 C ATOM 1918 CD LYS A 133 5.554 9.938 13.990 1.00 3.81 C ATOM 1919 CE LYS A 133 5.725 10.787 15.242 1.00 4.63 C ATOM 1920 NZ LYS A 133 6.855 11.749 15.127 1.00 5.17 N ATOM 0 H LYS A 133 4.607 7.627 12.543 1.00 1.29 H new ATOM 0 HA LYS A 133 2.856 9.887 11.942 1.00 1.47 H new ATOM 0 HB2 LYS A 133 5.769 9.229 11.387 1.00 2.24 H new ATOM 0 HB3 LYS A 133 4.974 10.607 10.651 1.00 2.24 H new ATOM 0 HG2 LYS A 133 6.132 11.432 12.566 1.00 3.04 H new ATOM 0 HG3 LYS A 133 4.428 11.451 12.971 1.00 3.04 H new ATOM 0 HD2 LYS A 133 4.736 9.233 14.138 1.00 3.81 H new ATOM 0 HD3 LYS A 133 6.456 9.350 13.823 1.00 3.81 H new ATOM 0 HE2 LYS A 133 4.803 11.336 15.434 1.00 4.63 H new ATOM 0 HE3 LYS A 133 5.893 10.135 16.099 1.00 4.63 H new ATOM 0 HZ1 LYS A 133 7.006 12.219 16.043 1.00 5.17 H new ATOM 0 HZ2 LYS A 133 7.719 11.239 14.853 1.00 5.17 H new ATOM 0 HZ3 LYS A 133 6.631 12.463 14.405 1.00 5.17 H new ATOM 1934 N ALA A 134 3.570 7.494 9.894 1.00 0.92 N ATOM 1935 CA ALA A 134 3.368 6.941 8.572 1.00 0.77 C ATOM 1936 C ALA A 134 3.258 5.429 8.649 1.00 0.81 C ATOM 1937 O ALA A 134 3.048 4.868 9.722 1.00 1.59 O ATOM 1938 CB ALA A 134 4.519 7.347 7.659 1.00 1.02 C ATOM 0 H ALA A 134 3.956 6.835 10.570 1.00 0.92 H new ATOM 0 HA ALA A 134 2.439 7.334 8.159 1.00 0.77 H new ATOM 0 HB1 ALA A 134 4.361 6.927 6.666 1.00 1.02 H new ATOM 0 HB2 ALA A 134 4.563 8.434 7.591 1.00 1.02 H new ATOM 0 HB3 ALA A 134 5.457 6.970 8.067 1.00 1.02 H new ATOM 1944 N ILE A 135 3.388 4.783 7.505 1.00 0.69 N ATOM 1945 CA ILE A 135 3.459 3.331 7.435 1.00 0.74 C ATOM 1946 C ILE A 135 4.571 2.791 8.355 1.00 1.09 C ATOM 1947 O ILE A 135 4.379 1.783 9.032 1.00 2.00 O ATOM 1948 CB ILE A 135 3.688 2.833 5.987 1.00 0.86 C ATOM 1949 CG1 ILE A 135 4.695 3.705 5.208 1.00 0.88 C ATOM 1950 CG2 ILE A 135 2.365 2.759 5.244 1.00 1.54 C ATOM 1951 CD1 ILE A 135 4.160 5.045 4.726 1.00 0.89 C ATOM 0 H ILE A 135 3.447 5.247 6.599 1.00 0.69 H new ATOM 0 HA ILE A 135 2.496 2.949 7.775 1.00 0.74 H new ATOM 0 HB ILE A 135 4.124 1.836 6.057 1.00 0.86 H new ATOM 0 HG12 ILE A 135 5.561 3.886 5.844 1.00 0.88 H new ATOM 0 HG13 ILE A 135 5.046 3.141 4.344 1.00 0.88 H new ATOM 0 HG21 ILE A 135 2.538 2.408 4.227 1.00 1.54 H new ATOM 0 HG22 ILE A 135 1.697 2.068 5.758 1.00 1.54 H new ATOM 0 HG23 ILE A 135 1.909 3.749 5.213 1.00 1.54 H new ATOM 0 HD11 ILE A 135 4.945 5.579 4.191 1.00 0.89 H new ATOM 0 HD12 ILE A 135 3.314 4.880 4.059 1.00 0.89 H new ATOM 0 HD13 ILE A 135 3.837 5.637 5.582 1.00 0.89 H new ATOM 1963 N LYS A 136 5.720 3.503 8.372 1.00 0.85 N ATOM 1964 CA LYS A 136 6.874 3.224 9.265 1.00 1.14 C ATOM 1965 C LYS A 136 7.553 1.862 9.008 1.00 0.75 C ATOM 1966 O LYS A 136 8.776 1.748 9.089 1.00 0.78 O ATOM 1967 CB LYS A 136 6.454 3.331 10.738 1.00 1.71 C ATOM 1968 CG LYS A 136 7.494 3.995 11.637 1.00 2.72 C ATOM 1969 CD LYS A 136 8.754 3.154 11.767 1.00 3.21 C ATOM 1970 CE LYS A 136 9.848 3.897 12.516 1.00 4.09 C ATOM 1971 NZ LYS A 136 11.085 3.081 12.644 1.00 4.81 N ATOM 0 H LYS A 136 5.877 4.301 7.757 1.00 0.85 H new ATOM 0 HA LYS A 136 7.618 3.986 9.031 1.00 1.14 H new ATOM 0 HB2 LYS A 136 5.523 3.895 10.799 1.00 1.71 H new ATOM 0 HB3 LYS A 136 6.246 2.331 11.119 1.00 1.71 H new ATOM 0 HG2 LYS A 136 7.751 4.974 11.232 1.00 2.72 H new ATOM 0 HG3 LYS A 136 7.066 4.162 12.625 1.00 2.72 H new ATOM 0 HD2 LYS A 136 8.520 2.226 12.289 1.00 3.21 H new ATOM 0 HD3 LYS A 136 9.113 2.880 10.775 1.00 3.21 H new ATOM 0 HE2 LYS A 136 10.078 4.826 11.995 1.00 4.09 H new ATOM 0 HE3 LYS A 136 9.488 4.169 13.508 1.00 4.09 H new ATOM 0 HZ1 LYS A 136 11.807 3.623 13.161 1.00 4.81 H new ATOM 0 HZ2 LYS A 136 10.871 2.206 13.164 1.00 4.81 H new ATOM 0 HZ3 LYS A 136 11.443 2.843 11.697 1.00 4.81 H new ATOM 1985 N TRP A 137 6.769 0.845 8.726 1.00 0.69 N ATOM 1986 CA TRP A 137 7.271 -0.509 8.521 1.00 0.45 C ATOM 1987 C TRP A 137 7.381 -0.852 7.045 1.00 0.43 C ATOM 1988 O TRP A 137 7.135 -0.016 6.182 1.00 0.55 O ATOM 1989 CB TRP A 137 6.358 -1.551 9.168 1.00 0.42 C ATOM 1990 CG TRP A 137 6.528 -1.740 10.637 1.00 0.62 C ATOM 1991 CD1 TRP A 137 7.114 -2.797 11.272 1.00 0.93 C ATOM 1992 CD2 TRP A 137 6.067 -0.862 11.659 1.00 1.00 C ATOM 1993 NE1 TRP A 137 7.073 -2.604 12.628 1.00 1.11 N ATOM 1994 CE2 TRP A 137 6.436 -1.423 12.888 1.00 1.16 C ATOM 1995 CE3 TRP A 137 5.391 0.353 11.649 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 6.148 -0.813 14.098 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 5.105 0.964 12.851 1.00 1.97 C ATOM 1998 CH2 TRP A 137 5.487 0.382 14.063 1.00 1.97 C ATOM 0 H TRP A 137 5.757 0.928 8.630 1.00 0.69 H new ATOM 0 HA TRP A 137 8.257 -0.533 8.984 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.323 -1.270 8.974 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.525 -2.509 8.676 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.545 -3.656 10.780 1.00 0.93 H new ATOM 0 HE1 TRP A 137 7.456 -3.238 13.329 1.00 1.11 H new ATOM 0 HE3 TRP A 137 5.095 0.810 10.716 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 6.436 -1.266 15.035 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 4.578 1.907 12.856 1.00 1.97 H new ATOM 0 HH2 TRP A 137 5.255 0.887 14.989 1.00 1.97 H new ATOM 2009 N ASN A 138 7.880 -2.061 6.810 1.00 0.37 N ATOM 2010 CA ASN A 138 7.668 -2.841 5.574 1.00 0.38 C ATOM 2011 C ASN A 138 6.213 -2.695 5.056 1.00 0.31 C ATOM 2012 O ASN A 138 5.553 -1.712 5.319 1.00 0.30 O ATOM 2013 CB ASN A 138 8.004 -4.316 5.868 1.00 0.41 C ATOM 2014 CG ASN A 138 8.457 -5.105 4.649 1.00 1.06 C ATOM 2015 OD1 ASN A 138 8.039 -4.842 3.526 1.00 2.04 O