USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1129 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 28 MET CE :methyl -133:sc= -1.35 (180deg=-0.81) USER MOD Set 1.2: A 110 MET CE :methyl 155:sc= -1.39 (180deg=0) USER MOD Single : A 10 SER OG : rot -16:sc= 0.758 USER MOD Single : A 11 ASN : amide:sc= -0.645 X(o=-0.65,f=-1.1) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN :FLIP amide:sc= 0.229 F(o=-0.46,f=0.23) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 135:sc= 0.512 (180deg=0.0268) USER MOD Single : A 29 SER OG : rot 103:sc= -1.65! USER MOD Single : A 30 SER OG : rot -132:sc= -0.0817 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.524 K(o=-0.52,f=-3.1!) USER MOD Single : A 40 TYR OH : rot 174:sc= 1.9 USER MOD Single : A 43 MET CE :methyl -107:sc= -1.27 (180deg=-7.65!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 102:sc= 1.21 USER MOD Single : A 57 THR OG1 : rot -34:sc= -0.791 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot -60:sc=-0.00528 USER MOD Single : A 70 HIS : no HE2:sc= -0.952 K(o=-0.95,f=-1.9) USER MOD Single : A 75 MET CE :methyl -174:sc= 0 (180deg=-0.0246) USER MOD Single : A 77 GLN : amide:sc= -0.122 K(o=-0.12,f=-1.2) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0.00565 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl -123:sc= -2.11 (180deg=-6.4!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -1.26 X(o=-1.3,f=-1.3) USER MOD Single : A 96 GLN : amide:sc= -0.0991 X(o=-0.099,f=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl -138:sc= -0.491 (180deg=-3.33!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.2 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -1.03 X(o=-1,f=-1) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 TYR OH : rot 165:sc= -0.443 USER MOD Single : A 107 LYS NZ :NH3+ -118:sc= -0.0408 (180deg=-0.631) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -1.98 X(o=-2,f=-2.2) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HE2:sc= -2.97 K(o=-3,f=-4.2!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -0.176 X(o=-0.18,f=-0.6) USER MOD Single : A 130 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 MET CE :methyl -166:sc= -0.575 (180deg=-1.08) USER MOD Single : A 137 SER OG : rot 80:sc= 0.0325 USER MOD ----------------------------------------------------------------- ATOM 97 N SER A 10 4.948 5.720 -8.925 1.00 32.10 N ATOM 98 CA SER A 10 5.509 6.990 -9.369 1.00 42.34 C ATOM 99 C SER A 10 5.902 6.925 -10.842 1.00 51.12 C ATOM 100 O SER A 10 5.862 7.930 -11.551 1.00 60.54 O ATOM 101 CB SER A 10 6.728 7.358 -8.521 1.00 12.22 C ATOM 102 OG SER A 10 7.221 6.229 -7.820 1.00 41.53 O ATOM 0 HA SER A 10 4.745 7.758 -9.248 1.00 42.34 H new ATOM 0 HB2 SER A 10 7.512 7.763 -9.161 1.00 12.22 H new ATOM 0 HB3 SER A 10 6.459 8.141 -7.812 1.00 12.22 H new ATOM 0 HG SER A 10 6.544 5.520 -7.824 1.00 41.53 H new ATOM 108 N ASN A 11 6.281 5.734 -11.295 1.00 3.42 N ATOM 109 CA ASN A 11 6.682 5.537 -12.683 1.00 23.30 C ATOM 110 C ASN A 11 5.557 5.931 -13.635 1.00 64.35 C ATOM 111 O ASN A 11 5.800 6.258 -14.797 1.00 40.31 O ATOM 112 CB ASN A 11 7.078 4.078 -12.919 1.00 34.54 C ATOM 113 CG ASN A 11 7.741 3.869 -14.266 1.00 71.52 C ATOM 114 OD1 ASN A 11 7.108 4.017 -15.312 1.00 30.13 O ATOM 115 ND2 ASN A 11 9.023 3.522 -14.247 1.00 74.22 N ATOM 0 H ASN A 11 6.319 4.892 -10.721 1.00 3.42 H new ATOM 0 HA ASN A 11 7.542 6.176 -12.881 1.00 23.30 H new ATOM 0 HB2 ASN A 11 7.757 3.757 -12.129 1.00 34.54 H new ATOM 0 HB3 ASN A 11 6.191 3.448 -12.852 1.00 34.54 H new ATOM 0 HD21 ASN A 11 9.522 3.367 -15.123 1.00 74.22 H new ATOM 0 HD22 ASN A 11 9.508 3.411 -13.357 1.00 74.22 H new ATOM 122 N ASP A 12 4.327 5.897 -13.135 1.00 63.33 N ATOM 123 CA ASP A 12 3.164 6.252 -13.941 1.00 24.24 C ATOM 124 C ASP A 12 2.828 7.732 -13.786 1.00 33.41 C ATOM 125 O ASP A 12 2.359 8.374 -14.726 1.00 12.45 O ATOM 126 CB ASP A 12 1.960 5.398 -13.541 1.00 24.53 C ATOM 127 CG ASP A 12 1.037 5.115 -14.710 1.00 24.33 C ATOM 128 OD1 ASP A 12 1.547 4.902 -15.830 1.00 54.02 O ATOM 129 OD2 ASP A 12 -0.194 5.105 -14.504 1.00 11.12 O ATOM 0 H ASP A 12 4.109 5.627 -12.176 1.00 63.33 H new ATOM 0 HA ASP A 12 3.404 6.060 -14.987 1.00 24.24 H new ATOM 0 HB2 ASP A 12 2.310 4.455 -13.122 1.00 24.53 H new ATOM 0 HB3 ASP A 12 1.401 5.908 -12.756 1.00 24.53 H new ATOM 134 N LYS A 13 3.069 8.267 -12.594 1.00 32.52 N ATOM 135 CA LYS A 13 2.792 9.671 -12.314 1.00 71.55 C ATOM 136 C LYS A 13 3.621 10.579 -13.217 1.00 24.33 C ATOM 137 O LYS A 13 3.080 11.419 -13.935 1.00 11.43 O ATOM 138 CB LYS A 13 3.085 9.987 -10.846 1.00 51.12 C ATOM 139 CG LYS A 13 1.947 10.703 -10.139 1.00 51.05 C ATOM 140 CD LYS A 13 1.611 10.042 -8.813 1.00 54.22 C ATOM 141 CE LYS A 13 0.899 11.005 -7.875 1.00 55.15 C ATOM 142 NZ LYS A 13 1.848 11.681 -6.949 1.00 1.13 N ATOM 0 H LYS A 13 3.456 7.749 -11.805 1.00 32.52 H new ATOM 0 HA LYS A 13 1.736 9.855 -12.514 1.00 71.55 H new ATOM 0 HB2 LYS A 13 3.301 9.058 -10.319 1.00 51.12 H new ATOM 0 HB3 LYS A 13 3.982 10.603 -10.788 1.00 51.12 H new ATOM 0 HG2 LYS A 13 2.221 11.744 -9.969 1.00 51.05 H new ATOM 0 HG3 LYS A 13 1.065 10.706 -10.779 1.00 51.05 H new ATOM 0 HD2 LYS A 13 0.980 9.171 -8.989 1.00 54.22 H new ATOM 0 HD3 LYS A 13 2.526 9.683 -8.342 1.00 54.22 H new ATOM 0 HE2 LYS A 13 0.366 11.755 -8.460 1.00 55.15 H new ATOM 0 HE3 LYS A 13 0.152 10.462 -7.296 1.00 55.15 H new ATOM 0 HZ1 LYS A 13 1.324 12.329 -6.327 1.00 1.13 H new ATOM 0 HZ2 LYS A 13 2.338 10.968 -6.372 1.00 1.13 H new ATOM 0 HZ3 LYS A 13 2.546 12.220 -7.500 1.00 1.13 H new ATOM 156 N VAL A 14 4.938 10.403 -13.176 1.00 63.30 N ATOM 157 CA VAL A 14 5.842 11.205 -13.992 1.00 23.42 C ATOM 158 C VAL A 14 5.553 11.019 -15.477 1.00 52.01 C ATOM 159 O VAL A 14 5.578 11.977 -16.250 1.00 13.54 O ATOM 160 CB VAL A 14 7.315 10.844 -13.718 1.00 75.00 C ATOM 161 CG1 VAL A 14 7.553 9.359 -13.949 1.00 13.52 C ATOM 162 CG2 VAL A 14 8.239 11.682 -14.588 1.00 54.23 C ATOM 0 H VAL A 14 5.403 9.712 -12.586 1.00 63.30 H new ATOM 0 HA VAL A 14 5.674 12.247 -13.720 1.00 23.42 H new ATOM 0 HB VAL A 14 7.537 11.065 -12.674 1.00 75.00 H new ATOM 0 HG11 VAL A 14 8.598 9.123 -13.751 1.00 13.52 H new ATOM 0 HG12 VAL A 14 6.917 8.780 -13.279 1.00 13.52 H new ATOM 0 HG13 VAL A 14 7.314 9.109 -14.983 1.00 13.52 H new ATOM 0 HG21 VAL A 14 9.275 11.414 -14.382 1.00 54.23 H new ATOM 0 HG22 VAL A 14 8.018 11.495 -15.639 1.00 54.23 H new ATOM 0 HG23 VAL A 14 8.087 12.739 -14.368 1.00 54.23 H new ATOM 172 N TYR A 15 5.278 9.780 -15.870 1.00 51.42 N ATOM 173 CA TYR A 15 4.985 9.468 -17.264 1.00 42.10 C ATOM 174 C TYR A 15 3.589 9.949 -17.649 1.00 4.34 C ATOM 175 O TYR A 15 3.245 10.007 -18.828 1.00 52.34 O ATOM 176 CB TYR A 15 5.102 7.962 -17.507 1.00 5.43 C ATOM 177 CG TYR A 15 4.763 7.549 -18.921 1.00 21.32 C ATOM 178 CD1 TYR A 15 5.238 8.270 -20.009 1.00 63.13 C ATOM 179 CD2 TYR A 15 3.967 6.438 -19.169 1.00 35.34 C ATOM 180 CE1 TYR A 15 4.930 7.896 -21.303 1.00 43.22 C ATOM 181 CE2 TYR A 15 3.655 6.056 -20.459 1.00 73.20 C ATOM 182 CZ TYR A 15 4.139 6.788 -21.523 1.00 13.31 C ATOM 183 OH TYR A 15 3.829 6.412 -22.810 1.00 21.02 O ATOM 0 H TYR A 15 5.252 8.976 -15.243 1.00 51.42 H new ATOM 0 HA TYR A 15 5.713 9.988 -17.886 1.00 42.10 H new ATOM 0 HB2 TYR A 15 6.119 7.643 -17.278 1.00 5.43 H new ATOM 0 HB3 TYR A 15 4.441 7.439 -16.816 1.00 5.43 H new ATOM 0 HD1 TYR A 15 5.859 9.138 -19.841 1.00 63.13 H new ATOM 0 HD2 TYR A 15 3.585 5.863 -18.338 1.00 35.34 H new ATOM 0 HE1 TYR A 15 5.307 8.468 -22.138 1.00 43.22 H new ATOM 0 HE2 TYR A 15 3.035 5.189 -20.634 1.00 73.20 H new ATOM 0 HH TYR A 15 3.265 5.611 -22.790 1.00 21.02 H new ATOM 193 N GLU A 16 2.791 10.294 -16.643 1.00 23.02 N ATOM 194 CA GLU A 16 1.433 10.770 -16.875 1.00 51.22 C ATOM 195 C GLU A 16 1.415 12.281 -17.087 1.00 11.30 C ATOM 196 O GLU A 16 0.962 12.768 -18.122 1.00 43.21 O ATOM 197 CB GLU A 16 0.530 10.398 -15.697 1.00 52.52 C ATOM 198 CG GLU A 16 -0.796 11.141 -15.689 1.00 21.23 C ATOM 199 CD GLU A 16 -1.638 10.846 -16.915 1.00 23.41 C ATOM 200 OE1 GLU A 16 -1.835 9.652 -17.225 1.00 21.00 O ATOM 201 OE2 GLU A 16 -2.099 11.807 -17.564 1.00 42.32 O ATOM 0 H GLU A 16 3.062 10.253 -15.660 1.00 23.02 H new ATOM 0 HA GLU A 16 1.056 10.289 -17.778 1.00 51.22 H new ATOM 0 HB2 GLU A 16 0.336 9.326 -15.723 1.00 52.52 H new ATOM 0 HB3 GLU A 16 1.058 10.604 -14.766 1.00 52.52 H new ATOM 0 HG2 GLU A 16 -1.356 10.868 -14.794 1.00 21.23 H new ATOM 0 HG3 GLU A 16 -0.607 12.213 -15.632 1.00 21.23 H new ATOM 208 N ASN A 17 1.910 13.018 -16.097 1.00 62.54 N ATOM 209 CA ASN A 17 1.950 14.473 -16.174 1.00 43.40 C ATOM 210 C ASN A 17 2.624 14.932 -17.464 1.00 30.11 C ATOM 211 O ASN A 17 2.200 15.906 -18.086 1.00 72.55 O ATOM 212 CB ASN A 17 2.692 15.048 -14.966 1.00 3.23 C ATOM 213 CG ASN A 17 2.019 14.696 -13.653 1.00 43.50 C ATOM 214 OD1 ASN A 17 1.004 15.468 -13.283 1.00 32.23 O flip ATOM 215 ND2 ASN A 17 2.408 13.742 -12.980 1.00 50.45 N flip ATOM 0 H ASN A 17 2.289 12.631 -15.233 1.00 62.54 H new ATOM 0 HA ASN A 17 0.924 14.840 -16.171 1.00 43.40 H new ATOM 0 HB2 ASN A 17 3.715 14.672 -14.959 1.00 3.23 H new ATOM 0 HB3 ASN A 17 2.751 16.132 -15.062 1.00 3.23 H new ATOM 0 HD21 ASN A 17 3.192 13.176 -13.303 1.00 50.45 H new ATOM 0 HD22 ASN A 17 1.946 13.517 -12.099 1.00 50.45 H new ATOM 222 N VAL A 18 3.676 14.223 -17.860 1.00 24.11 N ATOM 223 CA VAL A 18 4.408 14.555 -19.076 1.00 43.23 C ATOM 224 C VAL A 18 3.473 14.624 -20.279 1.00 25.33 C ATOM 225 O VAL A 18 3.748 15.323 -21.255 1.00 25.43 O ATOM 226 CB VAL A 18 5.519 13.527 -19.361 1.00 42.35 C ATOM 227 CG1 VAL A 18 4.918 12.182 -19.739 1.00 21.12 C ATOM 228 CG2 VAL A 18 6.444 14.033 -20.458 1.00 2.51 C ATOM 0 H VAL A 18 4.041 13.415 -17.356 1.00 24.11 H new ATOM 0 HA VAL A 18 4.861 15.533 -18.915 1.00 43.23 H new ATOM 0 HB VAL A 18 6.107 13.393 -18.453 1.00 42.35 H new ATOM 0 HG11 VAL A 18 5.718 11.469 -19.937 1.00 21.12 H new ATOM 0 HG12 VAL A 18 4.300 11.816 -18.919 1.00 21.12 H new ATOM 0 HG13 VAL A 18 4.304 12.296 -20.633 1.00 21.12 H new ATOM 0 HG21 VAL A 18 7.223 13.294 -20.647 1.00 2.51 H new ATOM 0 HG22 VAL A 18 5.871 14.197 -21.370 1.00 2.51 H new ATOM 0 HG23 VAL A 18 6.902 14.971 -20.144 1.00 2.51 H new ATOM 238 N THR A 19 2.365 13.893 -20.202 1.00 42.32 N ATOM 239 CA THR A 19 1.389 13.870 -21.284 1.00 40.11 C ATOM 240 C THR A 19 0.338 14.959 -21.100 1.00 43.11 C ATOM 241 O THR A 19 0.047 15.717 -22.024 1.00 62.04 O ATOM 242 CB THR A 19 0.685 12.503 -21.376 1.00 53.31 C ATOM 243 OG1 THR A 19 1.650 11.469 -21.598 1.00 33.11 O ATOM 244 CG2 THR A 19 -0.340 12.497 -22.500 1.00 52.22 C ATOM 0 H THR A 19 2.122 13.309 -19.402 1.00 42.32 H new ATOM 0 HA THR A 19 1.937 14.051 -22.208 1.00 40.11 H new ATOM 0 HB THR A 19 0.168 12.321 -20.434 1.00 53.31 H new ATOM 0 HG1 THR A 19 1.195 10.603 -21.654 1.00 33.11 H new ATOM 0 HG21 THR A 19 -0.824 11.522 -22.546 1.00 52.22 H new ATOM 0 HG22 THR A 19 -1.090 13.266 -22.313 1.00 52.22 H new ATOM 0 HG23 THR A 19 0.158 12.699 -23.448 1.00 52.22 H new ATOM 252 N GLY A 20 -0.228 15.032 -19.899 1.00 71.12 N ATOM 253 CA GLY A 20 -1.240 16.032 -19.616 1.00 14.50 C ATOM 254 C GLY A 20 -0.792 17.432 -19.988 1.00 75.13 C ATOM 255 O GLY A 20 -1.486 18.140 -20.720 1.00 30.13 O ATOM 0 H GLY A 20 -0.003 14.416 -19.117 1.00 71.12 H new ATOM 0 HA2 GLY A 20 -2.151 15.788 -20.163 1.00 14.50 H new ATOM 0 HA3 GLY A 20 -1.488 16.003 -18.555 1.00 14.50 H new ATOM 259 N LEU A 21 0.369 17.834 -19.484 1.00 32.55 N ATOM 260 CA LEU A 21 0.908 19.159 -19.766 1.00 4.21 C ATOM 261 C LEU A 21 0.939 19.426 -21.267 1.00 54.24 C ATOM 262 O LEU A 21 0.697 20.548 -21.714 1.00 62.31 O ATOM 263 CB LEU A 21 2.317 19.293 -19.184 1.00 72.32 C ATOM 264 CG LEU A 21 3.427 18.559 -19.938 1.00 34.02 C ATOM 265 CD1 LEU A 21 4.021 19.452 -21.016 1.00 14.22 C ATOM 266 CD2 LEU A 21 4.508 18.093 -18.974 1.00 33.53 C ATOM 0 H LEU A 21 0.956 17.261 -18.878 1.00 32.55 H new ATOM 0 HA LEU A 21 0.256 19.896 -19.297 1.00 4.21 H new ATOM 0 HB2 LEU A 21 2.572 20.352 -19.142 1.00 72.32 H new ATOM 0 HB3 LEU A 21 2.300 18.929 -18.157 1.00 72.32 H new ATOM 0 HG LEU A 21 2.994 17.682 -20.419 1.00 34.02 H new ATOM 0 HD11 LEU A 21 4.809 18.913 -21.542 1.00 14.22 H new ATOM 0 HD12 LEU A 21 3.242 19.736 -21.723 1.00 14.22 H new ATOM 0 HD13 LEU A 21 4.439 20.348 -20.557 1.00 14.22 H new ATOM 0 HD21 LEU A 21 5.290 17.573 -19.528 1.00 33.53 H new ATOM 0 HD22 LEU A 21 4.937 18.955 -18.464 1.00 33.53 H new ATOM 0 HD23 LEU A 21 4.073 17.416 -18.239 1.00 33.53 H new ATOM 278 N VAL A 22 1.235 18.387 -22.042 1.00 53.52 N ATOM 279 CA VAL A 22 1.293 18.509 -23.494 1.00 61.20 C ATOM 280 C VAL A 22 -0.086 18.794 -24.078 1.00 32.14 C ATOM 281 O VAL A 22 -0.237 19.640 -24.959 1.00 12.43 O ATOM 282 CB VAL A 22 1.858 17.231 -24.142 1.00 22.33 C ATOM 283 CG1 VAL A 22 1.873 17.361 -25.657 1.00 51.41 C ATOM 284 CG2 VAL A 22 3.253 16.937 -23.610 1.00 71.52 C ATOM 0 H VAL A 22 1.438 17.452 -21.689 1.00 53.52 H new ATOM 0 HA VAL A 22 1.957 19.345 -23.715 1.00 61.20 H new ATOM 0 HB VAL A 22 1.210 16.395 -23.880 1.00 22.33 H new ATOM 0 HG11 VAL A 22 2.275 16.448 -26.097 1.00 51.41 H new ATOM 0 HG12 VAL A 22 0.857 17.521 -26.019 1.00 51.41 H new ATOM 0 HG13 VAL A 22 2.497 18.207 -25.943 1.00 51.41 H new ATOM 0 HG21 VAL A 22 3.637 16.031 -24.078 1.00 71.52 H new ATOM 0 HG22 VAL A 22 3.914 17.773 -23.840 1.00 71.52 H new ATOM 0 HG23 VAL A 22 3.208 16.797 -22.530 1.00 71.52 H new ATOM 294 N LYS A 23 -1.092 18.082 -23.580 1.00 63.22 N ATOM 295 CA LYS A 23 -2.461 18.258 -24.050 1.00 3.32 C ATOM 296 C LYS A 23 -2.873 19.725 -23.985 1.00 15.34 C ATOM 297 O LYS A 23 -3.555 20.228 -24.877 1.00 52.12 O ATOM 298 CB LYS A 23 -3.422 17.409 -23.214 1.00 43.54 C ATOM 299 CG LYS A 23 -3.175 15.916 -23.334 1.00 61.42 C ATOM 300 CD LYS A 23 -3.249 15.452 -24.779 1.00 52.24 C ATOM 301 CE LYS A 23 -1.885 15.026 -25.299 1.00 4.31 C ATOM 302 NZ LYS A 23 -1.797 15.134 -26.782 1.00 34.44 N ATOM 0 H LYS A 23 -0.984 17.377 -22.850 1.00 63.22 H new ATOM 0 HA LYS A 23 -2.508 17.931 -25.089 1.00 3.32 H new ATOM 0 HB2 LYS A 23 -3.334 17.700 -22.167 1.00 43.54 H new ATOM 0 HB3 LYS A 23 -4.445 17.625 -23.521 1.00 43.54 H new ATOM 0 HG2 LYS A 23 -2.195 15.675 -22.923 1.00 61.42 H new ATOM 0 HG3 LYS A 23 -3.912 15.376 -22.739 1.00 61.42 H new ATOM 0 HD2 LYS A 23 -3.947 14.618 -24.859 1.00 52.24 H new ATOM 0 HD3 LYS A 23 -3.641 16.257 -25.401 1.00 52.24 H new ATOM 0 HE2 LYS A 23 -1.113 15.646 -24.843 1.00 4.31 H new ATOM 0 HE3 LYS A 23 -1.687 13.997 -24.998 1.00 4.31 H new ATOM 0 HZ1 LYS A 23 -0.896 15.582 -27.045 1.00 34.44 H new ATOM 0 HZ2 LYS A 23 -1.847 14.184 -27.203 1.00 34.44 H new ATOM 0 HZ3 LYS A 23 -2.586 15.711 -27.135 1.00 34.44 H new ATOM 316 N ALA A 24 -2.455 20.407 -22.923 1.00 65.52 N ATOM 317 CA ALA A 24 -2.778 21.816 -22.744 1.00 1.50 C ATOM 318 C ALA A 24 -1.951 22.692 -23.679 1.00 2.52 C ATOM 319 O ALA A 24 -2.464 23.640 -24.274 1.00 51.10 O ATOM 320 CB ALA A 24 -2.556 22.229 -21.296 1.00 44.15 C ATOM 0 H ALA A 24 -1.892 20.005 -22.174 1.00 65.52 H new ATOM 0 HA ALA A 24 -3.830 21.957 -22.993 1.00 1.50 H new ATOM 0 HB1 ALA A 24 -2.801 23.284 -21.177 1.00 44.15 H new ATOM 0 HB2 ALA A 24 -3.195 21.632 -20.645 1.00 44.15 H new ATOM 0 HB3 ALA A 24 -1.512 22.067 -21.027 1.00 44.15 H new ATOM 326 N VAL A 25 -0.667 22.370 -23.803 1.00 52.21 N ATOM 327 CA VAL A 25 0.231 23.128 -24.666 1.00 62.20 C ATOM 328 C VAL A 25 -0.310 23.206 -26.089 1.00 62.22 C ATOM 329 O VAL A 25 -0.243 24.254 -26.733 1.00 32.44 O ATOM 330 CB VAL A 25 1.639 22.503 -24.697 1.00 52.31 C ATOM 331 CG1 VAL A 25 2.551 23.288 -25.628 1.00 74.43 C ATOM 332 CG2 VAL A 25 2.224 22.439 -23.294 1.00 73.03 C ATOM 0 H VAL A 25 -0.226 21.589 -23.317 1.00 52.21 H new ATOM 0 HA VAL A 25 0.297 24.133 -24.250 1.00 62.20 H new ATOM 0 HB VAL A 25 1.558 21.485 -25.079 1.00 52.31 H new ATOM 0 HG11 VAL A 25 3.541 22.832 -25.637 1.00 74.43 H new ATOM 0 HG12 VAL A 25 2.137 23.278 -26.636 1.00 74.43 H new ATOM 0 HG13 VAL A 25 2.629 24.317 -25.278 1.00 74.43 H new ATOM 0 HG21 VAL A 25 3.219 21.995 -23.334 1.00 73.03 H new ATOM 0 HG22 VAL A 25 2.293 23.446 -22.882 1.00 73.03 H new ATOM 0 HG23 VAL A 25 1.580 21.830 -22.659 1.00 73.03 H new ATOM 