USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 963 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 117 MET CE :methyl -122:sc= -1.48 (180deg=-4.7!) USER MOD Set 1.2: A 121 LYS NZ :NH3+ 178:sc= -1.9! (180deg=-1.96!) USER MOD Set 2.1: A 35 MET CE :methyl -115:sc= -6.1! (180deg=-3.52!) USER MOD Set 2.2: A 86 ASN : amide:sc= -0.327 K(o=-6.4,f=-5.6) USER MOD Set 3.1: A 77 MET CE :methyl 166:sc= -0.347 (180deg=-0.752) USER MOD Set 3.2: A 111 MET CE :methyl -162:sc= -2.73! (180deg=-2.75) USER MOD Set 4.1: A 46 THR OG1 : rot -88:sc= 0.216 USER MOD Set 4.2: A 72 HIS : no HD1:sc= 0.0595 K(o=0.28,f=-10!) USER MOD Set 5.1: A 33 ASN : amide:sc= -1.03 K(o=-1.5,f=1) USER MOD Set 5.2: A 39 THR OG1 : rot 80:sc= -0.48 USER MOD Set 6.1: A 27 GLN : amide:sc= -0.678 K(o=-0.32,f=-5.1!) USER MOD Set 6.2: A 74 LYS NZ :NH3+ 155:sc= 0.361 (180deg=0) USER MOD Set 7.1: A 23 TYR OH : rot -146:sc= 1.3 USER MOD Set 7.2: A 25 SER OG : rot 174:sc= 1.21 USER MOD Set 7.3: A 62 CYS SG : rot -149:sc= 2.06 USER MOD Set 7.4: A 95 TYR OH : rot -155:sc= 0.902 USER MOD Single : A 18 HIS : no HD1:sc= -2.68 X(o=-2.7,f=-2.9!) USER MOD Single : A 19 ASN : amide:sc= -2.6! C(o=-2.6!,f=-2.9!) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -0.63 K(o=-0.63,f=-4.6!) USER MOD Single : A 60 TYR OH : rot -157:sc= 1.2 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -85:sc= 0.479 USER MOD Single : A 81 SER OG : rot 180:sc= 0.0403 USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -0.114 X(o=-0.11,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00422) USER MOD Single : A 115 THR OG1 : rot 60:sc= 0.201 USER MOD Single : A 116 TYR OH : rot 15:sc= -0.0047 USER MOD Single : A 120 ASN : amide:sc= 0.0785 K(o=0.079,f=-2.1) USER MOD Single : A 126 MET CE :methyl -154:sc= -2.59 (180deg=-4.3!) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 173:sc= 1.04 (180deg=0.943) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 MET CE :methyl 141:sc= -0.129 (180deg=-0.57) USER MOD Single : A 153 CYS SG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 93 N LEU A 17 -24.234 -11.659 -11.559 1.00 33.40 N ATOM 94 CA LEU A 17 -23.694 -10.911 -10.485 1.00 60.22 C ATOM 95 C LEU A 17 -22.719 -9.922 -11.013 1.00 5.33 C ATOM 96 O LEU A 17 -22.165 -10.079 -12.104 1.00 3.12 O ATOM 97 CB LEU A 17 -23.005 -11.794 -9.443 1.00 33.34 C ATOM 98 CG LEU A 17 -23.829 -12.887 -8.762 1.00 32.23 C ATOM 99 CD1 LEU A 17 -25.123 -12.351 -8.196 1.00 41.34 C ATOM 100 CD2 LEU A 17 -24.047 -14.078 -9.658 1.00 23.30 C ATOM 0 HA LEU A 17 -24.524 -10.407 -9.990 1.00 60.22 H new ATOM 0 HB2 LEU A 17 -22.151 -12.272 -9.924 1.00 33.34 H new ATOM 0 HB3 LEU A 17 -22.609 -11.142 -8.664 1.00 33.34 H new ATOM 0 HG LEU A 17 -23.241 -13.242 -7.916 1.00 32.23 H new ATOM 0 HD11 LEU A 17 -25.676 -13.162 -7.722 1.00 41.34 H new ATOM 0 HD12 LEU A 17 -24.905 -11.580 -7.457 1.00 41.34 H new ATOM 0 HD13 LEU A 17 -25.723 -11.924 -9.000 1.00 41.34 H new ATOM 0 HD21 LEU A 17 -24.637 -14.827 -9.130 1.00 23.30 H new ATOM 0 HD22 LEU A 17 -24.578 -13.765 -10.557 1.00 23.30 H new ATOM 0 HD23 LEU A 17 -23.084 -14.505 -9.936 1.00 23.30 H new ATOM 112 N HIS A 18 -22.547 -8.900 -10.280 1.00 34.14 N ATOM 113 CA HIS A 18 -21.737 -7.797 -10.682 1.00 12.20 C ATOM 114 C HIS A 18 -20.559 -7.704 -9.765 1.00 62.12 C ATOM 115 O HIS A 18 -20.563 -8.293 -8.670 1.00 51.44 O ATOM 116 CB HIS A 18 -22.545 -6.496 -10.587 1.00 4.41 C ATOM 117 CG HIS A 18 -23.851 -6.524 -11.330 1.00 15.32 C ATOM 118 ND1 HIS A 18 -24.055 -5.902 -12.532 1.00 13.12 N ATOM 119 CD2 HIS A 18 -25.034 -7.094 -11.003 1.00 23.20 C ATOM 120 CE1 HIS A 18 -25.298 -6.084 -12.908 1.00 11.10 C ATOM 121 NE2 HIS A 18 -25.911 -6.804 -11.998 1.00 53.13 N ATOM 0 H HIS A 18 -22.970 -8.790 -9.358 1.00 34.14 H new ATOM 0 HA HIS A 18 -21.407 -7.944 -11.710 1.00 12.20 H new ATOM 0 HB2 HIS A 18 -22.742 -6.280 -9.537 1.00 4.41 H new ATOM 0 HB3 HIS A 18 -21.939 -5.676 -10.972 1.00 4.41 H new ATOM 0 HD2 HIS A 18 -25.242 -7.672 -10.115 1.00 23.20 H new ATOM 0 HE1 HIS A 18 -25.743 -5.704 -13.816 1.00 11.10 H new ATOM 0 HE2 HIS A 18 -26.887 -7.098 -12.033 1.00 53.13 H new ATOM 130 N ASN A 19 -19.551 -7.028 -10.208 1.00 0.45 N ATOM 131 CA ASN A 19 -18.405 -6.774 -9.403 1.00 45.41 C ATOM 132 C ASN A 19 -18.028 -5.303 -9.447 1.00 11.24 C ATOM 133 O ASN A 19 -17.915 -4.696 -10.518 1.00 55.42 O ATOM 134 CB ASN A 19 -17.233 -7.744 -9.685 1.00 13.10 C ATOM 135 CG ASN A 19 -16.834 -7.883 -11.138 1.00 43.23 C ATOM 136 OD1 ASN A 19 -16.990 -6.978 -11.933 1.00 73.34 O ATOM 137 ND2 ASN A 19 -16.329 -9.041 -11.488 1.00 24.43 N ATOM 0 H ASN A 19 -19.500 -6.633 -11.147 1.00 0.45 H new ATOM 0 HA ASN A 19 -18.672 -6.991 -8.369 1.00 45.41 H new ATOM 0 HB2 ASN A 19 -16.364 -7.409 -9.119 1.00 13.10 H new ATOM 0 HB3 ASN A 19 -17.501 -8.730 -9.305 1.00 13.10 H new ATOM 0 HD21 ASN A 19 -16.052 -9.205 -12.456 1.00 24.43 H new ATOM 0 HD22 ASN A 19 -16.213 -9.778 -10.792 1.00 24.43 H new ATOM 144 N VAL A 20 -17.903 -4.729 -8.283 1.00 42.13 N ATOM 145 CA VAL A 20 -17.665 -3.306 -8.130 1.00 71.21 C ATOM 146 C VAL A 20 -16.366 -3.061 -7.374 1.00 51.12 C ATOM 147 O VAL A 20 -16.046 -3.793 -6.446 1.00 72.01 O ATOM 148 CB VAL A 20 -18.850 -2.642 -7.351 1.00 23.12 C ATOM 149 CG1 VAL A 20 -18.633 -1.150 -7.151 1.00 61.04 C ATOM 150 CG2 VAL A 20 -20.171 -2.884 -8.069 1.00 12.40 C ATOM 0 H VAL A 20 -17.963 -5.235 -7.399 1.00 42.13 H new ATOM 0 HA VAL A 20 -17.589 -2.863 -9.123 1.00 71.21 H new ATOM 0 HB VAL A 20 -18.888 -3.110 -6.367 1.00 23.12 H new ATOM 0 HG11 VAL A 20 -19.478 -0.729 -6.607 1.00 61.04 H new ATOM 0 HG12 VAL A 20 -17.718 -0.989 -6.581 1.00 61.04 H new ATOM 0 HG13 VAL A 20 -18.547 -0.661 -8.122 1.00 61.04 H new ATOM 0 HG21 VAL A 20 -20.980 -2.414 -7.510 1.00 12.40 H new ATOM 0 HG22 VAL A 20 -20.125 -2.456 -9.070 1.00 12.40 H new ATOM 0 HG23 VAL A 20 -20.355 -3.956 -8.141 1.00 12.40 H new ATOM 160 N PHE A 21 -15.636 -2.052 -7.778 1.00 10.41 N ATOM 161 CA PHE A 21 -14.413 -1.667 -7.112 1.00 40.45 C ATOM 162 C PHE A 21 -14.733 -0.576 -6.112 1.00 1.43 C ATOM 163 O PHE A 21 -15.324 0.448 -6.461 1.00 62.40 O ATOM 164 CB PHE A 21 -13.378 -1.179 -8.140 1.00 2.33 C ATOM 165 CG PHE A 21 -12.054 -0.739 -7.559 1.00 61.24 C ATOM 166 CD1 PHE A 21 -11.125 -1.673 -7.131 1.00 72.23 C ATOM 167 CD2 PHE A 21 -11.735 0.607 -7.459 1.00 61.51 C ATOM 168 CE1 PHE A 21 -9.912 -1.275 -6.617 1.00 34.04 C ATOM 169 CE2 PHE A 21 -10.519 1.009 -6.943 1.00 62.41 C ATOM 170 CZ PHE A 21 -9.609 0.067 -6.523 1.00 73.53 C ATOM 0 H PHE A 21 -15.873 -1.470 -8.582 1.00 10.41 H new ATOM 0 HA PHE A 21 -13.985 -2.524 -6.591 1.00 40.45 H new ATOM 0 HB2 PHE A 21 -13.194 -1.980 -8.856 1.00 2.33 H new ATOM 0 HB3 PHE A 21 -13.807 -0.346 -8.697 1.00 2.33 H new ATOM 0 HD1 PHE A 21 -11.355 -2.726 -7.201 1.00 72.23 H new ATOM 0 HD2 PHE A 21 -12.446 1.350 -7.789 1.00 61.51 H new ATOM 0 HE1 PHE A 21 -9.197 -2.014 -6.287 1.00 34.04 H new ATOM 0 HE2 PHE A 21 -10.283 2.060 -6.869 1.00 62.41 H new ATOM 0 HZ PHE A 21 -8.657 0.378 -6.119 1.00 73.53 H new ATOM 180 N VAL A 22 -14.380 -0.801 -4.886 1.00 10.51 N ATOM 181 CA VAL A 22 -14.649 0.143 -3.843 1.00 2.31 C ATOM 182 C VAL A 22 -13.379 0.820 -3.358 1.00 24.14 C ATOM 183 O VAL A 22 -12.396 0.160 -2.990 1.00 75.21 O ATOM 184 CB VAL A 22 -15.453 -0.477 -2.674 1.00 72.12 C ATOM 185 CG1 VAL A 22 -16.854 -0.831 -3.142 1.00 22.41 C ATOM 186 CG2 VAL A 22 -14.763 -1.727 -2.144 1.00 54.04 C ATOM 0 H VAL A 22 -13.897 -1.645 -4.577 1.00 10.51 H new ATOM 0 HA VAL A 22 -15.284 0.915 -4.278 1.00 2.31 H new ATOM 0 HB VAL A 22 -15.509 0.257 -1.870 1.00 72.12 H new ATOM 0 HG11 VAL A 22 -17.415 -1.267 -2.315 1.00 22.41 H new ATOM 0 HG12 VAL A 22 -17.360 0.070 -3.489 1.00 22.41 H new ATOM 0 HG13 VAL A 22 -16.794 -1.551 -3.959 1.00 22.41 H new ATOM 0 HG21 VAL A 22 -15.347 -2.145 -1.323 1.00 54.04 H new ATOM 0 HG22 VAL A 22 -14.681 -2.464 -2.943 1.00 54.04 H new ATOM 0 HG23 VAL A 22 -13.767 -1.468 -1.786 1.00 54.04 H new ATOM 196 N TYR A 23 -13.409 2.137 -3.371 1.00 10.33 N ATOM 197 CA TYR A 23 -12.266 2.960 -2.999 1.00 41.21 C ATOM 198 C TYR A 23 -11.890 2.859 -1.532 1.00 63.13 C ATOM 199 O TYR A 23 -10.720 2.937 -1.183 1.00 74.25 O ATOM 200 CB TYR A 23 -12.492 4.423 -3.400 1.00 10.11 C ATOM 201 CG TYR A 23 -13.752 5.087 -2.845 1.00 42.45 C ATOM 202 CD1 TYR A 23 -13.766 5.666 -1.582 1.00 51.04 C ATOM 203 CD2 TYR A 23 -14.919 5.146 -3.602 1.00 52.21 C ATOM 204 CE1 TYR A 23 -14.897 6.276 -1.086 1.00 34.52 C ATOM 205 CE2 TYR A 23 -16.056 5.758 -3.113 1.00 10.02 C ATOM 206 CZ TYR A 23 -16.038 6.322 -1.854 1.00 65.03 C ATOM 207 OH TYR A 23 -17.172 6.932 -1.356 1.00 25.22 O ATOM 0 H TYR A 23 -14.232 2.675 -3.642 1.00 10.33 H new ATOM 0 HA TYR A 23 -11.418 2.561 -3.556 1.00 41.21 H new ATOM 0 HB2 TYR A 23 -11.628 5.004 -3.078 1.00 10.11 H new ATOM 0 HB3 TYR A 23 -12.526 4.479 -4.488 1.00 10.11 H new ATOM 0 HD1 TYR A 23 -12.872 5.637 -0.977 1.00 51.04 H new ATOM 0 HD2 TYR A 23 -14.935 4.706 -4.588 1.00 52.21 H new ATOM 0 HE1 TYR A 23 -14.888 6.716 -0.100 1.00 34.52 H new ATOM 0 HE2 TYR A 23 -16.954 5.795 -3.712 1.00 10.02 H new ATOM 0 HH TYR A 23 -17.967 6.461 -1.682 1.00 25.22 H new ATOM 217 N GLY A 24 -12.869 2.691 -0.676 1.00 52.24 N ATOM 218 CA GLY A 24 -12.561 2.640 0.721 1.00 41.12 C ATOM 219 C GLY A 24 -13.771 2.698 1.596 1.00 33.21 C ATOM 220 O GLY A 24 -13.758 2.159 2.690 1.00 34.35 O ATOM 0 H GLY A 24 -13.855 2.591 -0.917 1.00 52.24 H new ATOM 0 HA2 GLY A 24 -12.013 1.722 0.932 1.00 41.12 H new ATOM 0 HA3 GLY A 24 -11.900 3.470 0.971 1.00 41.12 H new ATOM 224 N SER A 25 -14.823 3.338 1.120 1.00 10.04 N ATOM 225 CA SER A 25 -16.053 3.467 1.890 1.00 12.41 C ATOM 226 C SER A 25 -16.680 2.098 2.162 1.00 64.40 C ATOM 227 O SER A 25 -17.198 1.840 3.247 1.00 31.42 O ATOM 228 CB SER A 25 -17.028 4.351 1.110 1.00 13.21 C ATOM 229 OG SER A 25 -17.162 3.869 -0.234 1.00 12.51 O ATOM 0 H SER A 25 -14.853 3.779 0.201 1.00 10.04 H new ATOM 0 HA SER A 25 -15.826 3.921 2.854 1.00 12.41 H new ATOM 0 HB2 SER A 25 -18.001 4.355 1.602 1.00 13.21 H new ATOM 0 HB3 SER A 25 -16.671 5.381 1.102 1.00 13.21 H new ATOM 0 HG SER A 25 -17.854 4.385 -0.699 1.00 12.51 H new ATOM 235 N PHE A 26 -16.577 1.224 1.192 1.00 60.00 N ATOM 236 CA PHE A 26 -17.175 -0.081 1.277 1.00 65.12 C ATOM 237 C PHE A 26 -16.163 -1.192 1.059 1.00 73.12 C ATOM 238 O PHE A 26 -16.517 -2.281 0.651 1.00 62.43 O ATOM 239 CB PHE A 26 -18.338 -0.176 0.285 1.00 25.14 C ATOM 240 CG PHE A 26 -19.490 0.712 0.645 1.00 40.34 C ATOM 241 CD1 PHE A 26 -20.213 0.476 1.799 1.00 33.04 C ATOM 242 CD2 PHE A 26 -19.850 1.776 -0.157 1.00 4.43 C ATOM 243 CE1 PHE A 26 -21.266 1.278 2.148 1.00 62.35 C ATOM 244 CE2 PHE A 26 -20.912 2.584 