ATOM 2016 ND2 ASN A 138 9.317 -6.091 4.869 1.00 1.40 N ATOM 0 H ASN A 138 8.463 -2.549 7.490 1.00 0.37 H new ATOM 0 HA ASN A 138 8.321 -2.462 4.788 1.00 0.38 H new ATOM 0 HB2 ASN A 138 8.788 -4.355 6.624 1.00 0.41 H new ATOM 0 HB3 ASN A 138 7.125 -4.800 6.294 1.00 0.41 H new ATOM 0 HD21 ASN A 138 9.652 -6.659 4.091 1.00 1.40 H new ATOM 0 HD22 ASN A 138 9.643 -6.281 5.816 1.00 1.40 H new ATOM 2023 N PHE A 139 5.754 -3.688 4.299 1.00 0.34 N ATOM 2024 CA PHE A 139 4.476 -3.693 3.543 1.00 0.36 C ATOM 2025 C PHE A 139 3.299 -2.852 4.101 1.00 0.32 C ATOM 2026 O PHE A 139 2.429 -2.526 3.311 1.00 0.57 O ATOM 2027 CB PHE A 139 4.009 -5.132 3.487 1.00 0.55 C ATOM 2028 CG PHE A 139 4.239 -5.825 2.187 1.00 0.55 C ATOM 2029 CD1 PHE A 139 5.531 -6.010 1.750 1.00 0.61 C ATOM 2030 CD2 PHE A 139 3.186 -6.239 1.379 1.00 1.23 C ATOM 2031 CE1 PHE A 139 5.790 -6.602 0.545 1.00 1.22 C ATOM 2032 CE2 PHE A 139 3.441 -6.827 0.160 1.00 1.93 C ATOM 2033 CZ PHE A 139 4.584 -7.202 -0.180 1.00 1.89 C ATOM 0 H PHE A 139 6.276 -4.556 4.181 1.00 0.34 H new ATOM 0 HA PHE A 139 4.714 -3.228 2.586 1.00 0.36 H new ATOM 0 HB2 PHE A 139 4.515 -5.692 4.273 1.00 0.55 H new ATOM 0 HB3 PHE A 139 2.943 -5.160 3.711 1.00 0.55 H new ATOM 0 HD1 PHE A 139 6.353 -5.682 2.369 1.00 0.61 H new ATOM 0 HD2 PHE A 139 2.167 -6.099 1.708 1.00 1.23 H new ATOM 0 HE1 PHE A 139 6.786 -6.644 0.130 1.00 1.22 H new ATOM 0 HE2 PHE A 139 2.622 -6.970 -0.529 1.00 1.93 H new ATOM 0 HZ PHE A 139 4.717 -7.931 -0.966 1.00 1.89 H new ATOM 2043 N THR A 140 3.243 -2.571 5.418 1.00 0.25 N ATOM 2044 CA THR A 140 2.224 -1.705 6.045 1.00 0.25 C ATOM 2045 C THR A 140 1.207 -1.114 5.068 1.00 0.22 C ATOM 2046 O THR A 140 1.496 -0.187 4.306 1.00 0.29 O ATOM 2047 CB THR A 140 2.891 -0.563 6.825 1.00 0.37 C ATOM 2048 OG1 THR A 140 3.855 -1.096 7.732 1.00 0.48 O ATOM 2049 CG2 THR A 140 1.863 0.227 7.611 1.00 0.60 C ATOM 0 H THR A 140 3.916 -2.946 6.087 1.00 0.25 H new ATOM 0 HA THR A 140 1.670 -2.362 6.716 1.00 0.25 H new ATOM 0 HB THR A 140 3.376 0.099 6.108 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.673 -1.324 7.243 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.360 1.030 8.155 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.129 0.652 6.926 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.360 -0.433 8.318 1.00 0.60 H new ATOM 2057 N SER A 141 0.018 -1.667 5.130 1.00 0.19 N ATOM 2058 CA SER A 141 -1.052 -1.366 4.196 1.00 0.20 C ATOM 2059 C SER A 141 -1.828 -0.143 4.659 1.00 0.22 C ATOM 2060 O SER A 141 -1.615 0.326 5.762 1.00 0.39 O ATOM 2061 CB SER A 141 -1.978 -2.561 4.161 1.00 0.26 C ATOM 2062 OG SER A 141 -1.247 -3.759 4.337 1.00 0.62 O ATOM 0 H SER A 141 -0.241 -2.351 5.841 1.00 0.19 H new ATOM 0 HA SER A 141 -0.640 -1.160 3.208 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.730 -2.469 4.944 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.510 -2.589 3.210 1.00 0.26 H new ATOM 0 HG SER A 141 -0.988 -4.116 3.462 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.705 0.369 3.814 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.728 1.314 4.222 1.00 0.18 C ATOM 2070 C PHE A 142 -5.023 0.753 3.724 1.00 0.18 C ATOM 2071 O PHE A 142 -5.138 0.422 2.559 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.544 2.688 3.569 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.373 3.510 4.028 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -2.473 4.355 5.126 1.00 0.35 C ATOM 2075 CD2 PHE A 142 -1.146 3.376 3.402 1.00 0.42 C ATOM 2076 CE1 PHE A 142 -1.372 5.042 5.585 1.00 0.50 C ATOM 2077 CE2 PHE A 142 -0.046 4.076 3.850 1.00 0.55 C ATOM 2078 CZ PHE A 142 -0.270 5.145 4.799 1.00 0.57 C ATOM 0 H PHE A 142 -2.727 0.139 2.820 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.686 1.448 5.303 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.454 2.542 2.493 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.452 3.268 3.738 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -3.424 4.474 5.624 1.00 0.35 H new ATOM 0 HD2 PHE A 142 -1.049 2.716 2.553 1.00 0.42 H new ATOM 0 HE1 PHE A 142 -1.385 5.496 6.565 1.00 0.50 H new ATOM 0 HE2 PHE A 142 0.948 3.835 3.505 1.00 0.55 H new ATOM 0 HZ PHE A 142 0.406 5.983 4.878 1.00 0.57 H new ATOM 2088 N LEU A 143 -5.996 0.616 4.562 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.249 0.145 4.070 1.00 0.16 C ATOM 2090 C LEU A 143 -7.976 1.293 3.444 1.00 0.15 C ATOM 2091 O LEU A 143 -8.491 2.177 4.115 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.063 -0.501 5.159 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.555 -0.574 4.864 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -9.862 -1.667 3.855 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.357 -0.773 6.136 1.00 0.43 C ATOM 0 H LEU A 143 -5.954 0.816 5.561 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.078 -0.627 3.319 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.688 -1.510 5.327 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.914 0.053 6.086 1.00 0.21 H new ATOM 0 HG LEU A 143 -9.851 0.380 4.427 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -10.935 -1.695 3.664 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.333 -1.462 2.924 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.539 -2.629 4.251 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.418 -0.821 5.893 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -10.052 -1.703 6.617 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.177 0.062 6.814 1.00 0.43 H new ATOM 2107 N ILE A 144 -7.972 1.269 2.144 