342 N ILE A 26 -0.846 22.091 -26.574 1.00 64.05 N ATOM 343 CA ILE A 26 -1.400 22.034 -27.921 1.00 62.24 C ATOM 344 C ILE A 26 -2.804 22.626 -27.964 1.00 12.44 C ATOM 345 O ILE A 26 -3.126 23.422 -28.845 1.00 42.41 O ATOM 346 CB ILE A 26 -1.449 20.588 -28.449 1.00 61.30 C ATOM 347 CG1 ILE A 26 -0.045 19.979 -28.462 1.00 73.43 C ATOM 348 CG2 ILE A 26 -2.061 20.553 -29.842 1.00 23.55 C ATOM 349 CD1 ILE A 26 -0.001 18.551 -27.963 1.00 53.33 C ATOM 0 H ILE A 26 -0.908 21.215 -26.055 1.00 64.05 H new ATOM 0 HA ILE A 26 -0.740 22.623 -28.558 1.00 62.24 H new ATOM 0 HB ILE A 26 -2.076 19.995 -27.783 1.00 61.30 H new ATOM 0 HG12 ILE A 26 0.347 20.012 -29.478 1.00 73.43 H new ATOM 0 HG13 ILE A 26 0.614 20.591 -27.846 1.00 73.43 H new ATOM 0 HG21 ILE A 26 -2.089 19.524 -30.201 1.00 23.55 H new ATOM 0 HG22 ILE A 26 -3.075 20.952 -29.804 1.00 23.55 H new ATOM 0 HG23 ILE A 26 -1.458 21.158 -30.519 1.00 23.55 H new ATOM 0 HD11 ILE A 26 1.025 18.184 -28.000 1.00 53.33 H new ATOM 0 HD12 ILE A 26 -0.363 18.513 -26.936 1.00 53.33 H new ATOM 0 HD13 ILE A 26 -0.633 17.926 -28.593 1.00 53.33 H new ATOM 361 N GLU A 27 -3.636 22.234 -27.004 1.00 25.55 N ATOM 362 CA GLU A 27 -5.006 22.727 -26.931 1.00 43.31 C ATOM 363 C GLU A 27 -5.038 24.252 -26.978 1.00 4.25 C ATOM 364 O GLU A 27 -5.711 24.844 -27.821 1.00 21.13 O ATOM 365 CB GLU A 27 -5.683 22.231 -25.652 1.00 74.33 C ATOM 366 CG GLU A 27 -7.110 22.728 -25.487 1.00 62.50 C ATOM 367 CD GLU A 27 -8.048 22.167 -26.538 1.00 32.11 C ATOM 368 OE1 GLU A 27 -8.137 22.761 -27.632 1.00 54.33 O ATOM 369 OE2 GLU A 27 -8.693 21.133 -26.265 1.00 75.11 O ATOM 0 H GLU A 27 -3.385 21.576 -26.266 1.00 25.55 H new ATOM 0 HA GLU A 27 -5.550 22.342 -27.794 1.00 43.31 H new ATOM 0 HB2 GLU A 27 -5.684 21.141 -25.651 1.00 74.33 H new ATOM 0 HB3 GLU A 27 -5.094 22.550 -24.792 1.00 74.33 H new ATOM 0 HG2 GLU A 27 -7.474 22.454 -24.497 1.00 62.50 H new ATOM 0 HG3 GLU A 27 -7.120 23.817 -25.540 1.00 62.50 H new ATOM 376 N MET A 28 -4.305 24.882 -26.065 1.00 21.54 N ATOM 377 CA MET A 28 -4.249 26.337 -26.001 1.00 43.44 C ATOM 378 C MET A 28 -3.780 26.922 -27.330 1.00 74.55 C ATOM 379 O MET A 28 -4.232 27.990 -27.743 1.00 71.43 O ATOM 380 CB MET A 28 -3.313 26.785 -24.877 1.00 31.44 C ATOM 381 CG MET A 28 -1.851 26.464 -25.139 1.00 45.41 C ATOM 382 SD MET A 28 -0.831 26.610 -23.659 1.00 32.50 S ATOM 383 CE MET A 28 0.673 27.293 -24.350 1.00 3.43 C ATOM 0 H MET A 28 -3.742 24.407 -25.360 1.00 21.54 H new ATOM 0 HA MET A 28 -5.254 26.705 -25.795 1.00 43.44 H new ATOM 0 HB2 MET A 28 -3.420 27.860 -24.733 1.00 31.44 H new ATOM 0 HB3 MET A 28 -3.620 26.307 -23.947 1.00 31.44 H new ATOM 0 HG2 MET A 28 -1.771 25.451 -25.532 1.00 45.41 H new ATOM 0 HG3 MET A 28 -1.468 27.136 -25.907 1.00 45.41 H new ATOM 0 HE1 MET A 28 1.532 26.743 -23.966 1.00 3.43 H new ATOM 0 HE2 MET A 28 0.645 27.209 -25.436 1.00 3.43 H new ATOM 0 HE3 MET A 28 0.759 28.343 -24.069 1.00 3.43 H new ATOM 393 N SER A 29 -2.872 26.214 -27.996 1.00 14.45 N ATOM 394 CA SER A 29 -2.340 26.665 -29.276 1.00 51.30 C ATOM 395 C SER A 29 -3.423 26.649 -30.351 1.00 21.43 C ATOM 396 O SER A 29 -3.313 27.331 -31.369 1.00 41.21 O ATOM 397 CB SER A 29 -1.167 25.782 -29.704 1.00 61.33 C ATOM 398 OG SER A 29 -0.103 25.859 -28.771 1.00 71.13 O ATOM 0 H SER A 29 -2.490 25.326 -27.670 1.00 14.45 H new ATOM 0 HA SER A 29 -1.989 27.690 -29.155 1.00 51.30 H new ATOM 0 HB2 SER A 29 -1.500 24.748 -29.795 1.00 61.33 H new ATOM 0 HB3 SER A 29 -0.815 26.092 -30.688 1.00 61.33 H new ATOM 0 HG SER A 29 -0.103 25.057 -28.207 1.00 71.13 H new ATOM 404 N SER A 30 -4.469 25.863 -30.115 1.00 52.24 N ATOM 405 CA SER A 30 -5.571 25.753 -31.064 1.00 52.41 C ATOM 406 C SER A 30 -6.502 26.958 -30.958 1.00 23.34 C ATOM 407 O SER A 30 -6.885 27.552 -31.965 1.00 51.42 O ATOM 408 CB SER A 30 -6.357 24.464 -30.818 1.00 70.02 C ATOM 409 OG SER A 30 -7.638 24.742 -30.279 1.00 4.22 O ATOM 0 H SER A 30 -4.576 25.294 -29.276 1.00 52.24 H new ATOM 0 HA SER A 30 -5.151 25.728 -32.069 1.00 52.41 H new ATOM 0 HB2 SER A 30 -6.464 23.916 -31.754 1.00 70.02 H new ATOM 0 HB3 SER A 30 -5.803 23.822 -30.134 1.00 70.02 H new ATOM 0 HG SER A 30 -7.798 24.166 -29.502 1.00 4.22 H new ATOM 415 N LYS A 31 -6.862 27.312 -29.729 1.00 3.33 N ATOM 416 CA LYS A 31 -7.746 28.446 -29.487 1.00 72.02 C ATOM 417 C LYS A 31 -6.952 29.672 -29.050 1.00 2.42 C ATOM 418 O LYS A 31 -7.505 30.608 -28.472 1.00 14.15 O ATOM 419 CB LYS A 31 -8.785 28.091 -28.421 1.00 24.24 C ATOM 420 CG LYS A 31 -10.219 28.293 -28.877 1.00 71.22 C ATOM 421 CD LYS A 31 -11.020 27.005 -28.784 1.00 54.13 C ATOM 422 CE LYS A 31 -12.333 27.110 -29.545 1.00 35.42 C ATOM 423 NZ LYS A 31 -13.498 26.737 -28.695 1.00 10.34 N ATOM 0 H LYS A 31 -6.555 26.829 -28.884 1.00 3.33 H new ATOM 0 HA LYS A 31 -8.258 28.681 -30.420 1.00 72.02 H new ATOM 0 HB2 LYS A 31 -8.650 27.050 -28.126 1.00 24.24 H new ATOM 0 HB3 LYS A 31 -8.606 28.699 -27.534 1.00 24.24 H new ATOM 0 HG2 LYS A 31 -10.692 29.061 -28.265 1.00 71.22 H new ATOM 0 HG3 LYS A 31 -10.227 28.654 -29.905 1.00 71.22 H new ATOM 0 HD2 LYS A 31 -10.431 26.179 -29.184 1.00 54.13 H new ATOM 0 HD3 LYS A 31 -11.222 26.775 -27.738 1.00 54.13 H new ATOM 0 HE2 LYS A 31 -12.461 28.129 -29.910 1.00 35.42 H new ATOM 0 HE3 LYS A 31 -12.299 26.460 -30.420 1.00 35.42 H new ATOM 0 HZ1 LYS A 31 -14.374 26.821 -29.250 1.00 10.34 H new ATOM 0 HZ2 LYS A 31 -13.389 25.756 -28.368 1.00 10.34 H new ATOM 0 HZ3 LYS A 31 -13.546 27.373 -27.873 1.00 10.34 H new ATOM 437 N ILE A 32 -5.653 29.662 -29.331 1.00 31.53 N ATOM 438 CA ILE A 32 -4.784 30.774 -28.968 1.00 53.43 C ATOM 439 C ILE A 32 -5.229 32.064 -29.651 1.00 21.35 C ATOM 440 O ILE A 32 -5.215 33.134 -29.044 1.00 1.40 O ATOM 441 CB ILE A 32 -3.318 30.488 -29.342 1.00 2.52 C ATOM 442 CG1 ILE A 32 -2.432 31.680 -28.970 1.00 75.30 C ATOM 443 CG2 ILE A 32 -3.200 30.177 -30.826 1.00 54.34 C ATOM 444 CD1 ILE A 32 -2.497 32.047 -27.504 1.00 34.51 C ATOM 0 H ILE A 32 -5.179 28.896 -29.809 1.00 31.53 H new ATOM 0 HA ILE A 32 -4.858 30.893 -27.887 1.00 53.43 H new ATOM 0 HB ILE A 32 -2.979 29.617 -28.781 1.00 2.52 H new ATOM 0 HG12 ILE A 32 -1.399 31.451 -29.233 1.00 75.30 H new ATOM 0 HG13 ILE A 32 -2.729 32.543 -29.566 1.00 75.30 H new ATOM 0 HG21 ILE A 32 -2.158 29.977 -31.074 1.00 54.34 H new ATOM 0 HG22 ILE A 32 -3.804 29.301 -31.063 1.00 54.34 H new ATOM 0 HG23 ILE A 32 -3.554 31.030 -31.406 1.00 54.34 H new ATOM 0 HD11 ILE A 32 -1.845 32.899 -27.313 1.00 34.51 H new ATOM 0 HD12 ILE A 32 -3.522 32.308 -27.239 1.00 34.51 H new ATOM 0 HD13 ILE A 32 -2.171 31.199 -26.902 1.00 34.51 H new ATOM 456 N GLN A 33 -5.624 31.952 -30.914 1.00 74.15 N ATOM 457 CA GLN A 33 -6.075 33.109 -31.679 1.00 5.23 C ATOM 458 C GLN A 33 -7.311 33.735 -31.042 1.00 31.32 C ATOM 459 O GLN A 33 -7.307 34.894 -30.627 1.00 62.02 O ATOM 460 CB GLN A 33 -6.378 32.706 -33.123 1.00 14.52 C ATOM 461 CG GLN A 33 -5.300 33.123 -34.110 1.00 71.42 C ATOM 462 CD GLN A 33 -4.395 31.972 -34.505 1.00 53.23 C ATOM 463 OE1 GLN A 33 -3.615 31.474 -33.693 1.00 72.34 O ATOM 464 NE2 GLN A 33 -4.495 31.544 -35.758 1.00 61.42 N ATOM 0 H GLN A 33 -5.641 31.072 -31.430 1.00 74.15 H new ATOM 0 HA GLN A 33 -5.274 33.849 -31.677 1.00 5.23 H new ATOM 0 HB2 GLN A 33 -6.504 31.624 -33.171 1.00 14.52 H new ATOM 0 HB3 GLN A 33 -7.326 33.151 -33.424 1.00 14.52 H new ATOM 0 HG2 GLN A 33 -5.770 33.534 -35.003 1.00 71.42 H new ATOM 0 HG3 GLN A 33 -4.699 33.919 -33.671 1.00 71.42 H new ATOM 0 HE21 GLN A 33 -5.156 31.987 -36.397 1.00 61.42 H new ATOM 0 HE22 GLN A 33 -3.911 30.773 -36.082 1.00 61.42 H new ATOM 473 N PRO A 34 -8.397 32.951 -30.962 1.00 24.14 N ATOM 474 CA PRO A 34 -9.661 33.407 -30.376 1.00 42.02 C ATOM 475 C PRO A 34 -9.565 33.597 -28.866 1.00 74.51 C ATOM 476 O PRO A 34 -10.492 34.105 -28.235 1.00 64.22 O ATOM 477 CB PRO A 34 -10.636 32.276 -30.713 1.00 1.14 C ATOM 478 CG PRO A 34 -9.777 31.069 -30.868 1.00 41.04 C ATOM 479 CD PRO A 34 -8.473 31.559 -31.436 1.00 33.13 C ATOM 0 HA PRO A 34 -9.964 34.379 -30.765 1.00 42.02 H new ATOM 0 HB2 PRO A 34 -11.372 32.139 -29.921 1.00 1.14 H new ATOM 0 HB3 PRO A 34 -11.188 32.489 -31.628 1.00 1.14 H new ATOM 0 HG2 PRO A 34 -9.623 30.574 -29.909 1.00 41.04 H new ATOM 0 HG3 PRO A 34 -10.243 30.341 -31.532 1.00 41.04 H new ATOM 0 HD2 PRO A 34 -7.631 30.966 -31.079 1.00 33.13 H new ATOM 0 HD3 PRO A 34 -8.463 31.504 -32.525 1.00 33.13 H new ATOM 487 N ALA A 35 -8.439 33.185 -28.293 1.00 33.13 N ATOM 488 CA ALA A 35 -8.222 33.312 -26.857 1.00 34.10 C ATOM 489 C ALA A 35 -8.582 34.711 -26.369 1.00 54.10 C ATOM 490 O ALA A 35 -7.871 35.684 -26.620 1.00 55.42 O ATOM 491 CB ALA A 35 -6.777 32.986 -26.511 1.00 32.33 C ATOM 0 H ALA A 35 -7.663 32.760 -28.801 1.00 33.13 H new ATOM 0 HA ALA A 35 -8.875 32.600 -26.352 1.00 34.10 H new ATOM 0 HB1 ALA A 35 -6.629 33.085 -25.436 1.00 32.33 H new ATOM 0 HB2 ALA A 35 -6.552 31.964 -26.816 1.00 32.33 H new ATOM 0 HB3 ALA A 35 -6.113 33.675 -27.033 1.00 32.33 H new ATOM 497 N PRO A 36 -9.713 34.817 -25.655 1.00 50.02 N ATOM 498 CA PRO A 36 -10.193 36.093 -25.117 1.00 50.44 C ATOM 499 C PRO A 36 -9.314 36.613 -23.985 1.00 24.30 C ATOM 500 O PRO A 36 -8.456 35.904 -23.458 1.00 21.01 O ATOM 501 CB PRO A 36 -11.592 35.755 -24.596 1.00 1.10 C ATOM 502 CG PRO A 36 -11.544 34.296 -24.302 1.00 24.55 C ATOM 503 CD PRO A 36 -10.610 33.699 -25.318 1.00 23.33 C ATOM 0 HA PRO A 36 -10.183 36.882 -25.869 1.00 50.44 H new ATOM 0 HB2 PRO A 36 -11.832 36.331 -23.702 1.00 1.10 H new ATOM 0 HB3 PRO A 36 -12.357 35.984 -25.338 1.00 1.10 H new ATOM 0 HG2 PRO A 36 -11.186 34.114 -23.289 1.00 24.55 H new ATOM 0 HG3 PRO A 36 -12.536 33.850 -24.375 1.00 24.55 H new ATOM 0 HD2 PRO A 36 -10.060 32.852 -24.909 1.00 23.33 H new ATOM 0 HD3 PRO A 36 -11.148 33.337 -26.194 1.00 23.33 H new ATOM 511 N PRO A 37 -9.530 37.879 -23.600 1.00 43.31 N ATOM 512 CA PRO A 37 -8.767 38.521 -22.525 1.00 41.02 C ATOM 513 C PRO A 37 -9.100 37.944 -21.154 1.00 11.03 C ATOM 514 O PRO A 37 -8.333 38.096 -20.204 1.00 23.11 O ATOM 515 CB PRO A 37 -9.201 39.987 -22.609 1.00 22.44 C ATOM 516 CG PRO A 37 -10.553 39.946 -23.232 1.00 51.45 C ATOM 517 CD PRO A 37 -10.536 38.782 -24.184 1.00 44.31 C ATOM 0 HA PRO A 37 -7.693 38.373 -22.642 1.00 41.02 H new ATOM 0 HB2 PRO A 37 -9.234 40.447 -21.622 1.00 22.44 H new ATOM 0 HB3 PRO A 37 -8.505 40.572 -23.211 1.00 22.44 H new ATOM 0 HG2 PRO A 37 -11.327 39.820 -22.475 1.00 51.45 H new ATOM 0 HG3 PRO A 37 -10.769 40.876 -23.757 1.00 51.45 H new ATOM 0 HD2 PRO A 37 -11.513 38.304 -24.252 1.00 44.31 H new ATOM 0 HD3 PRO A 37 -10.261 39.091 -25.192 1.00 44.31 H new ATOM 525 N GLU A 38 -10.249 37.282 -21.058 1.00 63.44 N ATOM 526 CA GLU A 38 -10.682 36.682 -19.802 1.00 13.43 C ATOM 527 C GLU A 38 -10.092 35.285 -19.633 1.00 3.53 C ATOM 528 O GLU A 38 -10.016 34.764 -18.521 1.00 65.40 O ATOM 529 CB GLU A 38 -12.210 36.613 -19.744 1.00 63.45 C ATOM 530 CG GLU A 38 -12.819 37.491 -18.665 1.00 11.21 C ATOM 531 CD GLU A 38 -14.161 36.976 -18.182 1.00 51.10 C ATOM 532 OE1 GLU A 38 -14.198 35.870 -17.602 1.00 44.35 O ATOM 533 OE2 GLU A 38 -15.174 37.678 -18.384 1.00 30.34 O ATOM 0 H GLU A 38 -10.896 37.148 -21.835 1.00 63.44 H new ATOM 0 HA GLU A 38 -10.322 37.310 -18.987 1.00 13.43 H new ATOM 0 HB2 GLU A 38 -12.615 36.908 -20.712 1.00 63.45 H new ATOM 0 HB3 GLU A 38 -12.512 35.580 -19.573 1.00 63.45 H new ATOM 0 HG2 GLU A 38 -12.132 37.552 -17.821 1.00 11.21 H new ATOM 0 HG3 GLU A 38 -12.940 38.503 -19.051 1.00 11.21 H new ATOM 540 N GLU A 39 -9.676 34.687 -20.744 1.00 70.44 N ATOM 541 CA GLU A 39 -9.094 33.350 -20.719 1.00 62.13 C ATOM 542 C GLU A 39 -7.574 33.421 -20.601 1.00 31.44 C ATOM 543 O GLU A 39 -6.914 32.416 -20.333 1.00 11.23 O ATOM 544 CB GLU A 39 -9.482 32.576 -21.981 1.00 54.50 C ATOM 545 CG GLU A 39 -10.871 31.963 -21.916 1.00 10.24 C ATOM 546 CD GLU A 39 -10.850 30.519 -21.454 1.00 23.02 C ATOM 547 OE1 GLU A 39 -10.366 29.659 -22.220 1.00 2.14 O ATOM 548 OE2 GLU A 39 -11.317 30.248 -20.328 1.00 2.51 O ATOM 0 H GLU A 39 -9.731 35.106 -21.672 1.00 70.44 H new ATOM 0 HA GLU A 39 -9.486 32.828 -19.846 1.00 62.13 H new ATOM 0 HB2 GLU A 39 -9.430 33.247 -22.839 1.00 54.50 H new ATOM 0 HB3 GLU A 39 -8.752 31.784 -22.150 1.00 54.50 H new ATOM 0 HG2 GLU A 39 -11.491 32.549 -21.237 1.00 10.24 H new ATOM 0 HG3 GLU A 39 -11.335 32.019 -22.901 1.00 10.24 H new ATOM 555 N TYR A 40 -7.026 34.613 -20.802 1.00 41.54 N ATOM 556 CA TYR A 40 -5.584 34.816 -20.721 1.00 72.33 C ATOM 557 C TYR A 40 -5.104 34.739 -19.275 1.00 42.23 C ATOM 558 O TYR A 40 -4.057 34.159 -18.986 1.00 74.41 O ATOM 559 CB TYR A 40 -5.203 36.168 -21.326 1.00 61.12 C ATOM 560 CG TYR A 40 -4.339 36.056 -22.562 1.00 51.32 C ATOM 561 CD1 TYR A 40 -4.858 35.569 -23.755 1.00 54.53 C ATOM 562 CD2 TYR A 40 -3.003 36.439 -22.537 1.00 35.01 C ATOM 563 CE1 TYR A 40 -4.073 35.465 -24.887 1.00 5.25 C ATOM 564 CE2 TYR A 40 -2.211 36.340 -23.664 1.00 25.42 C ATOM 565 CZ TYR A 40 -2.749 35.852 -24.836 1.00 34.41 C ATOM 566 OH TYR A 40 -1.964 35.751 -25.961 1.00 63.31 O ATOM 0 H TYR A 40 -7.558 35.455 -21.022 1.00 41.54 H new ATOM 0 HA TYR A 40 -5.098 34.022 -21.289 1.00 72.33 H new ATOM 0 HB2 TYR A 40 -6.113 36.714 -21.577 1.00 61.12 H new ATOM 0 HB3 TYR A 40 -4.675 36.757 -20.576 1.00 61.12 H new ATOM 0 HD1 TYR A 40 -5.894 35.266 -23.798 1.00 54.53 H new ATOM 0 HD2 TYR A 40 -2.577 36.820 -21.621 1.00 35.01 H new ATOM 0 HE1 TYR A 40 -4.493 35.083 -25.806 1.00 5.25 H new ATOM 0 HE2 TYR A 40 -1.175 36.643 -23.628 1.00 25.42 H new ATOM 0 HH TYR A 40 -1.088 36.153 -25.785 1.00 63.31 H new ATOM 576 N VAL A 41 -5.877 35.330 -18.370 1.00 33.44 N ATOM 577 CA VAL A 41 -5.533 35.328 -16.953 1.00 35.23 C ATOM 578 C VAL A 41 -5.351 33.906 -16.433 1.00 54.22 C ATOM 579 O VAL A 41 -4.299 33.540 -15.909 1.00 12.30 O ATOM 580 CB VAL A 41 -6.613 36.035 -16.112 1.00 50.44 C ATOM 581 CG1 VAL A 41 -6.690 35.427 -14.720 1.00 51.33 C ATOM 582 CG2 VAL A 41 -6.334 37.529 -16.036 1.00 31.10 C ATOM 0 H VAL A 41 -6.746 35.816 -18.593 1.00 33.44 H new ATOM 0 HA VAL A 41 -4.593 35.871 -16.855 1.00 35.23 H new ATOM 0 HB VAL A 41 -7.578 35.892 -16.598 1.00 50.44 H new ATOM 0 HG11 VAL A 41 -7.458 35.940 -14.141 1.00 51.33 H new ATOM 0 HG12 VAL A 41 -6.940 34.369 -14.798 1.00 51.33 H new ATOM 0 HG13 VAL A 41 -5.727 35.536 -14.222 1.00 51.33 H new ATOM 0 HG21 VAL A 41 -7.106 38.013 -15.438 1.00 31.10 H new ATOM 0 HG22 VAL A 41 -5.361 37.694 -15.574 1.00 31.10 H new ATOM 0 HG23 VAL A 41 -6.335 37.951 -17.041 1.00 31.10 H new ATOM 592 N PRO A 42 -6.400 33.083 -16.581 1.00 51.23 N ATOM 593 CA PRO A 42 -6.380 31.687 -16.134 1.00 53.32 C ATOM 594 C PRO A 42 -5.456 30.820 -16.982 1.00 5.34 C ATOM 595 O PRO A 42 -4.899 29.835 -16.499 1.00 21.41 O ATOM 596 CB PRO A 42 -7.835 31.240 -16.302 1.00 3.40 C ATOM 597 CG PRO A 42 -8.385 32.131 -17.362 1.00 64.23 C ATOM 598 CD PRO A 42 -7.686 33.452 -17.197 1.00 61.01 C ATOM 0 HA PRO A 42 -6.005 31.591 -15.115 1.00 53.32 H new ATOM 0 HB2 PRO A 42 -7.896 30.192 -16.595 1.00 3.40 H new ATOM 0 HB3 PRO A 42 -8.391 31.343 -15.370 1.00 3.40 H new ATOM 0 HG2 PRO A 42 -8.205 31.715 -18.353 1.00 64.23 H new ATOM 0 HG3 PRO A 42 -9.464 32.244 -17.255 1.00 64.23 H new ATOM 0 HD2 PRO A 42 -7.544 33.954 -18.154 1.00 61.01 H new ATOM 0 HD3 PRO A 42 -8.255 34.131 -16.563 1.00 61.01 H new ATOM 606 N MET A 43 -5.296 31.194 -18.247 1.00 0.42 N ATOM 607 CA MET A 43 -4.437 30.451 -19.161 1.00 25.24 C ATOM 608 C MET A 43 -3.065 30.205 -18.539 1.00 14.31 C ATOM 609 O MET A 43 -2.547 29.089 -18.575 1.00 50.34 O ATOM 610 CB MET A 43 -4.283 31.209 -20.481 1.00 24.14 C ATOM 611 CG MET A 43 -5.068 30.596 -21.629 1.00 21.14 C ATOM 612 SD MET A 43 -5.342 31.757 -22.981 1.00 21.22 S ATOM 613 CE MET A 43 -6.784 31.035 -23.760 1.00 15.25 C ATOM 0 H MET A 43 -5.750 32.007 -18.662 1.00 0.42 H new ATOM 0 HA MET A 43 -4.906 29.487 -19.357 1.00 25.24 H new ATOM 0 HB2 MET A 43 -4.608 32.240 -20.339 1.00 24.14 H new ATOM 0 HB3 MET A 43 -3.227 31.242 -20.750 1.00 24.14 H new ATOM 0 HG2 MET A 43 -4.532 29.725 -22.006 1.00 21.14 H new ATOM 0 HG3 MET A 43 -6.030 30.242 -21.258 1.00 21.14 H new ATOM 0 HE1 MET A 43 -6.494 30.571 -24.703 1.00 15.25 H new ATOM 0 HE2 MET A 43 -7.214 