0.192 1.00 64.22 C ATOM 245 CZ PHE A 26 -21.618 2.333 1.344 1.00 22.53 C ATOM 0 H PHE A 26 -16.075 1.399 0.321 1.00 60.00 H new ATOM 0 HA PHE A 26 -17.559 -0.216 2.288 1.00 65.12 H new ATOM 0 HB2 PHE A 26 -17.981 0.087 -0.711 1.00 25.14 H new ATOM 0 HB3 PHE A 26 -18.684 -1.209 0.237 1.00 25.14 H new ATOM 0 HD1 PHE A 26 -19.943 -0.354 2.435 1.00 33.04 H new ATOM 0 HD2 PHE A 26 -19.297 1.977 -1.063 1.00 4.43 H new ATOM 0 HE1 PHE A 26 -21.819 1.081 3.055 1.00 62.35 H new ATOM 0 HE2 PHE A 26 -21.189 3.414 -0.440 1.00 64.22 H new ATOM 0 HZ PHE A 26 -22.450 2.966 1.617 1.00 22.53 H new ATOM 255 N GLN A 27 -14.904 -0.935 1.407 1.00 72.44 N ATOM 256 CA GLN A 27 -13.857 -1.972 1.269 1.00 32.51 C ATOM 257 C GLN A 27 -13.834 -2.822 2.538 1.00 63.23 C ATOM 258 O GLN A 27 -12.947 -3.655 2.747 1.00 43.42 O ATOM 259 CB GLN A 27 -12.466 -1.348 1.049 1.00 45.32 C ATOM 260 CG GLN A 27 -11.925 -0.569 2.244 1.00 52.33 C ATOM 261 CD GLN A 27 -10.526 -0.029 2.012 1.00 1.32 C ATOM 262 OE1 GLN A 27 -9.735 -0.612 1.271 1.00 72.14 O ATOM 263 NE2 GLN A 27 -10.205 1.061 2.659 1.00 14.33 N ATOM 0 H GLN A 27 -14.578 -0.043 1.779 1.00 72.44 H new ATOM 0 HA GLN A 27 -14.092 -2.584 0.398 1.00 32.51 H new ATOM 0 HB2 GLN A 27 -11.761 -2.141 0.800 1.00 45.32 H new ATOM 0 HB3 GLN A 27 -12.513 -0.681 0.188 1.00 45.32 H new ATOM 0 HG2 GLN A 27 -12.597 0.260 2.465 1.00 52.33 H new ATOM 0 HG3 GLN A 27 -11.918 -1.217 3.121 1.00 52.33 H new ATOM 0 HE21 GLN A 27 -10.889 1.515 3.264 1.00 14.33 H new ATOM 0 HE22 GLN A 27 -9.270 1.457 2.559 1.00 14.33 H new ATOM 272 N ASP A 28 -14.816 -2.598 3.354 1.00 22.40 N ATOM 273 CA ASP A 28 -14.953 -3.221 4.636 1.00 74.44 C ATOM 274 C ASP A 28 -16.222 -4.063 4.655 1.00 23.04 C ATOM 275 O ASP A 28 -17.279 -3.572 4.302 1.00 4.24 O ATOM 276 CB ASP A 28 -15.033 -2.122 5.691 1.00 31.40 C ATOM 277 CG ASP A 28 -15.287 -2.646 7.067 1.00 62.43 C ATOM 278 OD1 ASP A 28 -14.313 -2.954 7.783 1.00 33.35 O ATOM 279 OD2 ASP A 28 -16.449 -2.745 7.453 1.00 23.31 O ATOM 0 H ASP A 28 -15.574 -1.951 3.138 1.00 22.40 H new ATOM 0 HA ASP A 28 -14.102 -3.870 4.842 1.00 74.44 H new ATOM 0 HB2 ASP A 28 -14.100 -1.558 5.690 1.00 31.40 H new ATOM 0 HB3 ASP A 28 -15.827 -1.426 5.422 1.00 31.40 H new ATOM 284 N PRO A 29 -16.147 -5.338 5.071 1.00 53.24 N ATOM 285 CA PRO A 29 -17.310 -6.223 5.063 1.00 20.42 C ATOM 286 C PRO A 29 -18.336 -5.852 6.132 1.00 12.15 C ATOM 287 O PRO A 29 -19.536 -6.060 5.950 1.00 4.32 O ATOM 288 CB PRO A 29 -16.735 -7.612 5.355 1.00 54.35 C ATOM 289 CG PRO A 29 -15.248 -7.460 5.372 1.00 5.54 C ATOM 290 CD PRO A 29 -14.950 -6.008 5.578 1.00 55.21 C ATOM 0 HA PRO A 29 -17.840 -6.161 4.113 1.00 20.42 H new ATOM 0 HB2 PRO A 29 -17.098 -7.989 6.311 1.00 54.35 H new ATOM 0 HB3 PRO A 29 -17.043 -8.328 4.593 1.00 54.35 H new ATOM 0 HG2 PRO A 29 -14.810 -8.059 6.170 1.00 5.54 H new ATOM 0 HG3 PRO A 29 -14.815 -7.812 4.435 1.00 5.54 H new ATOM 0 HD2 PRO A 29 -14.777 -5.779 6.630 1.00 55.21 H new ATOM 0 HD3 PRO A 29 -14.057 -5.700 5.034 1.00 55.21 H new ATOM 298 N ASP A 30 -17.863 -5.269 7.224 1.00 41.25 N ATOM 299 CA ASP A 30 -18.735 -4.896 8.348 1.00 34.14 C ATOM 300 C ASP A 30 -19.761 -3.871 7.914 1.00 2.33 C ATOM 301 O ASP A 30 -20.961 -4.004 8.218 1.00 75.41 O ATOM 302 CB ASP A 30 -17.928 -4.361 9.540 1.00 44.24 C ATOM 303 CG ASP A 30 -18.811 -3.943 10.698 1.00 33.53 C ATOM 304 OD1 ASP A 30 -19.218 -4.823 11.494 1.00 75.43 O ATOM 305 OD2 ASP A 30 -19.132 -2.742 10.817 1.00 52.14 O ATOM 0 H ASP A 30 -16.879 -5.040 7.364 1.00 41.25 H new ATOM 0 HA ASP A 30 -19.251 -5.800 8.670 1.00 34.14 H new ATOM 0 HB2 ASP A 30 -17.232 -5.129 9.877 1.00 44.24 H new ATOM 0 HB3 ASP A 30 -17.331 -3.509 9.217 1.00 44.24 H new ATOM 310 N VAL A 31 -19.308 -2.877 7.170 1.00 40.54 N ATOM 311 CA VAL A 31 -20.196 -1.845 6.672 1.00 21.21 C ATOM 312 C VAL A 31 -21.107 -2.421 5.581 1.00 72.50 C ATOM 313 O VAL A 31 -22.246 -1.989 5.414 1.00 72.24 O ATOM 314 CB VAL A 31 -19.440 -0.567 6.170 1.00 22.21 C ATOM 315 CG1 VAL A 31 -18.551 -0.855 4.982 1.00 61.23 C ATOM 316 CG2 VAL A 31 -20.408 0.572 5.867 1.00 15.51 C ATOM 0 H VAL A 31 -18.331 -2.764 6.898 1.00 40.54 H new ATOM 0 HA VAL A 31 -20.807 -1.513 7.511 1.00 21.21 H new ATOM 0 HB VAL A 31 -18.791 -0.249 6.986 1.00 22.21 H new ATOM 0 HG11 VAL A 31 -18.050 0.062 4.672 1.00 61.23 H new ATOM 0 HG12 VAL A 31 -17.806 -1.601 5.258 1.00 61.23 H new ATOM 0 HG13 VAL A 31 -19.156 -1.234 4.158 1.00 61.23 H new ATOM 0 HG21 VAL A 31 -19.850 1.442 5.521 1.00 15.51 H new ATOM 0 HG22 VAL A 31 -21.107 0.259 5.092 1.00 15.51 H new ATOM 0 HG23 VAL A 31 -20.960 0.831 6.771 1.00 15.51 H new ATOM 326 N ILE A 32 -20.612 -3.427 4.867 1.00 72.02 N ATOM 327 CA ILE A 32 -21.388 -4.063 3.837 1.00 40.52 C ATOM 328 C ILE A 32 -22.591 -4.787 4.447 1.00 21.34 C ATOM 329 O ILE A 32 -23.709 -4.695 3.925 1.00 34.22 O ATOM 330 CB ILE A 32 -20.534 -5.038 3.006 1.00 42.31 C ATOM 331 CG1 ILE A 32 -19.428 -4.303 2.271 1.00 20.13 C ATOM 332 CG2 ILE A 32 -21.384 -5.770 2.012 1.00 53.03 C ATOM 333 CD1 ILE A 32 -19.938 -3.275 1.291 1.00 13.51 C ATOM 0 H ILE A 32 -19.675 -3.811 4.991 1.00 72.02 H new ATOM 0 HA ILE A 32 -21.749 -3.286 3.164 1.00 40.52 H new ATOM 0 HB ILE A 32 -20.087 -5.753 3.697 1.00 42.31 H new ATOM 0 HG12 ILE A 32 -18.783 -3.811 2.999 1.00 20.13 H new ATOM 0 HG13 ILE A 32 -18.812 -5.028 1.738 1.00 20.13 H new ATOM 0 HG21 ILE A 32 -20.762 -6.454 1.435 1.00 53.03 H new ATOM 0 HG22 ILE A 32 -22.153 -6.335 2.538 1.00 53.03 H new ATOM 0 HG23 ILE A 32 -21.856 -5.054 1.339 1.00 53.03 H new ATOM 0 HD11 ILE A 32 -19.094 -2.788 0.802 1.00 13.51 H new ATOM 0 HD12 ILE A 32 -20.559 -3.764 0.541 1.00 13.51 H new ATOM 0 HD13 ILE A 32 -20.529 -2.529 1.821 1.00 13.51 H new ATOM 345 N ASN A 33 -22.366 -5.461 5.578 1.00 25.02 N ATOM 346 CA ASN A 33 -23.444 -6.166 6.286 1.00 34.51 C ATOM 347 C ASN A 33 -24.597 -5.231 6.566 1.00 3.54 C ATOM 348 O ASN A 33 -25.753 -5.562 6.340 1.00 11.02 O ATOM 349 CB ASN A 33 -22.980 -6.717 7.657 1.00 13.31 C ATOM 350 CG ASN A 33 -22.095 -7.961 7.655 1.00 14.10 C ATOM 351 OD1 ASN A 33 -22.154 -8.755 8.592 1.00 21.12 O ATOM 352 ND2 ASN A 33 -21.295 -8.152 6.664 1.00 35.32 N ATOM 0 H ASN A 33 -21.452 -5.535 6.024 1.00 25.02 H new ATOM 0 HA ASN A 33 -23.742 -6.988 5.635 1.00 34.51 H new ATOM 0 HB2 ASN A 33 -22.442 -5.922 8.174 1.00 13.31 H new ATOM 0 HB3 ASN A 33 -23.868 -6.937 8.249 1.00 13.31 H new ATOM 0 HD21 ASN A 33 -20.693 -8.976 6.646 1.00 35.32 H new ATOM 0 HD22 ASN A 33 -21.263 -7.480 5.898 1.00 35.32 H new ATOM 359 N VAL A 34 -24.272 -4.066 7.052 1.00 51.10 N ATOM 360 CA VAL A 34 -25.273 -3.130 7.487 1.00 31.43 C ATOM 361 C VAL A 34 -25.884 -2.290 6.362 1.00 4.25 C ATOM 362 O VAL A 34 -27.079 -1.989 6.396 1.00 51.31 O ATOM 363 CB VAL A 34 -24.767 -2.243 8.645 1.00 31.33 C ATOM 364 CG1 VAL A 34 -23.613 -1.363 8.228 1.00 55.24 C ATOM 365 CG2 VAL A 34 -25.881 -1.440 9.268 1.00 31.33 C ATOM 0 H VAL A 34 -23.312 -3.739 7.158 1.00 51.10 H new ATOM 0 HA VAL A 34 -26.090 -3.747 7.862 1.00 31.43 H new ATOM 0 HB VAL A 34 -24.389 -2.919 9.412 1.00 31.33 H new ATOM 0 HG11 VAL A 34 -23.292 -0.758 9.076 1.00 55.24 H new ATOM 0 HG12 VAL A 34 -22.784 -1.985 7.892 1.00 55.24 H new ATOM 0 HG13 VAL A 34 -23.929 -0.709 7.415 1.00 55.24 H new ATOM 0 HG21 VAL A 34 -25.481 -0.830 10.078 1.00 31.33 H new ATOM 0 HG22 VAL A 34 -26.329 -0.793 8.514 1.00 31.33 H new ATOM 0 HG23 VAL A 34 -26.640 -2.116 9.663 1.00 31.33 H new ATOM 375 N MET A 35 -25.081 -1.920 5.380 1.00 31.25 N ATOM 376 CA MET A 35 -25.541 -1.023 4.332 1.00 64.23 C ATOM 377 C MET A 35 -26.594 -1.706 3.460 1.00 74.33 C ATOM 378 O MET A 35 -27.577 -1.078 3.044 1.00 30.32 O ATOM 379 CB MET A 35 -24.340 -0.517 3.511 1.00 63.12 C ATOM 380 CG MET A 35 -24.616 0.689 2.612 1.00 0.14 C ATOM 381 SD MET A 35 -25.690 0.376 1.202 1.00 30.25 S ATOM 382 CE MET A 35 -24.645 -0.682 0.232 1.00 4.52 C ATOM 0 H MET A 35 -24.112 -2.224 5.285 1.00 31.25 H new ATOM 0 HA MET A 35 -26.021 -0.155 4.784 1.00 64.23 H new ATOM 0 HB2 MET A 35 -23.535 -0.258 4.199 1.00 63.12 H new ATOM 0 HB3 MET A 35 -23.977 -1.335 2.889 1.00 63.12 H new ATOM 0 HG2 MET A 35 -25.062 1.477 3.218 1.00 0.14 H new ATOM 0 HG3 MET A 35 -23.664 1.071 2.243 1.00 0.14 H new ATOM 0 HE1 MET A 35 -24.389 -0.183 -0.703 1.00 4.52 H new ATOM 0 HE2 MET A 35 -23.733 -0.902 0.788 1.00 4.52 H new ATOM 0 HE3 MET A 35 -25.170 -1.612 0.015 1.00 4.52 H new ATOM 392 N LEU A 36 -26.429 -2.987 3.219 1.00 11.22 N ATOM 393 CA LEU A 36 -27.435 -3.709 2.493 1.00 51.23 C ATOM 394 C LEU A 36 -28.020 -4.835 3.323 1.00 1.04 C ATOM 395 O LEU A 36 -29.149 -4.713 3.812 1.00 12.13 O ATOM 396 CB LEU A 36 -27.007 -4.165 1.054 1.00 30.33 C ATOM 397 CG LEU A 36 -25.706 -4.982 0.883 1.00 33.24 C ATOM 398 CD1 LEU A 36 -25.662 -5.581 -0.503 1.00 15.21 C ATOM 399 CD2 LEU A 36 -24.501 -4.090 1.021 1.00 33.31 C ATOM 0 H LEU A 36 -25.621 -3.538 3.511 1.00 11.22 H new ATOM 0 HA LEU A 36 -28.233 -2.989 2.308 1.00 51.23 H new ATOM 0 HB2 LEU A 36 -27.824 -4.756 0.640 1.00 30.33 H new ATOM 0 HB3 LEU A 36 -26.917 -3.270 0.438 1.00 30.33 H new ATOM 0 HG LEU A 36 -25.693 -5.758 1.649 1.00 33.24 H new ATOM 0 HD11 LEU A 36 -24.744 -6.157 -0.622 1.00 15.21 H new ATOM 0 HD12 LEU A 36 -26.522 -6.236 -0.644 1.00 15.21 H new ATOM 0 HD13 LEU A 36 -25.688 -4.783 -1.245 1.00 15.21 H new ATOM 0 HD21 LEU A 36 -23.594 -4.682 0.898 1.00 33.31 H new ATOM 0 HD22 LEU A 36 -24.534 -3.313 0.257 1.00 33.31 H new ATOM 0 HD23 LEU A 36 -24.501 -3.628 2.008 1.00 33.31 H new ATOM 411 N ASP A 37 -27.230 -5.894 3.538 1.00 11.10 N ATOM 412 CA ASP A 37 -27.670 -7.105 4.271 1.00 24.44 C ATOM 413 C ASP A 37 -26.651 -8.211 4.078 1.00 12.31 C ATOM 414 O ASP A 37 -26.228 -8.865 5.030 1.00 61.14 O ATOM 415 CB ASP A 37 -29.039 -7.601 3.769 1.00 72.53 C ATOM 416 CG ASP A 37 -29.521 -8.836 4.476 1.00 22.34 C ATOM 417 OD1 ASP A 37 -30.036 -8.719 5.618 1.00 33.50 O ATOM 418 OD2 ASP A 37 -29.442 -9.927 3.887 1.00 21.21 O ATOM 0 H ASP A 37 -26.265 -5.943 3.211 1.00 11.10 H new ATOM 0 HA ASP A 37 -27.759 -6.844 5.326 1.00 24.44 H new ATOM 0 HB2 ASP A 37 -29.775 -6.807 3.898 1.00 72.53 H new ATOM 0 HB3 ASP A 37 -28.974 -7.805 2.700 1.00 72.53 H new ATOM 423 N ARG A 38 -26.250 -8.396 2.843 1.00 45.13 N ATOM 424 CA ARG A 38 -25.305 -9.442 2.478 1.00 62.24 C ATOM 425 C ARG A 38 -24.000 -8.839 2.047 1.00 14.24 C ATOM 426 O ARG A 38 -23.943 -7.664 1.702 1.00 23.00 O ATOM 427 CB ARG A 38 -25.875 -10.318 1.361 1.00 12.33 C ATOM 428 CG ARG A 38 -27.100 -11.118 1.763 1.00 11.21 C ATOM 429 CD ARG A 38 -26.763 -12.191 2.784 1.00 4.00 C ATOM 430 NE ARG A 38 -25.845 -13.202 2.229 1.00 62.54 N ATOM 431 CZ ARG A 38 -25.223 -14.149 2.942 1.00 43.23 C ATOM 432 NH1 ARG A 38 -25.340 -14.177 4.269 1.00 1.00 N ATOM 433 NH2 ARG A 38 -24.473 -15.054 2.320 1.00 25.11 N ATOM 0 H ARG A 38 -26.566 -7.828 2.057 1.00 45.13 H new ATOM 0 HA ARG A 38 -25.131 -10.067 3.354 1.00 62.24 H new ATOM 0 HB2 ARG A 38 -26.131 -9.684 0.512 1.00 12.33 H new ATOM 0 HB3 ARG A 38 -25.100 -11.006 1.023 1.00 12.33 H new ATOM 0 HG2 ARG A 38 -27.853 -10.447 2.176 1.00 11.21 H new ATOM 0 HG3 ARG A 38 -27.537 -11.582 0.879 1.00 11.21 H new ATOM 0 HD2 ARG A 38 -26.309 -11.729 3.661 1.00 4.00 H new ATOM 0 HD3 ARG A 38 -27.680 -12.676 3.118 1.00 4.00 H new ATOM 0 HE ARG A 38 -25.670 -13.178 1.224 1.00 62.54 H new ATOM 0 HH11 ARG A 38 -25.905 -13.475 4.746 1.00 1.00 H new ATOM 0 HH12 ARG A 38 -24.864 -14.901 4.808 1.00 1.00 H new ATOM 0 HH21 ARG A 38 -24.374 -15.024 1.305 1.00 25.11 H new ATOM 0 HH22 ARG A 38 -23.997 -15.778 2.858 1.00 25.11 H new ATOM 447 N THR A 39 -22.958 -9.629 2.076 1.00 11.42 N ATOM 448 CA THR A 39 -21.655 -9.171 1.710 1.00 33.24 C ATOM 449 C THR A 39 -21.104 -9.959 0.523 1.00 50.10 C ATOM 450 O THR A 39 -20.847 -11.170 0.625 1.00 34.42 O ATOM 451 CB THR A 39 -20.704 -9.276 2.916 1.00 10.14 C ATOM 452 OG1 THR A 39 -21.307 -8.572 3.994 1.00 20.30 O ATOM 453 CG2 THR A 39 -19.343 -8.640 2.621 1.00 55.01 C ATOM 0 H THR A 39 -22.996 -10.609 2.356 1.00 11.42 H new ATOM 0 HA THR A 39 -21.732 -8.127 1.407 1.00 33.24 H new ATOM 0 HB THR A 39 -20.540 -10.328 3.150 1.00 10.14 H new ATOM 0 HG1 THR A 39 -21.991 -9.136 4.411 1.00 20.30 H new ATOM 0 HG21 THR A 39 -18.700 -8.734 3.496 1.00 55.01 H new ATOM 0 HG22 THR A 39 -18.880 -9.147 1.774 1.00 55.01 H new ATOM 0 HG23 THR A 39 -19.478 -7.585 2.382 1.00 55.01 H new ATOM 461 N PRO A 40 -20.980 -9.302 -0.638 1.00 34.52 N ATOM 462 CA PRO A 40 -20.356 -9.887 -1.820 1.00 64.54 C ATOM 463 C PRO A 40 -18.906 -10.251 -1.529 1.00 32.13 C ATOM 464 O PRO A 40 -18.275 -9.634 -0.666 1.00 44.04 O ATOM 465 CB PRO A 40 -20.413 -8.756 -2.851 1.00 64.43 C ATOM 466 CG PRO A 40 -21.508 -7.881 -2.387 1.00 70.55 C ATOM 467 CD PRO A 40 -21.455 -7.929 -0.898 1.00 20.23 C ATOM 0 HA PRO A 40 -20.850 -10.800 -2.153 1.00 64.54 H new ATOM 0 HB2 PRO A 40 -19.468 -8.216 -2.899 1.00 64.43 H new ATOM 0 HB3 PRO A 40 -20.611 -9.141 -3.851 1.00 64.43 H new ATOM 0 HG2 PRO A 40 -21.377 -6.862 -2.751 1.00 70.55 H new ATOM 0 HG3 PRO A 40 -22.472 -8.230 -2.756 1.00 70.55 H new ATOM 0 HD2 PRO A 40 -20.774 -7.181 -0.492 1.00 20.23 H new ATOM 0 HD3 PRO A 40 -22.432 -7.747 -0.451 1.00 20.23 H new ATOM 475 N GLU A 41 -18.404 -11.247 -2.212 1.00 52.13 N ATOM 476 CA GLU A 41 -17.045 -11.695 -2.024 1.00 34.52 C ATOM 477 C GLU A 41 -16.082 -10.585 -2.391 1.00 12.45 C ATOM 478 O GLU A 41 -16.104 -10.065 -3.512 1.00 51.43 O ATOM 479 CB GLU A 41 -16.781 -12.963 -2.832 1.00 11.34 C ATOM 480 CG GLU A 41 -15.377 -13.524 -2.682 1.00 32.42 C ATOM 481 CD GLU A 41 -15.257 -14.877 -3.301 1.00 65.44 C ATOM 482 OE1 GLU A 41 -15.736 -15.842 -2.684 1.00 4.43 O ATOM 483 OE2 GLU A 41 -14.701 -15.004 -4.417 1.00 2.44 O ATOM 0 H GLU A 41 -18.925 -11.772 -2.915 1.00 52.13 H new ATOM 0 HA GLU A 41 -16.890 -11.943 -0.974 1.00 34.52 H new ATOM 0 HB2 GLU A 41 -17.498 -13.727 -2.531 1.00 11.34 H new ATOM 0 HB3 GLU A 41 -16.964 -12.752 -3.886 1.00 11.34 H new ATOM 0 HG2 GLU A 41 -14.662 -12.846 -3.147 1.00 32.42 H new ATOM 0 HG3 GLU A 41 -15.119 -13.583 -1.625 1.00 32.42 H new ATOM 490 N ILE A 42 -15.276 -10.210 -1.442 1.00 23.02 N ATOM 491 CA ILE A 42 -14.379 -9.101 -1.608 1.00 33.34 C ATOM 492 C ILE A 42 -12.997 -9.619 -1.952 1.00 5.41 C ATOM 493 O ILE A 42 -12.476 -10.520 -1.282 1.00 2.45 O ATOM 494 CB ILE A 42 -14.281 -8.282 -0.302 1.00 23.51 C ATOM 495 CG1 ILE A 42 -15.674 -7.996 0.253 1.00 13.34 C ATOM 496 CG2 ILE A 42 -13.567 -6.977 -0.584 1.00 71.20 C ATOM 497 CD1 ILE A 42 -15.684 -7.263 1.588 1.00 14.53 C ATOM 0 H ILE A 42 -15.221 -10.663 -0.530 1.00 23.02 H new ATOM 0 HA ILE A 42 -14.761 -8.465 -2.407 1.00 33.34 H new ATOM 0 HB ILE A 42 -13.723 -8.856 0.437 1.00 23.51 H new ATOM 0 HG12 ILE A 42 -16.227 -7.404 -0.476 1.00 13.34 H new ATOM 0 HG13 ILE A 42 -16.207 -8.940 0.367 1.00 13.34 H new ATOM 0 HG21 ILE A 42 -13.495 -6.395 0.335 1.00 71.20 H new ATOM 0 HG22 ILE A 42 -12.566 -7.184 -0.961 1.00 71.20 H new ATOM 0 HG23 ILE A 42 -14.125 -6.410 -1.329 1.00 71.20 H new ATOM 0 HD11 ILE A 42 -16.714 -7.102 1.907 1.00 14.53 H new ATOM 0 HD12 ILE A 42 -15.162 -7.861 2.335 1.00 14.53 H new ATOM 0 HD13 ILE A 42 -15.183 -6.301 1.479 1.00 14.53 H new ATOM 509 N VAL A 43 -12.420 -9.060 -2.968 1.00 62.52 N ATOM 510 CA VAL A 43 -11.098 -9.449 -3.416 1.00 52.35 C ATOM 511 C VAL A 43 -10.211 -8.211 -3.599 1.00 60.40 C ATOM 512 O VAL A 43 -10.708 -7.134 -3.921 1.00 54.44 O ATOM 513 CB VAL A 43 -11.143 -10.263 -4.739 1.00 32.33 C ATOM 514 CG1 VAL A 43 -11.630 -9.411 -5.906 1.00 23.42 C ATOM 515 CG2 VAL A 43 -9.794 -10.886 -5.035 1.00 74.15 C ATOM 0 H VAL A 43 -12.845 -8.316 -3.521 1.00 62.52 H new ATOM 0 HA VAL A 43 -10.675 -10.092 -2.645 1.00 52.35 H new ATOM 0 HB VAL A 43 -11.864 -11.070 -4.608 1.00 32.33 H new ATOM 0 HG11 VAL A 43 -11.648 -10.014 -6.814 1.00 23.42 H new ATOM 0 HG12 VAL A 43 -12.634 -9.044 -5.694 1.00 23.42 H new ATOM 0 HG13 VAL A 43 -10.956 -8.566 -6.045 1.00 23.42 H new ATOM 0 HG21 VAL A 43 -9.850 -11.451 -5.966 1.00 74.15 H new ATOM 0 HG22 VAL A 43 -9.044 -10.101 -5.132 1.00 74.15 H new ATOM 0 HG23 VAL A 43 -9.516 -11.555 -4.221 1.00 74.15 H new ATOM 525 N SER A 44 -8.931 -8.355 -3.366 1.00 24.21 N ATOM 526 CA SER A 44 -8.000 -7.265 -3.528 1.00 71.23 C ATOM 527 C SER A 44 -7.726 -7.019 -5.030 1.00 14.31 C ATOM 528 O SER A 44 -7.340 -7.940 -5.770 1.00 3.45 O ATOM 529 CB SER A 44 -6.703 -7.615 -2.815 1.00 22.40 C ATOM 530 OG SER A 44 -6.931 -7.916 -1.439 1.00 32.13 O ATOM 0 H SER A 44 -8.504 -9.229 -3.059 1.00 24.21 H new ATOM 0 HA SER A 44 -8.423 -6.356 -3.099 1.00 71.23 H new ATOM 0 HB2 SER A 44 -6.237 -8.470 -3.304 1.00 22.40 H new ATOM 0 HB3 SER A 44 -6.005 -6.782 -2.896 1.00 22.40 H new ATOM 0 HG SER A 44 -6.080 -8.139 -1.007 1.00 32.13 H new ATOM 536 N ALA A 45 -7.954 -5.802 -5.471 1.00 61.54 N ATOM 537 CA ALA A 45 -7.751 -5.424 -6.855 1.00 23.10 C ATOM 538 C ALA A 45 -7.106 -4.057 -6.969 1.00 1.23 C ATOM 539 O ALA A 45 -7.142 -3.255 -6.045 1.00 63.42 O ATOM 540 CB ALA A 45 -9.064 -5.419 -7.577 1.00 30.53 C ATOM 0 H ALA A 45 -8.287 -5.042 -4.878 1.00 61.54 H new ATOM 0 HA ALA A 45 -7.081 -6.155 -7.307 1.00 23.10 H new ATOM 0 HB1 ALA A 45 -8.906 -5.134 -8.617 1.00 30.53 H new ATOM 0 HB2 ALA A 45 -9.505 -6.415 -7.536 1.00 30.53 H new ATOM 0 HB3 ALA A 45 -9.737 -4.704 -7.103 1.00 30.53 H new ATOM 546 N THR A 46 -6.514 -3.813 -8.093 1.00 45.24 N ATOM 547 CA THR A 46 -5.873 -2.565 -8.383 1.00 40.33 C ATOM 548 C THR A 46 -6.545 -1.904 -9.565 1.00 31.12 C ATOM 549 O THR A 46 -6.743 -2.536 -10.589 1.00 50.13 O ATOM 550 CB THR A 46 -4.409 -2.810 -8.741 1.00 43.20 C ATOM 551 OG1 THR A 46 -3.777 -3.500 -7.661 1.00 14.51 O ATOM 552 CG2 THR A 46 -3.683 -1.497 -9.015 1.00 2.24 C ATOM 0 H THR A 46 -6.460 -4.489 -8.855 1.00 45.24 H new ATOM 0 HA THR A 46 -5.945 -1.924 -7.505 1.00 40.33 H new ATOM 0 HB THR A 46 -4.364 -3.413 -9.648 1.00 43.20 H new ATOM 0 HG1 THR A 46 -3.430 -2.849 -7.016 1.00 14.51 H new ATOM 0 HG21 THR A 46 -2.643 -1.702 -9.267 1.00 2.24 H new ATOM 0 HG22 THR A 46 -4.163 -0.982 -9.847 1.00 2.24 H new ATOM 0 HG23 THR A 46 -3.723 -0.867 -8.127 1.00 2.24 H new ATOM 560 N LEU A 47 -6.898 -0.664 -9.411 1.00 10.22 N ATOM 561 CA LEU A 47 -7.459 0.106 -10.472 1.00 14.03 C ATOM 562 C LEU A 47 -6.412 1.077 -11.014 1.00 64.33 C ATOM 563 O LEU A 47 -6.143 2.108 -10.399 1.00 71.20 O ATOM 564 CB LEU A 47 -8.704 0.856 -9.987 1.00 64.25 C ATOM 565 CG LEU A 47 -9.356 1.797 -10.991 1.00 32.25 C ATOM 566 CD1 LEU A 47 -9.695 1.069 -12.280 1.00 73.32 C ATOM 567 CD2 LEU A 47 -10.601 2.429 -10.394 1.00 12.10 C ATOM 0 H LEU A 47 -6.802 -0.155 -8.532 1.00 10.22 H new ATOM 0 HA LEU A 47 -7.763 -0.562 -11.278 1.00 14.03 H new ATOM 0 HB2 LEU A 47 -9.446 0.122 -9.674 1.00 64.25 H new ATOM 0 HB3 LEU A 47 -8.434 1.433 -9.103 1.00 64.25 H new ATOM 0 HG LEU A 47 -8.643 2.587 -11.227 1.00 32.25 H new ATOM 0 HD11 LEU A 47 -10.159 1.764 -12.979 1.00 73.32 H new ATOM 0 HD12 LEU A 47 -8.783 0.666 -12.721 1.00 73.32 H new ATOM 0 HD13 LEU A 47 -10.386 0.254 -12.066 1.00 73.32 H new ATOM 0 HD21 LEU A 47 -11.055 3.099 -11.124 1.00 12.10 H new ATOM 0 HD22 LEU A 47 -11.313 1.648 -10.126 1.00 12.10 H new ATOM 0 HD23 LEU A 47 -10.330 2.994 -9.502 1.00 12.10 H new ATOM 579 N PRO A 48 -5.765 0.732 -12.130 1.00 23.33 N ATOM 580 CA PRO A 48 -4.784 1.587 -12.760 1.00 72.32 C ATOM 581 C PRO A 48 -5.459 2.602 -13.671 1.00 61.21 C ATOM 582 O PRO A 48 -6.450 2.289 -14.350 1.00 14.44 O ATOM 583 CB PRO A 48 -3.920 0.614 -13.588 1.00 51.25 C ATOM 584 CG PRO A 48 -4.566 -0.738 -13.448 1.00 3.15 C ATOM 585 CD PRO A 48 -5.928 -0.515 -12.870 1.00 55.42 C ATOM 0 HA PRO A 48 -4.204 2.161 -12.037 1.00 72.32 H new ATOM 0 HB2 PRO A 48 -3.880 0.921 -14.633 1.00 51.25 H new ATOM 0 HB3 PRO A 48 -2.894 0.596 -13.222 1.00 51.25 H new ATOM 0 HG2 PRO A 48 -4.635 -1.235 -14.416 1.00 3.15 H new ATOM 0 HG3 PRO A 48 -3.973 -1.383 -12.800 1.00 3.15 H new ATOM 0 HD2 PRO A 48 -6.688 -0.428 -13.647 1.00 55.42 H new ATOM 0 HD3 PRO A 48 -6.230 -1.335 -12.219 1.00 55.42 H new ATOM 593 N GLY A 49 -4.946 3.802 -13.684 1.00 71.05 N ATOM 594 CA GLY A 49 -5.515 4.831 -14.506 1.00 10.12 C ATOM 595 C GLY A 49 -6.431 5.728 -13.713 1.00 61.33 C ATOM 596 O GLY A 49 -7.062 6.630 -14.263 1.00 63.31 O ATOM 0 H GLY A 49 -4.136 4.090 -13.135 1.00 71.05 H new ATOM 0 HA2 GLY A 49 -4.717 5.426 -14.951 1.00 10.12 H new ATOM 0 HA3 GLY A 49 -6.070 4.377 -15.327 1.00 10.12 H new ATOM 600 N PHE A 50 -6.497 5.492 -12.421 1.00 71.22 N ATOM 601 CA PHE A 50 -7.334 6.264 -11.524 1.00 22.31 C ATOM 602 C PHE A 50 -6.573 6.528 -10.249 1.00 41.00 C ATOM 603 O PHE A 50 -5.659 5.793 -9.928 1.00 24.44 O ATOM 604 CB PHE A 50 -8.673 5.547 -11.234 1.00 60.03 C ATOM 605 CG PHE A 50 -9.602 5.463 -12.431 1.00 52.22 C ATOM 606 CD1 PHE A 50 -9.451 4.473 -13.393 1.00 30.31 C ATOM 607 CD2 PHE A 50 -10.621 6.382 -12.588 1.00 2.41 C ATOM 608 CE1 PHE A 50 -10.295 4.413 -14.484 1.00 73.22 C ATOM 609 CE2 PHE A 50 -11.471 6.328 -13.673 1.00 44.24 C ATOM 610 CZ PHE A 50 -11.307 5.345 -14.625 1.00 72.24 C ATOM 0 H PHE A 50 -5.968 4.753 -11.958 1.00 71.22 H new ATOM 0 HA PHE A 50 -7.583 7.211 -12.002 1.00 22.31 H new ATOM 0 HB2 PHE A 50 -8.463 4.538 -10.879 1.00 60.03 H new ATOM 0 HB3 PHE A 50 -9.185 6.069 -10.426 1.00 60.03 H new ATOM 0 HD1 PHE A 50 -8.664 3.741 -13.286 1.00 30.31 H new ATOM 0 HD2 PHE A 50 -10.755 7.157 -11.848 1.00 2.41 H new ATOM 0 HE1 PHE A 50 -10.165 3.639 -15.226 1.00 73.22 H new