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.567 2.287 1.352 1.00 0.14 C ATOM 2109 C ILE A 144 -9.966 1.844 1.040 1.00 0.15 C ATOM 2110 O ILE A 144 -10.193 0.671 0.801 1.00 0.19 O ATOM 2111 CB ILE A 144 -7.784 2.475 0.044 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.319 2.810 0.311 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.440 3.532 -0.807 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.124 3.984 1.218 1.00 0.19 C ATOM 0 H ILE A 144 -7.543 0.521 1.599 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.563 3.236 1.888 1.00 0.14 H new ATOM 0 HB ILE A 144 -7.802 1.532 -0.502 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -5.831 1.939 0.749 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -5.823 3.010 -0.639 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -7.876 3.657 -1.731 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.460 3.228 -1.042 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.459 4.477 -0.264 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.058 4.161 1.360 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.582 4.867 0.773 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.590 3.780 2.182 1.00 0.19 H new ATOM 2126 N ASP A 145 -10.894 2.760 1.054 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.304 2.390 0.940 1.00 0.15 C ATOM 2128 C ASP A 145 -12.775 2.414 -0.517 1.00 0.14 C ATOM 2129 O ASP A 145 -11.983 2.703 -1.409 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.126 3.297 1.866 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.501 3.681 1.346 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -15.452 2.892 1.514 1.00 0.75 O ATOM 2133 OD2 ASP A 145 -14.643 4.779 0.770 1.00 0.98 O ATOM 0 H ASP A 145 -10.717 3.761 1.142 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.449 1.359 1.264 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -13.246 2.795 2.826 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.558 4.209 2.052 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.038 2.057 -0.750 1.00 0.17 N ATOM 2139 CA ARG A 146 -14.621 2.010 -2.090 1.00 0.17 C ATOM 2140 C ARG A 146 -14.334 3.286 -2.868 1.00 0.18 C ATOM 2141 O ARG A 146 -13.931 3.241 -4.024 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.131 1.840 -1.993 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.575 0.689 -1.113 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.073 0.728 -0.912 1.00 0.29 C ATOM 2145 NE ARG A 146 -18.492 2.048 -0.430 1.00 1.00 N ATOM 2146 CZ ARG A 146 -19.752 2.454 -0.295 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -20.761 1.660 -0.626 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -19.989 3.679 0.168 1.00 2.22 N ATOM 0 H ARG A 146 -14.688 1.791 -0.011 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.171 1.165 -2.612 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -16.565 2.763 -1.609 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.533 1.692 -2.995 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.287 -0.258 -1.569 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.070 0.744 -0.148 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.578 0.500 -1.851 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.370 -0.038 -0.196 1.00 0.29 H new ATOM 0 HE ARG A 146 -17.757 2.709 -0.178 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.576 0.725 -0.989 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -21.722 1.984 -0.517 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -19.211 4.291 0.413 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -20.949 4.006 0.278 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.537 4.423 -2.222 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.336 5.709 -2.870 1.00 0.21 C ATOM 2164 C ASP A 147 -12.956 6.224 -2.534 1.00 0.18 C ATOM 2165 O ASP A 147 -12.700 7.421 -2.564 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.402 6.719 -2.443 1.00 0.28 C ATOM 2167 CG ASP A 147 -16.760 6.403 -3.030 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.055 6.878 -4.145 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -17.540 5.673 -2.380 1.00 2.00 O ATOM 0 H ASP A 147 -14.841 4.482 -1.250 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.425 5.576 -3.948 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.473 6.731 -1.355 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.098 7.718 -2.754 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.075 5.293 -2.201 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.689 5.612 -1.954 1.00 0.16 C ATOM 2176 C GLY A 148 -10.458 6.359 -0.669 1.00 0.15 C ATOM 2177 O GLY A 148 -9.673 7.295 -0.631 1.00 0.17 O ATOM 0 H GLY A 148 -12.304 4.305 -2.097 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.111 4.688 -1.935 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.310 6.209 -2.784 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.115 5.959 0.393 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.880 6.606 1.665 1.00 0.18 C ATOM 2183 C VAL A 149 -10.016 5.731 2.569 1.00 0.17 C ATOM 2184 O VAL A 149 -10.417 4.648 2.962 1.00 0.24 O ATOM 2185 CB VAL A 149 -12.199 6.965 2.385 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -11.917 7.697 3.690 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -13.094 7.803 1.482 1.00 1.12 C ATOM 0 H VAL A 149 -11.802 5.206 0.406 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.350 7.535 1.454 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.723 6.038 2.619 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -12.859 