30.281 -23.101 1.00 15.25 H new ATOM 0 HE3 MET A 43 -7.522 31.814 -23.951 1.00 15.25 H new ATOM 623 N VAL A 44 -2.483 31.255 -17.969 1.00 5.14 N ATOM 624 CA VAL A 44 -1.172 31.153 -17.338 1.00 62.12 C ATOM 625 C VAL A 44 -1.209 30.206 -16.144 1.00 64.43 C ATOM 626 O VAL A 44 -0.221 29.539 -15.836 1.00 23.23 O ATOM 627 CB VAL A 44 -0.665 32.530 -16.871 1.00 43.33 C ATOM 628 CG1 VAL A 44 -1.315 32.920 -15.553 1.00 13.21 C ATOM 629 CG2 VAL A 44 0.851 32.525 -16.746 1.00 64.10 C ATOM 0 H VAL A 44 -2.898 32.186 -17.931 1.00 5.14 H new ATOM 0 HA VAL A 44 -0.489 30.759 -18.090 1.00 62.12 H new ATOM 0 HB VAL A 44 -0.943 33.273 -17.619 1.00 43.33 H new ATOM 0 HG11 VAL A 44 -0.944 33.896 -15.239 1.00 13.21 H new ATOM 0 HG12 VAL A 44 -2.397 32.967 -15.680 1.00 13.21 H new ATOM 0 HG13 VAL A 44 -1.071 32.178 -14.793 1.00 13.21 H new ATOM 0 HG21 VAL A 44 1.192 33.506 -16.415 1.00 64.10 H new ATOM 0 HG22 VAL A 44 1.154 31.771 -16.019 1.00 64.10 H new ATOM 0 HG23 VAL A 44 1.295 32.294 -17.714 1.00 64.10 H new ATOM 639 N LYS A 45 -2.355 30.150 -15.475 1.00 51.31 N ATOM 640 CA LYS A 45 -2.523 29.283 -14.315 1.00 14.20 C ATOM 641 C LYS A 45 -2.297 27.822 -14.690 1.00 45.31 C ATOM 642 O LYS A 45 -1.548 27.110 -14.022 1.00 45.32 O ATOM 643 CB LYS A 45 -3.923 29.457 -13.721 1.00 73.15 C ATOM 644 CG LYS A 45 -3.943 29.464 -12.203 1.00 14.42 C ATOM 645 CD LYS A 45 -3.465 30.794 -11.645 1.00 51.53 C ATOM 646 CE LYS A 45 -2.278 30.613 -10.712 1.00 10.13 C ATOM 647 NZ LYS A 45 -1.766 31.917 -10.206 1.00 64.32 N ATOM 0 H LYS A 45 -3.182 30.695 -15.716 1.00 51.31 H new ATOM 0 HA LYS A 45 -1.780 29.568 -13.570 1.00 14.20 H new ATOM 0 HB2 LYS A 45 -4.350 30.391 -14.086 1.00 73.15 H new ATOM 0 HB3 LYS A 45 -4.564 28.652 -14.081 1.00 73.15 H new ATOM 0 HG2 LYS A 45 -4.955 29.263 -11.851 1.00 14.42 H new ATOM 0 HG3 LYS A 45 -3.309 28.661 -11.826 1.00 14.42 H new ATOM 0 HD2 LYS A 45 -3.186 31.455 -12.466 1.00 51.53 H new ATOM 0 HD3 LYS A 45 -4.280 31.279 -11.108 1.00 51.53 H new ATOM 0 HE2 LYS A 45 -2.571 29.986 -9.870 1.00 10.13 H new ATOM 0 HE3 LYS A 45 -1.480 30.089 -11.237 1.00 10.13 H new ATOM 0 HZ1 LYS A 45 -0.957 31.751 -9.574 1.00 64.32 H new ATOM 0 HZ2 LYS A 45 -1.463 32.506 -11.008 1.00 64.32 H new ATOM 0 HZ3 LYS A 45 -2.520 32.406 -9.683 1.00 64.32 H new ATOM 661 N GLU A 46 -2.947 27.383 -15.763 1.00 52.52 N ATOM 662 CA GLU A 46 -2.815 26.007 -16.226 1.00 44.12 C ATOM 663 C GLU A 46 -1.367 25.693 -16.592 1.00 42.20 C ATOM 664 O GLU A 46 -0.787 24.723 -16.103 1.00 55.13 O ATOM 665 CB GLU A 46 -3.722 25.762 -17.434 1.00 2.32 C ATOM 666 CG GLU A 46 -5.159 26.205 -17.215 1.00 61.41 C ATOM 667 CD GLU A 46 -5.707 25.763 -15.872 1.00 74.43 C ATOM 668 OE1 GLU A 46 -6.263 24.647 -15.796 1.00 11.02 O ATOM 669 OE2 GLU A 46 -5.580 26.533 -14.898 1.00 13.14 O ATOM 0 H GLU A 46 -3.570 27.960 -16.328 1.00 52.52 H new ATOM 0 HA GLU A 46 -3.118 25.347 -15.413 1.00 44.12 H new ATOM 0 HB2 GLU A 46 -3.315 26.290 -18.296 1.00 2.32 H new ATOM 0 HB3 GLU A 46 -3.711 24.699 -17.677 1.00 2.32 H new ATOM 0 HG2 GLU A 46 -5.215 27.291 -17.287 1.00 61.41 H new ATOM 0 HG3 GLU A 46 -5.785 25.800 -18.010 1.00 61.41 H new ATOM 676 N VAL A 47 -0.788 26.521 -17.456 1.00 50.11 N ATOM 677 CA VAL A 47 0.592 26.333 -17.888 1.00 11.41 C ATOM 678 C VAL A 47 1.545 26.333 -16.698 1.00 11.10 C ATOM 679 O VAL A 47 2.429 25.483 -16.597 1.00 54.22 O ATOM 680 CB VAL A 47 1.025 27.431 -18.878 1.00 15.21 C ATOM 681 CG1 VAL A 47 2.436 27.171 -19.381 1.00 61.51 C ATOM 682 CG2 VAL A 47 0.044 27.519 -20.038 1.00 31.25 C ATOM 0 H VAL A 47 -1.253 27.328 -17.871 1.00 50.11 H new ATOM 0 HA VAL A 47 0.638 25.365 -18.387 1.00 11.41 H new ATOM 0 HB VAL A 47 1.022 28.388 -18.356 1.00 15.21 H new ATOM 0 HG11 VAL A 47 2.724 27.957 -20.079 1.00 61.51 H new ATOM 0 HG12 VAL A 47 3.127 27.163 -18.538 1.00 61.51 H new ATOM 0 HG13 VAL A 47 2.470 26.206 -19.887 1.00 61.51 H new ATOM 0 HG21 VAL A 47 0.365 28.300 -20.728 1.00 31.25 H new ATOM 0 HG22 VAL A 47 0.012 26.563 -20.561 1.00 31.25 H new ATOM 0 HG23 VAL A 47 -0.949 27.757 -19.657 1.00 31.25 H new ATOM 692 N GLY A 48 1.358 27.293 -15.797 1.00 4.00 N ATOM 693 CA GLY A 48 2.209 27.385 -14.625 1.00 11.53 C ATOM 694 C GLY A 48 2.175 26.125 -13.783 1.00 44.13 C ATOM 695 O GLY A 48 3.134 25.817 -13.074 1.00 45.23 O ATOM 0 H GLY A 48 0.633 28.008 -15.858 1.00 4.00 H new ATOM 0 HA2 GLY A 48 3.234 27.581 -14.939 1.00 11.53 H new ATOM 0 HA3 GLY A 48 1.894 28.233 -14.017 1.00 11.53 H new ATOM 699 N LEU A 49 1.069 25.394 -13.859 1.00 54.42 N ATOM 700 CA LEU A 49 0.913 24.160 -13.097 1.00 12.30 C ATOM 701 C LEU A 49 1.768 23.044 -13.688 1.00 30.25 C ATOM 702 O LEU A 49 2.401 22.281 -12.958 1.00 11.31 O ATOM 703 CB LEU A 49 -0.556 23.735 -13.073 1.00 32.41 C ATOM 704 CG LEU A 49 -0.876 22.473 -12.270 1.00 15.43 C ATOM 705 CD1 LEU A 49 -0.436 22.636 -10.823 1.00 71.42 C ATOM 706 CD2 LEU A 49 -2.363 22.157 -12.344 1.00 71.23 C ATOM 0 H LEU A 49 0.266 25.634 -14.441 1.00 54.42 H new ATOM 0 HA LEU A 49 1.247 24.347 -12.076 1.00 12.30 H new ATOM 0 HB2 LEU A 49 -1.145 24.558 -12.669 1.00 32.41 H new ATOM 0 HB3 LEU A 49 -0.886 23.581 -14.100 1.00 32.41 H new ATOM 0 HG LEU A 49 -0.325 21.639 -12.705 1.00 15.43 H new ATOM 0 HD11 LEU A 49 -0.671 21.729 -10.267 1.00 71.42 H new ATOM 0 HD12 LEU A 49 0.639 22.815 -10.787 1.00 71.42 H new ATOM 0 HD13 LEU A 49 -0.959 23.481 -10.377 1.00 71.42 H new ATOM 0 HD21 LEU A 49 -2.573 21.256 -11.767 1.00 71.23 H new ATOM 0 HD22 LEU A 49 -2.933 22.991 -11.935 1.00 71.23 H new ATOM 0 HD23 LEU A 49 -2.650 21.997 -13.383 1.00 71.23 H new ATOM 718 N ALA A 50 1.783 22.955 -15.014 1.00 2.55 N ATOM 719 CA ALA A 50 2.564 21.935 -15.702 1.00 50.32 C ATOM 720 C ALA A 50 4.045 22.053 -15.360 1.00 2.43 C ATOM 721 O ALA A 50 4.702 21.059 -15.048 1.00 0.12 O ATOM 722 CB ALA A 50 2.358 22.039 -17.206 1.00 42.12 C ATOM 0 H ALA A 50 1.263 23.577 -15.633 1.00 2.55 H new ATOM 0 HA ALA A 50 2.217 20.958 -15.365 1.00 50.32 H new ATOM 0 HB1 ALA A 50 2.947 21.271 -17.708 1.00 42.12 H new ATOM 0 HB2 ALA A 50 1.303 21.897 -17.439 1.00 42.12 H new ATOM 0 HB3 ALA A 50 2.676 23.023 -17.550 1.00 42.12 H new ATOM 728 N LEU A 51 4.566 23.274 -15.420 1.00 61.11 N ATOM 729 CA LEU A 51 5.971 23.522 -15.117 1.00 23.03 C ATOM 730 C LEU A 51 6.277 23.207 -13.656 1.00 13.22 C ATOM 731 O LEU A 51 7.170 22.415 -13.355 1.00 0.32 O ATOM 732 CB LEU A 51 6.330 24.977 -15.423 1.00 3.15 C ATOM 733 CG LEU A 51 6.619 25.303 -16.888 1.00 53.53 C ATOM 734 CD1 LEU A 51 7.768 24.454 -17.408 1.00 71.22 C ATOM 735 CD2 LEU A 51 5.373 25.095 -17.736 1.00 75.23 C ATOM 0 H LEU A 51 4.036 24.107 -15.676 1.00 61.11 H new ATOM 0 HA LEU A 51 6.574 22.866 -15.745 1.00 23.03 H new ATOM 0 HB2 LEU A 51 5.510 25.611 -15.085 1.00 3.15 H new ATOM 0 HB3 LEU A 51 7.206 25.246 -14.832 1.00 3.15 H new ATOM 0 HG LEU A 51 6.910 26.351 -16.956 1.00 53.53 H new ATOM 0 HD11 LEU A 51 7.959 24.700 -18.452 1.00 71.22 H new ATOM 0 HD12 LEU A 51 8.663 24.653 -16.819 1.00 71.22 H new ATOM 0 HD13 LEU A 51 7.507 23.399 -17.326 1.00 71.22 H new ATOM 0 HD21 LEU A 51 5.597 25.332 -18.776 1.00 75.23 H new ATOM 0 HD22 LEU A 51 5.051 24.056 -17.661 1.00 75.23 H new ATOM 0 HD23 LEU A 51 4.577 25.748 -17.379 1.00 75.23 H new ATOM 747 N ARG A 52 5.528 23.831 -12.752 1.00 73.24 N ATOM 748 CA ARG A 52 5.718 23.616 -11.323 1.00 13.41 C ATOM 749 C ARG A 52 5.599 22.135 -10.975 1.00 10.52 C ATOM 750 O ARG A 52 6.349 21.619 -10.146 1.00 32.24 O ATOM 751 CB ARG A 52 4.692 24.423 -10.524 1.00 23.12 C ATOM 752 CG ARG A 52 5.041 24.562 -9.051 1.00 32.21 C ATOM 753 CD ARG A 52 4.636 25.924 -8.509 1.00 24.22 C ATOM 754 NE ARG A 52 3.857 25.814 -7.279 1.00 33.12 N ATOM 755 CZ ARG A 52 3.386 26.861 -6.611 1.00 53.32 C ATOM 756 NH1 ARG A 52 3.614 28.090 -7.053 1.00 11.41 N ATOM 757 NH2 ARG A 52 2.684 26.680 -5.499 1.00 44.24 N ATOM 0 H ARG A 52 4.784 24.489 -12.984 1.00 73.24 H new ATOM 0 HA ARG A 52 6.721 23.953 -11.060 1.00 13.41 H new ATOM 0 HB2 ARG A 52 4.602 25.417 -10.963 1.00 23.12 H new ATOM 0 HB3 ARG A 52 3.716 23.945 -10.614 1.00 23.12 H new ATOM 0 HG2 ARG A 52 4.540 23.779 -8.482 1.00 32.21 H new ATOM 0 HG3 ARG A 52 6.113 24.419 -8.915 1.00 32.21 H new ATOM 0 HD2 ARG A 52 5.529 26.519 -8.320 1.00 24.22 H new ATOM 0 HD3 ARG A 52 4.053 26.455 -9.261 1.00 24.22 H new ATOM 0 HE ARG A 52 3.664 24.882 -6.913 1.00 33.12 H new ATOM 0 HH11 ARG A 52 4.152 28.233 -7.908 1.00 11.41 H new ATOM 0 HH12 ARG A 52 3.251 28.893 -6.538 1.00 11.41 H new ATOM 0 HH21 ARG A 52 2.506 25.736 -5.156 1.00 44.24 H new ATOM 0 HH22 ARG A 52 2.323 27.485 -4.987 1.00 44.24 H new ATOM 771 N THR A 53 4.651 21.457 -11.614 1.00 20.33 N ATOM 772 CA THR A 53 4.433 20.036 -11.371 1.00 15.41 C ATOM 773 C THR A 53 5.557 19.197 -11.967 1.00 2.35 C ATOM 774 O THR A 53 5.986 18.206 -11.375 1.00 70.51 O ATOM 775 CB THR A 53 3.089 19.566 -11.960 1.00 22.11 C ATOM 776 OG1 THR A 53 2.009 20.281 -11.350 1.00 3.34 O ATOM 777 CG2 THR A 53 2.899 18.072 -11.747 1.00 73.32 C ATOM 0 H THR A 53 4.022 21.869 -12.303 1.00 20.33 H new ATOM 0 HA THR A 53 4.416 19.899 -10.290 1.00 15.41 H new ATOM 0 HB THR A 53 3.097 19.767 -13.031 1.00 22.11 H new ATOM 0 HG1 THR A 53 1.698 20.984 -11.958 1.00 3.34 H new ATOM 0 HG21 THR A 53 1.944 17.763 -12.171 1.00 73.32 H new ATOM 0 HG22 THR A 53 3.707 17.529 -12.238 1.00 73.32 H new ATOM 0 HG23 THR A 53 2.910 17.852 -10.679 1.00 73.32 H new ATOM 785 N LEU A 54 6.032 19.601 -13.140 1.00 23.23 N ATOM 786 CA LEU A 54 7.109 18.886 -13.816 1.00 23.22 C ATOM 787 C LEU A 54 8.316 18.724 -12.897 1.00 61.21 C ATOM 788 O LEU A 54 8.999 17.699 -12.927 1.00 5.51 O ATOM 789 CB LEU A 54 7.519 19.627 -15.089 1.00 44.43 C ATOM 790 CG LEU A 54 6.702 19.312 -16.343 1.00 21.35 C ATOM 791 CD1 LEU A 54 6.842 20.428 -17.366 1.00 61.42 C ATOM 792 CD2 LEU A 54 7.134 17.980 -16.940 1.00 2.43 C ATOM 0 H LEU A 54 5.689 20.419 -13.643 1.00 23.23 H new ATOM 0 HA LEU A 54 6.743 17.895 -14.082 1.00 23.22 H new ATOM 0 HB2 LEU A 54 7.455 20.698 -14.898 1.00 44.43 H new ATOM 0 HB3 LEU A 54 8.565 19.402 -15.295 1.00 44.43 H new ATOM 0 HG LEU A 54 5.652 19.237 -16.060 1.00 21.35 H new ATOM 0 HD11 LEU A 54 6.254 20.186 -18.251 1.00 61.42 H new ATOM 0 HD12 LEU A 54 6.483 21.363 -16.936 1.00 61.42 H new ATOM 0 HD13 LEU A 54 7.890 20.536 -17.645 1.00 61.42 H new ATOM 0 HD21 LEU A 54 6.542 17.772 -17.831 1.00 2.43 H new ATOM 0 HD22 LEU A 54 8.190 18.027 -17.208 1.00 2.43 H new ATOM 0 HD23 LEU A 54 6.980 17.186 -16.209 1.00 2.43 H new ATOM 804 N LEU A 55 8.572 19.740 -12.080 1.00 74.41 N ATOM 805 CA LEU A 55 9.695 19.710 -11.150 1.00 30.51 C ATOM 806 C LEU A 55 9.539 18.573 -10.144 1.00 53.51 C ATOM 807 O LEU A 55 10.488 17.841 -9.868 1.00 60.42 O ATOM 808 CB LEU A 55 9.809 21.046 -10.414 1.00 21.42 C ATOM 809 CG LEU A 55 10.724 21.061 -9.189 1.00 30.13 C ATOM 810 CD1 LEU A 55 11.738 22.189 -9.294 1.00 44.12 C ATOM 811 CD2 LEU A 55 9.905 21.195 -7.913 1.00 50.12 C ATOM 0 H LEU A 55 8.017 20.595 -12.043 1.00 74.41 H new ATOM 0 HA LEU A 55 10.606 19.540 -11.724 1.00 30.51 H new ATOM 0 HB2 LEU A 55 10.166 21.797 -11.119 1.00 21.42 H new ATOM 0 HB3 LEU A 55 8.811 21.352 -10.101 1.00 21.42 H new ATOM 0 HG LEU A 55 11.265 20.116 -9.152 1.00 30.13 H new ATOM 0 HD11 LEU A 55 12.380 22.184 -8.413 1.00 44.12 H new ATOM 0 HD12 LEU A 55 12.346 22.049 -10.188 1.00 44.12 H new ATOM 0 HD13 LEU A 55 11.215 23.143 -9.356 1.00 44.12 H new ATOM 0 HD21 LEU A 55 10.573 21.204 -7.051 1.00 50.12 H new ATOM 0 HD22 LEU A 55 9.337 22.125 -7.941 1.00 50.12 H new ATOM 0 HD23 LEU A 55 9.218 20.352 -7.831 1.00 50.12 H new ATOM 823 N ALA A 56 8.334 18.432 -9.601 1.00 0.40 N ATOM 824 CA ALA A 56 8.052 17.383 -8.629 1.00 42.23 C ATOM 825 C ALA A 56 7.980 16.017 -9.302 1.00 60.33 C ATOM 826 O ALA A 56 8.515 15.032 -8.792 1.00 4.00 O ATOM 827 CB ALA A 56 6.754 17.680 -7.893 1.00 43.31 C ATOM 0 H ALA A 56 7.538 19.031 -9.818 1.00 0.40 H new ATOM 0 HA ALA A 56 8.869 17.361 -7.907 1.00 42.23 H new ATOM 0 HB1 ALA A 56 6.556 16.888 -7.170 1.00 43.31 H new ATOM 0 HB2 ALA A 56 6.841 18.633 -7.372 1.00 43.31 H new ATOM 0 HB3 ALA A 56 5.933 17.731 -8.609 1.00 43.31 H new ATOM 833 N THR A 57 7.314 15.963 -10.451 1.00 73.55 N ATOM 834 CA THR A 57 7.170 14.716 -11.193 1.00 53.44 C ATOM 835 C THR A 57 8.523 14.055 -11.426 1.00 5.24 C ATOM 836 O THR A 57 8.724 12.891 -11.080 1.00 24.20 O ATOM 837 CB THR A 57 6.485 14.948 -12.553 1.00 55.34 C ATOM 838 OG1 THR A 57 7.296 15.798 -13.372 1.00 53.11 O ATOM 839 CG2 THR A 57 5.111 15.575 -12.367 1.00 41.44 C ATOM 0 H THR A 57 6.866 16.768 -10.888 1.00 73.55 H new ATOM 0 HA THR A 57 6.547 14.058 -10.587 1.00 53.44 H new ATOM 0 HB THR A 57 6.363 13.982 -13.043 1.00 55.34 H new ATOM 0 HG1 THR A 57 7.755 16.455 -12.808 1.00 53.11 H new ATOM 0 HG21 THR A 57 4.647 15.729 -13.341 1.00 41.44 H new ATOM 0 HG22 THR A 57 4.487 14.912 -11.768 1.00 41.44 H new ATOM 0 HG23 THR A 57 5.214 16.533 -11.858 1.00 41.44 H new ATOM 847 N VAL A 58 9.451 14.805 -12.013 1.00 14.54 N ATOM 848 CA VAL A 58 10.787 14.292 -12.289 1.00 51.22 C ATOM 849 C VAL A 58 11.538 13.990 -10.997 1.00 51.13 C ATOM 850 O VAL A 58 12.346 13.063 -10.939 1.00 74.21 O ATOM 851 CB VAL A 58 11.609 15.290 -13.127 1.00 20.32 C ATOM 852 CG1 VAL A 58 11.851 16.572 -12.345 1.00 31.23 C ATOM 853 CG2 VAL A 58 12.926 14.663 -13.560 1.00 12.13 C ATOM 0 H VAL A 58 9.301 15.770 -12.306 1.00 14.54 H new ATOM 0 HA VAL A 58 10.661 13.370 -12.856 1.00 51.22 H new ATOM 0 HB VAL A 58 11.040 15.541 -14.022 1.00 20.32 H new ATOM 0 HG11 VAL A 58 12.433 17.265 -12.953 1.00 31.23 H new ATOM 0 HG12 VAL A 58 10.895 17.029 -12.090 1.00 31.23 H new ATOM 0 HG13 VAL A 58 12.399 16.343 -11.431 1.00 31.23 H new ATOM 0 HG21 VAL A 58 13.494 15.381 -14.151 1.00 12.13 H new ATOM 0 HG22 VAL A 58 13.502 14.382 -12.679 1.00 12.13 H new ATOM 0 HG23 VAL A 58 12.726 13.776 -14.161 1.00 12.13 H new ATOM 863 N ASP A 59 11.266 14.779 -9.963 1.00 71.54 N ATOM 864 CA ASP A 59 11.915 14.595 -8.670 1.00 73.13 C ATOM 865 C ASP A 59 11.786 13.150 -8.198 1.00 63.13 C ATOM 866 O ASP A 59 12.751 12.557 -7.716 1.00 14.23 O ATOM 867 CB ASP A 59 11.307 15.540 -7.632 1.00 62.51 C ATOM 868 CG ASP A 59 12.361 16.211 -6.773 1.00 71.24 C ATOM 869 OD1 ASP A 59 13.402 15.575 -6.508 1.00 3.31 O ATOM 870 OD2 ASP A 59 12.144 17.371 -6.366 1.00 53.40 O ATOM 0 H ASP A 59 10.601 15.552 -9.995 1.00 71.54 H new ATOM 0 HA ASP A 59 12.974 14.827 -8.786 1.00 73.13 H new ATOM 0 HB2 ASP A 59 10.717 16.303 -8.140 1.00 62.51 H new ATOM 0 HB3 ASP A 59 10.623 14.982 -6.993 1.00 62.51 H new ATOM 875 N GLU A 60 10.589 12.590 -8.340 1.00 52.44 N ATOM 876 CA GLU A 60 10.335 11.215 -7.926 1.00 51.53 C ATOM 877 C GLU A 60 10.802 10.231 -8.994 1.00 63.41 C ATOM 878 O GLU A 60 10.932 9.034 -8.736 1.00 2.02 O ATOM 879 CB GLU A 60 8.845 11.011 -7.645 1.00 73.15 C ATOM 880 CG GLU A 60 7.966 11.172 -8.874 1.00 51.35 C ATOM 881 CD GLU A 60 6.602 10.531 -8.705 1.00 3.11 C ATOM 882 OE1 GLU A 60 6.098 10.505 -7.563 1.00 32.24 O ATOM 883 OE2 GLU A 60 6.040 10.056 -9.713 1.00 70.23 O ATOM 0 H GLU A 60 9.780 13.067 -8.738 1.00 52.44 H new ATOM 0 HA GLU A 60 10.899 11.027 -7.012 1.00 51.53 H new ATOM 0 HB2 GLU A 60 8.695 10.014 -7.230 1.00 73.15 H new ATOM 0 HB3 GLU A 60 8.526 11.724 -6.885 1.00 73.15 H new ATOM 0 HG2 GLU A 60 7.840 12.233 -9.089 1.00 51.35 H new ATOM 0 HG3 GLU A 60 8.467 10.729 -9.735 1.00 51.35 H new ATOM 890 N SER A 61 11.053 10.743 -10.195 1.00 12.24 N ATOM 891 CA SER A 61 11.501 9.909 -11.303 1.00 44.14 C ATOM 892 C SER A 61 12.956 9.490 -11.114 1.00 21.10 C ATOM 893 O SER A 61 13.399 8.477 -11.658 1.00 15.13 O ATOM 894 CB SER A 61 11.343 10.657 -12.629 1.00 12.14 C ATOM 895 OG SER A 61 11.677 9.826 -13.726 1.00 61.15 O ATOM 0 H SER A 61 10.953 11.732 -10.425 1.00 12.24 H new ATOM 0 HA SER A 61 10.882 9.012 -11.323 1.00 44.14 H new ATOM 0 HB2 SER A 61 10.316 11.006 -12.733 1.00 12.14 H new ATOM 0 HB3 SER A 61 11.982 11.540 -12.630 1.00 12.14 H new ATOM 0 HG SER A 61 11.566 10.327 -14.561 1.00 61.15 H new ATOM 901 N LEU A 62 13.695 10.276 -10.339 1.00 64.02 N ATOM 902 CA LEU A 62 15.101 9.988 -10.077 1.00 22.14 C ATOM 903 C LEU A 62 15.284 8.547 -9.612 1.00 21.33 C ATOM 904 O LEU A 62 15.973 7.747 -10.245 1.00 63.01 O ATOM 905 CB LEU