ATOM 0 HE2 PHE A 50 -12.263 7.055 -13.776 1.00 44.24 H new ATOM 0 HZ PHE A 50 -11.967 5.303 -15.479 1.00 72.24 H new ATOM 620 N GLN A 51 -6.952 7.543 -9.523 1.00 35.23 N ATOM 621 CA GLN A 51 -6.225 7.916 -8.337 1.00 32.24 C ATOM 622 C GLN A 51 -7.197 8.287 -7.243 1.00 22.21 C ATOM 623 O GLN A 51 -8.304 8.772 -7.515 1.00 11.23 O ATOM 624 CB GLN A 51 -5.322 9.118 -8.640 1.00 44.11 C ATOM 625 CG GLN A 51 -4.330 9.492 -7.542 1.00 23.11 C ATOM 626 CD GLN A 51 -3.195 8.481 -7.375 1.00 44.54 C ATOM 627 OE1 GLN A 51 -3.349 7.281 -7.614 1.00 65.34 O ATOM 628 NE2 GLN A 51 -2.051 8.966 -6.972 1.00 3.10 N ATOM 0 H GLN A 51 -7.761 8.129 -9.730 1.00 35.23 H new ATOM 0 HA GLN A 51 -5.613 7.074 -8.013 1.00 32.24 H new ATOM 0 HB2 GLN A 51 -4.764 8.909 -9.553 1.00 44.11 H new ATOM 0 HB3 GLN A 51 -5.954 9.982 -8.843 1.00 44.11 H new ATOM 0 HG2 GLN A 51 -3.904 10.470 -7.766 1.00 23.11 H new ATOM 0 HG3 GLN A 51 -4.865 9.585 -6.597 1.00 23.11 H new ATOM 0 HE21 GLN A 51 -1.958 9.964 -6.783 1.00 3.10 H new ATOM 0 HE22 GLN A 51 -1.250 8.347 -6.846 1.00 3.10 H new ATOM 637 N ARG A 52 -6.795 8.021 -6.023 1.00 44.22 N ATOM 638 CA ARG A 52 -7.578 8.331 -4.858 1.00 13.14 C ATOM 639 C ARG A 52 -7.078 9.592 -4.205 1.00 63.42 C ATOM 640 O ARG A 52 -5.894 9.720 -3.881 1.00 74.50 O ATOM 641 CB ARG A 52 -7.553 7.161 -3.838 1.00 64.12 C ATOM 642 CG ARG A 52 -6.150 6.645 -3.527 1.00 61.13 C ATOM 643 CD ARG A 52 -6.127 5.565 -2.449 1.00 74.51 C ATOM 644 NE ARG A 52 -6.350 6.090 -1.090 1.00 63.01 N ATOM 645 CZ ARG A 52 -5.690 5.631 0.008 1.00 32.00 C ATOM 646 NH1 ARG A 52 -4.840 4.625 -0.097 1.00 34.44 N ATOM 647 NH2 ARG A 52 -5.895 6.172 1.198 1.00 51.14 N ATOM 0 H ARG A 52 -5.901 7.577 -5.812 1.00 44.22 H new ATOM 0 HA ARG A 52 -8.608 8.483 -5.181 1.00 13.14 H new ATOM 0 HB2 ARG A 52 -8.023 7.489 -2.911 1.00 64.12 H new ATOM 0 HB3 ARG A 52 -8.154 6.339 -4.227 1.00 64.12 H new ATOM 0 HG2 ARG A 52 -5.707 6.247 -4.440 1.00 61.13 H new ATOM 0 HG3 ARG A 52 -5.526 7.480 -3.208 1.00 61.13 H new ATOM 0 HD2 ARG A 52 -6.892 4.822 -2.673 1.00 74.51 H new ATOM 0 HD3 ARG A 52 -5.166 5.052 -2.479 1.00 74.51 H new ATOM 0 HE ARG A 52 -7.034 6.836 -0.966 1.00 63.01 H new ATOM 0 HH11 ARG A 52 -4.676 4.189 -1.004 1.00 34.44 H new ATOM 0 HH12 ARG A 52 -4.348 4.285 0.729 1.00 34.44 H new ATOM 0 HH21 ARG A 52 -6.555 6.943 1.301 1.00 51.14 H new ATOM 0 HH22 ARG A 52 -5.393 5.818 2.012 1.00 51.14 H new ATOM 661 N PHE A 53 -7.956 10.506 -4.005 1.00 44.24 N ATOM 662 CA PHE A 53 -7.637 11.704 -3.299 1.00 63.30 C ATOM 663 C PHE A 53 -8.315 11.631 -2.001 1.00 55.54 C ATOM 664 O PHE A 53 -9.462 11.258 -1.934 1.00 23.13 O ATOM 665 CB PHE A 53 -8.004 12.936 -4.098 1.00 3.45 C ATOM 666 CG PHE A 53 -7.065 13.151 -5.241 1.00 54.03 C ATOM 667 CD1 PHE A 53 -7.218 12.471 -6.438 1.00 51.53 C ATOM 668 CD2 PHE A 53 -6.007 14.019 -5.097 1.00 32.14 C ATOM 669 CE1 PHE A 53 -6.323 12.661 -7.471 1.00 64.11 C ATOM 670 CE2 PHE A 53 -5.115 14.221 -6.115 1.00 72.12 C ATOM 671 CZ PHE A 53 -5.266 13.543 -7.312 1.00 3.44 C ATOM 0 H PHE A 53 -8.923 10.449 -4.326 1.00 44.24 H new ATOM 0 HA PHE A 53 -6.562 11.791 -3.140 1.00 63.30 H new ATOM 0 HB2 PHE A 53 -9.021 12.835 -4.476 1.00 3.45 H new ATOM 0 HB3 PHE A 53 -7.991 13.810 -3.447 1.00 3.45 H new ATOM 0 HD1 PHE A 53 -8.044 11.787 -6.564 1.00 51.53 H new ATOM 0 HD2 PHE A 53 -5.878 14.550 -4.165 1.00 32.14 H new ATOM 0 HE1 PHE A 53 -6.446 12.124 -8.400 1.00 64.11 H new ATOM 0 HE2 PHE A 53 -4.293 14.909 -5.984 1.00 72.12 H new ATOM 0 HZ PHE A 53 -4.564 13.700 -8.118 1.00 3.44 H new ATOM 681 N ARG A 54 -7.623 11.963 -0.967 1.00 35.40 N ATOM 682 CA ARG A 54 -8.105 11.659 0.316 1.00 60.34 C ATOM 683 C ARG A 54 -8.107 12.828 1.254 1.00 2.34 C ATOM 684 O ARG A 54 -7.124 13.549 1.398 1.00 45.15 O ATOM 685 CB ARG A 54 -7.331 10.421 0.857 1.00 12.43 C ATOM 686 CG ARG A 54 -7.637 9.963 2.272 1.00 53.22 C ATOM 687 CD ARG A 54 -6.971 10.855 3.293 1.00 51.35 C ATOM 688 NE ARG A 54 -7.398 10.558 4.652 1.00 34.41 N ATOM 689 CZ ARG A 54 -7.227 11.381 5.696 1.00 64.02 C ATOM 690 NH1 ARG A 54 -6.524 12.509 5.557 1.00 51.43 N ATOM 691 NH2 ARG A 54 -7.731 11.061 6.877 1.00 60.22 N ATOM 0 H ARG A 54 -6.724 12.444 -0.994 1.00 35.40 H new ATOM 0 HA ARG A 54 -9.162 11.405 0.241 1.00 60.34 H new ATOM 0 HB2 ARG A 54 -7.523 9.585 0.185 1.00 12.43 H new ATOM 0 HB3 ARG A 54 -6.265 10.639 0.798 1.00 12.43 H new ATOM 0 HG2 ARG A 54 -8.715 9.965 2.432 1.00 53.22 H new ATOM 0 HG3 ARG A 54 -7.297 8.936 2.406 1.00 53.22 H new ATOM 0 HD2 ARG A 54 -5.889 10.740 3.222 1.00 51.35 H new ATOM 0 HD3 ARG A 54 -7.196 11.896 3.064 1.00 51.35 H new ATOM 0 HE ARG A 54 -7.858 9.664 4.821 1.00 34.41 H new ATOM 0 HH11 ARG A 54 -6.115 12.747 4.653 1.00 51.43 H new ATOM 0 HH12 ARG A 54 -6.397 13.132 6.354 1.00 51.43 H new ATOM 0 HH21 ARG A 54 -8.248 10.189 6.991 1.00 60.22 H new ATOM 0 HH22 ARG A 54 -7.602 11.686 7.673 1.00 60.22 H new ATOM 796 N TYR A 60 -14.860 13.263 0.444 1.00 23.10 N ATOM 797 CA TYR A 60 -14.525 11.903 0.795 1.00 40.23 C ATOM 798 C TYR A 60 -13.250 11.541 0.050 1.00 32.23 C ATOM 799 O TYR A 60 -12.783 12.331 -0.773 1.00 64.13 O ATOM 800 CB TYR A 60 -15.648 10.980 0.271 1.00 20.35 C ATOM 801 CG TYR A 60 -17.051 11.470 0.538 1.00 64.02 C ATOM 802 CD1 TYR A 60 -17.727 11.138 1.693 1.00 55.15 C ATOM 803 CD2 TYR A 60 -17.694 12.281 -0.389 1.00 45.24 C ATOM 804 CE1 TYR A 60 -19.007 11.602 1.921 1.00 31.30 C ATOM 805 CE2 TYR A 60 -18.959 12.749 -0.168 1.00 43.11 C ATOM 806 CZ TYR A 60 -19.615 12.410 0.986 1.00 52.00 C ATOM 807 OH TYR A 60 -20.883 12.893 1.209 1.00 32.42 O ATOM 0 HA TYR A 60 -14.404 11.796 1.873 1.00 40.23 H new ATOM 0 HB2 TYR A 60 -15.522 10.853 -0.804 1.00 20.35 H new ATOM 0 HB3 TYR A 60 -15.530 9.996 0.724 1.00 20.35 H new ATOM 0 HD1 TYR A 60 -17.249 10.507 2.428 1.00 55.15 H new ATOM 0 HD2 TYR A 60 -17.184 12.547 -1.303 1.00 45.24 H new ATOM 0 HE1 TYR A 60 -19.529 11.333 2.828 1.00 31.30 H new ATOM 0 HE2 TYR A 60 -19.439 13.383 -0.899 1.00 43.11 H new ATOM 0 HH TYR A 60 -21.301 13.121 0.353 1.00 32.42 H new ATOM 817 N PRO A 61 -12.644 10.365 0.311 1.00 74.30 N ATOM 818 CA PRO A 61 -11.552 9.893 -0.507 1.00 30.01 C ATOM 819 C PRO A 61 -12.086 9.405 -1.863 1.00 43.13 C ATOM 820 O PRO A 61 -12.324 8.222 -2.061 1.00 44.11 O ATOM 821 CB PRO A 61 -10.929 8.734 0.293 1.00 62.45 C ATOM 822 CG PRO A 61 -11.606 8.769 1.631 1.00 61.44 C ATOM 823 CD PRO A 61 -12.932 9.447 1.416 1.00 42.41 C ATOM 0 HA PRO A 61 -10.820 10.671 -0.720 1.00 30.01 H new ATOM 0 HB2 PRO A 61 -11.093 7.779 -0.206 1.00 62.45 H new ATOM 0 HB3 PRO A 61 -9.851 8.860 0.394 1.00 62.45 H new ATOM 0 HG2 PRO A 61 -11.744 7.761 2.024 1.00 61.44 H new ATOM 0 HG3 PRO A 61 -11.004 9.315 2.357 1.00 61.44 H new ATOM 0 HD2 PRO A 61 -13.715 8.734 1.158 1.00 42.41 H new ATOM 0 HD3 PRO A 61 -13.266 9.978 2.308 1.00 42.41 H new ATOM 831 N CYS A 62 -12.318 10.337 -2.753 1.00 21.35 N ATOM 832 CA CYS A 62 -12.936 10.050 -4.022 1.00 23.21 C ATOM 833 C CYS A 62 -11.913 9.606 -5.075 1.00 21.24 C ATOM 834 O CYS A 62 -10.704 9.894 -4.964 1.00 33.03 O ATOM 835 CB CYS A 62 -13.745 11.270 -4.499 1.00 61.02 C ATOM 836 SG CYS A 62 -14.951 11.861 -3.299 1.00 21.24 S ATOM 0 H CYS A 62 -12.082 11.320 -2.617 1.00 21.35 H new ATOM 0 HA CYS A 62 -13.618 9.211 -3.884 1.00 23.21 H new ATOM 0 HB2 CYS A 62 -13.056 12.080 -4.736 1.00 61.02 H new ATOM 0 HB3 CYS A 62 -14.263 11.012 -5.423 1.00 61.02 H new ATOM 0 HG CYS A 62 -15.968 12.377 -3.924 1.00 21.24 H new ATOM 842 N ILE A 63 -12.409 8.891 -6.077 1.00 3.33 N ATOM 843 CA ILE A 63 -11.595 8.373 -7.165 1.00 23.45 C ATOM 844 C ILE A 63 -11.818 9.216 -8.398 1.00 4.44 C ATOM 845 O ILE A 63 -12.937 9.655 -8.651 1.00 52.35 O ATOM 846 CB ILE A 63 -12.000 6.902 -7.506 1.00 54.25 C ATOM 847 CG1 ILE A 63 -11.827 5.996 -6.297 1.00 62.03 C ATOM 848 CG2 ILE A 63 -11.215 6.352 -8.699 1.00 22.41 C ATOM 849 CD1 ILE A 63 -10.409 5.923 -5.774 1.00 14.22 C ATOM 0 H ILE A 63 -13.398 8.653 -6.156 1.00 3.33 H new ATOM 0 HA ILE A 63 -10.550 8.402 -6.855 1.00 23.45 H new ATOM 0 HB ILE A 63 -13.054 6.919 -7.784 1.00 54.25 H new ATOM 0 HG12 ILE A 63 -12.479 6.347 -5.498 1.00 62.03 H new ATOM 0 HG13 ILE A 63 -12.157 4.991 -6.560 1.00 62.03 H new ATOM 0 HG21 ILE A 63 -11.529 5.328 -8.900 1.00 22.41 H new ATOM 0 HG22 ILE A 63 -11.407 6.969 -9.577 1.00 22.41 H new ATOM 0 HG23 ILE A 63 -10.149 6.367 -8.471 1.00 22.41 H new ATOM 0 HD11 ILE A 63 -10.373 5.257 -4.912 1.00 14.22 H new ATOM 0 HD12 ILE A 63 -9.752 5.541 -6.556 1.00 14.22 H new ATOM 0 HD13 ILE A 63 -10.079 6.918 -5.477 1.00 14.22 H new ATOM 861 N VAL A 64 -10.769 9.471 -9.139 1.00 10.14 N ATOM 862 CA VAL A 64 -10.866 10.187 -10.404 1.00 62.30 C ATOM 863 C VAL A 64 -9.839 9.593 -11.372 1.00 32.43 C ATOM 864 O VAL A 64 -8.843 9.009 -10.931 1.00 22.10 O ATOM 865 CB VAL A 64 -10.575 11.723 -10.248 1.00 2.41 C ATOM 866 CG1 VAL A 64 -11.555 12.382 -9.310 1.00 54.14 C ATOM 867 CG2 VAL A 64 -9.145 11.983 -9.786 1.00 41.04 C ATOM 0 H VAL A 64 -9.820 9.192 -8.890 1.00 10.14 H new ATOM 0 HA VAL A 64 -11.885 10.078 -10.775 1.00 62.30 H new ATOM 0 HB VAL A 64 -10.698 12.166 -11.236 1.00 2.41 H new ATOM 0 HG11 VAL A 64 -11.322 13.444 -9.227 1.00 54.14 H new ATOM 0 HG12 VAL A 64 -12.567 12.262 -9.697 1.00 54.14 H new ATOM 0 HG13 VAL A 64 -11.486 11.918 -8.326 1.00 54.14 H new ATOM 0 HG21 VAL A 64 -8.983 13.057 -9.690 1.00 41.04 H new ATOM 0 HG22 VAL A 64 -8.982 11.504 -8.821 1.00 41.04 H new ATOM 0 HG23 VAL A 64 -8.447 11.575 -10.517 1.00 41.04 H new ATOM 877 N PRO A 65 -10.078 9.692 -12.689 1.00 10.02 N ATOM 878 CA PRO A 65 -9.134 9.201 -13.703 1.00 52.54 C ATOM 879 C PRO A 65 -7.813 9.996 -13.709 1.00 54.42 C ATOM 880 O PRO A 65 -7.790 11.196 -14.025 1.00 51.32 O ATOM 881 CB PRO A 65 -9.892 9.388 -15.025 1.00 1.44 C ATOM 882 CG PRO A 65 -10.935 10.414 -14.737 1.00 64.31 C ATOM 883 CD PRO A 65 -11.297 10.254 -13.294 1.00 65.20 C ATOM 0 HA PRO A 65 -8.837 8.169 -13.517 1.00 52.54 H new ATOM 0 HB2 PRO A 65 -9.223 9.719 -15.819 1.00 1.44 H new ATOM 0 HB3 PRO A 65 -10.342 8.452 -15.357 1.00 1.44 H new ATOM 0 HG2 PRO A 65 -10.558 11.417 -14.934 1.00 64.31 H new ATOM 0 HG3 PRO A 65 -11.807 10.271 -15.375 1.00 64.31 H new ATOM 0 HD2 PRO A 65 -11.566 11.208 -12.840 1.00 65.20 H new ATOM 0 HD3 PRO A 65 -12.151 9.588 -13.167 1.00 65.20 H new ATOM 891 N SER A 66 -6.742 9.339 -13.329 1.00 72.42 N ATOM 892 CA SER A 66 -5.427 9.933 -13.296 1.00 33.35 C ATOM 893 C SER A 66 -4.490 9.064 -14.115 1.00 64.54 C ATOM 894 O SER A 66 -4.379 7.867 -13.863 1.00 44.44 O ATOM 895 CB SER A 66 -4.938 10.036 -11.857 1.00 43.24 C ATOM 896 OG SER A 66 -3.677 10.690 -11.772 1.00 2.41 O ATOM 0 H SER A 66 -6.760 8.364 -13.030 1.00 72.42 H new ATOM 0 HA SER