7.941 4.181 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -11.321 7.060 4.343 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -11.369 8.615 3.481 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -14.017 8.045 2.008 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -12.578 8.724 1.212 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -13.328 7.240 0.578 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.806 6.198 2.884 1.00 0.21 N ATOM 2198 CA PRO A 150 -7.893 5.500 3.793 1.00 0.20 C ATOM 2199 C PRO A 150 -8.461 5.495 5.213 1.00 0.23 C ATOM 2200 O PRO A 150 -8.581 6.544 5.848 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.621 6.340 3.755 1.00 0.26 C ATOM 2202 CG PRO A 150 -7.037 7.672 3.240 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.254 7.460 2.395 1.00 0.41 C ATOM 0 HA PRO A 150 -7.730 4.461 3.506 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.177 6.424 4.747 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -5.871 5.886 3.108 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -7.254 8.352 4.064 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.237 8.125 2.655 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.966 8.278 2.508 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -8.000 7.402 1.337 1.00 0.41 H new ATOM 2211 N VAL A 151 -8.820 4.330 5.705 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.497 4.218 6.982 1.00 0.29 C ATOM 2213 C VAL A 151 -8.603 3.510 7.975 1.00 0.32 C ATOM 2214 O VAL A 151 -8.682 3.734 9.181 1.00 0.61 O ATOM 2215 CB VAL A 151 -10.820 3.430 6.844 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -11.638 3.526 8.116 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.628 3.915 5.651 1.00 1.13 C ATOM 0 H VAL A 151 -8.654 3.439 5.237 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.723 5.225 7.332 1.00 0.29 H new ATOM 0 HB VAL A 151 -10.567 2.383 6.675 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -12.564 2.964 7.996 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -11.068 3.112 8.948 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -11.871 4.571 8.321 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.552 3.342 5.580 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -11.865 4.971 5.777 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -11.047 3.780 4.739 1.00 1.13 H new ATOM 2227 N GLU A 152 -7.742 2.664 7.447 1.00 0.19 N ATOM 2228 CA GLU A 152 -6.851 1.859 8.269 1.00 0.20 C ATOM 2229 C GLU A 152 -5.474 1.833 7.677 1.00 0.20 C ATOM 2230 O GLU A 152 -5.252 2.293 6.563 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.319 0.408 8.383 1.00 0.21 C ATOM 2232 CG GLU A 152 -8.737 0.259 8.851 1.00 0.57 C ATOM 2233 CD GLU A 152 -8.906 0.560 10.329 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -8.020 1.216 10.909 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -9.930 0.152 10.916 1.00 1.17 O ATOM 0 H GLU A 152 -7.638 2.513 6.444 1.00 0.19 H new ATOM 0 HA GLU A 152 -6.851 2.320 9.257 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.216 -0.074 7.411 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -6.662 -0.122 9.073 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.377 0.927 8.274 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.075 -0.758 8.651 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.557 1.343 8.460 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.291 0.885 7.952 1.00 0.24 C ATOM 2244 C ARG A 153 -2.827 -0.305 8.783 1.00 0.25 C ATOM 2245 O ARG A 153 -2.954 -0.304 10.010 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.262 2.014 7.928 1.00 0.36 C ATOM 2247 CG ARG A 153 -0.977 1.700 8.666 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.237 2.972 9.016 1.00 0.47 C ATOM 2249 NE ARG A 153 -1.144 4.059 9.403 1.00 0.65 N ATOM 2250 CZ ARG A 153 -2.072 3.982 10.364 1.00 1.51 C ATOM 2251 NH1 ARG A 153 -2.193 2.890 11.117 1.00 2.16 N ATOM 2252 NH2 ARG A 153 -2.873 5.009 10.573 1.00 1.85 N ATOM 0 H ARG A 153 -4.663 1.248 9.470 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.406 0.561 6.918 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.024 2.251 6.891 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.709 2.907 8.364 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -1.201 1.142 9.575 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.344 1.063 8.049 1.00 0.40 H new ATOM 0 HD2 ARG A 153 0.456 2.773 9.833 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.361 3.288 8.161 1.00 0.47 H new ATOM 0 HE ARG A 153 -1.060 4.942 8.900 1.00 0.65 H new ATOM 0 HH11 ARG A 153 -1.572 2.095 10.966 1.00 2.16 H new ATOM 0 HH12 ARG A 153 -2.906 2.849 11.845 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -2.782 5.851 10.005 1.00 1.85 H new ATOM 0 HH22 ARG A 153 -3.584 4.961 11.303 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.305 -1.314 8.112 1.00 0.24 N ATOM 2267 CA PHE A 154 -2.000 -2.585 8.747 1.00 0.22 C ATOM 2268 C PHE A 154 -0.509 -2.798 8.793 1.00 0.24 C ATOM 2269 O PHE A 154 0.200 -2.386 7.887 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.642 -3.731 7.968 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.141 -3.726 7.992 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.857 -2.990 7.062 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -4.834 -4.440 8.955 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.236 -2.971 7.091 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.213 -4.420 8.989 1.00 0.22 C ATOM 2276 CZ PHE A 154 -6.914 -3.746 8.019 1.00 0.22 C ATOM 0 H PHE