A 62 15.651 10.950 -9.022 1.00 32.33 C ATOM 906 CG LEU A 62 16.755 11.899 -9.489 1.00 20.40 C ATOM 907 CD1 LEU A 62 17.207 12.795 -8.347 1.00 12.42 C ATOM 908 CD2 LEU A 62 17.931 11.113 -10.050 1.00 23.00 C ATOM 0 H LEU A 62 13.344 11.117 -9.881 1.00 64.02 H new ATOM 0 HA LEU A 62 15.654 10.123 -11.007 1.00 22.14 H new ATOM 0 HB2 LEU A 62 14.824 11.548 -8.638 1.00 32.33 H new ATOM 0 HB3 LEU A 62 16.034 10.362 -8.188 1.00 32.33 H new ATOM 0 HG LEU A 62 16.354 12.530 -10.282 1.00 20.40 H new ATOM 0 HD11 LEU A 62 17.993 13.463 -8.698 1.00 12.42 H new ATOM 0 HD12 LEU A 62 16.362 13.384 -7.990 1.00 12.42 H new ATOM 0 HD13 LEU A 62 17.590 12.181 -7.532 1.00 12.42 H new ATOM 0 HD21 LEU A 62 18.707 11.804 -10.378 1.00 23.00 H new ATOM 0 HD22 LEU A 62 18.332 10.457 -9.277 1.00 23.00 H new ATOM 0 HD23 LEU A 62 17.597 10.514 -10.897 1.00 23.00 H new ATOM 920 N PRO A 63 14.651 8.205 -8.480 1.00 21.03 N ATOM 921 CA PRO A 63 14.727 6.858 -7.906 1.00 55.02 C ATOM 922 C PRO A 63 13.983 5.827 -8.749 1.00 24.24 C ATOM 923 O PRO A 63 14.474 4.719 -8.968 1.00 3.31 O ATOM 924 CB PRO A 63 14.055 7.016 -6.540 1.00 1.23 C ATOM 925 CG PRO A 63 13.138 8.179 -6.701 1.00 31.04 C ATOM 926 CD PRO A 63 13.812 9.107 -7.673 1.00 4.14 C ATOM 0 HA PRO A 63 15.753 6.495 -7.852 1.00 55.02 H new ATOM 0 HB2 PRO A 63 13.507 6.116 -6.262 1.00 1.23 H new ATOM 0 HB3 PRO A 63 14.790 7.197 -5.756 1.00 1.23 H new ATOM 0 HG2 PRO A 63 12.166 7.860 -7.076 1.00 31.04 H new ATOM 0 HG3 PRO A 63 12.964 8.674 -5.746 1.00 31.04 H new ATOM 0 HD2 PRO A 63 13.087 9.640 -8.289 1.00 4.14 H new ATOM 0 HD3 PRO A 63 14.410 9.861 -7.160 1.00 4.14 H new ATOM 934 N VAL A 64 12.797 6.198 -9.219 1.00 71.13 N ATOM 935 CA VAL A 64 11.987 5.305 -10.039 1.00 54.44 C ATOM 936 C VAL A 64 12.797 4.739 -11.200 1.00 75.02 C ATOM 937 O VAL A 64 12.544 3.626 -11.663 1.00 72.13 O ATOM 938 CB VAL A 64 10.746 6.028 -10.598 1.00 20.35 C ATOM 939 CG1 VAL A 64 9.981 5.119 -11.548 1.00 23.02 C ATOM 940 CG2 VAL A 64 9.850 6.501 -9.463 1.00 2.21 C ATOM 0 H VAL A 64 12.375 7.111 -9.046 1.00 71.13 H new ATOM 0 HA VAL A 64 11.663 4.489 -9.393 1.00 54.44 H new ATOM 0 HB VAL A 64 11.078 6.902 -11.158 1.00 20.35 H new ATOM 0 HG11 VAL A 64 9.108 5.647 -11.933 1.00 23.02 H new ATOM 0 HG12 VAL A 64 10.627 4.834 -12.378 1.00 23.02 H new ATOM 0 HG13 VAL A 64 9.659 4.225 -11.015 1.00 23.02 H new ATOM 0 HG21 VAL A 64 8.978 7.009 -9.875 1.00 2.21 H new ATOM 0 HG22 VAL A 64 9.525 5.643 -8.874 1.00 2.21 H new ATOM 0 HG23 VAL A 64 10.404 7.190 -8.825 1.00 2.21 H new ATOM 950 N LEU A 65 13.772 5.511 -11.666 1.00 54.33 N ATOM 951 CA LEU A 65 14.621 5.087 -12.774 1.00 33.31 C ATOM 952 C LEU A 65 16.062 4.896 -12.313 1.00 43.50 C ATOM 953 O LEU A 65 16.488 5.430 -11.288 1.00 52.03 O ATOM 954 CB LEU A 65 14.567 6.114 -13.907 1.00 33.55 C ATOM 955 CG LEU A 65 13.400 5.973 -14.884 1.00 54.44 C ATOM 956 CD1 LEU A 65 13.787 5.082 -16.054 1.00 44.53 C ATOM 957 CD2 LEU A 65 12.172 5.420 -14.174 1.00 44.45 C ATOM 0 H LEU A 65 13.995 6.434 -11.294 1.00 54.33 H new ATOM 0 HA LEU A 65 14.247 4.131 -13.141 1.00 33.31 H new ATOM 0 HB2 LEU A 65 14.528 7.110 -13.466 1.00 33.55 H new ATOM 0 HB3 LEU A 65 15.497 6.052 -14.472 1.00 33.55 H new ATOM 0 HG LEU A 65 13.156 6.962 -15.272 1.00 54.44 H new ATOM 0 HD11 LEU A 65 12.943 4.994 -16.739 1.00 44.53 H new ATOM 0 HD12 LEU A 65 14.636 5.519 -16.579 1.00 44.53 H new ATOM 0 HD13 LEU A 65 14.059 4.093 -15.684 1.00 44.53 H new ATOM 0 HD21 LEU A 65 11.352 5.327 -14.886 1.00 44.45 H new ATOM 0 HD22 LEU A 65 12.404 4.440 -13.757 1.00 44.45 H new ATOM 0 HD23 LEU A 65 11.880 6.097 -13.371 1.00 44.45 H new ATOM 969 N PRO A 66 16.834 4.120 -13.088 1.00 32.53 N ATOM 970 CA PRO A 66 18.240 3.843 -12.780 1.00 43.34 C ATOM 971 C PRO A 66 19.125 5.072 -12.962 1.00 24.41 C ATOM 972 O PRO A 66 18.997 5.801 -13.944 1.00 55.52 O ATOM 973 CB PRO A 66 18.618 2.758 -13.792 1.00 12.11 C ATOM 974 CG PRO A 66 17.677 2.957 -14.930 1.00 20.03 C ATOM 975 CD PRO A 66 16.393 3.451 -14.324 1.00 13.44 C ATOM 0 HA PRO A 66 18.379 3.543 -11.741 1.00 43.34 H new ATOM 0 HB2 PRO A 66 19.655 2.860 -14.113 1.00 12.11 H new ATOM 0 HB3 PRO A 66 18.514 1.762 -13.362 1.00 12.11 H new ATOM 0 HG2 PRO A 66 18.075 3.679 -15.644 1.00 20.03 H new ATOM 0 HG3 PRO A 66 17.519 2.025 -15.473 1.00 20.03 H new ATOM 0 HD2 PRO A 66 15.873 4.140 -14.990 1.00 13.44 H new ATOM 0 HD3 PRO A 66 15.706 2.631 -14.114 1.00 13.44 H new ATOM 983 N ALA A 67 20.024 5.294 -12.008 1.00 63.44 N ATOM 984 CA ALA A 67 20.932 6.432 -12.065 1.00 4.41 C ATOM 985 C ALA A 67 21.669 6.481 -13.399 1.00 43.31 C ATOM 986 O ALA A 67 22.320 5.514 -13.796 1.00 13.34 O ATOM 987 CB ALA A 67 21.925 6.373 -10.913 1.00 41.43 C ATOM 0 H ALA A 67 20.142 4.700 -11.187 1.00 63.44 H new ATOM 0 HA ALA A 67 20.340 7.342 -11.974 1.00 4.41 H new ATOM 0 HB1 ALA A 67 22.597 7.229 -10.968 1.00 41.43 H new ATOM 0 HB2 ALA A 67 21.386 6.395 -9.966 1.00 41.43 H new ATOM 0 HB3 ALA A 67 22.504 5.452 -10.979 1.00 41.43 H new ATOM 993 N SER A 68 21.562 7.613 -14.088 1.00 4.12 N ATOM 994 CA SER A 68 22.215 7.786 -15.380 1.00 43.01 C ATOM 995 C SER A 68 21.899 9.157 -15.969 1.00 52.25 C ATOM 996 O SER A 68 22.726 9.757 -16.657 1.00 12.31 O ATOM 997 CB SER A 68 21.774 6.688 -16.349 1.00 71.43 C ATOM 998 OG SER A 68 22.887 5.952 -16.827 1.00 53.05 O ATOM 0 H SER A 68 21.029 8.424 -13.773 1.00 4.12 H new ATOM 0 HA SER A 68 23.292 7.715 -15.228 1.00 43.01 H new ATOM 0 HB2 SER A 68 21.077 6.016 -15.849 1.00 71.43 H new ATOM 0 HB3 SER A 68 21.240 7.133 -17.189 1.00 71.43 H new ATOM 0 HG SER A 68 22.578 5.255 -17.443 1.00 53.05 H new ATOM 1004 N THR A 69 20.694 9.649 -15.695 1.00 62.43 N ATOM 1005 CA THR A 69 20.266 10.948 -16.198 1.00 62.21 C ATOM 1006 C THR A 69 20.122 11.956 -15.064 1.00 35.01 C ATOM 1007 O THR A 69 19.344 12.906 -15.160 1.00 10.13 O ATOM 1008 CB THR A 69 18.927 10.845 -16.952 1.00 60.12 C ATOM 1009 OG1 THR A 69 18.571 12.121 -17.496 1.00 5.23 O ATOM 1010 CG2 THR A 69 17.822 10.356 -16.028 1.00 71.23 C ATOM 0 H THR A 69 19.997 9.167 -15.127 1.00 62.43 H new ATOM 0 HA THR A 69 21.037 11.290 -16.888 1.00 62.21 H new ATOM 0 HB THR A 69 19.046 10.126 -17.762 1.00 60.12 H new ATOM 0 HG1 THR A 69 18.487 12.774 -16.770 1.00 5.23 H new ATOM 0 HG21 THR A 69 16.886 10.291 -16.583 1.00 71.23 H new ATOM 0 HG22 THR A 69 18.082 9.372 -15.639 1.00 71.23 H new ATOM 0 HG23 THR A 69 17.705 11.054 -15.199 1.00 71.23 H new ATOM 1018 N HIS A 70 20.876 11.744 -13.990 1.00 34.21 N ATOM 1019 CA HIS A 70 20.832 12.636 -12.837 1.00 32.13 C ATOM 1020 C HIS A 70 21.126 14.074 -13.251 1.00 53.53 C ATOM 1021 O HIS A 70 20.397 14.997 -12.886 1.00 0.01 O ATOM 1022 CB HIS A 70 21.836 12.183 -11.777 1.00 22.04 C ATOM 1023 CG HIS A 70 21.356 11.030 -10.950 1.00 71.24 C ATOM 1024 ND1 HIS A 70 21.518 10.965 -9.583 1.00 12.15 N ATOM 1025 CD2 HIS A 70 20.713 9.893 -11.306 1.00 22.11 C ATOM 1026 CE1 HIS A 70 20.997 9.837 -9.133 1.00 10.43 C ATOM 1027 NE2 HIS A 70 20.502 9.169 -10.158 1.00 73.25 N ATOM 0 H HIS A 70 21.525 10.963 -13.894 1.00 34.21 H new ATOM 0 HA HIS A 70 19.827 12.596 -12.416 1.00 32.13 H new ATOM 0 HB2 HIS A 70 22.769 11.904 -12.268 1.00 22.04 H new ATOM 0 HB3 HIS A 70 22.061 13.023 -11.119 1.00 22.04 H new ATOM 0 HD1 HIS A 70 21.970 11.676 -9.008 1.00 12.15 H new ATOM 0 HD2 HIS A 70 20.421 9.608 -12.306 1.00 22.11 H new ATOM 0 HE1 HIS A 70 20.979 9.516 -8.102 1.00 10.43 H new ATOM 1035 N ARG A 71 22.198 14.258 -14.015 1.00 73.22 N ATOM 1036 CA ARG A 71 22.589 15.584 -14.477 1.00 53.14 C ATOM 1037 C ARG A 71 21.412 16.299 -15.135 1.00 43.24 C ATOM 1038 O ARG A 71 21.092 17.435 -14.788 1.00 12.31 O ATOM 1039 CB ARG A 71 23.753 15.481 -15.464 1.00 61.11 C ATOM 1040 CG ARG A 71 24.715 16.656 -15.396 1.00 70.21 C ATOM 1041 CD ARG A 71 26.107 16.264 -15.865 1.00 64.31 C ATOM 1042 NE ARG A 71 26.472 16.929 -17.113 1.00 60.32 N ATOM 1043 CZ ARG A 71 27.476 16.535 -17.889 1.00 53.44 C ATOM 1044 NH1 ARG A 71 28.210 15.486 -17.548 1.00 24.11 N ATOM 1045 NH2 ARG A 71 27.746 17.192 -19.010 1.00 52.14 N ATOM 0 H ARG A 71 22.811 13.505 -14.327 1.00 73.22 H new ATOM 0 HA ARG A 71 22.907 16.164 -13.611 1.00 53.14 H new ATOM 0 HB2 ARG A 71 24.303 14.560 -15.269 1.00 61.11 H new ATOM 0 HB3 ARG A 71 23.355 15.406 -16.476 1.00 61.11 H new ATOM 0 HG2 ARG A 71 24.338 17.472 -16.013 1.00 70.21 H new ATOM 0 HG3 ARG A 71 24.766 17.027 -14.372 1.00 70.21 H new ATOM 0 HD2 ARG A 71 26.834 16.517 -15.093 1.00 64.31 H new ATOM 0 HD3 ARG A 71 26.152 15.184 -16.003 1.00 64.31 H new ATOM 0 HE ARG A 71 25.927 17.740 -17.405 1.00 60.32 H new ATOM 0 HH11 ARG A 71 28.005 14.978 -16.687 1.00 24.11 H new ATOM 0 HH12 ARG A 71 28.980 15.186 -18.146 1.00 24.11 H new ATOM 0 HH21 ARG A 71 27.183 18.000 -19.276 1.00 52.14 H new ATOM 0 HH22 ARG A 71 28.517 16.889 -19.605 1.00 52.14 H new ATOM 1059 N GLU A 72 20.774 15.625 -16.087 1.00 40.52 N ATOM 1060 CA GLU A 72 19.634 16.198 -16.794 1.00 64.12 C ATOM 1061 C GLU A 72 18.460 16.419 -15.845 1.00 5.33 C ATOM 1062 O GLU A 72 17.807 17.463 -15.881 1.00 62.54 O ATOM 1063 CB GLU A 72 19.208 15.284 -17.945 1.00 23.10 C ATOM 1064 CG GLU A 72 20.371 14.772 -18.778 1.00 42.24 C ATOM 1065 CD GLU A 72 19.937 14.280 -20.145 1.00 62.04 C ATOM 1066 OE1 GLU A 72 18.958 14.830 -20.691 1.00 43.15 O ATOM 1067 OE2 GLU A 72 20.578 13.344 -20.669 1.00 55.21 O ATOM 0 H GLU A 72 21.027 14.683 -16.386 1.00 40.52 H new ATOM 0 HA GLU A 72 19.938 17.163 -17.199 1.00 64.12 H new ATOM 0 HB2 GLU A 72 18.661 14.433 -17.539 1.00 23.10 H new ATOM 0 HB3 GLU A 72 18.519 15.826 -18.593 1.00 23.10 H new ATOM 0 HG2 GLU A 72 21.105 15.569 -18.899 1.00 42.24 H new ATOM 0 HG3 GLU A 72 20.866 13.961 -18.244 1.00 42.24 H new ATOM 1074 N ILE A 73 18.199 15.431 -14.996 1.00 72.34 N ATOM 1075 CA ILE A 73 17.105 15.517 -14.037 1.00 54.32 C ATOM 1076 C ILE A 73 17.249 16.747 -13.148 1.00 4.42 C ATOM 1077 O ILE A 73 16.347 17.580 -13.073 1.00 12.41 O ATOM 1078 CB ILE A 73 17.034 14.261 -13.149 1.00 52.01 C ATOM 1079 CG1 ILE A 73 16.545 13.061 -13.963 1.00 41.22 C ATOM 1080 CG2 ILE A 73 16.121 14.506 -11.957 1.00 2.12 C ATOM 1081 CD1 ILE A 73 16.757 11.734 -13.270 1.00 21.34 C ATOM 0 H ILE A 73 18.730 14.561 -14.953 1.00 72.34 H new ATOM 0 HA ILE A 73 16.184 15.595 -14.615 1.00 54.32 H new ATOM 0 HB ILE A 73 18.034 14.041 -12.777 1.00 52.01 H new ATOM 0 HG12 ILE A 73 15.483 13.185 -14.176 1.00 41.22 H new ATOM 0 HG13 ILE A 73 17.063 13.048 -14.922 1.00 41.22 H new ATOM 0 HG21 ILE A 73 16.081 13.609 -11.339 1.00 2.12 H new ATOM 0 HG22 ILE A 73 16.508 15.337 -11.367 1.00 2.12 H new ATOM 0 HG23 ILE A 73 15.119 14.748 -12.310 1.00 2.12 H new ATOM 0 HD11 ILE A 73 16.387 10.929 -13.905 1.00 21.34 H new ATOM 0 HD12 ILE A 73 17.821 11.588 -13.081 1.00 21.34 H new ATOM 0 HD13 ILE A 73 16.216 11.727 -12.324 1.00 21.34 H new ATOM 1093 N GLU A 74 18.392 16.855 -12.477 1.00 20.21 N ATOM 1094 CA GLU A 74 18.655 17.985 -11.593 1.00 71.42 C ATOM 1095 C GLU A 74 18.614 19.300 -12.365 1.00 41.23 C ATOM 1096 O GLU A 74 17.957 20.255 -11.951 1.00 74.44 O ATOM 1097 CB GLU A 74 20.016 17.822 -10.912 1.00 55.23 C ATOM 1098 CG GLU A 74 19.940 17.818 -9.395 1.00 20.13 C ATOM 1099 CD GLU A 74 20.211 16.449 -8.801 1.00 0.20 C ATOM 1100 OE1 GLU A 74 19.723 15.449 -9.367 1.00 13.01 O ATOM 1101 OE2 GLU A 74 20.912 16.379 -7.770 1.00 22.12 O ATOM 0 H GLU A 74 19.150 16.174 -12.529 1.00 20.21 H new ATOM 0 HA GLU A 74 17.876 18.007 -10.831 1.00 71.42 H new ATOM 0 HB2 GLU A 74 20.471 16.890 -11.247 1.00 55.23 H new ATOM 0 HB3 GLU A 74 20.673 18.631 -11.232 1.00 55.23 H new ATOM 0 HG2 GLU A 74 20.661 18.532 -8.997 1.00 20.13 H new ATOM 0 HG3 GLU A 74 18.952 18.156 -9.084 1.00 20.13 H new ATOM 1108 N MET A 75 19.322 19.342 -13.489 1.00 43.21 N ATOM 1109 CA MET A 75 19.367 20.540 -14.320 1.00 13.14 C ATOM 1110 C MET A 75 17.974 20.902 -14.826 1.00 43.32 C ATOM 1111 O MET A 75 17.708 22.055 -15.166 1.00 33.41 O ATOM 1112 CB MET A 75 20.314 20.332 -15.503 1.00 23.45 C ATOM 1113 CG MET A 75 20.743 21.627 -16.173 1.00 64.40 C ATOM 1114 SD MET A 75 21.659 21.347 -17.701 1.00 53.32 S ATOM 1115 CE MET A 75 23.226 20.769 -17.056 1.00 62.32 C ATOM 0 H MET A 75 19.872 18.561 -13.845 1.00 43.21 H new ATOM 0 HA MET A 75 19.738 21.362 -13.708 1.00 13.14 H new ATOM 0 HB2 MET A 75 21.201 19.800 -15.159 1.00 23.45 H new ATOM 0 HB3 MET A 75 19.826 19.695 -16.241 1.00 23.45 H new ATOM 0 HG2 MET A 75 19.861 22.230 -16.388 1.00 64.40 H new ATOM 0 HG3 MET A 75 21.361 22.201 -15.483 1.00 64.40 H new ATOM 0 HE1 MET A 75 23.937 20.655 -17.875 1.00 62.32 H new ATOM 0 HE2 MET A 75 23.613 21.492 -16.338 1.00 62.32 H new ATOM 0 HE3 MET A 75 23.084 19.808 -16.562 1.00 62.32 H new ATOM 1125 N ALA A 76 17.091 19.911 -14.874 1.00 75.15 N ATOM 1126 CA ALA A 76 15.725 20.126 -15.338 1.00 5.20 C ATOM 1127 C ALA A 76 14.908 20.892 -14.303 1.00 25.44 C ATOM 1128 O ALA A 76 14.076 21.728 -14.651 1.00 40.14 O ATOM 1129 CB ALA A 76 15.061 18.796 -15.659 1.00 30.41 C ATOM 0 H ALA A 76 17.296 18.951 -14.597 1.00 75.15 H new ATOM 0 HA ALA A 76 15.766 20.727 -16.247 1.00 5.20 H new ATOM 0 HB1 ALA A 76 14.042 18.972 -16.004 1.00 30.41 H new ATOM 0 HB2 ALA A 76 15.626 18.287 -16.440 1.00 30.41 H new ATOM 0 HB3 ALA A 76 15.039 18.175 -14.763 1.00 30.41 H new ATOM 1135 N GLN A 77 15.152 20.599 -13.029 1.00 72.42 N ATOM 1136 CA GLN A 77 14.437 21.259 -11.944 1.00 14.13 C ATOM 1137 C GLN A 77 14.579 22.774 -12.041 1.00 3.54 C ATOM 1138 O GLN A 77 13.596 23.491 -12.232 1.00 62.40 O ATOM 1139 CB GLN A 77 14.957 20.771 -10.591 1.00 3.44 C ATOM 1140 CG GLN A 77 14.557 19.342 -10.264 1.00 64.44 C ATOM 1141 CD GLN A 77 14.834 18.973 -8.820 1.00 12.40 C ATOM 1142 OE1 GLN A 77 15.303 19.799 -8.036 1.00 23.52 O ATOM 1143 NE2 GLN A 77 14.543 17.729 -8.460 1.00 61.30 N ATOM 0 H GLN A 77 15.839 19.909 -12.724 1.00 72.42 H new ATOM 0 HA GLN A 77 13.381 21.005 -12.032 1.00 14.13 H new ATOM 0 HB2 GLN A 77 16.044 20.846 -10.581 1.00 3.44 H new ATOM 0 HB3 GLN A 77 14.584 21.432 -9.808 1.00 3.44 H new ATOM 0 HG2 GLN A 77 13.495 19.210 -10.471 1.00 64.44 H new ATOM 0 HG3 GLN A 77 15.097 18.659 -10.919 1.00 64.44 H new ATOM 0 HE21 GLN A 77 14.156 17.078 -9.143 1.00 61.30 H new ATOM 0 HE22 GLN A 77 14.707 17.424 -7.500 1.00 61.30 H new ATOM 1152 N LYS A 78 15.810 23.258 -11.907 1.00 32.42 N ATOM 1153 CA LYS A 78 16.083 24.688 -11.980 1.00 12.01 C ATOM 1154 C LYS A 78 15.679 25.250 -13.339 1.00 45.14 C ATOM 1155 O LYS A 78 15.066 26.315 -13.425 1.00 75.41 O ATOM 1156 CB LYS A 78 17.567 24.959 -11.724 1.00 63.55 C ATOM 1157 CG LYS A 78 17.940 26.429 -11.806 1.00 25.41 C ATOM 1158 CD LYS A 78 19.218 26.723 -11.037 1.00 15.21 C ATOM 1159 CE LYS A 78 19.630 28.180 -11.179 1.00 44.14 C ATOM 1160 NZ LYS A 78 21.039 28.402 -10.750 1.00 61.24 N ATOM 0 H LYS A 78 16.635 22.680 -11.747 1.00 32.42 H new ATOM 0 HA LYS A 78 15.492 25.185 -11.211 1.00 12.01 H new ATOM 0 HB2 LYS A 78 17.832 24.580 -10.737 1.00 63.55 H new ATOM 0 HB3 LYS A 78 18.160 24.401 -12.449 1.00 63.55 H new ATOM 0 HG2 LYS A 78 18.068 26.715 -12.850 1.00 25.41 H new ATOM 0 HG3 LYS A 78 17.126 27.035 -11.407 1.00 25.41 H new ATOM 0 HD2 LYS A 78 19.073 26.486 -9.983 1.00 15.21 H new ATOM 0 HD3 LYS A 78 20.019 26.080 -11.401 1.00 15.21 H new ATOM 0 HE2 LYS A 78 19.513 28.491 -12.217 1.00 44.14 H new ATOM 0 HE3 LYS A 78 18.966 28.805 -10.582 1.00 44.14 H new ATOM 0 HZ1 LYS A 78 21.282 29.407 -10.862 1.00 61.24 H new ATOM 0 HZ2 LYS A 78 21.145 28.129 -9.752 1.00 61.24 H new ATOM 0 HZ3 LYS A 78 21.675 27.825 -11.336 1.00 61.24 H new ATOM 1174 N LEU A 79 16.027 24.529 -14.399 1.00 74.43 N ATOM 1175 CA LEU A 79 15.699 24.955 -15.756 1.00 21.35 C ATOM 1176 C LEU A 79 14.204 25.221 -15.897 1.00 32.15 C ATOM 1177 O LEU A 79 13.793 26.268 -16.399 1.00 3.12 O ATOM 1178 CB LEU A 79 16.137 23.892 -16.765 1.00 31.11 C ATOM 1179 CG LEU A 79 15.560 24.027 -18.174 1.00 71.15 C ATOM 1180 CD1 LEU A 79 16.608 23.669 -19.217 1.00 32.33 C ATOM 1181 CD2 LEU A 79 14.327 23.150 -18.332 1.00 75.41 C ATOM 0 H LEU A 79 16.536 23.647 -14.346 1.00 74.43 H new ATOM 0 HA LEU A 79 16.235 25.882 -15.959 1.00 21.35 H new ATOM 0 HB2 LEU A 79 17.225 23.913 -16.836 1.00 31.11 H new ATOM 0 HB3 LEU A 79 15.862 22.913 -16.373 1.00 31.11 H new