A 66 -5.457 10.939 -13.715 1.00 33.35 H new ATOM 0 HB2 SER A 66 -5.671 10.581 -11.262 1.00 43.24 H new ATOM 0 HB3 SER A 66 -4.859 9.037 -11.428 1.00 43.24 H new ATOM 0 HG SER A 66 -3.396 10.739 -10.834 1.00 2.41 H new ATOM 902 N GLU A 67 -3.805 9.662 -15.059 1.00 43.41 N ATOM 903 CA GLU A 67 -2.962 8.927 -15.992 1.00 12.24 C ATOM 904 C GLU A 67 -1.836 8.144 -15.310 1.00 4.41 C ATOM 905 O GLU A 67 -1.488 7.036 -15.744 1.00 71.25 O ATOM 906 CB GLU A 67 -2.377 9.868 -17.016 1.00 34.11 C ATOM 907 CG GLU A 67 -3.413 10.629 -17.811 1.00 1.24 C ATOM 908 CD GLU A 67 -2.782 11.487 -18.858 1.00 72.31 C ATOM 909 OE1 GLU A 67 -2.448 12.648 -18.570 1.00 31.34 O ATOM 910 OE2 GLU A 67 -2.596 11.005 -19.987 1.00 12.12 O ATOM 0 H GLU A 67 -3.811 10.671 -15.209 1.00 43.41 H new ATOM 0 HA GLU A 67 -3.608 8.194 -16.475 1.00 12.24 H new ATOM 0 HB2 GLU A 67 -1.726 10.581 -16.510 1.00 34.11 H new ATOM 0 HB3 GLU A 67 -1.752 9.298 -17.704 1.00 34.11 H new ATOM 0 HG2 GLU A 67 -4.100 9.926 -18.282 1.00 1.24 H new ATOM 0 HG3 GLU A 67 -4.004 11.250 -17.138 1.00 1.24 H new ATOM 917 N LYS A 68 -1.275 8.703 -14.253 1.00 3.03 N ATOM 918 CA LYS A 68 -0.157 8.069 -13.558 1.00 74.02 C ATOM 919 C LYS A 68 -0.584 7.505 -12.219 1.00 64.44 C ATOM 920 O LYS A 68 0.257 7.244 -11.344 1.00 52.14 O ATOM 921 CB LYS A 68 0.960 9.070 -13.333 1.00 52.03 C ATOM 922 CG LYS A 68 1.494 9.688 -14.603 1.00 74.52 C ATOM 923 CD LYS A 68 2.698 10.554 -14.324 1.00 42.43 C ATOM 924 CE LYS A 68 2.395 11.685 -13.352 1.00 23.12 C ATOM 925 NZ LYS A 68 3.570 12.557 -13.156 1.00 34.12 N ATOM 0 H LYS A 68 -1.571 9.594 -13.853 1.00 3.03 H new ATOM 0 HA LYS A 68 0.195 7.252 -14.188 1.00 74.02 H new ATOM 0 HB2 LYS A 68 0.597 9.863 -12.679 1.00 52.03 H new ATOM 0 HB3 LYS A 68 1.778 8.575 -12.810 1.00 52.03 H new ATOM 0 HG2 LYS A 68 1.764 8.901 -15.308 1.00 74.52 H new ATOM 0 HG3 LYS A 68 0.714 10.286 -15.075 1.00 74.52 H new ATOM 0 HD2 LYS A 68 3.499 9.936 -13.918 1.00 42.43 H new ATOM 0 HD3 LYS A 68 3.064 10.974 -15.261 1.00 42.43 H new ATOM 0 HE2 LYS A 68 1.560 12.276 -13.728 1.00 23.12 H new ATOM 0 HE3 LYS A 68 2.085 11.269 -12.393 1.00 23.12 H new ATOM 0 HZ1 LYS A 68 3.330 13.318 -12.488 1.00 34.12 H new ATOM 0 HZ2 LYS A 68 4.358 11.997 -12.774 1.00 34.12 H new ATOM 0 HZ3 LYS A 68 3.850 12.972 -14.067 1.00 34.12 H new ATOM 939 N GLY A 69 -1.858 7.295 -12.059 1.00 54.15 N ATOM 940 CA GLY A 69 -2.347 6.813 -10.809 1.00 73.53 C ATOM 941 C GLY A 69 -2.826 5.385 -10.875 1.00 51.42 C ATOM 942 O GLY A 69 -3.122 4.867 -11.957 1.00 22.12 O ATOM 0 H GLY A 69 -2.569 7.449 -12.774 1.00 54.15 H new ATOM 0 HA2 GLY A 69 -1.557 6.891 -10.062 1.00 73.53 H new ATOM 0 HA3 GLY A 69 -3.166 7.450 -10.475 1.00 73.53 H new ATOM 946 N GLU A 70 -2.900 4.763 -9.725 1.00 23.41 N ATOM 947 CA GLU A 70 -3.426 3.430 -9.577 1.00 74.22 C ATOM 948 C GLU A 70 -3.864 3.259 -8.146 1.00 10.33 C ATOM 949 O GLU A 70 -3.115 3.597 -7.210 1.00 31.03 O ATOM 950 CB GLU A 70 -2.438 2.318 -9.995 1.00 61.52 C ATOM 951 CG GLU A 70 -1.181 2.180 -9.145 1.00 63.33 C ATOM 952 CD GLU A 70 -0.309 1.063 -9.628 1.00 54.12 C ATOM 953 OE1 GLU A 70 0.429 1.258 -10.594 1.00 5.51 O ATOM 954 OE2 GLU A 70 -0.370 -0.042 -9.038 1.00 64.40 O ATOM 0 H GLU A 70 -2.589 5.179 -8.847 1.00 23.41 H new ATOM 0 HA GLU A 70 -4.270 3.321 -10.259 1.00 74.22 H new ATOM 0 HB2 GLU A 70 -2.968 1.366 -9.980 1.00 61.52 H new ATOM 0 HB3 GLU A 70 -2.136 2.498 -11.027 1.00 61.52 H new ATOM 0 HG2 GLU A 70 -0.621 3.115 -9.168 1.00 63.33 H new ATOM 0 HG3 GLU A 70 -1.461 2.001 -8.107 1.00 63.33 H new ATOM 961 N VAL A 71 -5.046 2.761 -7.964 1.00 43.51 N ATOM 962 CA VAL A 71 -5.619 2.615 -6.657 1.00 73.13 C ATOM 963 C VAL A 71 -5.749 1.163 -6.321 1.00 61.02 C ATOM 964 O VAL A 71 -6.354 0.406 -7.051 1.00 33.43 O ATOM 965 CB VAL A 71 -7.027 3.263 -6.588 1.00 4.50 C ATOM 966 CG1 VAL A 71 -7.619 3.151 -5.187 1.00 41.11 C ATOM 967 CG2 VAL A 71 -6.967 4.704 -7.032 1.00 40.22 C ATOM 0 H VAL A 71 -5.648 2.441 -8.722 1.00 43.51 H new ATOM 0 HA VAL A 71 -4.960 3.114 -5.946 1.00 73.13 H new ATOM 0 HB VAL A 71 -7.683 2.719 -7.268 1.00 4.50 H new ATOM 0 HG11 VAL A 71 -8.606 3.614 -5.171 1.00 41.11 H new ATOM 0 HG12 VAL A 71 -7.707 2.100 -4.912 1.00 41.11 H new ATOM 0 HG13 VAL A 71 -6.968 3.659 -4.475 1.00 41.11 H new ATOM 0 HG21 VAL A 71 -7.963 5.143 -6.977 1.00 40.22 H new ATOM 0 HG22 VAL A 71 -6.290 5.257 -6.381 1.00 40.22 H new ATOM 0 HG23 VAL A 71 -6.604 4.754 -8.059 1.00 40.22 H new ATOM 977 N HIS A 72 -5.166 0.769 -5.238 1.00 44.34 N ATOM 978 CA HIS A 72 -5.283 -0.591 -4.807 1.00 34.55 C ATOM 979 C HIS A 72 -6.376 -0.644 -3.790 1.00 42.31 C ATOM 980 O HIS A 72 -6.277 -0.026 -2.734 1.00 74.24 O ATOM 981 CB HIS A 72 -3.960 -1.124 -4.235 1.00 75.51 C ATOM 982 CG HIS A 72 -2.835 -1.189 -5.239 1.00 53.23 C ATOM 983 ND1 HIS A 72 -2.120 -2.328 -5.501 1.00 20.44 N ATOM 984 CD2 HIS A 72 -2.284 -0.223 -6.021 1.00 54.12 C ATOM 985 CE1 HIS A 72 -1.185 -2.059 -6.393 1.00 45.52 C ATOM 986 NE2 HIS A 72 -1.265 -0.797 -6.721 1.00 3.14 N ATOM 0 H HIS A 72 -4.603 1.367 -4.633 1.00 44.34 H new ATOM 0 HA HIS A 72 -5.521 -1.232 -5.656 1.00 34.55 H new ATOM 0 HB2 HIS A 72 -3.654 -0.489 -3.404 1.00 75.51 H new ATOM 0 HB3 HIS A 72 -4.128 -2.121 -3.829 1.00 75.51 H new ATOM 0 HD2 HIS A 72 -2.596 0.809 -6.077 1.00 54.12 H new ATOM 0 HE1 HIS A 72 -0.471 -2.767 -6.787 1.00 45.52 H new ATOM 0 HE2 HIS A 72 -0.663 -0.319 -7.392 1.00 3.14 H new ATOM 995 N GLY A 73 -7.407 -1.339 -4.109 1.00 54.40 N ATOM 996 CA GLY A 73 -8.538 -1.409 -3.259 1.00 21.55 C ATOM 997 C GLY A 73 -9.148 -2.758 -3.324 1.00 54.31 C ATOM 998 O GLY A 73 -8.446 -3.748 -3.560 1.00 2.15 O ATOM 0 H GLY A 73 -7.490 -1.878 -4.971 1.00 54.40 H new ATOM 0 HA2 GLY A 73 -8.245 -1.184 -2.233 1.00 21.55 H new ATOM 0 HA3 GLY A 73 -9.270 -0.657 -3.554 1.00 21.55 H new ATOM 1002 N LYS A 74 -10.422 -2.829 -3.135 1.00 3.43 N ATOM 1003 CA LYS A 74 -11.107 -4.088 -3.133 1.00 1.10 C ATOM 1004 C LYS A 74 -12.281 -4.119 -4.071 1.00 1.34 C ATOM 1005 O LYS A 74 -12.897 -3.096 -4.354 1.00 33.31 O ATOM 1006 CB LYS A 74 -11.526 -4.525 -1.719 1.00 30.40 C ATOM 1007 CG LYS A 74 -10.502 -5.397 -0.963 1.00 70.21 C ATOM 1008 CD LYS A 74 -9.182 -4.718 -0.668 1.00 44.23 C ATOM 1009 CE LYS A 74 -9.335 -3.582 0.338 1.00 12.40 C ATOM 1010 NZ LYS A 74 -8.037 -2.956 0.697 1.00 3.03 N ATOM 0 H LYS A 74 -11.023 -2.020 -2.977 1.00 3.43 H new ATOM 0 HA LYS A 74 -10.381 -4.812 -3.504 1.00 1.10 H new ATOM 0 HB2 LYS A 74 -11.725 -3.633 -1.126 1.00 30.40 H new ATOM 0 HB3 LYS A 74 -12.464 -5.076 -1.791 1.00 30.40 H new ATOM 0 HG2 LYS A 74 -10.946 -5.720 -0.021 1.00 70.21 H new ATOM 0 HG3 LYS A 74 -10.309 -6.296 -1.549 1.00 70.21 H new ATOM 0 HD2 LYS A 74 -8.475 -5.452 -0.281 1.00 44.23 H new ATOM 0 HD3 LYS A 74 -8.760 -4.327 -1.594 1.00 44.23 H new ATOM 0 HE2 LYS A 74 -9.998 -2.822 -0.076 1.00 12.40 H new ATOM 0 HE3 LYS A 74 -9.812 -3.963 1.241 1.00 12.40 H new ATOM 0 HZ1 LYS A 74 -8.199 -1.979 1.015 1.00 3.03 H new ATOM 0 HZ2 LYS A 74 -7.589 -3.500 1.462 1.00 3.03 H new ATOM 0 HZ3 LYS A 74 -7.413 -2.950 -0.135 1.00 3.03 H new ATOM 1024 N VAL A 75 -12.554 -5.294 -4.558 1.00 33.55 N ATOM 1025 CA VAL A 75 -13.685 -5.556 -5.421 1.00 60.41 C ATOM 1026 C VAL A 75 -14.741 -6.407 -4.734 1.00 31.04 C ATOM 1027 O VAL A 75 -14.431 -7.429 -4.134 1.00 10.13 O ATOM 1028 CB VAL A 75 -13.243 -6.244 -6.744 1.00 4.13 C ATOM 1029 CG1 VAL A 75 -14.431 -6.853 -7.476 1.00 42.12 C ATOM 1030 CG2 VAL A 75 -12.550 -5.245 -7.641 1.00 5.52 C ATOM 0 H VAL A 75 -11.988 -6.120 -4.366 1.00 33.55 H new ATOM 0 HA VAL A 75 -14.124 -4.586 -5.655 1.00 60.41 H new ATOM 0 HB VAL A 75 -12.552 -7.047 -6.489 1.00 4.13 H new ATOM 0 HG11 VAL A 75 -14.088 -7.326 -8.396 1.00 42.12 H new ATOM 0 HG12 VAL A 75 -14.907 -7.600 -6.840 1.00 42.12 H new ATOM 0 HG13 VAL A 75 -15.150 -6.070 -7.717 1.00 42.12 H new ATOM 0 HG21 VAL A 75 -12.244 -5.736 -8.565 1.00 5.52 H new ATOM 0 HG22 VAL A 75 -13.234 -4.429 -7.873 1.00 5.52 H new ATOM 0 HG23 VAL A 75 -11.671 -4.848 -7.133 1.00 5.52 H new ATOM 1040 N LEU A 76 -15.974 -5.961 -4.840 1.00 13.01 N ATOM 1041 CA LEU A 76 -17.129 -6.665 -4.340 1.00 13.43 C ATOM 1042 C LEU A 76 -17.750 -7.444 -5.493 1.00 43.44 C ATOM 1043 O LEU A 76 -18.335 -6.845 -6.393 1.00 54.42 O ATOM 1044 CB LEU A 76 -18.182 -5.667 -3.823 1.00 72.01 C ATOM 1045 CG LEU A 76 -17.752 -4.689 -2.733 1.00 50.15 C ATOM 1046 CD1 LEU A 76 -18.915 -3.793 -2.347 1.00 30.43 C ATOM 1047 CD2 LEU A 76 -17.238 -5.432 -1.527 1.00 65.42 C ATOM 0 H LEU A 76 -16.204 -5.074 -5.289 1.00 13.01 H new ATOM 0 HA LEU A 76 -16.822 -7.325 -3.529 1.00 13.43 H new ATOM 0 HB2 LEU A 76 -18.541 -5.087 -4.673 1.00 72.01 H new ATOM 0 HB3 LEU A 76 -19.030 -6.238 -3.446 1.00 72.01 H new ATOM 0 HG LEU A 76 -16.945 -4.068 -3.122 1.00 50.15 H new ATOM 0 HD11 LEU A 76 -18.597 -3.099 -1.569 1.00 30.43 H new ATOM 0 HD12 LEU A 76 -19.247 -3.231 -3.220 1.00 30.43 H new ATOM 0 HD13 LEU A 76 -19.737 -4.404 -1.975 1.00 30.43 H new ATOM 0 HD21 LEU A 76 -16.936 -4.718 -0.761 1.00 65.42 H new ATOM 0 HD22 LEU A 76 -18.025 -6.075 -1.133 1.00 65.42 H new ATOM 0 HD23 LEU A 76 -16.380 -6.041 -1.813 1.00 65.42 H new ATOM 1059 N MET A 77 -17.597 -8.743 -5.496 1.00 52.11 N ATOM 1060 CA MET A 77 -18.189 -9.577 -6.546 1.00 43.43 C ATOM 1061 C MET A 77 -19.245 -10.485 -5.973 1.00 44.13 C ATOM 1062 O MET A 77 -19.161 -10.884 -4.821 1.00 5.04 O ATOM 1063 CB MET A 77 -17.133 -10.378 -7.321 1.00 45.15 C ATOM 1064 CG MET A 77 -16.233 -11.235 -6.464 1.00 23.35 C ATOM 1065 SD MET A 77 -15.092 -12.243 -7.441 1.00 2.34 S ATOM 1066 CE MET A 77 -14.300 -10.994 -8.452 1.00 73.10 C ATOM 0 H MET A 77 -17.071 -9.259 -4.791 1.00 52.11 H new ATOM 0 HA MET A 77 -18.661 -8.905 -7.262 1.00 43.43 H new ATOM 0 HB2 MET A 77 -17.640 -11.018 -8.043 1.00 45.15 H new ATOM 0 HB3 MET A 77 -16.515 -9.683 -7.890 1.00 45.15 H new ATOM 0 HG2 MET A 77 -15.662 -10.595 -5.791 1.00 23.35 H new ATOM 0 HG3 MET A 77 -16.845 -11.887 -5.841 1.00 23.35 H new ATOM 0 HE1 MET A 77 -13.411 -11.415 -8.920 1.00 73.10 H new ATOM 0 HE2 MET A 77 -14.992 -10.658 -9.224 1.00 73.10 H new ATOM 0 HE3 MET A 77 -14.015 -10.148 -7.827 1.00 73.10 H new ATOM 1076 N GLY A 78 -20.235 -10.819 -6.763 1.00 52.11 N ATOM 1077 CA GLY A 78 -21.319 -11.600 -6.244 1.00 63.42 C ATOM 1078 C GLY A 78 -22.444 -10.718 -5.778 1.00 60.22 C ATOM 1079 O GLY A 78 -23.329 -11.147 -5.032 1.00 10.25 O ATOM 0 H GLY A 78 -20.309 -10.566 -7.748 1.00 52.11 H new ATOM 0 HA2 GLY A 78 -21.682 -12.282 -7.013 1.00 63.42 H new ATOM 0 HA3 GLY A 78 -20.966 -12.213 -5.415 1.00 63.42 H new ATOM 1083 N VAL A 79 -22.415 -9.470 -6.199 1.00 53.02 N ATOM 1084 CA VAL A 79 -23.457 -8.547 -5.845 1.00 2.21 C ATOM 1085 C VAL A 79 -24.580 -8.672 -6.886 1.00 3.53 C ATOM 1086 O VAL A 79 -24.321 -8.609 -8.107 1.00 42.30 O ATOM 1087 CB VAL A 79 -22.920 -7.063 -5.719 1.00 52.31 C ATOM 1088 CG1 VAL A 79 -22.460 -6.477 -7.027 1.00 5.42 C ATOM 1089 CG2 VAL A 79 -23.915 -6.161 -5.054 1.00 11.23 C ATOM 0 H VAL A 79 -21.679 -9.078 -6.786 1.00 53.02 H new ATOM 0 HA VAL A 79 -23.847 -8.796 -4.858 1.00 2.21 H new ATOM 0 HB VAL A 79 -22.039 -7.131 -5.081 1.00 52.31 H new ATOM 0 HG11 VAL A 79 -22.105 -5.459 -6.865 1.00 5.42 H new ATOM 0 HG12 VAL A 79 -21.650 -7.083 -7.432 1.00 5.42 H new ATOM 0 HG13 VAL A 79 -23.291 -6.464 -7.732 1.00 5.42 H new ATOM 0 HG21 VAL A 79 -23.505 -5.153 -4.988 1.00 11.23 H new ATOM 0 HG22 VAL A 79 -24.835 -6.141 -5.638 1.00 11.23 H new ATOM 0 HG23 VAL A 79 -24.129 -6.532 -4.052 1.00 11.23 H new ATOM 1099 N THR A 80 -25.793 -8.902 -6.429 1.00 13.02 N ATOM 1100 CA THR A 80 -26.905 -9.072 -7.335 1.00 62.42 C ATOM 1101 C THR A 80 -27.347 -7.722 -7.888 1.00 44.45 C ATOM 1102 O THR A 80 -26.864 -6.667 -7.447 1.00 11.21 O ATOM 1103 CB THR A 80 -28.117 -9.798 -6.660 1.00 3.21 C ATOM 1104 OG1 THR A 80 -28.594 -9.038 -5.548 1.00 53.41 O ATOM 1105 CG2 THR A 80 -27.725 -11.183 -6.170 1.00 45.31 C ATOM 0 H THR A 80 -26.032 -8.975 -5.440 1.00 13.02 H new ATOM 0 HA THR A 80 -26.560 -9.706 -8.152 1.00 62.42 H new ATOM 0 HB THR A 80 -28.901 -9.893 -7.412 1.00 3.21 H new ATOM 0 HG1 THR A 80 -28.072 -9.264 -4.750 1.00 53.41 H new ATOM 0 HG21 THR A 80 -28.587 -11.662 -5.706 1.00 45.31 H new ATOM 0 HG22 THR A 80 -27.385 -11.785 -7.013 1.00 45.31 H new ATOM 0 HG23 THR A 80 -26.921 -11.096 -5.439 1.00 45.31 H new ATOM 1113 N SER A 81 -28.244 -7.748 -8.829 1.00 14.20 N ATOM 1114 CA SER A 81 -28.761 -6.547 -9.447 1.00 22.32 C ATOM 1115 C SER A 81 -29.444 -5.606 -8.421 1.00 44.53 C ATOM 1116 O SER A 81 -29.239 -4.384 -8.446 1.00 13.24 O ATOM 1117 CB SER A 81 -29.705 -6.969 -10.560 1.00 55.42 C ATOM 1118 OG SER A 81 -30.558 -8.002 -10.097 1.00 44.32 O ATOM 0 H SER A 81 -28.646 -8.610 -9.198 1.00 14.20 H new ATOM 0 HA SER A 81 -27.940 -5.963 -9.862 1.00 22.32 H new ATOM 0 HB2 SER A 81 -30.297 -6.116 -10.891 1.00 55.42 H new ATOM 0 HB3 SER A 81 -29.135 -7.314 -11.422 1.00 55.42 H new ATOM 0 HG SER A 81 -31.167 -8.271 -10.817 1.00 44.32 H new ATOM 1124 N ASP A 82 -30.207 -6.192 -7.497 1.00 40.02 N ATOM 1125 CA ASP A 82 -30.936 -5.428 -6.460 1.00 2.21 C ATOM 1126 C ASP A 82 -29.970 -4.730 -5.524 1.00 31.12 C ATOM 1127 O ASP A 82 -30.205 -3.619 -5.066 1.00 23.43 O ATOM 1128 CB ASP A 82 -31.833 -6.355 -5.636 1.00 55.01 C ATOM 1129 CG ASP A 82 -32.876 -7.056 -6.455 1.00 53.41 C ATOM 1130 OD1 ASP A 82 -32.579 -8.135 -7.036 1.00 61.23 O ATOM 1131 OD2 ASP A 82 -34.021 -6.558 -6.534 1.00 63.44 O ATOM 0 H ASP A 82 -30.342 -7.201 -7.438 1.00 40.02 H new ATOM 0 HA ASP A 82 -31.547 -4.685 -6.972 1.00 2.21 H new ATOM 0 HB2 ASP A 82 -31.213 -7.099 -5.137 1.00 55.01 H new ATOM 0 HB3 ASP A 82 -32.324 -5.774 -4.856 1.00 55.01 H new ATOM 1136 N GLU A 83 -28.890 -5.389 -5.248 1.00 31.01 N ATOM 1137 CA GLU A 83 -27.871 -4.866 -4.375 1.00 20.33 C ATOM 1138 C GLU A 83 -27.026 -3.835 -5.145 1.00 73.05 C ATOM 1139 O GLU A 83 -26.534 -2.867 -4.568 1.00 23.45 O ATOM 1140 CB GLU A 83 -27.016 -6.022 -3.893 1.00 71.41 C ATOM 1141 CG GLU A 83 -27.794 -7.117 -3.181 1.00 55.43 C ATOM 1142 CD GLU A 83 -26.945 -8.330 -2.884 1.00 4.11 C ATOM 1143 OE1 GLU A 83 -26.548 -9.018 -3.841 1.00 11.52 O ATOM 1144 OE2 GLU A 83 -26.697 -8.641 -1.706 1.00 62.51 O ATOM 0 H GLU A 83 -28.682 -6.315 -5.623 1.00 31.01 H new ATOM 0 HA GLU A 83 -28.314 -4.368 -3.513 1.00 20.33 H new ATOM 0 HB2 GLU A 83 -26.497 -6.457 -4.747 1.00 71.41 H new ATOM 0 HB3 GLU A 83 -26.251 -5.637 -3.218 1.00 71.41 H new ATOM 0 HG2 GLU A 83 -28.198 -6.723 -2.248 1.00 55.43 H new ATOM 0 HG3 GLU A 83 -28.643 -7.414 -3.796 1.00 55.43 H new ATOM 1151 N LEU A 84 -26.888 -4.046 -6.455 1.00 24.14 N ATOM 1152 CA LEU A 84 -26.150 -3.130 -7.316 1.00 4.33 C ATOM 1153 C LEU A 84 -26.861 -1.787 -7.404 1.00 10.24 C ATOM 1154 O LEU A 84 -26.231 -0.738 -7.266 1.00 61.50 O ATOM 1155 CB LEU A 84 -25.997 -3.691 -8.723 1.00 42.01 C ATOM 1156 CG LEU A 84 -25.211 -2.805 -9.692 1.00 33.40 C ATOM 1157 CD1 LEU A 84 -23.730 -2.770 -9.354 1.00 33.14 C ATOM 1158 CD2 LEU A 84 -25.439 -3.215 -11.114 1.00 61.11 C ATOM 0 H LEU A 84 -27.282 -4.851 -6.943 1.00 24.14 H new ATOM 0 HA LEU A 84 -25.162 -3.000 -6.873 1.00 4.33 H new ATOM 0 HB2 LEU A 84 -25.503 -4.661 -8.659 1.00 42.01 H new ATOM 0 HB3 LEU A 84 -26.990 -3.865 -9.138 1.00 42.01 H new ATOM 0 HG LEU A 84 -25.589 -1.789 -9.577 1.00 33.40 H new ATOM 0 HD11 LEU A 84 -23.209 -2.130 -10.066 1.00 33.14 H new ATOM 0 HD12 LEU A 84 -23.596 -2.376 -8.347 1.00 33.14 H new ATOM 0 HD13 LEU A 84 -23.321 -3.779 -9.406 1.00 33.14 H new ATOM 0 HD21 LEU A 84 -24.866 -2.566 -11.776 1.00 61.11 H new ATOM 0 HD22 LEU A 84 -25.117 -4.247 -11.251 1.00 61.11 H new ATOM 0 HD23 LEU A 84 -26.500 -3.131 -11.351 1.00 61.11 H new ATOM 1170 N GLU A 85 -28.184 -1.818 -7.641 1.00 34.20 N ATOM 1171 CA GLU A 85 -28.972 -0.584 -7.722 1.00 54.22 C ATOM 1172 C GLU A 85 -28.913 0.153 -6.381 1.00 72.32 C ATOM 1173 O GLU A 85 -28.987 1.373 -6.323 1.00 2.22 O ATOM 1174 CB GLU A 85 -30.443 -0.850 -8.136 1.00 3.10 C ATOM 1175 CG GLU A 85 -31.232 -1.692 -7.156 1.00 72.24 C ATOM 1176 CD GLU A 85 -32.695 -1.809 -7.506 1.00 13.15 C ATOM 1177 OE1 GLU A 85 -33.461 -0.887 -7.171 1.00 52.35 O ATOM 1178 OE2 GLU A 85 -33.113 -2.832 -8.081 1.00 72.33 O ATOM 0 H GLU A 85 -28.721 -2.674 -7.778 1.00 34.20 H new ATOM 0 HA GLU A 85 -28.535 0.040 -8.501 1.00 54.22 H new ATOM 0 HB2 GLU A 85 -30.950 0.107 -8.263 1.00 3.10 H new ATOM 0 HB3 GLU A 85 -30.449 -1.345 -9.107 1.00 3.10 H new ATOM 0 HG2 GLU A 85 -30.796 -2.690 -7.113 1.00 72.24 H new ATOM 0 HG3 GLU A 85 -31.138 -1.260 -6.160 1.00 72.24 H new ATOM 1185 N ASN A 86 -28.758 -0.618 -5.319 1.00 31.32 N ATOM 1186 CA ASN A 86 -28.638 -0.105 -3.969 1.00 43.23 C ATOM 1187 C ASN A 86 -27.323 0.667 -3.827 1.00 30.11 C ATOM 1188 O ASN A 86 -27.289 1.755 -3.278 1.00 14.33 O ATOM 1189 CB ASN A 86 -28.690 -1.283 -2.988 1.00 71.13 C ATOM 1190 CG ASN A 86 -28.496 -0.919 -1.560 1.00 72.10 C ATOM 1191 OD1 ASN A 86 -29.433 -0.588 -0.848 1.00 13.42 O ATOM 1192 ND2 ASN A 86 -27.305 -1.033 -1.124 1.00 23.20 N ATOM 0 H ASN A 86 -28.711 -1.635 -5.373 1.00 31.32 H new ATOM 0 HA ASN A 86 -29.458 0.578 -3.749 1.00 43.23 H new ATOM 0 HB2 ASN A 86 -29.654 -1.782 -3.093 1.00 71.13 H new ATOM 0 HB3 ASN A 86 -27.925 -2.006 -3.271 1.00 71.13 H new ATOM 0 HD21 ASN A 86 -27.101 -0.845 -0.142 1.00 23.20 H new ATOM 0 HD22 ASN A 86 -26.555 -1.312 -1.756 1.00 23.20 H new ATOM 1199 N LEU A 87 -26.257 0.091 -4.362 1.00 51.31 N ATOM 1200 CA LEU A 87 -24.927 0.715 -4.356 1.00 71.41 C ATOM 1201 C LEU A 87 -24.951 1.978 -5.188 1.00 63.34 C ATOM 1202 O LEU A 87 -24.420 3.022 -4.786 1.00 25.43 O ATOM 1203 CB LEU A 87 -23.884 -0.250 -4.937 1.00 52.21 C ATOM 1204 CG LEU A 87 -23.631 -1.538 -4.156 1.00 63.01 C ATOM 1205 CD1 LEU A 87 -22.687 -2.441 -4.935 1.00 32.23 C ATOM 1206 CD2 LEU A 87 -23.025 -1.216 -2.801 1.00 22.51 C ATOM 0 H LEU A 87 -26.282 -0.823 -4.815 1.00 51.31 H new ATOM 0 HA LEU A 87 -24.660 0.956 -3.327 1.00 71.41 H new ATOM 0 HB2 LEU A 87 -24.195 -0.520 -5.946 1.00 52.21 H new ATOM 0 HB3 LEU A 87 -22.938 0.285 -5.027 1.00 52.21 H new ATOM 0 HG LEU A 87 -24.581 -2.052 -4.010 1.00 63.01 H new ATOM 0 HD11 LEU A 87 -22.512 -3.357 -4.371 1.00 32.23 H new ATOM 0 HD12 LEU A 87 -23.132 -2.688 -5.899 1.00 32.23 H new ATOM 0 HD13 LEU A 87 -21.740 -1.926 -5.094 1.00 32.23 H new ATOM 0 HD21 LEU A 87 -22.849 -2.141 -2.252 1.00 22.51 H new ATOM 0 HD22 LEU A 87 -22.080 -0.691 -2.941 1.00 22.51 H new ATOM 0 HD23 LEU A 87 -23.711 -0.584 -2.236 1.00 22.51 H new ATOM 1218 N ASP A 88 -25.599 1.877 -6.335 1.00 3.43 N ATOM 1219 CA ASP A 88 -25.728 2.984 -7.274 1.00 54.25 C ATOM 1220 C ASP A 88 -26.559 4.094 -6.666 1.00 25.21 C ATOM 1221 O ASP A 88 -26.402 5.252 -6.997 1.00 31.42 O ATOM 1222 CB ASP A 88 -26.343 2.495 -8.589 1.00 63.31 C ATOM 1223 CG ASP A 88 -26.450 3.581 -9.634 1.00 20.21 C ATOM 1224 OD1 ASP A 88 -25.427 3.920 -10.248 1.00 21.15 O ATOM 1225 OD2 ASP A 88 -27.567 4.082 -9.876 1.00 35.32 O ATOM 0 H ASP A 88 -26.055 1.019 -6.646 1.00 3.43 H new ATOM 0 HA ASP A 88 -24.736 3.382 -7.490 1.00 54.25 H new ATOM 0 HB2 ASP A 88 -25.739 1.678 -8.984 1.00 63.31 H new ATOM 0 HB3 ASP A 88 -27.336 2.091 -8.391 1.00 63.31 H new ATOM 1230 N ALA A 89 -27.434 3.730 -5.774 1.00 41.42 N ATOM 1231 CA ALA A 89 -28.237 4.688 -5.070 1.00 70.40 C ATOM 1232 C ALA A 89 -27.401 5.398 -4.000 1.00 25.21 C ATOM 1233 O ALA A 89 -27.381 6.633 -3.931 1.00 55.42 O ATOM 1234 CB ALA A 89 -29.429 3.996 -4.436 1.00 55.41 C ATOM 0 H ALA A 89 -27.611 2.760 -5.514 1.00 41.42 H new ATOM 0 HA ALA A 89 -28.598 5.435 -5.777 1.00 70.40 H new ATOM 0 HB1 ALA A 89 -30.034 4.729 -3.903 1.00 55.41 H new ATOM 0 HB2 ALA A 89 -30.031 3.524 -5.212 1.00 55.41 H new ATOM 0 HB3 ALA A 89 -29.079 3.237 -3.736 1.00 55.41 H new ATOM 1240 N VAL A 90 -26.680 4.613 -3.209 1.00 12.52 N ATOM 1241 CA VAL A 90 -25.908 5.142 -2.093 1.00 4.21 C ATOM 1242 C VAL A 90 -24.691 5.968 -2.557 1.00 34.42 C ATOM 1243 O VAL A 90 -24.587 7.155 -2.241 1.00 32.12 O ATOM 1244 CB VAL A 90 -25.454 3.993 -1.134 1.00 42.24 C ATOM 1245 CG1 VAL A 90 -24.607 4.528 0.009 1.00 23.11 C ATOM 1246 CG2 VAL A 90 -26.666 3.257 -0.577 1.00 61.24 C ATOM 0 H VAL A 90 -26.614 3.601 -3.322 1.00 12.52 H new ATOM 0 HA VAL A 90 -26.568 5.817 -1.548 1.00 4.21 H new ATOM 0 HB VAL A 90 -24.846 3.299 -1.714 1.00 42.24 H new ATOM 0 HG11 VAL A 90 -24.308 3.704 0.657 1.00 23.11 H new ATOM 0 HG12 VAL A 90 -23.718 5.014 -0.393 1.00 23.11 H new ATOM 0 HG13 VAL A 90 -25.187 5.250 0.584 1.00 23.11 H new ATOM 0 HG21 VAL A 90 -26.334 2.460 0.089 1.00 61.24 H new ATOM 0 HG22 VAL A 90 -27.293 3.955 -0.022 1.00 61.24 H new ATOM 0 HG23 VAL A 90 -27.240 2.828 -1.398 1.00 61.24 H new ATOM 1256 N GLU A 91 -23.804 5.364 -3.324 1.00 44.11 N ATOM 1257 CA GLU A 91 -22.618 6.074 -3.798 1.00 51.44 C ATOM 1258 C GLU A 91 -22.947 6.976 -4.975 1.00 1.41 C ATOM 1259 O GLU A 91 -22.402 8.067 -5.110 1.00 53.43 O ATOM 1260 CB GLU A 91 -21.474 5.111 -4.123 1.00 21.44 C ATOM 1261 CG GLU A 91 -20.968 4.330 -2.912 1.00 13.33 C ATOM 1262 CD GLU A 91 -20.367 5.220 -1.822 1.00 22.51 C ATOM 1263 OE1 GLU A 91 -21.127 5.909 -1.100 1.00 13.14 O ATOM 1264 OE2 GLU A 91 -19.119 5.218 -1.650 1.00 73.53 O ATOM 0 H GLU A 91 -23.875 4.394 -3.633 1.00 44.11 H new ATOM 0 HA GLU A 91 -22.274 6.713 -2.985 1.00 51.44 H new ATOM 0 HB2 GLU A 91 -21.809 4.407 -4.885 1.00 21.44 H new ATOM 0 HB3 GLU A 91 -20.646 5.675 -4.552 1.00 21.44 H new ATOM 0 HG2 GLU A 91 -21.793 