A 154 -2.081 -1.278 7.118 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.398 -2.566 9.762 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.306 -3.684 6.932 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.286 -4.677 8.376 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.330 -2.426 6.307 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.290 -5.018 9.687 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.785 -2.355 6.394 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.741 -4.934 9.778 1.00 0.22 H new ATOM 0 HZ PHE A 154 -7.991 -3.820 7.979 1.00 0.22 H new ATOM 2286 N SER A 155 -0.042 -3.434 9.847 1.00 0.22 N ATOM 2287 CA SER A 155 1.359 -3.788 9.963 1.00 0.25 C ATOM 2288 C SER A 155 1.724 -4.779 8.858 1.00 0.22 C ATOM 2289 O SER A 155 0.872 -5.525 8.385 1.00 0.26 O ATOM 2290 CB SER A 155 1.607 -4.405 11.341 1.00 0.35 C ATOM 2291 OG SER A 155 1.039 -3.602 12.365 1.00 1.11 O ATOM 0 H SER A 155 -0.616 -3.718 10.641 1.00 0.22 H new ATOM 0 HA SER A 155 1.981 -2.900 9.856 1.00 0.25 H new ATOM 0 HB2 SER A 155 1.178 -5.406 11.378 1.00 0.35 H new ATOM 0 HB3 SER A 155 2.679 -4.511 11.509 1.00 0.35 H new ATOM 0 HG SER A 155 1.208 -4.016 13.237 1.00 1.11 H new ATOM 2297 N PRO A 156 2.991 -4.801 8.422 1.00 0.25 N ATOM 2298 CA PRO A 156 3.445 -5.729 7.383 1.00 0.29 C ATOM 2299 C PRO A 156 3.393 -7.156 7.881 1.00 0.39 C ATOM 2300 O PRO A 156 3.360 -8.100 7.105 1.00 0.78 O ATOM 2301 CB PRO A 156 4.889 -5.305 7.129 1.00 0.34 C ATOM 2302 CG PRO A 156 5.310 -4.638 8.389 1.00 0.36 C ATOM 2303 CD PRO A 156 4.081 -3.949 8.912 1.00 0.33 C ATOM 0 HA PRO A 156 2.826 -5.696 6.486 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.521 -6.164 6.905 1.00 0.34 H new ATOM 0 HB3 PRO A 156 4.960 -4.627 6.279 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.689 -5.364 9.109 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.112 -3.923 8.205 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.086 -3.886 10.000 1.00 0.33 H new ATOM 0 HD3 PRO A 156 3.998 -2.930 8.534 1.00 0.33 H new ATOM 2311 N GLY A 157 3.431 -7.285 9.191 1.00 0.36 N ATOM 2312 CA GLY A 157 3.244 -8.558 9.837 1.00 0.46 C ATOM 2313 C GLY A 157 1.782 -8.895 10.064 1.00 0.41 C ATOM 2314 O GLY A 157 1.465 -9.805 10.833 1.00 0.50 O ATOM 0 H GLY A 157 3.592 -6.509 9.833 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.702 -9.339 9.230 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.764 -8.554 10.795 1.00 0.46 H new ATOM 2318 N ALA A 158 0.884 -8.158 9.415 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.532 -8.493 9.441 1.00 0.31 C ATOM 2320 C ALA A 158 -0.835 -9.471 8.320 1.00 0.34 C ATOM 2321 O ALA A 158 -0.176 -9.459 7.276 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.398 -7.245 9.314 1.00 0.37 C ATOM 0 H ALA A 158 1.113 -7.329 8.867 1.00 0.34 H new ATOM 0 HA ALA A 158 -0.766 -8.955 10.400 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.450 -7.528 9.337 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.186 -6.569 10.143 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.178 -6.744 8.372 1.00 0.37 H new ATOM 2328 N SER A 159 -1.818 -10.323 8.531 1.00 0.26 N ATOM 2329 CA SER A 159 -2.116 -11.367 7.586 1.00 0.30 C ATOM 2330 C SER A 159 -3.419 -11.095 6.845 1.00 0.23 C ATOM 2331 O SER A 159 -4.157 -10.165 7.173 1.00 0.22 O ATOM 2332 CB SER A 159 -2.197 -12.715 8.304 1.00 0.41 C ATOM 2333 OG SER A 159 -1.032 -12.952 9.076 1.00 1.42 O ATOM 0 H SER A 159 -2.422 -10.308 9.352 1.00 0.26 H new ATOM 0 HA SER A 159 -1.311 -11.393 6.852 1.00 0.30 H new ATOM 0 HB2 SER A 159 -3.075 -12.735 8.949 1.00 0.41 H new ATOM 0 HB3 SER A 159 -2.321 -13.513 7.572 1.00 0.41 H new ATOM 0 HG SER A 159 -1.109 -13.819 9.526 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.666 -11.928 5.847 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.885 -11.915 5.042 1.00 0.20 C ATOM 2341 C VAL A 160 -6.126 -11.633 5.892 1.00 0.21 C ATOM 2342 O VAL A 160 -6.856 -10.672 5.652 1.00 0.20 O ATOM 2343 CB VAL A 160 -5.021 -13.310 4.398 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.379 -13.520 3.754 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.906 -13.549 3.392 1.00 0.26 C ATOM 0 H VAL A 160 -3.008 -12.654 5.564 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.815 -11.124 4.295 1.00 0.20 H new ATOM 0 HB VAL A 160 -4.933 -14.042 5.201 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.423 -14.517 3.315 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.159 -13.421 4.509 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.531 -12.774 2.974 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -4.021 -14.539 2.950 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.955 -12.793 2.608 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.942 -13.487 3.896 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.315 -12.454 6.914 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.508 -12.408 7.755 1.00 0.31 C ATOM 2357 C LYS A 161 -7.602 -11.097 8.521 1.00 0.26 C ATOM 2358 O LYS A 161 -8.690 -10.580 8.775 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.467 -13.577 8.743 1.00 0.45 C ATOM 2360 CG LYS A 161 -6.164 -13.635 9.532 1.00 1.12 C ATOM 2361 CD LYS A 161 -6.124 -14.801 10.504 1.00 1.80 C ATOM 2362 CE LYS A 161 -4.768 -14.901 11.194 1.00 2.67 C ATOM 2363 NZ LYS A 161 -4.447 -13.687 11.996 1.00 3.46 N ATOM 0 H LYS A 161 -5.645 -13.174 7.187 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.385 -12.483 7.112 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -8.303 -13.491 9.437 