ATOM 0 HG LEU A 79 15.265 25.065 -18.327 1.00 71.15 H new ATOM 0 HD11 LEU A 79 16.179 23.771 -20.214 1.00 32.33 H new ATOM 0 HD12 LEU A 79 17.462 24.339 -19.119 1.00 32.33 H new ATOM 0 HD13 LEU A 79 16.935 22.640 -19.066 1.00 32.33 H new ATOM 0 HD21 LEU A 79 13.930 23.259 -19.341 1.00 75.41 H new ATOM 0 HD22 LEU A 79 14.597 22.108 -18.159 1.00 75.41 H new ATOM 0 HD23 LEU A 79 13.570 23.454 -17.609 1.00 75.41 H new ATOM 1193 N LEU A 80 13.394 24.268 -15.448 1.00 52.14 N ATOM 1194 CA LEU A 80 11.943 24.400 -15.522 1.00 51.22 C ATOM 1195 C LEU A 80 11.485 25.721 -14.913 1.00 14.33 C ATOM 1196 O LEU A 80 10.673 26.437 -15.497 1.00 52.23 O ATOM 1197 CB LEU A 80 11.267 23.232 -14.802 1.00 64.21 C ATOM 1198 CG LEU A 80 10.982 21.994 -15.653 1.00 31.20 C ATOM 1199 CD1 LEU A 80 11.161 20.728 -14.830 1.00 64.50 C ATOM 1200 CD2 LEU A 80 9.578 22.059 -16.235 1.00 55.12 C ATOM 0 H LEU A 80 13.717 23.396 -15.029 1.00 52.14 H new ATOM 0 HA LEU A 80 11.655 24.386 -16.573 1.00 51.22 H new ATOM 0 HB2 LEU A 80 11.897 22.935 -13.963 1.00 64.21 H new ATOM 0 HB3 LEU A 80 10.325 23.586 -14.384 1.00 64.21 H new ATOM 0 HG LEU A 80 11.695 21.971 -16.477 1.00 31.20 H new ATOM 0 HD11 LEU A 80 10.954 19.857 -15.452 1.00 64.50 H new ATOM 0 HD12 LEU A 80 12.185 20.675 -14.462 1.00 64.50 H new ATOM 0 HD13 LEU A 80 10.472 20.743 -13.986 1.00 64.50 H new ATOM 0 HD21 LEU A 80 9.392 21.170 -16.838 1.00 55.12 H new ATOM 0 HD22 LEU A 80 8.850 22.107 -15.425 1.00 55.12 H new ATOM 0 HD23 LEU A 80 9.484 22.947 -16.860 1.00 55.12 H new ATOM 1212 N ASN A 81 12.013 26.038 -13.735 1.00 52.50 N ATOM 1213 CA ASN A 81 11.659 27.275 -13.047 1.00 21.21 C ATOM 1214 C ASN A 81 11.828 28.478 -13.969 1.00 55.24 C ATOM 1215 O ASN A 81 10.923 29.303 -14.102 1.00 63.23 O ATOM 1216 CB ASN A 81 12.523 27.452 -11.796 1.00 73.24 C ATOM 1217 CG ASN A 81 11.693 27.700 -10.551 1.00 43.24 C ATOM 1218 OD1 ASN A 81 11.487 26.798 -9.739 1.00 42.31 O ATOM 1219 ND2 ASN A 81 11.213 28.928 -10.396 1.00 54.42 N ATOM 0 H ASN A 81 12.687 25.456 -13.237 1.00 52.50 H new ATOM 0 HA ASN A 81 10.612 27.210 -12.752 1.00 21.21 H new ATOM 0 HB2 ASN A 81 13.134 26.561 -11.651 1.00 73.24 H new ATOM 0 HB3 ASN A 81 13.207 28.287 -11.945 1.00 73.24 H new ATOM 0 HD21 ASN A 81 10.648 29.155 -9.578 1.00 54.42 H new ATOM 0 HD22 ASN A 81 11.409 29.644 -11.095 1.00 54.42 H new ATOM 1226 N SER A 82 12.991 28.571 -14.605 1.00 41.41 N ATOM 1227 CA SER A 82 13.280 29.675 -15.513 1.00 51.30 C ATOM 1228 C SER A 82 12.182 29.817 -16.563 1.00 31.41 C ATOM 1229 O SER A 82 11.531 30.857 -16.660 1.00 42.24 O ATOM 1230 CB SER A 82 14.631 29.460 -16.198 1.00 1.45 C ATOM 1231 OG SER A 82 15.619 29.063 -15.262 1.00 41.44 O ATOM 0 H SER A 82 13.749 27.895 -14.508 1.00 41.41 H new ATOM 0 HA SER A 82 13.320 30.593 -14.927 1.00 51.30 H new ATOM 0 HB2 SER A 82 14.533 28.700 -16.973 1.00 1.45 H new ATOM 0 HB3 SER A 82 14.942 30.380 -16.692 1.00 1.45 H new ATOM 0 HG SER A 82 16.473 28.930 -15.724 1.00 41.44 H new ATOM 1237 N ASP A 83 11.982 28.763 -17.346 1.00 62.52 N ATOM 1238 CA ASP A 83 10.963 28.767 -18.389 1.00 33.01 C ATOM 1239 C ASP A 83 9.609 29.188 -17.824 1.00 65.41 C ATOM 1240 O ASP A 83 8.912 30.018 -18.408 1.00 50.20 O ATOM 1241 CB ASP A 83 10.853 27.383 -19.031 1.00 44.10 C ATOM 1242 CG ASP A 83 12.142 26.954 -19.705 1.00 0.04 C ATOM 1243 OD1 ASP A 83 12.355 27.336 -20.874 1.00 62.42 O ATOM 1244 OD2 ASP A 83 12.937 26.236 -19.062 1.00 61.14 O ATOM 0 H ASP A 83 12.512 27.894 -17.278 1.00 62.52 H new ATOM 0 HA ASP A 83 11.260 29.489 -19.150 1.00 33.01 H new ATOM 0 HB2 ASP A 83 10.584 26.652 -18.268 1.00 44.10 H new ATOM 0 HB3 ASP A 83 10.047 27.389 -19.765 1.00 44.10 H new ATOM 1249 N LEU A 84 9.244 28.609 -16.686 1.00 34.32 N ATOM 1250 CA LEU A 84 7.973 28.922 -16.042 1.00 12.52 C ATOM 1251 C LEU A 84 7.807 30.429 -15.869 1.00 60.15 C ATOM 1252 O LEU A 84 6.969 31.050 -16.523 1.00 20.24 O ATOM 1253 CB LEU A 84 7.883 28.229 -14.681 1.00 41.13 C ATOM 1254 CG LEU A 84 6.810 28.756 -13.729 1.00 14.44 C ATOM 1255 CD1 LEU A 84 5.455 28.794 -14.419 1.00 20.41 C ATOM 1256 CD2 LEU A 84 6.746 27.902 -12.471 1.00 62.10 C ATOM 0 H LEU A 84 9.810 27.920 -16.190 1.00 34.32 H new ATOM 0 HA LEU A 84 7.170 28.557 -16.683 1.00 12.52 H new ATOM 0 HB2 LEU A 84 7.702 27.167 -14.848 1.00 41.13 H new ATOM 0 HB3 LEU A 84 8.851 28.314 -14.188 1.00 41.13 H new ATOM 0 HG LEU A 84 7.076 29.773 -13.441 1.00 14.44 H new ATOM 0 HD11 LEU A 84 4.704 29.172 -13.725 1.00 20.41 H new ATOM 0 HD12 LEU A 84 5.508 29.449 -15.289 1.00 20.41 H new ATOM 0 HD13 LEU A 84 5.181 27.788 -14.738 1.00 20.41 H new ATOM 0 HD21 LEU A 84 5.976 28.292 -11.805 1.00 62.10 H new ATOM 0 HD22 LEU A 84 6.505 26.874 -12.741 1.00 62.10 H new ATOM 0 HD23 LEU A 84 7.711 27.927 -11.965 1.00 62.10 H new ATOM 1268 N ALA A 85 8.613 31.011 -14.987 1.00 60.43 N ATOM 1269 CA ALA A 85 8.559 32.445 -14.732 1.00 75.34 C ATOM 1270 C ALA A 85 8.644 33.237 -16.032 1.00 43.15 C ATOM 1271 O ALA A 85 8.007 34.279 -16.177 1.00 53.43 O ATOM 1272 CB ALA A 85 9.678 32.856 -13.787 1.00 34.41 C ATOM 0 H ALA A 85 9.311 30.511 -14.437 1.00 60.43 H new ATOM 0 HA ALA A 85 7.601 32.670 -14.262 1.00 75.34 H new ATOM 0 HB1 ALA A 85 9.625 33.930 -13.606 1.00 34.41 H new ATOM 0 HB2 ALA A 85 9.571 32.323 -12.842 1.00 34.41 H new ATOM 0 HB3 ALA A 85 10.641 32.611 -14.235 1.00 34.41 H new ATOM 1278 N GLU A 86 9.437 32.736 -16.975 1.00 31.44 N ATOM 1279 CA GLU A 86 9.606 33.399 -18.262 1.00 43.01 C ATOM 1280 C GLU A 86 8.272 33.515 -18.994 1.00 3.31 C ATOM 1281 O GLU A 86 7.947 34.564 -19.553 1.00 62.40 O ATOM 1282 CB GLU A 86 10.610 32.634 -19.127 1.00 70.31 C ATOM 1283 CG GLU A 86 11.254 33.484 -20.209 1.00 4.33 C ATOM 1284 CD GLU A 86 12.695 33.093 -20.478 1.00 14.55 C ATOM 1285 OE1 GLU A 86 13.090 31.976 -20.085 1.00 1.23 O ATOM 1286 OE2 GLU A 86 13.426 33.906 -21.081 1.00 62.25 O ATOM 0 H GLU A 86 9.972 31.874 -16.871 1.00 31.44 H new ATOM 0 HA GLU A 86 9.988 34.403 -18.077 1.00 43.01 H new ATOM 0 HB2 GLU A 86 11.391 32.224 -18.486 1.00 70.31 H new ATOM 0 HB3 GLU A 86 10.104 31.789 -19.594 1.00 70.31 H new ATOM 0 HG2 GLU A 86 10.678 33.391 -21.130 1.00 4.33 H new ATOM 0 HG3 GLU A 86 11.215 34.532 -19.913 1.00 4.33 H new ATOM 1293 N LEU A 87 7.504 32.432 -18.987 1.00 20.35 N ATOM 1294 CA LEU A 87 6.205 32.410 -19.650 1.00 12.43 C ATOM 1295 C LEU A 87 5.207 33.305 -18.922 1.00 1.53 C ATOM 1296 O LEU A 87 4.436 34.032 -19.550 1.00 62.51 O ATOM 1297 CB LEU A 87 5.668 30.980 -19.718 1.00 23.51 C ATOM 1298 CG LEU A 87 4.982 30.582 -21.025 1.00 60.41 C ATOM 1299 CD1 LEU A 87 4.393 29.184 -20.915 1.00 21.21 C ATOM 1300 CD2 LEU A 87 3.902 31.590 -21.389 1.00 42.20 C ATOM 0 H LEU A 87 7.758 31.557 -18.529 1.00 20.35 H new ATOM 0 HA LEU A 87 6.336 32.791 -20.663 1.00 12.43 H new ATOM 0 HB2 LEU A 87 6.496 30.294 -19.542 1.00 23.51 H new ATOM 0 HB3 LEU A 87 4.959 30.840 -18.902 1.00 23.51 H new ATOM 0 HG LEU A 87 5.730 30.578 -21.818 1.00 60.41 H new ATOM 0 HD11 LEU A 87 3.909 28.918 -21.855 1.00 21.21 H new ATOM 0 HD12 LEU A 87 5.188 28.470 -20.702 1.00 21.21 H new ATOM 0 HD13 LEU A 87 3.659 29.161 -20.110 1.00 21.21 H new ATOM 0 HD21 LEU A 87 3.424 31.291 -22.322 1.00 42.20 H new ATOM 0 HD22 LEU A 87 3.156 31.627 -20.595 1.00 42.20 H new ATOM 0 HD23 LEU A 87 4.351 32.576 -21.511 1.00 42.20 H new ATOM 1312 N ILE A 88 5.229 33.250 -17.594 1.00 61.23 N ATOM 1313 CA ILE A 88 4.329 34.058 -16.781 1.00 72.13 C ATOM 1314 C ILE A 88 4.581 35.546 -16.997 1.00 15.45 C ATOM 1315 O ILE A 88 3.645 36.325 -17.173 1.00 12.22 O ATOM 1316 CB ILE A 88 4.480 33.735 -15.283 1.00 60.51 C ATOM 1317 CG1 ILE A 88 4.289 32.236 -15.041 1.00 33.13 C ATOM 1318 CG2 ILE A 88 3.483 34.541 -14.464 1.00 61.31 C ATOM 1319 CD1 ILE A 88 4.662 31.798 -13.642 1.00 22.40 C ATOM 0 H ILE A 88 5.861 32.654 -17.059 1.00 61.23 H new ATOM 0 HA ILE A 88 3.314 33.814 -17.096 1.00 72.13 H new ATOM 0 HB ILE A 88 5.486 34.010 -14.966 1.00 60.51 H new ATOM 0 HG12 ILE A 88 3.247 31.976 -15.229 1.00 33.13 H new ATOM 0 HG13 ILE A 88 4.891 31.680 -15.760 1.00 33.13 H new ATOM 0 HG21 ILE A 88 3.602 34.302 -13.407 1.00 61.31 H new ATOM 0 HG22 ILE A 88 3.662 35.605 -14.617 1.00 61.31 H new ATOM 0 HG23 ILE A 88 2.469 34.295 -14.780 1.00 61.31 H new ATOM 0 HD11 ILE A 88 4.502 30.725 -13.542 1.00 22.40 H new ATOM 0 HD12 ILE A 88 5.711 32.027 -13.457 1.00 22.40 H new ATOM 0 HD13 ILE A 88 4.042 32.327 -12.918 1.00 22.40 H new ATOM 1331 N ASN A 89 5.852 35.934 -16.982 1.00 52.05 N ATOM 1332 CA ASN A 89 6.227 37.330 -17.178 1.00 24.35 C ATOM 1333 C ASN A 89 5.759 37.834 -18.539 1.00 72.01 C ATOM 1334 O ASN A 89 4.959 38.765 -18.627 1.00 55.50 O ATOM 1335 CB ASN A 89 7.744 37.493 -17.055 1.00 13.32 C ATOM 1336 CG ASN A 89 8.134 38.824 -16.442 1.00 12.43 C ATOM 1337 OD1 ASN A 89 7.593 39.869 -16.804 1.00 2.52 O ATOM 1338 ND2 ASN A 89 9.077 38.792 -15.508 1.00 24.41 N ATOM 0 H ASN A 89 6.639 35.302 -16.836 1.00 52.05 H new ATOM 0 HA ASN A 89 5.740 37.923 -16.404 1.00 24.35 H new ATOM 0 HB2 ASN A 89 8.145 36.684 -16.445 1.00 13.32 H new ATOM 0 HB3 ASN A 89 8.198 37.404 -18.042 1.00 13.32 H new ATOM 0 HD21 ASN A 89 9.380 39.657 -15.060 1.00 24.41 H new ATOM 0 HD22 ASN A 89 9.498 37.903 -15.239 1.00 24.41 H new ATOM 1345 N LYS A 90 6.263 37.212 -19.600 1.00 35.14 N ATOM 1346 CA LYS A 90 5.895 37.595 -20.958 1.00 23.22 C ATOM 1347 C LYS A 90 4.379 37.638 -21.120 1.00 22.51 C ATOM 1348 O LYS A 90 3.846 38.487 -21.833 1.00 11.34 O ATOM 1349 CB LYS A 90 6.499 36.615 -21.967 1.00 4.43 C ATOM 1350 CG LYS A 90 6.229 36.989 -23.414 1.00 31.12 C ATOM 1351 CD LYS A 90 7.520 37.231 -24.178 1.00 72.40 C ATOM 1352 CE LYS A 90 7.896 36.029 -25.031 1.00 20.31 C ATOM 1353 NZ LYS A 90 8.206 34.833 -24.199 1.00 4.43 N ATOM 0 H LYS A 90 6.928 36.440 -19.545 1.00 35.14 H new ATOM 0 HA LYS A 90 6.291 38.593 -21.147 1.00 23.22 H new ATOM 0 HB2 LYS A 90 7.576 36.562 -21.809 1.00 4.43 H new ATOM 0 HB3 LYS A 90 6.099 35.619 -21.777 1.00 4.43 H new ATOM 0 HG2 LYS A 90 5.663 36.192 -23.897 1.00 31.12 H new ATOM 0 HG3 LYS A 90 5.611 37.886 -23.450 1.00 31.12 H new ATOM 0 HD2 LYS A 90 7.409 38.109 -24.814 1.00 72.40 H new ATOM 0 HD3 LYS A 90 8.325 37.446 -23.475 1.00 72.40 H new ATOM 0 HE2 LYS A 90 7.077 35.796 -25.711 1.00 20.31 H new ATOM 0 HE3 LYS A 90 8.761 36.277 -25.647 1.00 20.31 H new ATOM 0 HZ1 LYS A 90 8.457 34.036 -24.817 1.00 4.43 H new ATOM 0 HZ2 LYS A 90 9.004 35.047 -23.568 1.00 4.43 H new ATOM 0 HZ3 LYS A 90 7.373 34.580 -23.630 1.00 4.43 H new ATOM 1367 N MET A 91 3.691 36.717 -20.453 1.00 61.42 N ATOM 1368 CA MET A 91 2.236 36.652 -20.522 1.00 71.10 C ATOM 1369 C MET A 91 1.606 37.892 -19.895 1.00 63.13 C ATOM 1370 O MET A 91 0.718 38.513 -20.480 1.00 5.11 O ATOM 1371 CB MET A 91 1.726 35.394 -19.816 1.00 10.35 C ATOM 1372 CG MET A 91 0.211 35.270 -19.815 1.00 30.32 C ATOM 1373 SD MET A 91 -0.541 35.943 -18.321 1.00 4.24 S ATOM 1374 CE MET A 91 -1.468 37.317 -18.998 1.00 55.31 C ATOM 0 H MET A 91 4.117 36.006 -19.859 1.00 61.42 H new ATOM 0 HA MET A 91 1.949 36.612 -21.573 1.00 71.10 H new ATOM 0 HB2 MET A 91 2.154 34.516 -20.301 1.00 10.35 H new ATOM 0 HB3 MET A 91 2.083 35.395 -18.786 1.00 10.35 H new ATOM 0 HG2 MET A 91 -0.192 35.788 -20.685 1.00 30.32 H new ATOM 0 HG3 MET A 91 -0.064 34.220 -19.914 1.00 30.32 H new ATOM 0 HE1 MET A 91 -1.156 38.241 -18.511 1.00 55.31 H new ATOM 0 HE2 MET A 91 -1.280 37.390 -20.069 1.00 55.31 H new ATOM 0 HE3 MET A 91 -2.532 37.158 -18.826 1.00 55.31 H new ATOM 1384 N LYS A 92 2.071 38.247 -18.702 1.00 40.33 N ATOM 1385 CA LYS A 92 1.555 39.414 -17.996 1.00 33.41 C ATOM 1386 C LYS A 92 1.585 40.649 -18.890 1.00 73.24 C ATOM 1387 O LYS A 92 0.717 41.517 -18.796 1.00 55.51 O ATOM 1388 CB LYS A 92 2.371 39.670 -16.727 1.00 61.21 C ATOM 1389 CG LYS A 92 1.678 40.585 -15.732 1.00 61.43 C ATOM 1390 CD LYS A 92 2.518 40.788 -14.482 1.00 61.54 C ATOM 1391 CE LYS A 92 2.030 41.977 -13.670 1.00 32.13 C ATOM 1392 NZ LYS A 92 3.040 42.417 -12.668 1.00 63.23 N ATOM 0 H LYS A 92 2.805 37.743 -18.204 1.00 40.33 H new ATOM 0 HA LYS A 92 0.520 39.212 -17.721 1.00 33.41 H new ATOM 0 HB2 LYS A 92 2.584 38.717 -16.244 1.00 61.21 H new ATOM 0 HB3 LYS A 92 3.330 40.108 -17.004 1.00 61.21 H new ATOM 0 HG2 LYS A 92 1.481 41.550 -16.200 1.00 61.43 H new ATOM 0 HG3 LYS A 92 0.712 40.161 -15.458 1.00 61.43 H new ATOM 0 HD2 LYS A 92 2.483 39.888 -13.868 1.00 61.54 H new ATOM 0 HD3 LYS A 92 3.560 40.941 -14.763 1.00 61.54 H new ATOM 0 HE2 LYS A 92 1.800 42.805 -14.341 1.00 32.13 H new ATOM 0 HE3 LYS A 92 1.104 41.713 -13.160 1.00 32.13 H new ATOM 0 HZ1 LYS A 92 2.669 43.229 -12.135 1.00 63.23 H new ATOM 0 HZ2 LYS A 92 3.242 41.636 -12.012 1.00 63.23 H new ATOM 0 HZ3 LYS A 92 3.916 42.694 -13.156 1.00 63.23 H new ATOM 1406 N LEU A 93 2.588 40.721 -19.759 1.00 35.53 N ATOM 1407 CA LEU A 93 2.730 41.849 -20.672 1.00 14.20 C ATOM 1408 C LEU A 93 1.606 41.860 -21.703 1.00 71.14 C ATOM 1409 O LEU A 93 0.938 42.875 -21.897 1.00 75.20 O ATOM 1410 CB LEU A 93 4.085 41.791 -21.378 1.00 42.54 C ATOM 1411 CG LEU A 93 5.166 42.726 -20.834 1.00 23.54 C ATOM 1412 CD1 LEU A 93 5.865 42.094 -19.639 1.00 52.33 C ATOM 1413 CD2 LEU A 93 6.173 43.069 -21.922 1.00 73.22 C ATOM 0 H LEU A 93 3.315 40.011 -19.850 1.00 35.53 H new ATOM 0 HA LEU A 93 2.671 42.767 -20.088 1.00 14.20 H new ATOM 0 HB2 LEU A 93 4.457 40.768 -21.324 1.00 42.54 H new ATOM 0 HB3 LEU A 93 3.933 42.019 -22.433 1.00 42.54 H new ATOM 0 HG LEU A 93 4.689 43.649 -20.505 1.00 23.54 H new ATOM 0 HD11 LEU A 93 6.631 42.773 -19.265 1.00 52.33 H new ATOM 0 HD12 LEU A 93 5.136 41.900 -18.852 1.00 52.33 H new ATOM 0 HD13 LEU A 93 6.329 41.156 -19.943 1.00 52.33 H new ATOM 0 HD21 LEU A 93 6.934 43.735 -21.516 1.00 73.22 H new ATOM 0 HD22 LEU A 93 6.645 42.155 -22.282 1.00 73.22 H new ATOM 0 HD23 LEU A 93 5.662 43.563 -22.748 1.00 73.22 H new ATOM 1425 N ALA A 94 1.403 40.723 -22.361 1.00 55.10 N ATOM 1426 CA ALA A 94 0.357 40.600 -23.369 1.00 40.43 C ATOM 1427 C ALA A 94 -0.990 41.059 -22.822 1.00 12.41 C ATOM 1428 O ALA A 94 -1.803 41.630 -23.549 1.00 0.25 O ATOM 1429 CB ALA A 94 0.266 39.164 -23.864 1.00 4.34 C ATOM 0 H ALA A 94 1.949 39.874 -22.214 1.00 55.10 H new ATOM 0 HA ALA A 94 0.618 41.246 -24.207 1.00 40.43 H new ATOM 0 HB1 ALA A 94 -0.519 39.087 -24.616 1.00 4.34 H new ATOM 0 HB2 ALA A 94 1.219 38.869 -24.303 1.00 4.34 H new ATOM 0 HB3 ALA A 94 0.033 38.505 -23.028 1.00 4.34 H new ATOM 1435 N GLN A 95 -1.219 40.806 -21.538 1.00 34.45 N ATOM 1436 CA GLN A 95 -2.469 41.192 -20.894 1.00 55.22 C ATOM 1437 C GLN A 95 -2.713 42.691 -21.035 1.00 13.11 C ATOM 1438 O GLN A 95 -3.858 43.141 -21.079 1.00 42.12 O ATOM 1439 CB GLN A 95 -2.448 40.804 -19.415 1.00 22.41 C ATOM 1440 CG GLN A 95 -3.560 39.845 -19.021 1.00 63.33 C ATOM 1441 CD GLN A 95 -4.897 40.539 -18.854 1.00 21.04 C ATOM 1442 OE1 GLN A 95 -5.285 41.371 -19.675 1.00 21.35 O ATOM 1443 NE2 GLN A 95 -5.610 40.200 -17.786 1.00 53.31 N ATOM 0 H GLN A 95 -0.555 40.335 -20.923 1.00 34.45 H new ATOM 0 HA GLN A 95 -3.282 40.661 -21.389 1.00 55.22 H new ATOM 0 HB2 GLN A 95 -1.486 40.347 -19.182 1.00 22.41 H new ATOM 0 HB3 GLN A 95 -2.527 41.707 -18.810 1.00 22.41 H new ATOM 0 HG2 GLN A 95 -3.651 39.068 -19.780 1.00 63.33 H new ATOM 0 HG3 GLN A 95 -3.293 39.349 -18.088 1.00 63.33 H new ATOM 0 HE21 GLN A 95 -5.250 39.506 -17.132 1.00 53.31 H new ATOM 0 HE22 GLN A 95 -6.518 40.634 -17.620 1.00 53.31 H new ATOM 1452 N GLN A 96 -1.630 43.458 -21.104 1.00 61.11 N ATOM 1453 CA GLN A 96 -1.727 44.907 -21.239 1.00 33.44 C ATOM 1454 C GLN A 96 -1.431 45.341 -22.670 1.00 53.51 C ATOM 1455 O GLN A 96 -1.870 46.405 -23.110 1.00 21.42 O ATOM 1456 CB GLN A 96 -0.761 45.596 -20.274 1.00 31.45 C ATOM 1457 CG GLN A 96 -1.381 45.930 -18.927 1.00 35.55 C ATOM 1458 CD GLN A 96 -0.369 46.470 -17.936 1.00 14.32 C ATOM 1459 OE1 GLN A 96 -0.280 45.998 -16.802 1.00 50.40 O ATOM 1460 NE2 GLN A 96 0.400 47.466 -18.359 1.00 63.04 N ATOM 0 H GLN A 96 -0.675 43.101 -21.069 1.00 61.11 H new ATOM 0 HA GLN A 96 -2.747 45.202 -20.993 1.00 33.44 H new ATOM 0 HB2 GLN A 96 0.104 44.951 -20.117 1.00 31.45 H new ATOM 0 HB3 GLN A 96 -0.395 46.514 -20.734 1.00 31.45 H new ATOM 0 HG2 GLN A 96 -2.173 46.665 -19.068 1.00 35.55 H new ATOM 0 HG3 GLN A 96 -1.847 45.035 -18.514 1.00 35.55 H new ATOM 0 HE21 GLN A 96 0.292 47.826 -19.307 1.00 63.04 H new ATOM 0 HE22 GLN A 96 1.099 47.871 -17.736 1.00 63.04 H new ATOM 1469 N TYR A 97 -0.685 44.513 -23.392 1.00 43.42 N ATOM 1470 CA TYR A 97 -0.328 44.814 -24.774 1.00 24.15 C ATOM 1471 C TYR A 97 -1.290 44.136 -25.745 1.00 4.43 C ATOM 1472 O TYR A 97 -0.938 43.855 -26.890 1.00 70.34 O ATOM 1473 CB TYR A 97 1.106 44.364 -25.061 1.00 52.11 C ATOM 1474 CG TYR A 97 2.155 45.332 -24.564 1.00 45.54 C ATOM 1475 CD1 TYR A 97 2.277 45.621 -23.211 1.00 24.24 C ATOM 1476 CD2 TYR A 97 3.024 45.960 -25.448 1.00 64.25 C ATOM 1477 CE1 TYR A 97 3.234 46.505 -22.752 1.00 44.40 C ATOM 1478 CE2 TYR A 97 3.985 46.845 -24.999 1.00 23.52 C ATOM 1479 CZ TYR A 97 4.086 47.114 -23.650 1.00 2.21 C ATOM 1480 OH TYR A 97 5.041 47.996 -23.198 1.00 41.11 O ATOM 0 H TYR A 97 -0.316 43.628 -23.044 1.00 43.42 H new ATOM 0 HA TYR A 97 -0.399 45.893 -24.915 1.00 24.15 H new ATOM 0 HB2 TYR A 97 1.272 43.392 -24.598 1.00 52.11 H new ATOM 0 HB3 TYR A 97 1.228 44.230 -26.136 1.00 52.11 H new ATOM 0 HD1 TYR A 97 1.612 45.146 -22.505 1.00 24.24 H new ATOM 0 HD2 TYR A 97 2.947 45.752 -26.505 1.00 64.25 H new ATOM 0 HE1 TYR A 97 3.315 46.718 -21.696 1.00 44.40 H new ATOM 0 HE2 TYR A 97 4.653 47.323 -25.700 1.00 23.52 H new ATOM 0 HH TYR A 97 5.559 48.335 -23.958 1.00 41.11 H new ATOM 1490 N VAL A 98 -2.507 43.878 -25.278 1.00 30.23 N ATOM 1491 CA VAL A 98 -3.522 43.235 -26.104 1.00 11.13 C ATOM 1492 C VAL A 98 -4.640 44.209 -26.458 1.00 41.31 C ATOM 1493 O VAL A 98 -5.170 44.184 -27.568 1.00 74.32 O ATOM 1494 CB VAL A 98 -4.129 42.010 -25.395 1.00 35.12 C ATOM 1495 CG1 VAL A 98 -4.712 42.407 -24.047 1.00 51.11 C ATOM 1496 CG2 VAL A 98 -5.188 41.358 -26.271 1.00 52.25 C ATOM 0 H VAL A 98 -2.814 44.104 -24.332 1.00 30.23 H new ATOM 0 HA VAL A 98 -3.026 42.908 -27.018 1.00 11.13 H new ATOM 0 HB VAL A 98 -3.336 41.283 -25.221 1.00 35.12 H new ATOM 0 HG11 VAL A 98 -5.136 41.528 -23.561 1.00 51.11 H new ATOM 0 HG12 VAL A 98 -3.925 42.825 -23.419 1.00 51.11 H new ATOM 0 HG13 VAL A 98 -5.493 43.153 -24.194 1.00 51.11 H new ATOM 0 HG21 VAL A 98 -5.606 40.494 -25.754 1.00 52.25 H new ATOM 0 HG22 VAL A 98 -5.981 42.076 -26.478 1.00 52.25 H new ATOM 0 HG23 VAL A 98 -4.736 41.036 -27.209 1.00 52.25 H new ATOM 1506 N MET A 99 -4.993 45.068 -25.507 1.00 44.00 N ATOM 1507 CA MET A 99 -6.047 46.053 -25.720 1.00 21.22 C ATOM 1508 C MET A 99 -5.553 47.197 -26.600 1.00 21.42 C ATOM 1509 O MET A 99 -6.349 47.954 -27.157 1.00 25.11 O ATOM 1510 CB MET A 99 -6.540 46.601 -24.379 1.00 41.34 C ATOM 1511 CG MET A 99 -5.569 47.572 -23.726 1.00 33.52 C ATOM 1512 SD MET A 99 -5.177 47.121 -22.025 1.00 2.14 S ATOM 1513 CE MET A 99 -3.735 48.142 -21.728 1.00 71.31 C ATOM 0 H MET A 99 -4.565 45.102 -24.582 1.00 44.00 H new ATOM 0 HA MET A 99 -6.875 45.559 -26.229 1.00 21.22 H new ATOM 0 HB2 MET A 99 -7.496 47.102 -24.530 1.00 41.34 H new ATOM 0 HB3 MET A 99 -6.720 45.768 -23.699 1.00 41.34 H new ATOM 0 HG2 MET A 99 -4.649 47.608 -24.310 1.00 33.52 H new ATOM 0 HG3 MET A 99 -5.997 48.574 -23.743 1.00 33.52 H new ATOM 0 HE1 MET A 99 -2.986 47.565 -21.186 1.00 71.31 H new ATOM 0 HE2 MET A 99 -3.320 48.472 -22.681 1.00 71.31 H new ATOM 0 HE3 MET A 99 -4.021 49.012 -21.136 1.00 71.31 H new ATOM 1523 N THR A 100 -4.235 47.317 -26.721 1.00 45.42 N ATOM 1524 CA THR A 100 -3.635 48.370 -27.532 1.00 22.50 C ATOM 1525 C THR A 100 -3.710 48.030 -29.016 1.00 64.02 C ATOM 1526 O THR A 100 -4.502 48.612 -29.757 1.00 10.13 O ATOM 1527 CB THR A 100 -2.163 48.607 -27.145 1.00 0.12 C ATOM 1528 OG1 THR A 100 -1.499 47.353 -26.950 1.00 11.41 O ATOM 1529 CG2 THR A 100 -2.065 49.441 -25.876 1.00 41.24 C ATOM 0 H THR A 100 -3.562 46.698 -26.268 1.00 45.42 H new ATOM 0 HA THR A 100 -4.204 49.280 -27.341 1.00 22.50 H new ATOM 0 HB THR A 100 -1.680 49.151 -27.957 1.00 0.12 H new ATOM 0 HG1 THR A 100 -0.563 47.513 -26.706 1.00 11.41 H new ATOM 0 HG21 THR A 100 -1.016 49.595 -25.622 1.00 41.24 H new ATOM 0 HG22 THR A 100 -2.545 50.406 -26.037 1.00 41.24 H new ATOM 0 HG23 THR A 100 -2.563 48.920 -25.059 1.00 41.24 H new ATOM 1537 N SER A 101 -2.880 47.084 -29.445 1.00 20.14 N ATOM 1538 CA SER A 101 -2.850 46.669 -30.842 1.00 73.12 C ATOM 1539 C SER A 101 -1.819 45.566 -31.059 1.00 61.25 C ATOM 1540 O SER A 101 -2.015 44.669 -31.881 1.00 41.53 O ATOM 1541 CB SER A 101 -2.534 47.863 -31.744 1.00 40.42 C ATOM 1542 OG SER A 101 -3.480 47.974 -32.794 1.00 4.32 O ATOM 0 H SER A 101 -2.219 46.591 -28.844 1.00 20.14 H new ATOM 0 HA SER A 101 -3.834 46.278 -31.100 1.00 73.12 H new ATOM 0 HB2 SER A 101 -2.533 48.779 -31.153 1.00 40.42 H new ATOM 0 HB3 SER A 101 -1.533 47.752 -32.162 1.00 40.42 H new ATOM 0 HG SER A 101 -3.257 48.746 -33.355 1.00 4.32 H new ATOM 1548 N LEU A 102 -0.720 45.638 -30.317 1.00 44.12 N ATOM 1549 CA LEU A 102 0.344 44.646 -30.427 1.00 45.32 C ATOM 1550 C LEU A 102 -0.039 43.354 -29.713 1.00 12.43 C ATOM 1551 O LEU A 102 0.620 42.944 -28.758 1.00 34.51 O ATOM 1552 CB LEU A 102 1.646 45.199 -29.843 1.00 32.51 C ATOM 1553 CG LEU A 102 1.920 46.681 -30.098 1.00 0.13 C ATOM 1554 CD1 LEU A 102 3.294 47.068 -29.572 1.00 34.10 C ATOM 1555 CD2 LEU A 102 1.807 46.997 -31.582 1.00 34.00 C ATOM 0 H LEU A 102 -0.542 46.373 -29.632 1.00 44.12 H new ATOM 0 HA LEU A 102 0.492 44.424 -31.484 1.00 45.32 H new ATOM 0 HB2 LEU A 102 1.637 45.032 -28.766 1.00 32.51 H new ATOM 0 HB3 LEU A 102 2.477 44.622 -30.249 1.00 32.51 H new ATOM 0 HG LEU A 102 1.171 47.266 -29.564 1.00 0.13 H new ATOM 0 HD11 LEU A 102 3.472 48.126 -29.762 1.00 34.10 H new ATOM 0 HD12 LEU A 102 3.339 46.880 -28.499 1.00 34.10 H new ATOM 0 HD13 LEU A 102 4.057 46.476 -30.077 1.00 34.10 H new ATOM 0 HD21 LEU A 102 2.005 48.056 -31.745 1.00 34.00 H new ATOM 0 HD22 LEU A 102 2.533 46.403 -32.137 1.00 34.00 H new ATOM 0 HD23 LEU A 102 0.802 46.759 -31.929 1.00 34.00 H new ATOM 1567 N GLN A 103 -1.107 42.719 -30.183 1.00 73.45 N ATOM 1568 CA GLN A 103 -1.577 41.472 -29.590 1.00 11.41 C ATOM 1569 C GLN A 103 -1.037 40.268 -30.354 1.00 24.04 C ATOM 1570 O GLN A 103 -0.425 39.375 -29.769 1.00 25.14 O ATOM 1571 CB GLN A 103 -3.106 41.436 -29.572 1.00 72.13 C ATOM 1572 CG GLN A 103 -3.678 40.104 -29.114 1.00 23.00 C ATOM 1573 CD GLN A 103 -3.885 39.133 -30.259 1.00 61.43 C ATOM 1574 OE1 GLN A 103 -3.252 38.078 -30.316 1.00 35.41 O ATOM 1575 NE2 GLN A 103 -4.774 39.484 -31.180 1.00 55.14 N ATOM 0 H GLN A 103 -1.664 43.047 -30.972 1.00 73.45 H new ATOM 0 HA GLN A 103 -1.207 41.424 -28.566 1.00 11.41 H new ATOM 0 HB2 GLN A 103 -3.472 42.224 -28.914 1.00 72.13 H new ATOM 0 HB3 GLN A 103 -3.478 41.657 -30.572 1.00 72.13 H new ATOM 0 HG2 GLN A 103 -3.006 39.657 -28.381 1.00 23.00 H new ATOM 0 HG3 GLN A 103 -4.630 40.275 -28.611 1.00 23.00 H new ATOM 0 HE21 GLN A 103 -5.276 40.368 -31.093 1.00 55.14 H new ATOM 0 HE22 GLN A 103 -4.955 38.870 -31.974 1.00 55.14 H new ATOM 1584 N GLN A 104 -1.268 40.251 -31.662 1.00 43.03 N ATOM 1585 CA GLN A 104 -0.805 39.155 -32.505 1.00 45.12 C ATOM 1586 C GLN A 104 0.680 38.886 -32.281 1.00 50.24 C ATOM 1587 O GLN A 104 1.125 37.740 -32.323 1.00 23.13 O ATOM 1588 CB GLN A 104 -1.061 39.474 -33.979 1.00 62.21 C ATOM 1589 CG GLN A 104 -2.533 39.456 -34.358 1.00 63.15 C ATOM 1590 CD GLN A 104 -2.752 39.176 -35.832 1.00 72.21 C ATOM 1591 OE1 GLN A 104 -3.139 40.063 -36.594 1.00 32.25 O ATOM 1592 NE2 GLN A 104 -2.506 37.937 -36.243 1.00 5.42 N ATOM 0 H GLN A 104 -1.773 40.983 -32.161 1.00 43.03 H new ATOM 0 HA GLN A 104 -1.363 38.259 -32.232 1.00 45.12 H new ATOM 0 HB2 GLN A 104 -0.648 40.457 -34.207 1.00 62.21 H new ATOM 0 HB3 GLN A 104 -0.526 38.752 -34.597 1.00 62.21 H new ATOM 0 HG2 GLN A 104 -3.047 38.698 -33.768 1.00 63.15 H new ATOM 0 HG3 GLN A 104 -2.982 40.416 -34.104 1.00 63.15 H new ATOM 0 HE21 GLN A 104 -2.187 37.233 -35.578 1.00 5.42 H new ATOM 0 HE22 GLN A 104 -2.636 37.690 -37.224 1.00 5.42 H new ATOM 1601 N GLU A 105 1.440 39.951 -32.045 1.00 62.11 N ATOM 1602 CA GLU A 105 2.875 39.828 -31.816 1.00 41.42 C ATOM 1603 C GLU A 105 3.167 38.799 -30.728 1.00 74.01 C ATOM 1604 O GLU A 105 3.839 37.796 -30.971 1.00 11.51 O ATOM 1605 CB GLU A 105 3.469 41.183 -31.424 1.00 51.03 C ATOM 1606 CG GLU A 105 4.984 41.174 -31.313 1.00 23.02 C ATOM 1607 CD GLU A 105 5.629 42.344 -32.030 1.00 10.20 C ATOM 1608 OE1 GLU A 105 5.857 42.237 -33.253 1.00 73.23 O ATOM 1609 OE2 GLU A 105 5.906 43.366 -31.369 1.00 0.43 O ATOM 0 H GLU A 105 1.087 40.907 -32.007 1.00 62.11 H new ATOM 0 HA GLU A 105 3.337 39.491 -32.744 1.00 41.42 H new ATOM 0 HB2 GLU A 105 3.172 41.928 -32.162 1.00 51.03 H new ATOM 0 HB3 GLU A 105 3.045 41.494 -30.469 1.00 51.03 H new ATOM 0 HG2 GLU A 105 5.267 41.197 -30.261 1.00 23.02 H new ATOM 0 HG3 GLU A 105 5.369 40.242 -31.727 1.00 23.02 H new ATOM 1616 N TYR A 106 2.657 39.055 -29.529 1.00 34.55 N ATOM 1617 CA TYR A 106 2.864 38.153 -28.402 1.00 21.41 C ATOM 1618 C TYR A 106 2.428 36.733 -28.753 1.00 11.44 C ATOM 1619 O TYR A 106 2.994 35.757 -28.261 1.00 5.11 O ATOM 1620 CB TYR A 106 2.093 38.647 -27.177 1.00 11.11 C ATOM 1621 CG TYR A 106 2.006 37.628 -26.064 1.00 25.43 C ATOM 1622 CD1 TYR A 106 0.957 36.718 -26.008 1.00 2.30 C ATOM 1623 CD2 TYR A 106 2.973 37.574 -25.067 1.00 41.12 C ATOM 1624 CE1 TYR A 106 0.874 35.785 -24.992 1.00 54.54 C ATOM 1625 CE2 TYR A 106 2.898 36.644 -24.049 1.00 23.22 C ATOM 1626 CZ TYR A 106 1.847 35.752 -24.016 1.00 33.15 C ATOM 1627 OH TYR A 106 1.768 34.825 -23.002 1.00 31.41 O ATOM 0 H TYR A 106 2.097 39.880 -29.312 1.00 34.55 H new ATOM 0 HA TYR A 106 3.929 38.140 -28.171 1.00 21.41 H new ATOM 0 HB2 TYR A 106 2.572 39.549 -26.796 1.00 11.11 H new ATOM 0 HB3 TYR A 106 1.084 38.927 -27.482 1.00 11.11 H new ATOM 0 HD1 TYR A 106 0.194 36.740 -26.772 1.00 2.30 H new ATOM 0 HD2 TYR A 106 3.797 38.271 -25.089 1.00 41.12 H new ATOM 0 HE1 TYR A 106 0.052 35.086 -24.963 1.00 54.54 H new ATOM 0 HE2 TYR A 106 3.659 36.615 -23.283 1.00 23.22 H new ATOM 0 HH TYR A 106 2.631 34.770 -22.541 1.00 31.41 H new ATOM 1637 N LYS A 107 1.416 36.627 -29.608 1.00 25.34 N ATOM 1638 CA LYS A 107 0.903 35.328 -30.028 1.00 10.40 C ATOM 1639 C LYS A 107 1.974 34.534 -30.769 1.00 33.21 C ATOM 1640 O LYS A 107 2.131 33.332 -30.552 1.00 41.14 O ATOM 1641 CB LYS A 107 -0.325 35.508 -30.924 1.00 1.25 C ATOM 1642 CG LYS A 107 -1.479 34.589 -30.565 1.00 34.24 C ATOM 1643 CD LYS A 107 -1.841 33.670 -31.720 1.00 3.32 C ATOM 1644 CE LYS A 107 -0.837 32.537 -31.866 1.00 45.32 C ATOM 1645 NZ LYS A 107 0.144 32.802 -32.956 1.00 13.25 N ATOM 0 H LYS A 107 0.935 37.425 -30.023 1.00 25.34 H new ATOM 0 HA LYS A 107 0.616 34.772 -29.135 1.00 10.40 H new ATOM 0 HB2 LYS A 107 -0.662 36.543 -30.861 1.00 1.25 H new ATOM 0 HB3 LYS A 107 -0.038 35.329 -31.960 1.00 1.25 H new ATOM 0 HG2 LYS A 107 -1.212 33.991 -29.694 1.00 34.24 H new ATOM 0 HG3 LYS A 107 -2.348 35.186 -30.288 1.00 34.24 H new ATOM 0 HD2 LYS A 107 -2.837 33.257 -31.559 1.00 3.32 H new ATOM 0 HD3 LYS A 107 -1.880 34.245 -32.645 1.00 3.32 H new ATOM 0 HE2 LYS A 107 -0.305 32.399 -30.924 1.00 45.32 H new ATOM 0 HE3 LYS A 107 -1.366 31.607 -32.072 1.00 45.32 H new ATOM 0 HZ1 LYS A 107 0.054 32.070 -33.689 1.00 13.25 H new ATOM 0 HZ2 LYS A 107 -0.045 33.736 -33.374 1.00 13.25 H new ATOM 0 HZ3 LYS A 107 1.108 32.785 -32.567 1.00 13.25 H new ATOM 1659 N LYS A 108 2.709 35.213 -31.643 1.00 71.40 N ATOM 1660 CA LYS A 108 3.767 34.572 -32.414 1.00 62.44 C ATOM 1661 C LYS A 108 4.862 34.037 -31.497 1.00 31.24 C ATOM 1662 O LYS A 108 5.123 32.835 -31.463 1.00 62.45 O ATOM 1663 CB LYS A 108 4.366 35.560 -33.417 1.00 51.25 C ATOM 1664 CG LYS A 108 3.921 35.318 -34.849 1.00 52.44 C ATOM 1665 CD LYS A 108 3.322 36.571 -35.466 1.00 41.34 C ATOM 1666 CE LYS A 108 2.502 36.245 -36.705 1.00 15.31 C ATOM 1667 NZ LYS A 108 3.010 36.957 -37.910 1.00 54.31 N ATOM 0 H LYS A 108 2.591 36.208 -31.835 1.00 71.40 H new ATOM 0 HA LYS A 108 3.329 33.734 -32.956 1.00 62.44 H new ATOM 0 HB2 LYS A 108 4.089 36.573 -33.126 1.00 51.25 H new ATOM 0 HB3 LYS A 108 5.453 35.500 -33.368 1.00 51.25 H new ATOM 0 HG2 LYS A 108 4.772 34.989 -35.445 1.00 52.44 H new ATOM 0 HG3 LYS A 108 3.186 34.513 -34.872 1.00 52.44 H new ATOM 0 HD2 LYS A 108 2.691 37.073 -34.733 1.00 41.34 H new ATOM 0 HD3 LYS A 108 4.120 37.266 -35.729 1.00 41.34 H new ATOM 0 HE2 LYS A 108 2.524 35.170 -36.882 1.00 15.31 H new ATOM 0 HE3 LYS A 108 1.461 36.518 -36.534 1.00 15.31 H new ATOM 0 HZ1 LYS A 108 2.425 36.708 -38.733 1.00 54.31 H new ATOM 0 HZ2 LYS A 108 2.965 37.984 -37.751 1.00 54.31 H new ATOM 0 HZ3 LYS A 108 3.995 36.677 -38.089 1.00 54.31 H new ATOM 1681 N GLN A 109 5.497 34.937 -30.753 1.00 54.10 N ATOM 1682 CA GLN A 109 6.562 34.554 -29.834 1.00 43.14 C ATOM 1683 C GLN A 109 6.082 33.484 -28.859 1.00 50.42 C ATOM 1684 O GLN A 109 6.770 32.492 -28.623 1.00 64.14 O ATOM 1685 CB GLN A 109 7.063 35.776 -29.063 1.00 42.40 C ATOM 1686 CG GLN A 109 5.957 36.549 -28.362 1.00 62.14 C ATOM 1687 CD GLN A 109 6.402 37.926 -27.913 1.00 3.55 C ATOM 1688 OE1 GLN A 109 7.177 38.595 -28.597 1.00 3.32 O ATOM 1689 NE2 GLN A 109 5.913 38.359 -26.756 1.00 61.32 N ATOM 0 H GLN A 109 5.292 35.936 -30.769 1.00 54.10 H new ATOM 0 HA GLN A 109 7.383 34.142 -30.421 1.00 43.14 H new ATOM 0 HB2 GLN A 109 7.795 35.453 -28.322 1.00 42.40 H new ATOM 0 HB3 GLN A 109 7.580 36.443 -29.752 1.00 42.40 H new ATOM 0 HG2 GLN A 109 5.105 36.648 -29.035 1.00 62.14 H new ATOM 0 HG3 GLN A 109 5.615 35.982 -27.496 1.00 62.14 H new ATOM 0 HE21 GLN A 109 5.273 37.772 -26.221 1.00 61.32 H new ATOM 0 HE22 GLN A 109 6.177 39.279 -26.403 1.00 61.32 H new ATOM 1698 N MET A 110 4.897 33.694 -28.295 1.00 70.12 N ATOM 1699 CA MET A 110 4.325 32.746 -27.346 1.00 13.42 C ATOM 1700 C MET A 110 4.317 31.335 -27.924 1.00 62.11 C ATOM 1701 O MET A 110 4.765 30.386 -27.278 1.00 53.23 O ATOM 1702 CB MET A 110 2.901 33.164 -26.971 1.00 5.11 C ATOM 1703 CG MET A 110 2.267 32.277 -25.912 1.00 0.33 C ATOM 1704 SD MET A 110 0.698 31.568 -26.448 1.00 43.41 S ATOM 1705 CE MET A 110 1.043 29.819 -26.282 1.00 32.35 C ATOM 0 H MET A 110 4.315 34.511 -28.478 1.00 70.12 H new ATOM 0 HA MET A 110 4.945 32.748 -26.450 1.00 13.42 H new ATOM 0 HB2 MET A 110 2.916 34.193 -26.610 1.00 5.11 H new ATOM 0 HB3 MET A 110 2.279 33.149 -27.866 1.00 5.11 H new ATOM 0 HG2 MET A 110 2.957 31.472 -25.657 1.00 0.33 H new ATOM 0 HG3 MET A 110 2.107 32.859 -25.004 1.00 0.33 H new ATOM 0 HE1 MET A 110 0.109 29.276 -26.137 1.00 32.35 H new ATOM 0 HE2 MET A 110 1.536 29.458 -27.184 1.00 32.35 H new ATOM 0 HE3 MET A 110 1.694 29.656 -25.423 1.00 32.35 H new ATOM 1715 N LEU A 111 3.806 31.203 -29.143 1.00 64.42 N ATOM 1716 CA LEU A 111 3.740 29.906 -29.809 1.00 25.05 C ATOM 1717 C LEU A 111 5.103 29.220 -29.800 1.00 73.22 C ATOM 1718 O LEU A 111 5.204 28.018 -29.548 1.00 50.55 O ATOM 1719 CB LEU A 111 3.250 30.074 -31.248 1.00 31.43 C ATOM 1720 CG LEU A 111 3.240 28.807 -32.105 1.00 52.51 C ATOM 1721 CD1 LEU A 111 1.841 28.534 -32.636 1.00 63.23 C ATOM 1722 CD2 LEU A 111 4.233 28.932 -33.251 1.00 71.43 C ATOM 0 H LEU A 111 3.431 31.978 -29.691 1.00 64.42 H new ATOM 0 HA LEU A 111 3.035 29.280 -29.263 1.00 25.05 H new ATOM 0 HB2 LEU A 111 2.238 30.479 -31.221 1.00 31.43 H new ATOM 0 HB3 LEU A 111 3.878 30.817 -31.740 1.00 31.43 H new ATOM 0 HG LEU A 111 3.540 27.965 -31.481 1.00 52.51 H new ATOM 0 HD11 LEU A 111 1.853 27.629 -33.243 1.00 63.23 H new ATOM 0 HD12 LEU A 111 1.154 28.401 -31.800 1.00 63.23 H new ATOM 0 HD13 LEU A 111 1.512 29.376 -33.245 1.00 63.23 H new ATOM 0 HD21 LEU A 111 4.213 28.022 -33.851 1.00 71.43 H new ATOM 0 HD22 LEU A 111 3.963 29.784 -33.875 1.00 71.43 H new ATOM 0 HD23 LEU A 111 5.235 29.080 -32.849 1.00 71.43 H new ATOM 1734 N THR A 112 6.150 29.991 -30.075 1.00 40.22 N ATOM 1735 CA THR A 112 7.506 29.459 -30.098 1.00 64.44 C ATOM 1736 C THR A 112 7.904 28.908 -28.734 1.00 4.13 C ATOM 1737 O THR A 112 8.414 27.793 -28.628 1.00 72.14 O ATOM 1738 CB THR A 112 8.525 30.534 -30.523 1.00 31.45 C ATOM 1739 OG1 THR A 112 8.175 31.060 -31.807 1.00 61.05 O ATOM 1740 CG2 THR A 112 9.932 29.957 -30.571 1.00 12.01 C ATOM 0 H THR A 112 6.084 30.987 -30.285 1.00 40.22 H new ATOM 0 HA THR A 112 7.516 28.651 -30.830 1.00 