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -7.599 -14.512 8.199 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -5.327 -13.715 8.839 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -6.034 -12.703 10.082 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -6.907 -14.680 11.252 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -6.333 -15.729 9.971 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -4.758 -15.776 11.844 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -3.992 -15.053 10.444 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -3.690 -13.909 12.674 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -4.131 -12.926 11.362 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -5.295 -13.378 12.512 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.446 -10.556 8.854 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.354 -9.383 9.700 1.00 0.27 C ATOM 2379 C ASP A 162 -6.726 -8.142 8.919 1.00 0.22 C ATOM 2380 O ASP A 162 -7.274 -7.187 9.462 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.935 -9.257 10.233 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.559 -10.422 11.119 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -4.981 -10.446 12.291 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.848 -11.332 10.641 1.00 1.40 O ATOM 0 H ASP A 162 -5.544 -10.918 8.545 1.00 0.26 H new ATOM 0 HA ASP A 162 -7.048 -9.487 10.534 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.238 -9.197 9.397 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.840 -8.328 10.795 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.409 -8.167 7.640 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.755 -7.083 6.746 1.00 0.15 C ATOM 2391 C ILE A 163 -8.185 -7.228 6.244 1.00 0.14 C ATOM 2392 O ILE A 163 -8.941 -6.254 6.230 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.776 -7.015 5.559 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.420 -6.456 6.017 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.364 -6.178 4.429 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.350 -6.514 4.953 1.00 0.21 C ATOM 0 H ILE A 163 -5.907 -8.935 7.194 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.680 -6.152 7.308 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.615 -8.024 5.179 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.551 -5.421 6.332 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.083 -7.015 6.890 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.659 -6.141 3.599 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.298 -6.627 4.092 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.556 -5.167 4.787 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.421 -6.103 5.348 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.190 -7.550 4.654 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.666 -5.931 4.087 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.560 -8.446 5.853 1.00 0.13 N ATOM 2409 CA GLU A 164 -9.895 -8.696 5.323 1.00 0.13 C ATOM 2410 C GLU A 164 -10.975 -8.218 6.283 1.00 0.15 C ATOM 2411 O GLU A 164 -11.967 -7.648 5.865 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.127 -10.179 5.028 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.436 -10.697 3.781 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.947 -12.069 3.383 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -11.168 -12.311 3.513 1.00 0.60 O ATOM 2416 OE2 GLU A 164 -9.147 -12.904 2.921 1.00 0.67 O ATOM 0 H GLU A 164 -7.960 -9.270 5.894 1.00 0.13 H new ATOM 0 HA GLU A 164 -9.958 -8.134 4.391 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -9.787 -10.762 5.883 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.199 -10.352 4.930 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.595 -9.998 2.960 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.361 -10.746 3.955 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.773 -8.440 7.569 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.770 -8.074 8.574 1.00 0.21 C ATOM 2425 C GLU A 165 -12.125 -6.585 8.518 1.00 0.21 C ATOM 2426 O GLU A 165 -13.227 -6.194 8.901 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.286 -8.437 9.980 1.00 0.27 C ATOM 2428 CG GLU A 165 -10.080 -7.637 10.436 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.782 -7.814 11.908 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -9.097 -8.793 12.278 1.00 0.83 O ATOM 2431 OE2 GLU A 165 -10.233 -6.970 12.709 1.00 0.87 O ATOM 0 H GLU A 165 -9.930 -8.871 7.948 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.671 -8.644 8.345 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.102 -8.282 10.686 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.038 -9.498 10.007 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.209 -7.939 9.855 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -10.251 -6.581 10.229 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.197 -5.755 8.054 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.480 -4.336 7.885 1.00 0.20 C ATOM 2440 C LYS A 166 -11.870 -4.044 6.443 1.00 0.19 C ATOM 2441 O LYS A 166 -12.609 -3.103 6.157 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.284 -3.474 8.298 1.00 0.25 C ATOM 2443 CG LYS A 166 -9.942 -3.554 9.777 1.00 0.38 C ATOM 2444 CD LYS A 166 -11.095 -3.070 10.642 1.00 0.58 C ATOM 2445 CE LYS A 166 -10.662 -2.833 12.080 1.00 1.09 C ATOM 2446 NZ LYS A 166 -10.088 -4.052 12.713 1.00 1.71 N ATOM 0 H LYS A 166 -10.253 -6.037 7.791 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.315 -4.081 8.537 