64.44 H new ATOM 0 HB THR A 112 8.504 31.336 -29.785 1.00 31.45 H new ATOM 0 HG1 THR A 112 8.826 31.744 -32.069 1.00 61.05 H new ATOM 0 HG21 THR A 112 10.634 30.734 -30.873 1.00 12.01 H new ATOM 0 HG22 THR A 112 10.206 29.584 -29.584 1.00 12.01 H new ATOM 0 HG23 THR A 112 9.965 29.138 -31.290 1.00 12.01 H new ATOM 1748 N ALA A 113 7.668 29.697 -27.691 1.00 1.13 N ATOM 1749 CA ALA A 113 8.000 29.287 -26.332 1.00 34.21 C ATOM 1750 C ALA A 113 7.241 28.024 -25.939 1.00 74.11 C ATOM 1751 O ALA A 113 7.839 27.033 -25.522 1.00 3.24 O ATOM 1752 CB ALA A 113 7.699 30.412 -25.353 1.00 33.23 C ATOM 0 H ALA A 113 7.248 30.624 -27.761 1.00 1.13 H new ATOM 0 HA ALA A 113 9.066 29.065 -26.296 1.00 34.21 H new ATOM 0 HB1 ALA A 113 7.952 30.092 -24.342 1.00 33.23 H new ATOM 0 HB2 ALA A 113 8.290 31.290 -25.614 1.00 33.23 H new ATOM 0 HB3 ALA A 113 6.639 30.662 -25.400 1.00 33.23 H new ATOM 1758 N ALA A 114 5.919 28.067 -26.075 1.00 63.21 N ATOM 1759 CA ALA A 114 5.079 26.925 -25.736 1.00 11.35 C ATOM 1760 C ALA A 114 5.483 25.690 -26.533 1.00 32.20 C ATOM 1761 O ALA A 114 5.354 24.562 -26.056 1.00 65.44 O ATOM 1762 CB ALA A 114 3.614 27.257 -25.979 1.00 1.32 C ATOM 0 H ALA A 114 5.407 28.880 -26.417 1.00 63.21 H new ATOM 0 HA ALA A 114 5.219 26.704 -24.678 1.00 11.35 H new ATOM 0 HB1 ALA A 114 2.998 26.395 -25.722 1.00 1.32 H new ATOM 0 HB2 ALA A 114 3.326 28.107 -25.360 1.00 1.32 H new ATOM 0 HB3 ALA A 114 3.467 27.507 -27.030 1.00 1.32 H new ATOM 1768 N HIS A 115 5.971 25.910 -27.750 1.00 34.22 N ATOM 1769 CA HIS A 115 6.393 24.813 -28.614 1.00 3.32 C ATOM 1770 C HIS A 115 7.553 24.044 -27.988 1.00 12.33 C ATOM 1771 O HIS A 115 7.502 22.821 -27.860 1.00 41.41 O ATOM 1772 CB HIS A 115 6.802 25.347 -29.987 1.00 62.31 C ATOM 1773 CG HIS A 115 7.042 24.270 -31.000 1.00 43.35 C ATOM 1774 ND1 HIS A 115 6.452 24.265 -32.247 1.00 30.54 N ATOM 1775 CD2 HIS A 115 7.816 23.161 -30.947 1.00 72.31 C ATOM 1776 CE1 HIS A 115 6.850 23.197 -32.915 1.00 44.12 C ATOM 1777 NE2 HIS A 115 7.679 22.511 -32.149 1.00 61.11 N ATOM 0 H HIS A 115 6.084 26.837 -28.160 1.00 34.22 H new ATOM 0 HA HIS A 115 5.551 24.132 -28.733 1.00 3.32 H new ATOM 0 HB2 HIS A 115 6.023 26.014 -30.355 1.00 62.31 H new ATOM 0 HB3 HIS A 115 7.708 25.943 -29.881 1.00 62.31 H new ATOM 0 HD1 HIS A 115 5.809 24.975 -32.598 1.00 30.54 H new ATOM 0 HD2 HIS A 115 8.428 22.846 -30.114 1.00 72.31 H new ATOM 0 HE1 HIS A 115 6.549 22.930 -33.917 1.00 44.12 H new ATOM 1785 N ALA A 116 8.597 24.770 -27.600 1.00 33.42 N ATOM 1786 CA ALA A 116 9.768 24.156 -26.986 1.00 72.23 C ATOM 1787 C ALA A 116 9.423 23.550 -25.630 1.00 70.11 C ATOM 1788 O ALA A 116 9.992 22.533 -25.230 1.00 1.31 O ATOM 1789 CB ALA A 116 10.885 25.179 -26.841 1.00 33.30 C ATOM 0 H ALA A 116 8.655 25.783 -27.700 1.00 33.42 H new ATOM 0 HA ALA A 116 10.109 23.351 -27.637 1.00 72.23 H new ATOM 0 HB1 ALA A 116 11.753 24.707 -26.381 1.00 33.30 H new ATOM 0 HB2 ALA A 116 11.158 25.561 -27.825 1.00 33.30 H new ATOM 0 HB3 ALA A 116 10.545 26.003 -26.213 1.00 33.30 H new ATOM 1795 N LEU A 117 8.489 24.180 -24.926 1.00 71.23 N ATOM 1796 CA LEU A 117 8.068 23.703 -23.613 1.00 64.13 C ATOM 1797 C LEU A 117 7.448 22.313 -23.712 1.00 23.21 C ATOM 1798 O LEU A 117 7.844 21.394 -22.995 1.00 75.22 O ATOM 1799 CB LEU A 117 7.067 24.678 -22.992 1.00 31.45 C ATOM 1800 CG LEU A 117 7.666 25.883 -22.266 1.00 55.33 C ATOM 1801 CD1 LEU A 117 6.564 26.795 -21.747 1.00 63.13 C ATOM 1802 CD2 LEU A 117 8.565 25.428 -21.126 1.00 74.42 C ATOM 0 H LEU A 117 8.009 25.022 -25.242 1.00 71.23 H new ATOM 0 HA LEU A 117 8.950 23.642 -22.975 1.00 64.13 H new ATOM 0 HB2 LEU A 117 6.410 25.044 -23.781 1.00 31.45 H new ATOM 0 HB3 LEU A 117 6.443 24.128 -22.287 1.00 31.45 H new ATOM 0 HG LEU A 117 8.272 26.446 -22.976 1.00 55.33 H new ATOM 0 HD11 LEU A 117 7.009 27.647 -21.233 1.00 63.13 H new ATOM 0 HD12 LEU A 117 5.961 27.150 -22.583 1.00 63.13 H new ATOM 0 HD13 LEU A 117 5.931 26.242 -21.052 1.00 63.13 H new ATOM 0 HD21 LEU A 117 8.982 26.300 -20.621 1.00 74.42 H new ATOM 0 HD22 LEU A 117 7.983 24.841 -20.415 1.00 74.42 H new ATOM 0 HD23 LEU A 117 9.375 24.817 -21.523 1.00 74.42 H new ATOM 1814 N ALA A 118 6.476 22.166 -24.606 1.00 40.30 N ATOM 1815 CA ALA A 118 5.804 20.887 -24.802 1.00 4.54 C ATOM 1816 C ALA A 118 6.807 19.784 -25.122 1.00 0.12 C ATOM 1817 O ALA A 118 6.835 18.746 -24.461 1.00 20.21 O ATOM 1818 CB ALA A 118 4.768 21.000 -25.910 1.00 62.30 C ATOM 0 H ALA A 118 6.136 22.917 -25.206 1.00 40.30 H new ATOM 0 HA ALA A 118 5.298 20.623 -23.873 1.00 4.54 H new ATOM 0 HB1 ALA A 118 4.274 20.038 -26.046 1.00 62.30 H new ATOM 0 HB2 ALA A 118 4.028 21.753 -25.640 1.00 62.30 H new ATOM 0 HB3 ALA A 118 5.259 21.290 -26.839 1.00 62.30 H new ATOM 1824 N VAL A 119 7.629 20.015 -26.141 1.00 0.24 N ATOM 1825 CA VAL A 119 8.634 19.041 -26.548 1.00 71.44 C ATOM 1826 C VAL A 119 9.641 18.789 -25.432 1.00 11.54 C ATOM 1827 O VAL A 119 10.120 17.669 -25.254 1.00 50.31 O ATOM 1828 CB VAL A 119 9.387 19.505 -27.809 1.00 42.10 C ATOM 1829 CG1 VAL A 119 10.435 18.479 -28.213 1.00 40.44 C ATOM 1830 CG2 VAL A 119 8.412 19.761 -28.948 1.00 72.41 C ATOM 0 H VAL A 119 7.618 20.868 -26.700 1.00 0.24 H new ATOM 0 HA VAL A 119 8.104 18.115 -26.770 1.00 71.44 H new ATOM 0 HB VAL A 119 9.898 20.441 -27.582 1.00 42.10 H new ATOM 0 HG11 VAL A 119 10.957 18.824 -29.106 1.00 40.44 H new ATOM 0 HG12 VAL A 119 11.151 18.351 -27.401 1.00 40.44 H new ATOM 0 HG13 VAL A 119 9.949 17.526 -28.422 1.00 40.44 H new ATOM 0 HG21 VAL A 119 8.961 20.088 -29.831 1.00 72.41 H new ATOM 0 HG22 VAL A 119 7.871 18.843 -29.177 1.00 72.41 H new ATOM 0 HG23 VAL A 119 7.704 20.536 -28.654 1.00 72.41 H new ATOM 1840 N ASP A 120 9.957 19.839 -24.681 1.00 22.20 N ATOM 1841 CA ASP A 120 10.907 19.732 -23.579 1.00 54.32 C ATOM 1842 C ASP A 120 10.400 18.761 -22.517 1.00 41.33 C ATOM 1843 O ASP A 120 11.081 17.797 -22.168 1.00 53.25 O ATOM 1844 CB ASP A 120 11.153 21.107 -22.955 1.00 72.13 C ATOM 1845 CG ASP A 120 12.244 21.880 -23.669 1.00 62.33 C ATOM 1846 OD1 ASP A 120 12.704 21.412 -24.732 1.00 30.13 O ATOM 1847 OD2 ASP A 120 12.639 22.952 -23.165 1.00 44.13 O ATOM 0 H ASP A 120 9.570 20.773 -24.815 1.00 22.20 H new ATOM 0 HA ASP A 120 11.847 19.349 -23.977 1.00 54.32 H new ATOM 0 HB2 ASP A 120 10.228 21.684 -22.978 1.00 72.13 H new ATOM 0 HB3 ASP A 120 11.426 20.984 -21.907 1.00 72.13 H new ATOM 1852 N ALA A 121 9.201 19.024 -22.006 1.00 65.45 N ATOM 1853 CA ALA A 121 8.604 18.173 -20.985 1.00 75.32 C ATOM 1854 C ALA A 121 8.596 16.712 -21.423 1.00 24.11 C ATOM 1855 O ALA A 121 8.730 15.806 -20.600 1.00 75.42 O ATOM 1856 CB ALA A 121 7.189 18.639 -20.672 1.00 24.43 C ATOM 0 H ALA A 121 8.625 19.819 -22.283 1.00 65.45 H new ATOM 0 HA ALA A 121 9.210 18.251 -20.082 1.00 75.32 H new ATOM 0 HB1 ALA A 121 6.754 17.995 -19.908 1.00 24.43 H new ATOM 0 HB2 ALA A 121 7.216 19.666 -20.308 1.00 24.43 H new ATOM 0 HB3 ALA A 121 6.582 18.590 -21.576 1.00 24.43 H new ATOM 1862 N LYS A 122 8.440 16.490 -22.723 1.00 74.44 N ATOM 1863 CA LYS A 122 8.416 15.139 -23.272 1.00 35.22 C ATOM 1864 C LYS A 122 9.817 14.538 -23.301 1.00 4.32 C ATOM 1865 O LYS A 122 10.024 13.402 -22.878 1.00 65.44 O ATOM 1866 CB LYS A 122 7.825 15.150 -24.683 1.00 74.34 C ATOM 1867 CG LYS A 122 7.707 13.769 -25.304 1.00 71.52 C ATOM 1868 CD LYS A 122 8.972 13.384 -26.052 1.00 63.32 C ATOM 1869 CE LYS A 122 8.722 12.235 -27.017 1.00 72.12 C ATOM 1870 NZ LYS A 122 8.615 12.707 -28.425 1.00 74.14 N ATOM 0 H LYS A 122 8.328 17.229 -23.417 1.00 74.44 H new ATOM 0 HA LYS A 122 7.789 14.523 -22.627 1.00 35.22 H new ATOM 0 HB2 LYS A 122 6.837 15.610 -24.651 1.00 74.34 H new ATOM 0 HB3 LYS A 122 8.447 15.775 -25.324 1.00 74.34 H new ATOM 0 HG2 LYS A 122 7.507 13.034 -24.524 1.00 71.52 H new ATOM 0 HG3 LYS A 122 6.858 13.748 -25.988 1.00 71.52 H new ATOM 0 HD2 LYS A 122 9.348 14.247 -26.602 1.00 63.32 H new ATOM 0 HD3 LYS A 122 9.745 13.099 -25.339 1.00 63.32 H new ATOM 0 HE2 LYS A 122 9.533 11.511 -26.937 1.00 72.12 H new ATOM 0 HE3 LYS A 122 7.804 11.718 -26.736 1.00 72.12 H new ATOM 0 HZ1 LYS A 122 8.445 11.895 -29.052 1.00 74.14 H new ATOM 0 HZ2 LYS A 122 7.825 13.379 -28.507 1.00 74.14 H new ATOM 0 HZ3 LYS A 122 9.500 13.178 -28.702 1.00 74.14 H new ATOM 1884 N ASN A 123 10.777 15.310 -23.801 1.00 12.33 N ATOM 1885 CA ASN A 123 12.160 14.854 -23.884 1.00 15.24 C ATOM 1886 C ASN A 123 12.659 14.383 -22.521 1.00 63.54 C ATOM 1887 O ASN A 123 13.547 13.533 -22.433 1.00 41.25 O ATOM 1888 CB ASN A 123 13.058 15.976 -24.408 1.00 71.04 C ATOM 1889 CG ASN A 123 14.518 15.570 -24.463 1.00 70.42 C ATOM 1890 OD1 ASN A 123 14.876 14.585 -25.110 1.00 11.12 O ATOM 1891 ND2 ASN A 123 15.369 16.328 -23.782 1.00 50.44 N ATOM 0 H ASN A 123 10.622 16.254 -24.155 1.00 12.33 H new ATOM 0 HA ASN A 123 12.199 14.013 -24.577 1.00 15.24 H new ATOM 0 HB2 ASN A 123 12.727 16.267 -25.405 1.00 71.04 H new ATOM 0 HB3 ASN A 123 12.951 16.852 -23.768 1.00 71.04 H new ATOM 0 HD21 ASN A 123 16.364 16.103 -23.781 1.00 50.44 H new ATOM 0 HD22 ASN A 123 15.028 17.135 -23.260 1.00 50.44 H new ATOM 1898 N LEU A 124 12.083 14.938 -21.461 1.00 42.33 N ATOM 1899 CA LEU A 124 12.469 14.575 -20.102 1.00 71.42 C ATOM 1900 C LEU A 124 12.428 13.062 -19.911 1.00 32.11 C ATOM 1901 O LEU A 124 13.429 12.444 -19.545 1.00 13.10 O ATOM 1902 CB LEU A 124 11.545 15.253 -19.090 1.00 11.43 C ATOM 1903 CG LEU A 124 11.623 16.779 -19.027 1.00 4.20 C ATOM 1904 CD1 LEU A 124 10.745 17.313 -17.907 1.00 13.34 C ATOM 1905 CD2 LEU A 124 13.064 17.232 -18.839 1.00 61.22 C ATOM 0 H LEU A 124 11.347 15.642 -21.516 1.00 42.33 H new ATOM 0 HA LEU A 124 13.491 14.917 -19.937 1.00 71.42 H new ATOM 0 HB2 LEU A 124 10.518 14.971 -19.320 1.00 11.43 H new ATOM 0 HB3 LEU A 124 11.770 14.856 -18.100 1.00 11.43 H new ATOM 0 HG LEU A 124 11.256 17.181 -19.971 1.00 4.20 H new ATOM 0 HD11 LEU A 124 10.814 18.400 -17.878 1.00 13.34 H new ATOM 0 HD12 LEU A 124 9.710 17.019 -18.084 1.00 13.34 H new ATOM 0 HD13 LEU A 124 11.081 16.903 -16.955 1.00 13.34 H new ATOM 0 HD21 LEU A 124 13.101 18.321 -18.796 1.00 61.22 H new ATOM 0 HD22 LEU A 124 13.457 16.819 -17.910 1.00 61.22 H new ATOM 0 HD23 LEU A 124 13.668 16.881 -19.676 1.00 61.22 H new ATOM 1917 N LEU A 125 11.265 12.470 -20.163 1.00 3.44 N ATOM 1918 CA LEU A 125 11.094 11.029 -20.020 1.00 73.35 C ATOM 1919 C LEU A 125 11.823 10.281 -21.133 1.00 15.43 C ATOM 1920 O LEU A 125 12.366 9.198 -20.914 1.00 12.50 O ATOM 1921 CB LEU A 125 9.607 10.668 -20.037 1.00 43.01 C ATOM 1922 CG LEU A 125 9.143 9.687 -18.961 1.00 33.44 C ATOM 1923 CD1 LEU A 125 8.268 10.393 -17.936 1.00 61.42 C ATOM 1924 CD2 LEU A 125 8.395 8.520 -19.589 1.00 72.15 C ATOM 0 H LEU A 125 10.427 12.966 -20.467 1.00 3.44 H new ATOM 0 HA LEU A 125 11.524 10.730 -19.064 1.00 73.35 H new ATOM 0 HB2 LEU A 125 9.029 11.587 -19.936 1.00 43.01 H new ATOM 0 HB3 LEU A 125 9.367 10.246 -21.013 1.00 43.01 H new ATOM 0 HG LEU A 125 10.023 9.296 -18.450 1.00 33.44 H new ATOM 0 HD11 LEU A 125 7.947 9.679 -17.178 1.00 61.42 H new ATOM 0 HD12 LEU A 125 8.836 11.194 -17.463 1.00 61.42 H new ATOM 0 HD13 LEU A 125 7.393 10.813 -18.432 1.00 61.42 H new ATOM 0 HD21 LEU A 125 8.072 7.832 -18.808 1.00 72.15 H new ATOM 0 HD22 LEU A 125 7.523 8.893 -20.126 1.00 72.15 H new ATOM 0 HD23 LEU A 125 9.053 7.998 -20.283 1.00 72.15 H new ATOM 1936 N ASP A 126 11.832 10.868 -22.325 1.00 34.43 N ATOM 1937 CA ASP A 126 12.497 10.259 -23.471 1.00 32.00 C ATOM 1938 C ASP A 126 13.972 10.008 -23.173 1.00 52.33 C ATOM 1939 O ASP A 126 14.509 8.947 -23.492 1.00 13.30 O ATOM 1940 CB ASP A 126 12.357 11.154 -24.703 1.00 43.31 C ATOM 1941 CG ASP A 126 11.573 10.489 -25.817 1.00 22.42 C ATOM 1942 OD1 ASP A 126 10.490 9.935 -25.532 1.00 3.32 O ATOM 1943 OD2 ASP A 126 12.042 10.521 -26.974 1.00 1.54 O ATOM 0 H ASP A 126 11.387 11.764 -22.523 1.00 34.43 H new ATOM 0 HA ASP A 126 12.018 9.301 -23.672 1.00 32.00 H new ATOM 0 HB2 ASP A 126 11.862 12.083 -24.419 1.00 43.31 H new ATOM 0 HB3 ASP A 126 13.348 11.420 -25.069 1.00 43.31 H new ATOM 1948 N VAL A 127 14.622 10.993 -22.561 1.00 64.32 N ATOM 1949 CA VAL A 127 16.036 10.879 -22.220 1.00 55.25 C ATOM 1950 C VAL A 127 16.265 9.781 -21.189 1.00 25.34 C ATOM 1951 O VAL A 127 16.982 8.813 -21.446 1.00 44.44 O ATOM 1952 CB VAL A 127 16.589 12.208 -21.672 1.00 20.31 C ATOM 1953 CG1 VAL A 127 18.049 12.054 -21.273 1.00 33.03 C ATOM 1954 CG2 VAL A 127 16.423 13.318 -22.698 1.00 54.12 C ATOM 0 H VAL A 127 14.193 11.878 -22.291 1.00 64.32 H new ATOM 0 HA VAL A 127 16.565 10.626 -23.139 1.00 55.25 H new ATOM 0 HB VAL A 127 16.020 12.479 -20.783 1.00 20.31 H new ATOM 0 HG11 VAL A 127 18.423 13.003 -20.888 1.00 33.03 H new ATOM 0 HG12 VAL A 127 18.137 11.289 -20.501 1.00 33.03 H new ATOM 0 HG13 VAL A 127 18.635 11.759 -22.144 1.00 33.03 H new ATOM 0 HG21 VAL A 127 16.819 14.249 -22.294 1.00 54.12 H new ATOM 0 HG22 VAL A 127 16.965 13.057 -23.607 1.00 54.12 H new ATOM 0 HG23 VAL A 127 15.365 13.444 -22.930 1.00 54.12 H new ATOM 1964 N ILE A 128 15.652 9.937 -20.020 1.00 64.42 N ATOM 1965 CA ILE A 128 15.789 8.957 -18.950 1.00 21.23 C ATOM 1966 C ILE A 128 15.374 7.567 -19.420 1.00 63.13 C ATOM 1967 O ILE A 128 15.799 6.557 -18.858 1.00 13.44 O ATOM 1968 CB ILE A 128 14.945 9.344 -17.721 1.00 73.32 C ATOM 1969 CG1 ILE A 128 15.189 8.358 -16.576 1.00 51.34 C ATOM 1970 CG2 ILE A 128 13.468 9.386 -18.085 1.00 61.33 C ATOM 1971 CD1 ILE A 128 15.054 8.981 -15.204 1.00 64.23 C ATOM 0 H ILE A 128 15.056 10.732 -19.790 1.00 64.42 H new ATOM 0 HA ILE A 128 16.842 8.943 -18.668 1.00 21.23 H new ATOM 0 HB ILE A 128 15.246 10.338 -17.390 1.00 73.32 H new ATOM 0 HG12 ILE A 128 14.483 7.532 -16.662 1.00 51.34 H new ATOM 0 HG13 ILE A 128 16.189 7.935 -16.678 1.00 51.34 H new ATOM 0 HG21 ILE A 128 12.884 9.661 -17.206 1.00 61.33 H new ATOM 0 HG22 ILE A 128 13.308 10.123 -18.872 1.00 61.33 H new ATOM 0 HG23 ILE A 128 13.152 8.404 -18.438 1.00 61.33 H new ATOM 0 HD11 ILE A 128 15.240 8.225 -14.441 1.00 64.23 H new ATOM 0 HD12 ILE A 128 15.778 9.789 -15.098 1.00 64.23 H new ATOM 0 HD13 ILE A 128 14.046 9.379 -15.083 1.00 64.23 H new ATOM 1983 N ASP A 129 14.544 7.523 -20.456 1.00 61.44 N ATOM 1984 CA ASP A 129 14.074 6.256 -21.006 1.00 13.24 C ATOM 1985 C ASP A 129 15.248 5.366 -21.402 1.00 14.15 C ATOM 1986 O ASP A 129 15.223 4.156 -21.179 1.00 22.00 O ATOM 1987 CB ASP A 129 13.174 6.504 -22.217 1.00 41.14 C ATOM 1988 CG ASP A 129 11.794 5.900 -22.047 1.00 40.22 C ATOM 1989 OD1 ASP A 129 11.106 6.258 -21.068 1.00 52.55 O ATOM 1990 OD2 ASP A 129 11.402 5.070 -22.893 1.00 72.13 O ATOM 0 H ASP A 129 14.183 8.349 -20.932 1.00 61.44 H new ATOM 0 HA ASP A 129 13.499 5.745 -20.234 1.00 13.24 H new ATOM 0 HB2 ASP A 129 13.080 7.577 -22.382 1.00 41.14 H new ATOM 0 HB3 ASP A 129 13.644 6.085 -23.107 1.00 41.14 H new ATOM 1995 N GLN A 130 16.273 5.974 -21.990 1.00 14.10 N ATOM 1996 CA GLN A 130 17.455 5.236 -22.418 1.00 74.34 C ATOM 1997 C GLN A 130 18.176 4.623 -21.223 1.00 24.40 C ATOM 1998 O GLN A 130 18.889 3.629 -21.359 1.00 21.42 O ATOM 1999 CB GLN A 130 18.406 6.155 -23.187 1.00 15.02 C ATOM 2000 CG GLN A 130 18.598 5.754 -24.640 1.00 74.24 C ATOM 2001 CD GLN A 130 19.437 6.751 -25.415 1.00 75.11 C ATOM 2002 OE1 GLN A 130 19.642 7.882 -24.974 1.00 61.01 O ATOM 2003 NE2 GLN A 130 19.927 6.336 -26.577 1.00 71.23 N ATOM 0 H GLN A 130 16.309 6.975 -22.181 1.00 14.10 H new ATOM 0 HA GLN A 130 17.130 4.430 -23.076 1.00 74.34 H new ATOM 0 HB2 GLN A 130 18.023 7.175 -23.148 1.00 15.02 H new ATOM 0 HB3 GLN A 130 19.376 6.159 -22.689 1.00 15.02 H new ATOM 0 HG2 GLN A 130 19.074 4.774 -24.683 1.00 74.24 H new ATOM 0 HG3 GLN A 130 17.623 5.656 -25.118 1.00 74.24 H new ATOM 0 HE21 GLN A 130 19.732 5.390 -26.904 1.00 71.23 H new ATOM 0 HE22 GLN A 130 20.499 6.963 -27.143 1.00 71.23 H new ATOM 2012 N ALA A 131 17.987 5.223 -20.052 1.00 70.43 N ATOM 2013 CA ALA A 131 18.619 4.735 -18.833 1.00 33.53 C ATOM 2014 C ALA A 131 17.974 3.435 -18.363 1.00 11.03 C ATOM 2015 O ALA A 131 18.666 2.481 -18.005 1.00 52.55 O ATOM 2016 CB ALA A 131 18.541 5.790 -17.740 1.00 24.05 C ATOM 0 H ALA A 131 17.401 6.048 -19.922 1.00 70.43 H new ATOM 0 HA ALA A 131 19.667 4.532 -19.053 1.00 