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.413 -3.778 7.718 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.492 -2.436 8.040 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.696 -4.583 10.040 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -9.056 -2.952 9.980 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -11.498 -2.146 10.227 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -11.899 -3.806 10.621 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -9.923 -2.032 12.106 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -11.519 -2.495 12.663 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -10.260 -4.025 13.738 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -10.538 -4.898 12.309 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -9.064 -4.086 12.535 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.389 -4.889 5.552 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.600 -4.739 4.126 1.00 0.15 C ATOM 2462 C LEU A 167 -13.004 -5.166 3.707 1.00 0.15 C ATOM 2463 O LEU A 167 -13.693 -4.449 2.981 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.584 -5.596 3.387 1.00 0.13 C ATOM 2465 CG LEU A 167 -10.958 -5.893 1.947 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.767 -4.660 1.085 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.164 -7.064 1.418 1.00 0.16 C ATOM 0 H LEU A 167 -10.835 -5.708 5.801 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.482 -3.684 3.877 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.618 -5.092 3.404 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.461 -6.538 3.921 1.00 0.13 H new ATOM 0 HG LEU A 167 -12.012 -6.167 1.911 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -11.040 -4.890 0.055 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.400 -3.855 1.457 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.723 -4.348 1.123 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.448 -7.259 0.384 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.100 -6.833 1.464 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.370 -7.947 2.024 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.399 -6.351 4.156 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.655 -6.970 3.757 1.00 0.19 C ATOM 2481 C ILE A 168 -15.856 -6.039 3.979 1.00 0.22 C ATOM 2482 O ILE A 168 -16.711 -5.940 3.102 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.875 -8.318 4.477 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.724 -9.281 4.150 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.213 -8.932 4.080 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.776 -10.576 4.930 1.00 0.24 C ATOM 0 H ILE A 168 -12.854 -6.912 4.811 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.580 -7.161 2.687 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.891 -8.139 5.552 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.743 -9.508 3.084 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.776 -8.783 4.353 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.346 -9.881 4.599 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -17.020 -8.252 4.353 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.230 -9.102 3.003 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.932 -11.206 4.647 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.725 -10.360 5.997 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.708 -11.097 4.709 1.00 0.24 H new ATOM 2498 N PRO A 169 -15.955 -5.351 5.140 1.00 0.24 N ATOM 2499 CA PRO A 169 -16.986 -4.327 5.356 1.00 0.29 C ATOM 2500 C PRO A 169 -17.052 -3.299 4.223 1.00 0.29 C ATOM 2501 O PRO A 169 -18.136 -2.883 3.818 1.00 0.41 O ATOM 2502 CB PRO A 169 -16.546 -3.652 6.655 1.00 0.34 C ATOM 2503 CG PRO A 169 -15.822 -4.716 7.397 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.132 -5.551 6.353 1.00 0.24 C ATOM 0 HA PRO A 169 -17.983 -4.765 5.395 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -15.901 -2.795 6.459 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.402 -3.284 7.221 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.101 -4.286 8.092 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -16.512 -5.320 7.986 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.103 -5.226 6.197 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -15.094 -6.601 6.642 1.00 0.24 H new ATOM 2512 N LEU A 170 -15.900 -2.897 3.702 1.00 0.22 N ATOM 2513 CA LEU A 170 -15.872 -1.917 2.627 1.00 0.22 C ATOM 2514 C LEU A 170 -16.190 -2.562 1.281 1.00 0.20 C ATOM 2515 O LEU A 170 -16.960 -2.004 0.500 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.534 -1.172 2.576 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.226 -0.306 3.787 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -12.826 0.270 3.669 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.256 0.803 3.908 1.00 0.69 C ATOM 0 H LEU A 170 -14.984 -3.230 4.002 1.00 0.22 H new ATOM 0 HA LEU A 170 -16.649 -1.183 2.839 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -13.734 -1.903 2.460 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.521 -0.542 1.687 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.273 -0.918 4.688 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -12.613 0.889 4.540 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.102 -0.543 3.615 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -12.757 0.877 2.767 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.028 1.418 4.778 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.233 1.421 3.010 