33.53 H new ATOM 0 HB1 ALA A 131 19.017 5.412 -16.835 1.00 24.05 H new ATOM 0 HB2 ALA A 131 19.054 6.694 -18.069 1.00 24.05 H new ATOM 0 HB3 ALA A 131 17.496 6.021 -17.531 1.00 24.05 H new ATOM 2022 N ARG A 132 16.645 3.405 -18.365 1.00 22.33 N ATOM 2023 CA ARG A 132 15.907 2.222 -17.936 1.00 44.44 C ATOM 2024 C ARG A 132 16.316 1.001 -18.754 1.00 73.24 C ATOM 2025 O ARG A 132 16.653 -0.046 -18.200 1.00 61.44 O ATOM 2026 CB ARG A 132 14.402 2.459 -18.070 1.00 32.34 C ATOM 2027 CG ARG A 132 13.588 1.856 -16.936 1.00 1.21 C ATOM 2028 CD ARG A 132 12.174 2.415 -16.907 1.00 3.22 C ATOM 2029 NE ARG A 132 11.167 1.363 -17.015 1.00 3.01 N ATOM 2030 CZ ARG A 132 10.859 0.536 -16.022 1.00 61.12 C ATOM 2031 NH1 ARG A 132 11.476 0.639 -14.853 1.00 63.13 N ATOM 2032 NH2 ARG A 132 9.931 -0.396 -16.198 1.00 22.34 N ATOM 0 H ARG A 132 16.058 4.185 -18.659 1.00 22.33 H new ATOM 0 HA ARG A 132 16.146 2.033 -16.890 1.00 44.44 H new ATOM 0 HB2 ARG A 132 14.214 3.532 -18.111 1.00 32.34 H new ATOM 0 HB3 ARG A 132 14.059 2.039 -19.016 1.00 32.34 H new ATOM 0 HG2 ARG A 132 13.550 0.773 -17.050 1.00 1.21 H new ATOM 0 HG3 ARG A 132 14.080 2.059 -15.985 1.00 1.21 H new ATOM 0 HD2 ARG A 132 12.022 2.968 -15.980 1.00 3.22 H new ATOM 0 HD3 ARG A 132 12.047 3.123 -17.726 1.00 3.22 H new ATOM 0 HE ARG A 132 10.673 1.257 -17.901 1.00 3.01 H new ATOM 0 HH11 ARG A 132 12.189 1.355 -14.714 1.00 63.13 H new ATOM 0 HH12 ARG A 132 11.237 0.003 -14.093 1.00 63.13 H new ATOM 0 HH21 ARG A 132 9.454 -0.478 -17.096 1.00 22.34 H new ATOM 0 HH22 ARG A 132 9.695 -1.031 -15.435 1.00 22.34 H new ATOM 2046 N LEU A 133 16.282 1.142 -20.075 1.00 24.41 N ATOM 2047 CA LEU A 133 16.649 0.050 -20.970 1.00 74.53 C ATOM 2048 C LEU A 133 18.123 -0.310 -20.816 1.00 50.34 C ATOM 2049 O LEU A 133 18.510 -1.468 -20.970 1.00 24.32 O ATOM 2050 CB LEU A 133 16.354 0.433 -22.422 1.00 2.25 C ATOM 2051 CG LEU A 133 14.915 0.220 -22.893 1.00 44.34 C ATOM 2052 CD1 LEU A 133 14.502 1.321 -23.858 1.00 34.11 C ATOM 2053 CD2 LEU A 133 14.764 -1.147 -23.545 1.00 4.34 C ATOM 0 H LEU A 133 16.004 2.001 -20.550 1.00 24.41 H new ATOM 0 HA LEU A 133 16.052 -0.822 -20.702 1.00 74.53 H new ATOM 0 HB2 LEU A 133 16.608 1.484 -22.558 1.00 2.25 H new ATOM 0 HB3 LEU A 133 17.016 -0.141 -23.070 1.00 2.25 H new ATOM 0 HG LEU A 133 14.258 0.260 -22.024 1.00 44.34 H new ATOM 0 HD11 LEU A 133 13.475 1.154 -24.183 1.00 34.11 H new ATOM 0 HD12 LEU A 133 14.572 2.287 -23.359 1.00 34.11 H new ATOM 0 HD13 LEU A 133 15.163 1.312 -24.725 1.00 34.11 H new ATOM 0 HD21 LEU A 133 13.734 -1.281 -23.874 1.00 4.34 H new ATOM 0 HD22 LEU A 133 15.431 -1.216 -24.404 1.00 4.34 H new ATOM 0 HD23 LEU A 133 15.019 -1.924 -22.824 1.00 4.34 H new ATOM 2065 N LYS A 134 18.942 0.691 -20.510 1.00 54.12 N ATOM 2066 CA LYS A 134 20.373 0.482 -20.331 1.00 64.44 C ATOM 2067 C LYS A 134 20.640 -0.567 -19.257 1.00 32.54 C ATOM 2068 O LYS A 134 21.494 -1.438 -19.424 1.00 12.42 O ATOM 2069 CB LYS A 134 21.059 1.797 -19.956 1.00 2.20 C ATOM 2070 CG LYS A 134 21.876 2.401 -21.085 1.00 52.33 C ATOM 2071 CD LYS A 134 22.150 3.877 -20.848 1.00 33.11 C ATOM 2072 CE LYS A 134 23.178 4.418 -21.829 1.00 64.21 C ATOM 2073 NZ LYS A 134 24.540 4.474 -21.230 1.00 4.23 N ATOM 0 H LYS A 134 18.638 1.656 -20.381 1.00 54.12 H new ATOM 0 HA LYS A 134 20.782 0.122 -21.275 1.00 64.44 H new ATOM 0 HB2 LYS A 134 20.302 2.515 -19.642 1.00 2.20 H new ATOM 0 HB3 LYS A 134 21.710 1.626 -19.099 1.00 2.20 H new ATOM 0 HG2 LYS A 134 22.821 1.865 -21.179 1.00 52.33 H new ATOM 0 HG3 LYS A 134 21.344 2.276 -22.028 1.00 52.33 H new ATOM 0 HD2 LYS A 134 21.222 4.440 -20.945 1.00 33.11 H new ATOM 0 HD3 LYS A 134 22.507 4.023 -19.828 1.00 33.11 H new ATOM 0 HE2 LYS A 134 23.198 3.788 -22.718 1.00 64.21 H new ATOM 0 HE3 LYS A 134 22.882 5.416 -22.152 1.00 64.21 H new ATOM 0 HZ1 LYS A 134 25.212 4.848 -21.930 1.00 4.23 H new ATOM 0 HZ2 LYS A 134 24.527 5.095 -20.396 1.00 4.23 H new ATOM 0 HZ3 LYS A 134 24.833 3.518 -20.945 1.00 4.23 H new ATOM 2087 N MET A 135 19.902 -0.479 -18.154 1.00 64.45 N ATOM 2088 CA MET A 135 20.058 -1.423 -17.054 1.00 30.51 C ATOM 2089 C MET A 135 19.387 -2.754 -17.380 1.00 12.12 C ATOM 2090 O MET A 135 20.003 -3.814 -17.266 1.00 75.33 O ATOM 2091 CB MET A 135 19.467 -0.842 -15.768 1.00 21.41 C ATOM 2092 CG MET A 135 20.179 -1.308 -14.508 1.00 14.42 C ATOM 2093 SD MET A 135 19.073 -2.144 -13.355 1.00 24.13 S ATOM 2094 CE MET A 135 18.344 -0.744 -12.509 1.00 1.04 C ATOM 0 H MET A 135 19.191 0.236 -17.999 1.00 64.45 H new ATOM 0 HA MET A 135 21.124 -1.600 -16.908 1.00 30.51 H new ATOM 0 HB2 MET A 135 19.509 0.246 -15.818 1.00 21.41 H new ATOM 0 HB3 MET A 135 18.415 -1.118 -15.704 1.00 21.41 H new ATOM 0 HG2 MET A 135 20.990 -1.983 -14.782 1.00 14.42 H new ATOM 0 HG3 MET A 135 20.633 -0.449 -14.013 1.00 14.42 H new ATOM 0 HE1 MET A 135 17.833 -1.088 -11.609 1.00 1.04 H new ATOM 0 HE2 MET A 135 19.127 -0.037 -12.234 1.00 1.04 H new ATOM 0 HE3 MET A 135 17.627 -0.254 -13.168 1.00 1.04 H new ATOM 2104 N ILE A 136 18.123 -2.690 -17.784 1.00 72.45 N ATOM 2105 CA ILE A 136 17.370 -3.890 -18.127 1.00 72.42 C ATOM 2106 C ILE A 136 18.134 -4.752 -19.126 1.00 61.42 C ATOM 2107 O ILE A 136 18.415 -5.922 -18.865 1.00 62.00 O ATOM 2108 CB ILE A 136 15.991 -3.540 -18.718 1.00 20.45 C ATOM 2109 CG1 ILE A 136 15.184 -2.704 -17.723 1.00 14.21 C ATOM 2110 CG2 ILE A 136 15.236 -4.808 -19.087 1.00 71.24 C ATOM 2111 CD1 ILE A 136 14.036 -1.951 -18.358 1.00 40.45 C ATOM 0 H ILE A 136 17.599 -1.820 -17.882 1.00 72.45 H new ATOM 0 HA ILE A 136 17.229 -4.449 -17.202 1.00 72.42 H new ATOM 0 HB ILE A 136 16.138 -2.952 -19.624 1.00 20.45 H new ATOM 0 HG12 ILE A 136 14.792 -3.359 -16.945 1.00 14.21 H new ATOM 0 HG13 ILE A 136 15.850 -1.992 -17.235 1.00 14.21 H new ATOM 0 HG21 ILE A 136 14.264 -4.544 -19.503 1.00 71.24 H new ATOM 0 HG22 ILE A 136 15.807 -5.369 -19.826 1.00 71.24 H new ATOM 0 HG23 ILE A 136 15.095 -5.420 -18.196 1.00 71.24 H new ATOM 0 HD11 ILE A 136 13.508 -1.380 -17.594 1.00 40.45 H new ATOM 0 HD12 ILE A 136 14.423 -1.271 -19.117 1.00 40.45 H new ATOM 0 HD13 ILE A 136 13.349 -2.659 -18.821 1.00 40.45 H new ATOM 2123 N SER A 137 18.469 -4.166 -20.271 1.00 41.10 N ATOM 2124 CA SER A 137 19.200 -4.881 -21.311 1.00 13.20 C ATOM 2125 C SER A 137 20.684 -4.969 -20.969 1.00 41.44 C ATOM 2126 O SER A 137 21.531 -4.460 -21.703 1.00 1.21 O ATOM 2127 CB SER A 137 19.016 -4.187 -22.662 1.00 12.31 C ATOM 2128 OG SER A 137 17.665 -3.807 -22.861 1.00 20.24 O ATOM 0 H SER A 137 18.246 -3.198 -20.502 1.00 41.10 H new ATOM 0 HA SER A 137 18.799 -5.893 -21.373 1.00 13.20 H new ATOM 0 HB2 SER A 137 19.656 -3.306 -22.712 1.00 12.31 H new ATOM 0 HB3 SER A 137 19.331 -4.855 -23.463 1.00 12.31 H new ATOM 0 HG SER A 137 17.483 -2.977 -22.372 1.00 20.24 H new ATOM 2272 N GLU A 162 2.026 10.462 -31.088 1.00 44.42 N ATOM 2273 CA GLU A 162 0.824 11.268 -30.912 1.00 11.24 C ATOM 2274 C GLU A 162 1.182 12.720 -30.607 1.00 52.14 C ATOM 2275 O GLU A 162 0.621 13.646 -31.195 1.00 71.01 O ATOM 2276 CB GLU A 162 -0.039 10.697 -29.784 1.00 45.01 C ATOM 2277 CG GLU A 162 -1.511 11.053 -29.904 1.00 62.11 C ATOM 2278 CD GLU A 162 -1.981 11.974 -28.795 1.00 23.32 C ATOM 2279 OE1 GLU A 162 -1.841 13.205 -28.948 1.00 3.42 O ATOM 2280 OE2 GLU A 162 -2.488 11.463 -27.774 1.00 42.52 O ATOM 0 HA GLU A 162 0.259 11.239 -31.843 1.00 11.24 H new ATOM 0 HB2 GLU A 162 0.064 9.612 -29.773 1.00 45.01 H new ATOM 0 HB3 GLU A 162 0.338 11.063 -28.829 1.00 45.01 H new ATOM 0 HG2 GLU A 162 -1.688 11.531 -30.867 1.00 62.11 H new ATOM 0 HG3 GLU A 162 -2.104 10.139 -29.888 1.00 62.11 H new ATOM 2287 N LEU A 163 2.119 12.911 -29.685 1.00 53.43 N ATOM 2288 CA LEU A 163 2.552 14.250 -29.301 1.00 42.34 C ATOM 2289 C LEU A 163 3.252 14.950 -30.462 1.00 71.13 C ATOM 2290 O LEU A 163 3.057 16.144 -30.689 1.00 1.34 O ATOM 2291 CB LEU A 163 3.490 14.178 -28.095 1.00 31.21 C ATOM 2292 CG LEU A 163 2.987 13.365 -26.902 1.00 33.24 C ATOM 2293 CD1 LEU A 163 3.972 12.260 -26.555 1.00 61.52 C ATOM 2294 CD2 LEU A 163 2.753 14.269 -25.700 1.00 41.55 C ATOM 0 H LEU A 163 2.593 12.156 -29.190 1.00 53.43 H new ATOM 0 HA LEU A 163 1.668 14.828 -29.032 1.00 42.34 H new ATOM 0 HB2 LEU A 163 4.439 13.755 -28.423 1.00 31.21 H new ATOM 0 HB3 LEU A 163 3.694 15.194 -27.757 1.00 31.21 H new ATOM 0 HG LEU A 163 2.038 12.905 -27.176 1.00 33.24 H new ATOM 0 HD11 LEU A 163 3.597 11.692 -25.704 1.00 61.52 H new ATOM 0 HD12 LEU A 163 4.090 11.595 -27.411 1.00 61.52 H new ATOM 0 HD13 LEU A 163 4.937 12.699 -26.301 1.00 61.52 H new ATOM 0 HD21 LEU A 163 2.395 13.673 -24.861 1.00 41.55 H new ATOM 0 HD22 LEU A 163 3.687 14.758 -25.425 1.00 41.55 H new ATOM 0 HD23 LEU A 163 2.008 15.024 -25.952 1.00 41.55 H new ATOM 2306 N ASP A 164 4.065 14.198 -31.196 1.00 30.12 N ATOM 2307 CA ASP A 164 4.791 14.745 -32.336 1.00 63.20 C ATOM 2308 C ASP A 164 3.827 15.320 -33.369 1.00 4.41 C ATOM 2309 O ASP A 164 3.996 16.450 -33.828 1.00 44.02 O ATOM 2310 CB ASP A 164 5.662 13.664 -32.979 1.00 51.22 C ATOM 2311 CG ASP A 164 6.852 13.290 -32.117 1.00 53.42 C ATOM 2312 OD1 ASP A 164 6.665 13.105 -30.896 1.00 44.02 O ATOM 2313 OD2 ASP A 164 7.969 13.182 -32.664 1.00 1.31 O ATOM 0 H ASP A 164 4.238 13.208 -31.022 1.00 30.12 H new ATOM 0 HA ASP A 164 5.431 15.550 -31.976 1.00 63.20 H new ATOM 0 HB2 ASP A 164 5.057 12.776 -33.163 1.00 51.22 H new ATOM 0 HB3 ASP A 164 6.015 14.015 -33.948 1.00 51.22 H new ATOM 2318 N ARG A 165 2.818 14.536 -33.730 1.00 75.33 N ATOM 2319 CA ARG A 165 1.828 14.967 -34.711 1.00 21.44 C ATOM 2320 C ARG A 165 1.242 16.323 -34.331 1.00 51.32 C ATOM 2321 O ARG A 165 1.250 17.261 -35.130 1.00 72.54 O ATOM 2322 CB ARG A 165 0.709 13.930 -34.827 1.00 21.02 C ATOM 2323 CG ARG A 165 -0.167 14.115 -36.055 1.00 70.30 C ATOM 2324 CD ARG A 165 -1.635 14.240 -35.678 1.00 40.24 C ATOM 2325 NE ARG A 165 -2.506 14.199 -36.850 1.00 10.41 N ATOM 2326 CZ ARG A 165 -3.832 14.217 -36.780 1.00 75.54 C ATOM 2327 NH1 ARG A 165 -4.437 14.274 -35.602 1.00 32.31 N ATOM 2328 NH2 ARG A 165 -4.557 14.177 -37.891 1.00 62.15 N ATOM 0 H ARG A 165 2.663 13.599 -33.359 1.00 75.33 H new ATOM 0 HA ARG A 165 2.326 15.063 -35.676 1.00 21.44 H new ATOM 0 HB2 ARG A 165 1.150 12.933 -34.852 1.00 21.02 H new ATOM 0 HB3 ARG A 165 0.085 13.980 -33.935 1.00 21.02 H new ATOM 0 HG2 ARG A 165 0.148 15.007 -36.597 1.00 70.30 H new ATOM 0 HG3 ARG A 165 -0.034 13.269 -36.729 1.00 70.30 H new ATOM 0 HD2 ARG A 165 -1.905 13.432 -34.997 1.00 40.24 H new ATOM 0 HD3 ARG A 165 -1.793 15.175 -35.141 1.00 40.24 H new ATOM 0 HE ARG A 165 -2.072 14.154 -37.772 1.00 10.41 H new ATOM 0 HH11 ARG A 165 -3.884 14.304 -34.746 1.00 32.31 H new ATOM 0 HH12 ARG A 165 -5.456 14.288 -35.552 1.00 32.31 H new ATOM 0 HH21 ARG A 165 -4.096 14.132 -38.800 1.00 62.15 H new ATOM 0 HH22 ARG A 165 -5.575 14.191 -37.836 1.00 62.15 H new ATOM 2342 N LEU A 166 0.734 16.421 -33.108 1.00 12.03 N ATOM 2343 CA LEU A 166 0.143 17.663 -32.622 1.00 34.03 C ATOM 2344 C LEU A 166 1.120 18.825 -32.767 1.00 23.33 C ATOM 2345 O LEU A 166 0.732 19.936 -33.130 1.00 34.24 O ATOM 2346 CB LEU A 166 -0.276 17.513 -31.158 1.00 3.20 C ATOM 2347 CG LEU A 166 -1.693 16.993 -30.915 1.00 21.12 C ATOM 2348 CD1 LEU A 166 -2.718 17.924 -31.542 1.00 14.41 C ATOM 2349 CD2 LEU A 166 -1.845 15.582 -31.464 1.00 43.04 C ATOM 0 H LEU A 166 0.719 15.655 -32.434 1.00 12.03 H new ATOM 0 HA LEU A 166 -0.739 17.877 -33.226 1.00 34.03 H new ATOM 0 HB2 LEU A 166 0.426 16.839 -30.667 1.00 3.20 H new ATOM 0 HB3 LEU A 166 -0.178 18.484 -30.672 1.00 3.20 H new ATOM 0 HG LEU A 166 -1.869 16.964 -29.840 1.00 21.12 H new ATOM 0 HD11 LEU A 166 -3.721 17.538 -31.359 1.00 14.41 H new ATOM 0 HD12 LEU A 166 -2.626 18.917 -31.101 1.00 14.41 H new ATOM 0 HD13 LEU A 166 -2.544 17.986 -32.616 1.00 14.41 H new ATOM 0 HD21 LEU A 166 -2.860 15.228 -31.282 1.00 43.04 H new ATOM 0 HD22 LEU A 166 -1.649 15.586 -32.536 1.00 43.04 H new ATOM 0 HD23 LEU A 166 -1.135 14.920 -30.968 1.00 43.04 H new ATOM 2361 N LEU A 167 2.391 18.561 -32.483 1.00 71.40 N ATOM 2362 CA LEU A 167 3.426 19.584 -32.584 1.00 30.40 C ATOM 2363 C LEU A 167 3.444 20.205 -33.977 1.00 72.40 C ATOM 2364 O LEU A 167 3.402 21.427 -34.124 1.00 62.13 O ATOM 2365 CB LEU A 167 4.796 18.984 -32.263 1.00 2.22 C ATOM 2366 CG LEU A 167 5.875 19.974 -31.820 1.00 35.31 C ATOM 2367 CD1 LEU A 167 5.612 20.448 -30.399 1.00 43.30 C ATOM 2368 CD2 LEU A 167 7.255 19.342 -31.927 1.00 33.41 C ATOM 0 H LEU A 167 2.729 17.647 -32.181 1.00 71.40 H new ATOM 0 HA LEU A 167 3.200 20.367 -31.860 1.00 30.40 H new ATOM 0 HB2 LEU A 167 4.669 18.240 -31.477 1.00 2.22 H new ATOM 0 HB3 LEU A 167 5.156 18.457 -33.147 1.00 2.22 H new ATOM 0 HG LEU A 167 5.842 20.839 -32.482 1.00 35.31 H new ATOM 0 HD11 LEU A 167 6.389 21.151 -30.100 1.00 43.30 H new ATOM 0 HD12 LEU A 167 4.640 20.940 -30.353 1.00 43.30 H new ATOM 0 HD13 LEU A 167 5.618 19.593 -29.723 1.00 43.30 H new ATOM 0 HD21 LEU A 167 8.010 20.061 -31.608 1.00 33.41 H new ATOM 0 HD22 LEU A 167 7.301 18.459 -31.289 1.00 33.41 H new ATOM 0 HD23 LEU A 167 7.444 19.053 -32.961 1.00 33.41 H new ATOM 2380 N LEU A 168 3.504 19.355 -34.997 1.00 13.52 N ATOM 2381 CA LEU A 168 3.524 19.820 -36.379 1.00 44.44 C ATOM 2382 C LEU A 168 2.374 20.785 -36.647 1.00 14.12 C ATOM 2383 O LEU A 168 2.556 21.822 -37.284 1.00 60.43 O ATOM 2384 CB LEU A 168 3.442 18.632 -37.339 1.00 43.01 C ATOM 2385 CG LEU A 168 3.931 18.886 -38.765 1.00 43.14 C ATOM 2386 CD1 LEU A 168 5.433 18.667 -38.862 1.00 21.42 C ATOM 2387 CD2 LEU A 168 3.195 17.989 -39.749 1.00 61.34 C ATOM 0 H LEU A 168 3.540 18.341 -34.893 1.00 13.52 H new ATOM 0 HA LEU A 168 4.463 20.349 -36.544 1.00 44.44 H new ATOM 0 HB2 LEU A 168 4.022 17.810 -36.919 1.00 43.01 H new ATOM 0 HB3 LEU A 168 2.405 18.299 -37.386 1.00 43.01 H new ATOM 0 HG LEU A 168 3.719 19.924 -39.021 1.00 43.14 H new ATOM 0 HD11 LEU A 168 5.762 18.852 -39.884 1.00 21.42 H new ATOM 0 HD12 LEU A 168 5.945 19.352 -38.186 1.00 21.42 H new ATOM 0 HD13 LEU A 168 5.669 17.640 -38.585 1.00 21.42 H new ATOM 0 HD21 LEU A 168 3.556 18.184 -40.759 1.00 61.34 H new ATOM 0 HD22 LEU A 168 3.375 16.945 -39.494 1.00 61.34 H new ATOM 0 HD23 LEU A 168 2.126 18.195 -39.700 1.00 61.34 H new ATOM 2399 N GLU A 169 1.189 20.437 -36.153 1.00 64.12 N ATOM 2400 CA GLU A 169 0.009 21.274 -36.338 1.00 65.53 C ATOM 2401 C GLU A 169 0.222 22.656 -35.729 1.00 40.41 C ATOM 2402 O GLU A 169 -0.135 23.672 -36.327 1.00 50.40 O ATOM 2403 CB GLU A 169 -1.217 20.610 -35.709 1.00 13.10 C ATOM 2404 CG GLU A 169 -2.515 21.353 -35.976 1.00 55.04 C ATOM 2405 CD GLU A 169 -3.464 21.315 -34.794 1.00 22.12 C ATOM 2406 OE1 GLU A 169 -4.074 20.252 -34.556 1.00 54.12 O ATOM 2407 OE2 GLU A 169 -3.595 22.349 -34.106 1.00 24.04 O ATOM 0 H GLU A 169 1.021 19.582 -35.622 1.00 64.12 H new ATOM 0 HA GLU A 169 -0.159 21.390 -37.409 1.00 65.53 H new ATOM 0 HB2 GLU A 169 -1.305 19.593 -36.091 1.00 13.10 H new ATOM 0 HB3 GLU A 169 -1.066 20.534 -34.632 1.00 13.10 H new ATOM 0 HG2 GLU A 169 -2.291 22.391 -36.224 1.00 55.04 H new ATOM 0 HG3 GLU A 169 -3.006 20.917 -36.846 1.00 55.04 H new ATOM 2414 N LEU A 170 0.805 22.687 -34.536 1.00 2.31 N ATOM 2415 CA LEU A 170 1.066 23.945 -33.844 1.00 34.11 C ATOM 2416 C LEU A 170 1.809 24.921 -34.750 1.00 10.21 C ATOM 2417 O LEU A 170 1.462 26.099 -34.827 1.00 30.12 O ATOM 2418 CB LEU A 170 1.878 23.692 -32.573 1.00 32.43 C ATOM 2419 CG LEU A 170 1.269 24.216 -31.272 1.00 21.34 C ATOM 2420 CD1 LEU A 170 1.386 23.174 -30.170 1.00 4.12 C ATOM 2421 CD2 LEU A 170 1.942 25.515 -30.854 1.00 12.15 C ATOM 0 H LEU A 170 1.106 21.856 -34.027 1.00 2.31 H new ATOM 0 HA LEU A 170 0.107 24.388 -33.573 1.00 34.11 H new ATOM 0 HB2 LEU A 170 2.032 22.618 -32.472 1.00 32.43 H new ATOM 0 HB3 LEU A 170 2.862 24.144 -32.698 1.00 32.43 H new ATOM 0 HG LEU A 170 0.211 24.417 -31.443 1.00 21.34 H new ATOM 0 HD11 LEU A 170 0.947 23.565 -29.252 1.00 4.12 H new ATOM 0 HD12 LEU A 170 0.858 22.268 -30.468 1.00 4.12 H new ATOM 0 HD13 LEU A 170 2.437 22.941 -29.999 1.00 4.12 H new ATOM 0 HD21 LEU A 170 1.496 25.874 -29.926 1.00 12.15 H new ATOM 0 HD22 LEU A 170 3.007 25.340 -30.701 1.00 12.15 H new ATOM 0 HD23 LEU A 170 1.806 26.263 -31.635 1.00 12.15 H new