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.248 0.367 4.022 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.613 -3.736 1.005 1.00 0.18 N ATOM 2532 CA LEU A 171 -15.924 -4.465 -0.234 1.00 0.20 C ATOM 2533 C LEU A 171 -17.401 -4.741 -0.302 1.00 0.27 C ATOM 2534 O LEU A 171 -18.087 -4.397 -1.265 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.209 -5.809 -0.294 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.706 -5.732 -0.376 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -13.103 -7.119 -0.308 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.289 -5.037 -1.657 1.00 0.31 C ATOM 0 H LEU A 171 -14.937 -4.199 1.612 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.594 -3.841 -1.064 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.480 -6.387 0.590 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.577 -6.360 -1.160 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.338 -5.154 0.472 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -12.017 -7.047 -0.368 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.383 -7.592 0.633 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.474 -7.718 -1.140 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.201 -4.987 -1.706 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.665 -5.596 -2.514 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.700 -4.028 -1.674 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.864 -5.360 0.762 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.241 -5.755 0.881 1.00 0.39 C ATOM 2552 C GLY A 172 -20.199 -4.581 0.975 1.00 0.66 C ATOM 2553 O GLY A 172 -21.415 -4.774 1.000 1.00 1.12 O ATOM 0 H GLY A 172 -17.290 -5.602 1.569 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.511 -6.367 0.021 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.357 -6.381 1.766 1.00 0.39 H new ATOM 2557 N SER A 173 -19.649 -3.369 1.037 1.00 0.85 N ATOM 2558 CA SER A 173 -20.441 -2.146 1.028 1.00 1.33 C ATOM 2559 C SER A 173 -21.334 -2.065 2.266 1.00 1.84 C ATOM 2560 O SER A 173 -22.546 -1.859 2.166 1.00 2.43 O ATOM 2561 CB SER A 173 -21.276 -2.074 -0.261 1.00 2.03 C ATOM 2562 OG SER A 173 -21.985 -0.849 -0.359 1.00 2.64 O ATOM 0 H SER A 173 -18.643 -3.210 1.095 1.00 0.85 H new ATOM 0 HA SER A 173 -19.766 -1.291 1.054 1.00 1.33 H new ATOM 0 HB2 SER A 173 -20.621 -2.186 -1.125 1.00 2.03 H new ATOM 0 HB3 SER A 173 -21.981 -2.905 -0.285 1.00 2.03 H new ATOM 0 HG SER A 173 -22.514 -0.711 0.454 1.00 2.64 H new ATOM 2568 N ALA A 174 -20.727 -2.240 3.437 1.00 2.40 N ATOM 2569 CA ALA A 174 -21.448 -2.128 4.696 1.00 3.35 C ATOM 2570 C ALA A 174 -21.990 -0.718 4.873 1.00 3.69 C ATOM 2571 O ALA A 174 -23.117 -0.526 5.324 1.00 4.35 O ATOM 2572 CB ALA A 174 -20.548 -2.501 5.866 1.00 4.30 C ATOM 0 H ALA A 174 -19.736 -2.460 3.537 1.00 2.40 H new ATOM 0 HA ALA A 174 -22.287 -2.823 4.673 1.00 3.35 H new ATOM 0 HB1 ALA A 174 -21.106 -2.411 6.798 1.00 4.30 H new ATOM 0 HB2 ALA A 174 -20.204 -3.528 5.747 1.00 4.30 H new ATOM 0 HB3 ALA A 174 -19.688 -1.831 5.892 1.00 4.30 H new ATOM 2578 N ARG A 175 -21.180 0.268 4.509 1.00 3.66 N ATOM 2579 CA ARG A 175 -21.605 1.656 4.575 1.00 4.44 C ATOM 2580 C ARG A 175 -22.095 2.104 3.205 1.00 4.81 C ATOM 2581 O ARG A 175 -21.661 1.574 2.183 1.00 5.15 O ATOM 2582 CB ARG A 175 -20.464 2.554 5.076 1.00 5.16 C ATOM 2583 CG ARG A 175 -19.327 2.768 4.085 1.00 5.82 C ATOM 2584 CD ARG A 175 -18.175 3.508 4.748 1.00 6.62 C ATOM 2585 NE ARG A 175 -17.254 4.118 3.787 1.00 7.03 N ATOM 2586 CZ ARG A 175 -16.560 5.230 4.048 1.00 7.84 C ATOM 2587 NH1 ARG A 175 -16.621 5.781 5.256 1.00 8.30 N ATOM 2588 NH2 ARG A 175 -15.787 5.776 3.118 1.00 8.45 N ATOM 0 H ARG A 175 -20.229 0.131 4.167 1.00 3.66 H new ATOM 0 HA ARG A 175 -22.426 1.744 5.287 1.00 4.44 H new ATOM 0 HB2 ARG A 175 -20.879 3.526 5.345 1.00 5.16 H new ATOM 0 HB3 ARG A 175 -20.054 2.119 5.987 1.00 5.16 H new ATOM 0 HG2 ARG A 175 -18.980 1.806 3.707 1.00 5.82 H new ATOM 0 HG3 ARG A 175 -19.686 3.336 3.227 1.00 5.82 H new ATOM 0 HD2 ARG A 175 -18.577 4.284 5.400 1.00 6.62 H new ATOM 0 HD3 ARG A 175 -17.622 2.814 5.382 1.00 6.62 H new ATOM 0 HE ARG A 175 -17.137 3.674 2.876 1.00 7.03 H new ATOM 0 HH11 ARG A 175 -17.197 5.355 5.982 1.00 8.30 H new ATOM 0 HH12 ARG A 175 -16.092 6.630 5.457 1.00 8.30 H new ATOM 0 HH21 ARG A 175 -15.719 5.347 2.195 1.00 8.45 H new ATOM 0 HH22 ARG A 175 -15.261 6.625 3.326 1.00 8.45 H new ATOM 2602 N LEU A 176 -23.013 3.054 3.186 1.00 5.22 N ATOM 2603 CA LEU A 176 -23.597 3.515 1.937 1.00 6.05 C ATOM 2604 C LEU A 176 -23.149 4.936 1.644 1.00 6.72 C ATOM 2605 O LEU A 176 -23.863 5.881 2.037 1.00 7.14 O ATOM 2606 CB LEU A 176 -25.133 3.444 1.978 1.00 6.60 C ATOM 2607 CG LEU A 176 -25.749 2.039 1.893 1.00 7.19 C ATOM 2608 CD1 LEU A 176 -25.169 1.270 0.716 1.00 7.69 C ATOM 2609 CD2 LEU A 176 -25.552 1.268 3.191 1.00 7.60 C ATOM 2610 OXT LEU A 176 -22.075 5.104 1.036 1.00 7.13 O ATOM 0 H LEU A 176 -23.370 3.521 4.019 1.00 5.22 H new ATOM 0 HA LEU A 176 -23.250 2.857 1.140 1.00 6.05 H new ATOM 0 HB2 LEU A 176 -25.473 3.912 2.902 1.00 6.60 H new ATOM 0 HB3 LEU A 176 -25.526 4.041 1.155 1.00 6.60 H new ATOM 0 HG LEU A 176 -26.821 2.154 1.735 1.00 7.19 H new ATOM 0 HD11 LEU A 176 -25.618 0.278 0.673 1.00 7.69 H new ATOM 0 HD12 LEU A 176 -25.383 1.805 -0.209 1.00 7.69 H new ATOM 0 HD13 LEU A 176 -24.090 1.175 0.839 1.00 7.69 H new ATOM 0 HD21 LEU A 176 -25.999 0.278 3.098 1.00 7.60 H new ATOM 0 HD22 LEU A 176 -24.486 1.167 3.396 1.00 7.60 H new ATOM 0 HD23 LEU A 176 -26.029 1.806 4.010 1.00 7.60 H new TER 2622 LEU A 176