3.756 -2.489 1.00 13.33 H new ATOM 0 HG3 GLU A 91 -20.216 3.612 -3.240 1.00 13.33 H new ATOM 1271 N GLY A 92 -23.889 6.532 -5.797 1.00 4.21 N ATOM 1272 CA GLY A 92 -24.304 7.264 -6.996 1.00 11.21 C ATOM 1273 C GLY A 92 -24.853 8.646 -6.701 1.00 32.44 C ATOM 1274 O GLY A 92 -24.958 9.484 -7.594 1.00 32.41 O ATOM 0 H GLY A 92 -24.389 5.655 -5.655 1.00 4.21 H new ATOM 0 HA2 GLY A 92 -23.451 7.356 -7.669 1.00 11.21 H new ATOM 0 HA3 GLY A 92 -25.063 6.685 -7.521 1.00 11.21 H new ATOM 1278 N ASN A 93 -25.202 8.877 -5.446 1.00 50.40 N ATOM 1279 CA ASN A 93 -25.714 10.164 -4.996 1.00 73.25 C ATOM 1280 C ASN A 93 -24.704 11.278 -5.294 1.00 25.43 C ATOM 1281 O ASN A 93 -25.087 12.384 -5.665 1.00 32.15 O ATOM 1282 CB ASN A 93 -25.987 10.122 -3.482 1.00 11.13 C ATOM 1283 CG ASN A 93 -26.534 11.436 -2.923 1.00 51.42 C ATOM 1284 OD1 ASN A 93 -27.266 12.169 -3.597 1.00 32.44 O ATOM 1285 ND2 ASN A 93 -26.160 11.756 -1.709 1.00 62.55 N ATOM 0 H ASN A 93 -25.139 8.176 -4.707 1.00 50.40 H new ATOM 0 HA ASN A 93 -26.641 10.369 -5.531 1.00 73.25 H new ATOM 0 HB2 ASN A 93 -26.698 9.323 -3.271 1.00 11.13 H new ATOM 0 HB3 ASN A 93 -25.063 9.872 -2.961 1.00 11.13 H new ATOM 0 HD21 ASN A 93 -26.474 12.633 -1.293 1.00 62.55 H new ATOM 0 HD22 ASN A 93 -25.555 11.128 -1.180 1.00 62.55 H new ATOM 1292 N GLU A 94 -23.411 10.979 -5.145 1.00 73.12 N ATOM 1293 CA GLU A 94 -22.368 11.978 -5.394 1.00 31.23 C ATOM 1294 C GLU A 94 -21.233 11.415 -6.265 1.00 41.54 C ATOM 1295 O GLU A 94 -20.216 12.068 -6.484 1.00 63.43 O ATOM 1296 CB GLU A 94 -21.829 12.535 -4.059 1.00 72.34 C ATOM 1297 CG GLU A 94 -22.905 13.218 -3.221 1.00 42.22 C ATOM 1298 CD GLU A 94 -22.409 13.744 -1.900 1.00 74.42 C ATOM 1299 OE1 GLU A 94 -22.333 12.957 -0.934 1.00 52.34 O ATOM 1300 OE2 GLU A 94 -22.111 14.945 -1.792 1.00 2.32 O ATOM 0 H GLU A 94 -23.064 10.064 -4.857 1.00 73.12 H new ATOM 0 HA GLU A 94 -22.817 12.799 -5.953 1.00 31.23 H new ATOM 0 HB2 GLU A 94 -21.390 11.721 -3.483 1.00 72.34 H new ATOM 0 HB3 GLU A 94 -21.030 13.247 -4.265 1.00 72.34 H new ATOM 0 HG2 GLU A 94 -23.328 14.043 -3.794 1.00 42.22 H new ATOM 0 HG3 GLU A 94 -23.713 12.510 -3.038 1.00 42.22 H new ATOM 1307 N TYR A 95 -21.429 10.225 -6.779 1.00 43.21 N ATOM 1308 CA TYR A 95 -20.436 9.552 -7.614 1.00 10.13 C ATOM 1309 C TYR A 95 -21.066 9.025 -8.876 1.00 44.21 C ATOM 1310 O TYR A 95 -22.283 8.994 -8.997 1.00 54.10 O ATOM 1311 CB TYR A 95 -19.788 8.385 -6.890 1.00 71.31 C ATOM 1312 CG TYR A 95 -18.950 8.730 -5.696 1.00 64.44 C ATOM 1313 CD1 TYR A 95 -19.508 8.839 -4.431 1.00 64.40 C ATOM 1314 CD2 TYR A 95 -17.590 8.915 -5.833 1.00 60.30 C ATOM 1315 CE1 TYR A 95 -18.730 9.127 -3.340 1.00 25.13 C ATOM 1316 CE2 TYR A 95 -16.805 9.195 -4.748 1.00 24.23 C ATOM 1317 CZ TYR A 95 -17.381 9.301 -3.504 1.00 70.24 C ATOM 1318 OH TYR A 95 -16.597 9.558 -2.418 1.00 75.24 O ATOM 0 H TYR A 95 -22.282 9.685 -6.635 1.00 43.21 H new ATOM 0 HA TYR A 95 -19.676 10.297 -7.852 1.00 10.13 H new ATOM 0 HB2 TYR A 95 -20.574 7.701 -6.571 1.00 71.31 H new ATOM 0 HB3 TYR A 95 -19.164 7.844 -7.602 1.00 71.31 H new ATOM 0 HD1 TYR A 95 -20.571 8.695 -4.304 1.00 64.40 H new ATOM 0 HD2 TYR A 95 -17.138 8.838 -6.811 1.00 60.30 H new ATOM 0 HE1 TYR A 95 -19.176 9.216 -2.360 1.00 25.13 H new ATOM 0 HE2 TYR A 95 -15.740 9.332 -4.868 1.00 24.23 H new ATOM 0 HH TYR A 95 -15.789 10.033 -2.703 1.00 75.24 H new ATOM 1328 N GLU A 96 -20.237 8.605 -9.802 1.00 13.13 N ATOM 1329 CA GLU A 96 -20.698 8.044 -11.047 1.00 50.31 C ATOM 1330 C GLU A 96 -20.130 6.663 -11.187 1.00 10.32 C ATOM 1331 O GLU A 96 -18.918 6.452 -10.998 1.00 55.10 O ATOM 1332 CB GLU A 96 -20.262 8.925 -12.242 1.00 12.14 C ATOM 1333 CG GLU A 96 -20.713 8.434 -13.611 1.00 35.24 C ATOM 1334 CD GLU A 96 -20.382 9.412 -14.729 1.00 22.30 C ATOM 1335 OE1 GLU A 96 -19.227 9.432 -15.218 1.00 33.21 O ATOM 1336 OE2 GLU A 96 -21.285 10.167 -15.145 1.00 43.30 O ATOM 0 H GLU A 96 -19.222 8.643 -9.712 1.00 13.13 H new ATOM 0 HA GLU A 96 -21.787 8.002 -11.045 1.00 50.31 H new ATOM 0 HB2 GLU A 96 -20.649 9.932 -12.090 1.00 12.14 H new ATOM 0 HB3 GLU A 96 -19.174 8.998 -12.241 1.00 12.14 H new ATOM 0 HG2 GLU A 96 -20.239 7.475 -13.822 1.00 35.24 H new ATOM 0 HG3 GLU A 96 -21.789 8.261 -13.593 1.00 35.24 H new ATOM 1343 N ARG A 97 -20.999 5.727 -11.486 1.00 65.44 N ATOM 1344 CA ARG A 97 -20.619 4.362 -11.670 1.00 43.04 C ATOM 1345 C ARG A 97 -20.192 4.190 -13.100 1.00 41.52 C ATOM 1346 O ARG A 97 -20.992 4.342 -14.022 1.00 14.30 O ATOM 1347 CB ARG A 97 -21.813 3.449 -11.362 1.00 22.42 C ATOM 1348 CG ARG A 97 -21.539 1.960 -11.506 1.00 34.40 C ATOM 1349 CD ARG A 97 -22.793 1.140 -11.227 1.00 31.53 C ATOM 1350 NE ARG A 97 -23.880 1.447 -12.171 1.00 20.20 N ATOM 1351 CZ ARG A 97 -25.129 0.944 -12.114 1.00 32.12 C ATOM 1352 NH1 ARG A 97 -25.486 0.146 -11.116 1.00 61.43 N ATOM 1353 NH2 ARG A 97 -26.022 1.264 -13.043 1.00 63.41 N ATOM 0 H ARG A 97 -21.997 5.901 -11.608 1.00 65.44 H new ATOM 0 HA ARG A 97 -19.801 4.097 -11.000 1.00 43.04 H new ATOM 0 HB2 ARG A 97 -22.147 3.645 -10.343 1.00 22.42 H new ATOM 0 HB3 ARG A 97 -22.636 3.717 -12.024 1.00 22.42 H new ATOM 0 HG2 ARG A 97 -21.180 1.749 -12.513 1.00 34.40 H new ATOM 0 HG3 ARG A 97 -20.747 1.665 -10.817 1.00 34.40 H new ATOM 0 HD2 ARG A 97 -22.552 0.079 -11.286 1.00 31.53 H new ATOM 0 HD3 ARG A 97 -23.132 1.333 -10.209 1.00 31.53 H new ATOM 0 HE ARG A 97 -23.671 2.094 -12.931 1.00 20.20 H new ATOM 0 HH11 ARG A 97 -24.814 -0.090 -10.386 1.00 61.43 H new ATOM 0 HH12 ARG A 97 -26.433 -0.231 -11.079 1.00 61.43 H new ATOM 0 HH21 ARG A 97 -25.764 1.893 -13.804 1.00 63.41 H new ATOM 0 HH22 ARG A 97 -26.966 0.881 -12.996 1.00 63.41 H new ATOM 1367 N VAL A 98 -18.941 3.906 -13.282 1.00 62.51 N ATOM 1368 CA VAL A 98 -18.371 3.759 -14.595 1.00 34.00 C ATOM 1369 C VAL A 98 -17.677 2.453 -14.758 1.00 61.42 C ATOM 1370 O VAL A 98 -17.344 1.785 -13.771 1.00 53.04 O ATOM 1371 CB VAL A 98 -17.424 4.903 -14.988 1.00 30.34 C ATOM 1372 CG1 VAL A 98 -18.204 6.184 -15.096 1.00 33.14 C ATOM 1373 CG2 VAL A 98 -16.290 5.048 -13.971 1.00 31.35 C ATOM 0 H VAL A 98 -18.276 3.767 -12.521 1.00 62.51 H new ATOM 0 HA VAL A 98 -19.223 3.797 -15.274 1.00 34.00 H new ATOM 0 HB VAL A 98 -16.975 4.673 -15.954 1.00 30.34 H new ATOM 0 HG11 VAL A 98 -17.533 6.996 -15.375 1.00 33.14 H new ATOM 0 HG12 VAL A 98 -18.978 6.076 -15.856 1.00 33.14 H new ATOM 0 HG13 VAL A 98 -18.668 6.410 -14.136 1.00 33.14 H new ATOM 0 HG21 VAL A 98 -15.634 5.864 -14.272 1.00 31.35 H new ATOM 0 HG22 VAL A 98 -16.708 5.262 -12.988 1.00 31.35 H new ATOM 0 HG23 VAL A 98 -15.719 4.120 -13.928 1.00 31.35 H new ATOM 1383 N THR A 99 -17.457 2.093 -15.984 1.00 30.35 N ATOM 1384 CA THR A 99 -16.835 0.845 -16.296 1.00 75.43 C ATOM 1385 C THR A 99 -15.324 1.016 -16.265 1.00 1.51 C ATOM 1386 O THR A 99 -14.761 1.902 -16.919 1.00 52.23 O ATOM 1387 CB THR A 99 -17.315 0.270 -17.676 1.00 43.02 C ATOM 1388 OG1 THR A 99 -16.698 -1.012 -17.940 1.00 4.20 O ATOM 1389 CG2 THR A 99 -17.009 1.226 -18.826 1.00 71.25 C ATOM 0 H THR A 99 -17.704 2.657 -16.797 1.00 30.35 H new ATOM 0 HA THR A 99 -17.132 0.116 -15.542 1.00 75.43 H new ATOM 0 HB THR A 99 -18.396 0.147 -17.610 1.00 43.02 H new ATOM 0 HG1 THR A 99 -17.011 -1.354 -18.803 1.00 4.20 H new ATOM 0 HG21 THR A 99 -17.357 0.791 -19.763 1.00 71.25 H new ATOM 0 HG22 THR A 99 -17.518 2.175 -18.655 1.00 71.25 H new ATOM 0 HG23 THR A 99 -15.934 1.396 -18.882 1.00 71.25 H new ATOM 1397 N VAL A 100 -14.683 0.210 -15.479 1.00 31.04 N ATOM 1398 CA VAL A 100 -13.234 0.284 -15.344 1.00 34.31 C ATOM 1399 C VAL A 100 -12.585 -1.093 -15.420 1.00 54.31 C ATOM 1400 O VAL A 100 -13.266 -2.125 -15.419 1.00 52.42 O ATOM 1401 CB VAL A 100 -12.790 0.999 -14.034 1.00 70.44 C ATOM 1402 CG1 VAL A 100 -13.239 2.454 -14.019 1.00 61.11 C ATOM 1403 CG2 VAL A 100 -13.309 0.268 -12.803 1.00 13.45 C ATOM 0 H VAL A 100 -15.127 -0.514 -14.913 1.00 31.04 H new ATOM 0 HA VAL A 100 -12.892 0.882 -16.188 1.00 34.31 H new ATOM 0 HB VAL A 100 -11.701 0.980 -14.007 1.00 70.44 H new ATOM 0 HG11 VAL A 100 -12.914 2.926 -13.092 1.00 61.11 H new ATOM 0 HG12 VAL A 100 -12.799 2.979 -14.867 1.00 61.11 H new ATOM 0 HG13 VAL A 100 -14.326 2.500 -14.088 1.00 61.11 H new ATOM 0 HG21 VAL A 100 -12.982 0.791 -11.904 1.00 13.45 H new ATOM 0 HG22 VAL A 100 -14.398 0.238 -12.830 1.00 13.45 H new ATOM 0 HG23 VAL A 100 -12.918 -0.750 -12.792 1.00 13.45 H new ATOM 1413 N GLY A 101 -11.286 -1.106 -15.497 1.00 5.13 N ATOM 1414 CA GLY A 101 -10.561 -2.334 -15.559 1.00 63.02 C ATOM 1415 C GLY A 101 -9.600 -2.435 -14.419 1.00 1.15 C ATOM 1416 O GLY A 101 -8.723 -1.585 -14.267 1.00 4.45 O ATOM 0 H GLY A 101 -10.705 -0.268 -15.518 1.00 5.13 H new ATOM 0 HA2 GLY A 101 -11.255 -3.174 -15.532 1.00 63.02 H new ATOM 0 HA3 GLY A 101 -10.021 -2.397 -16.504 1.00 63.02 H new ATOM 1420 N ILE A 102 -9.753 -3.444 -13.618 1.00 61.44 N ATOM 1421 CA ILE A 102 -8.914 -3.623 -12.462 1.00 34.31 C ATOM 1422 C ILE A 102 -8.088 -4.872 -12.595 1.00 5.21 C ATOM 1423 O ILE A 102 -8.389 -5.724 -13.414 1.00 32.14 O ATOM 1424 CB ILE A 102 -9.740 -3.610 -11.117 1.00 5.23 C ATOM 1425 CG1 ILE A 102 -10.856 -4.666 -11.062 1.00 41.52 C ATOM 1426 CG2 ILE A 102 -10.339 -2.258 -10.878 1.00 3.10 C ATOM 1427 CD1 ILE A 102 -10.428 -6.080 -10.817 1.00 61.52 C ATOM 0 H ILE A 102 -10.460 -4.168 -13.742 1.00 61.44 H new ATOM 0 HA ILE A 102 -8.235 -2.772 -12.414 1.00 34.31 H new ATOM 0 HB ILE A 102 -9.022 -3.857 -10.335 1.00 5.23 H new ATOM 0 HG12 ILE A 102 -11.557 -4.381 -10.277 1.00 41.52 H new ATOM 0 HG13 ILE A 102 -11.403 -4.634 -12.004 1.00 41.52 H new ATOM 0 HG21 ILE A 102 -10.904 -2.270 -9.946 1.00 3.10 H new ATOM 0 HG22 ILE A 102 -9.545 -1.515 -10.811 1.00 3.10 H new ATOM 0 HG23 ILE A 102 -11.005 -2.004 -11.703 1.00 3.10 H new ATOM 0 HD11 ILE A 102 -11.304 -6.728 -10.800 1.00 61.52 H new ATOM 0 HD12 ILE A 102 -9.756 -6.400 -11.613 1.00 61.52 H new ATOM 0 HD13 ILE A 102 -9.912 -6.143 -9.859 1.00 61.52 H new ATOM 1439 N VAL A 103 -7.068 -4.978 -11.814 1.00 74.14 N ATOM 1440 CA VAL A 103 -6.235 -6.138 -11.829 1.00 15.03 C ATOM 1441 C VAL A 103 -6.330 -6.780 -10.483 1.00 71.23 C ATOM 1442 O VAL A 103 -6.125 -6.120 -9.464 1.00 3.22 O ATOM 1443 CB VAL A 103 -4.764 -5.796 -12.174 1.00 64.21 C ATOM 1444 CG1 VAL A 103 -3.900 -7.051 -12.207 1.00 73.51 C ATOM 1445 CG2 VAL A 103 -4.681 -5.053 -13.503 1.00 3.20 C ATOM 0 H VAL A 103 -6.785 -4.263 -11.144 1.00 74.14 H new ATOM 0 HA VAL A 103 -6.577 -6.820 -12.607 1.00 15.03 H new ATOM 0 HB VAL A 103 -4.380 -5.144 -11.389 1.00 64.21 H new ATOM 0 HG11 VAL A 103 -2.873 -6.779 -12.452 1.00 73.51 H new ATOM 0 HG12 VAL A 103 -3.924 -7.535 -11.231 1.00 73.51 H new ATOM 0 HG13 VAL A 103 -4.284 -7.737 -12.962 1.00 73.51 H new ATOM 0 HG21 VAL A 103 -3.639 -4.822 -13.726 1.00 3.20 H new ATOM 0 HG22 VAL A 103 -5.092 -5.678 -14.296 1.00 3.20 H new ATOM 0 HG23 VAL A 103 -5.252 -4.127 -13.438 1.00 3.20 H new ATOM 1455 N ARG A 104 -6.674 -8.034 -10.463 1.00 30.34 N ATOM 1456 CA ARG A 104 -6.882 -8.721 -9.238 1.00 50.31 C ATOM 1457 C ARG A 104 -5.532 -9.096 -8.676 1.00 14.13 C ATOM 1458 O ARG A 104 -4.790 -9.870 -9.298 1.00 55.01 O ATOM 1459 CB ARG A 104 -7.719 -9.971 -9.494 1.00 42.33 C ATOM 1460 CG ARG A 104 -8.474 -10.474 -8.284 1.00 33.13 C ATOM 1461 CD ARG A 104 -9.330 -11.683 -8.636 1.00 72.41 C ATOM 1462 NE ARG A 104 -8.539 -12.879 -8.853 1.00 14.23 N ATOM 1463 CZ ARG A 104 -8.651 -13.712 -9.875 1.00 71.52 C ATOM 1464 NH1 ARG A 104 -9.540 -13.491 -10.846 1.00 51.24 N ATOM 1465 NH2 ARG A 104 -7.884 -14.783 -9.910 1.00 54.43 N ATOM 0 H ARG A 104 -6.816 -8.602 -11.298 1.00 30.34 H new ATOM 0 HA ARG A 104 -7.414 -8.090 -8.526 1.00 50.31 H new ATOM 0 HB2 ARG A 104 -8.432 -9.759 -10.290 1.00 42.33 H new ATOM 0 HB3 ARG A 104 -7.065 -10.764 -9.855 1.00 42.33 H new ATOM 0 HG2 ARG A 104 -7.769 -10.740 -7.496 1.00 33.13 H new ATOM 0 HG3 ARG A 104 -9.107 -9.679 -7.890 1.00 33.13 H new ATOM 0 HD2 ARG A 104 -10.044 -11.864 -7.833 1.00 72.41 H new ATOM 0 HD3 ARG A 104 -9.908 -11.466 -9.534 1.00 72.41 H new ATOM 0 HE ARG A 104 -7.831 -13.098 -8.153 1.00 14.23 H new ATOM 0 HH11 ARG A 104 -10.145 -12.671 -10.807 1.00 51.24 H new ATOM 0 HH12 ARG A 104 -9.614 -14.142 -11.627 1.00 51.24 H new ATOM 0 HH21 ARG A 104 -7.218 -14.958 -9.157 1.00 54.43 H new ATOM 0 HH22 ARG A 104 -7.956 -15.437 -10.690 1.00 54.43 H new ATOM 1479 N GLU A 105 -5.225 -8.578 -7.493 1.00 62.42 N ATOM 1480 CA GLU A 105 -3.923 -8.775 -6.842 1.00 71.32 C ATOM 1481 C GLU A 105 -3.725 -10.234 -6.441 1.00 72.24 C ATOM 1482 O GLU A 105 -2.648 -10.632 -5.979 1.00 5.42 O ATOM 1483 CB GLU A 105 -3.782 -7.853 -5.634 1.00 41.01 C ATOM 1484 CG GLU A 105 -3.949 -6.380 -5.968 1.00 10.24 C ATOM 1485 CD GLU A 105 -3.767 -5.486 -4.771 1.00 5.22 C ATOM 1486 OE1 GLU A 105 -4.644 -5.469 -3.893 1.00 24.31 O ATOM 1487 OE2 GLU A 105 -2.731 -4.790 -4.679 1.00 15.31 O ATOM 0 H GLU A 105 -5.872 -8.005 -6.950 1.00 62.42 H new ATOM 0 HA GLU A 105 -3.143 -8.519 -7.559 1.00 71.32 H new ATOM 0 HB2 GLU A 105 -4.523 -8.133 -4.886 1.00 41.01 H new ATOM 0 HB3 GLU A 105 -2.801 -8.006 -5.184 1.00 41.01 H new ATOM 0 HG2 GLU A 105 -3.227 -6.102 -6.736 1.00 10.24 H new ATOM 0 HG3 GLU A 105 -4.941 -6.218 -6.389 1.00 10.24 H new ATOM 1494 N ASP A 106 -4.790 -11.008 -6.599 1.00 1.32 N ATOM 1495 CA ASP A 106 -4.776 -12.452 -6.420 1.00 12.12 C ATOM 1496 C ASP A 106 -3.692 -13.050 -7.310 1.00 74.21 C ATOM 1497 O ASP A 106 -2.894 -13.886 -6.864 1.00 34.05 O ATOM 1498 CB ASP A 106 -6.135 -13.007 -6.793 1.00 60.03 C ATOM 1499 CG ASP A 106 -6.239 -14.511 -6.708 1.00 61.05 C ATOM 1500 OD1 ASP A 106 -6.317 -15.049 -5.592 1.00 32.45 O ATOM 1501 OD2 ASP A 106 -6.275 -15.156 -7.759 1.00 41.34 O ATOM 0 H ASP A 106 -5.705 -10.642 -6.860 1.00 1.32 H new ATOM 0 HA ASP A 106 -4.563 -12.707 -5.382 1.00 12.12 H new ATOM 0 HB2 ASP A 106 -6.886 -12.565 -6.138 1.00 60.03 H new ATOM 0 HB3 ASP A 106 -6.375 -12.695 -7.810 1.00 60.03 H new ATOM 1506 N ASN A 107 -3.657 -12.610 -8.578 1.00 74.32 N ATOM 1507 CA ASN A 107 -2.538 -12.972 -9.447 1.00 73.45 C ATOM 1508 C ASN A 107 -2.070 -11.713 -10.168 1.00 12.22 C ATOM 1509 O ASN A 107 -1.422 -10.843 -9.598 1.00 71.31 O ATOM 1510 CB ASN A 107 -2.864 -14.054 -10.527 1.00 42.10 C ATOM 1511 CG ASN A 107 -3.575 -15.272 -10.062 1.00 53.24 C ATOM 1512 OD1 ASN A 107 -2.968 -16.212 -9.555 1.00 20.22 O ATOM 1513 ND2 ASN A 107 -4.857 -15.308 -10.337 1.00 42.22 N ATOM 0 H ASN A 107 -4.369 -12.021 -9.010 1.00 74.32 H new ATOM 0 HA ASN A 107 -1.778 -13.407 -8.798 1.00 73.45 H new ATOM 0 HB2 ASN A 107 -3.466 -13.586 -11.306 1.00 42.10 H new ATOM 0 HB3 ASN A 107 -1.928 -14.364 -10.991 1.00 42.10 H new ATOM 0 HD21 ASN A 107 -5.400 -16.146 -10.129 1.00 42.22 H new ATOM 0 HD22 ASN A 107 -5.311 -14.498 -10.758 1.00 42.22 H new ATOM 1520 N SER A 108 -2.450 -11.631 -11.407 1.00 23.44 N ATOM 1521 CA SER A 108 -2.244 -10.518 -12.265 1.00 54.24 C ATOM 1522 C SER A 108 -3.368 -10.548 -13.281 1.00 10.32 C ATOM 1523 O SER A 108 -3.324 -9.891 -14.321 1.00 34.31 O ATOM 1524 CB SER A 108 -0.870 -10.625 -12.932 1.00 12.04 C ATOM 1525 OG SER A 108 -0.684 -11.909 -13.521 1.00 74.05 O ATOM 0 H SER A 108 -2.944 -12.394 -11.870 1.00 23.44 H new ATOM 0 HA SER A 108 -2.256 -9.573 -11.722 1.00 54.24 H new ATOM 0 HB2 SER A 108 -0.772 -9.854 -13.696 1.00 12.04 H new ATOM 0 HB3 SER A 108 -0.089 -10.444 -12.194 1.00 12.04 H new ATOM 0 HG SER A 108 0.200 -11.951 -13.942 1.00 74.05 H new ATOM 1531 N GLU A 109 -4.407 -11.334 -12.940 1.00 62.32 N ATOM 1532 CA GLU A 109 -5.567 -11.460 -13.772 1.00 73.41 C ATOM 1533 C GLU A 109 -6.349 -10.199 -13.672 1.00 22.32 C ATOM 1534 O GLU A 109 -6.665 -9.732 -12.578 1.00 71.24 O ATOM 1535 CB GLU A 109 -6.456 -12.639 -13.367 1.00 2.01 C ATOM 1536 CG GLU A 109 -5.836 -14.012 -13.514 1.00 75.23 C ATOM 1537 CD GLU A 109 -6.866 -15.114 -13.344 1.00 53.34 C ATOM 1538 OE1 GLU A 109 -7.552 -15.462 -14.333 1.00 24.14 O ATOM 1539 OE2 GLU A 109 -7.019 -15.643 -12.240 1.00 41.41 O ATOM 0 H GLU A 109 -4.444 -11.886 -12.083 1.00 62.32 H new ATOM 0 HA GLU A 109 -5.235 -11.646 -14.793 1.00 73.41 H new ATOM 0 HB2 GLU A 109 -6.754 -12.505 -12.327 1.00 2.01 H new ATOM 0 HB3 GLU A 109 -7.366 -12.606 -13.966 1.00 2.01 H new ATOM 0 HG2 GLU A 109 -5.370 -14.098 -14.496 1.00 75.23 H new ATOM 0 HG3 GLU A 109 -5.045 -14.135 -12.774 1.00 75.23 H new ATOM 1546 N LYS A 110 -6.655 -9.672 -14.765 1.00 22.25 N ATOM 1547 CA LYS A 110 -7.346 -8.430 -14.831 1.00 74.34 C ATOM 1548 C LYS A 110 -8.811 -8.674 -15.070 1.00 63.43 C ATOM 1549 O LYS A 110 -9.198 -9.660 -15.713 1.00 33.42 O ATOM 1550 CB LYS A 110 -6.728 -7.515 -15.882 1.00 13.41 C ATOM 1551 CG LYS A 110 -6.706 -8.088 -17.273 1.00 35.14 C ATOM 1552 CD LYS A 110 -5.975 -7.173 -18.217 1.00 24.44 C ATOM 1553 CE LYS A 110 -5.950 -7.746 -19.609 1.00 12.13 C ATOM 1554 NZ LYS A 110 -5.164 -6.908 -20.528 1.00 71.13 N ATOM 0 H LYS A 110 -6.438 -10.081 -15.674 1.00 22.25 H new ATOM 0 HA LYS A 110 -7.247 -7.913 -13.877 1.00 74.34 H new ATOM 0 HB2 LYS A 110 -7.281 -6.576 -15.898 1.00 13.41 H new ATOM 0 HB3 LYS A 110 -5.707 -7.278 -15.584 1.00 13.41 H new ATOM 0 HG2 LYS A 110 -6.224 -9.065 -17.261 1.00 35.14 H new ATOM 0 HG3 LYS A 110 -7.726 -8.240 -17.624 1.00 35.14 H new ATOM 0 HD2 LYS A 110 -6.458 -6.196 -18.230 1.00 24.44 H new ATOM 0 HD3 LYS A 110 -4.955 -7.019 -17.864 1.00 24.44 H new ATOM 0 HE2 LYS A 110 -5.528 -8.751 -19.582 1.00 12.13 H new ATOM 0 HE3 LYS A 110 -6.970 -7.839 -19.983 1.00 12.13 H new ATOM 0 HZ1 LYS A 110 -5.169 -7.334 -21.477 1.00 71.13 H new ATOM 0 HZ2 LYS A 110 -5.581 -5.957 -20.573 1.00 71.13 H new ATOM 0 HZ3 LYS A 110 -4.185 -6.840 -20.184 1.00 71.13 H new ATOM 1568 N MET A 111 -9.616 -7.821 -14.533 1.00 63.21 N ATOM 1569 CA MET A 111 -11.045 -7.958 -14.609 1.00 5.21 C ATOM 1570 C MET A 111 -11.676 -6.664 -14.924 1.00 32.10 C ATOM 1571 O MET A 111 -11.068 -5.597 -14.796 1.00 10.15 O ATOM 1572 CB MET A 111 -11.674 -8.497 -13.340 1.00 65.13 C ATOM 1573 CG MET A 111 -11.151 -9.831 -12.893 1.00 1.20 C ATOM 1574 SD MET A 111 -12.044 -10.499 -11.477 1.00 2.14 S ATOM 1575 CE MET A 111 -12.095 -9.064 -10.430 1.00 24.41 C ATOM 0 H MET A 111 -9.304 -6.996 -14.021 1.00 63.21 H new ATOM 0 HA MET A 111 -11.222 -8.683 -15.403 1.00 5.21 H new ATOM 0 HB2 MET A 111 -11.517 -7.775 -12.539 1.00 65.13 H new ATOM 0 HB3 MET A 111 -12.751 -8.577 -13.491 1.00 65.13 H new ATOM 0 HG2 MET A 111 -11.215 -10.536 -13.722 1.00 1.20 H new ATOM 0 HG3 MET A 111 -10.096 -9.734 -12.637 1.00 1.20 H new ATOM 0 HE1 MET A 111 -12.317 -9.368 -9.407 1.00 24.41 H new ATOM 0 HE2 MET A 111 -11.129 -8.559 -10.457 1.00 24.41 H new ATOM 0 HE3 MET A 111 -12.870 -8.384 -10.783 1.00 24.41 H new ATOM 1585 N ALA A 112 -12.864 -6.752 -15.327 1.00 65.34 N ATOM 1586 CA ALA A 112 -13.633 -5.595 -15.688 1.00 21.44 C ATOM 1587 C ALA A 112 -14.694 -5.386 -14.655 1.00 12.50 C ATOM 1588 O ALA A 112 -15.552 -6.243 -14.464 1.00 65.44 O ATOM 1589 CB ALA A 112 -14.253 -5.751 -17.056 1.00 24.13 C ATOM 0 H ALA A 112 -13.365 -7.635 -15.427 1.00 65.34 H new ATOM 0 HA ALA A 112 -12.974 -4.727 -15.729 1.00 21.44 H new ATOM 0 HB1 ALA A 112 -14.828 -4.858 -17.299 1.00 24.13 H new ATOM 0 HB2 ALA A 112 -13.467 -5.889 -17.798 1.00 24.13 H new ATOM 0 HB3 ALA A 112 -14.912 -6.619 -17.060 1.00 24.13 H new ATOM 1595 N VAL A 113 -14.642 -4.273 -13.993 1.00 35.52 N ATOM 1596 CA VAL A 113 -15.555 -3.988 -12.913 1.00 74.42 C ATOM 1597 C VAL A 113 -16.086 -2.586 -13.066 1.00 61.21 C ATOM 1598 O VAL A 113 -15.682 -1.858 -13.968 1.00 61.14 O ATOM 1599 CB VAL A 113 -14.886 -4.113 -11.505 1.00 75.10 C ATOM 1600 CG1 VAL A 113 -14.289 -5.490 -11.275 1.00 43.42 C ATOM 1601 CG2 VAL A 113 -13.844 -3.036 -11.298 1.00 23.12 C ATOM 0 H VAL A 113 -13.968 -3.531 -14.180 1.00 35.52 H new ATOM 0 HA VAL A 113 -16.355 -4.726 -12.970 1.00 74.42 H new ATOM 0 HB VAL A 113 -15.675 -3.974 -10.766 1.00 75.10 H new ATOM 0 HG11 VAL A 113 -13.836 -5.529 -10.284 1.00 43.42 H new ATOM 0 HG12 VAL A 113 -15.074 -6.243 -11.345 1.00 43.42 H new ATOM 0 HG13 VAL A 113 -13.528 -5.687 -12.030 1.00 43.42 H new ATOM 0 HG21 VAL A 113 -13.396 -3.148 -10.311 1.00 23.12 H new ATOM 0 HG22 VAL A 113 -13.070 -3.127 -12.060 1.00 23.12 H new ATOM 0 HG23 VAL A 113 -14.314 -2.056 -11.374 1.00 23.12 H new ATOM 1611 N LYS A 114 -16.999 -2.218 -12.233 1.00 51.21 N ATOM 1612 CA LYS A 114 -17.485 -0.875 -12.240 1.00 50.53 C ATOM 1613 C LYS A 114 -17.075 -0.196 -10.950 1.00 52.50 C ATOM 1614 O LYS A 114 -16.975 -0.849 -9.919 1.00 54.03 O ATOM 1615 CB LYS A 114 -18.994 -0.841 -12.436 1.00 2.55 C ATOM 1616 CG LYS A 114 -19.447 -1.517 -13.720 1.00 50.43 C ATOM 1617 CD LYS A 114 -20.921 -1.340 -13.915 1.00 45.55 C ATOM 1618 CE LYS A 114 -21.447 -2.118 -15.114 1.00 3.23 C ATOM 1619 NZ LYS A 114 -20.889 -1.655 -16.393 1.00 21.03 N ATOM 0 H LYS A 114 -17.427 -2.828 -11.536 1.00 51.21 H new ATOM 0 HA LYS A 114 -17.047 -0.334 -13.079 1.00 50.53 H new ATOM 0 HB2 LYS A 114 -19.475 -1.328 -11.588 1.00 2.55 H new ATOM 0 HB3 LYS A 114 -19.330 0.196 -12.441 1.00 2.55 H new ATOM 0 HG2 LYS A 114 -18.909 -1.096 -14.569 1.00 50.43 H new ATOM 0 HG3 LYS A 114 -19.204 -2.579 -13.684 1.00 50.43 H new ATOM 0 HD2 LYS A 114 -21.445 -1.665 -13.016 1.00 45.55 H new ATOM 0 HD3 LYS A 114 -21.142 -0.281 -14.047 1.00 45.55 H new ATOM 0 HE2 LYS A 114 -21.214 -3.175 -14.984 1.00 3.23 H new ATOM 0 HE3 LYS A 114 -22.533 -2.033 -15.146 1.00 3.23 H new ATOM 0 HZ1 LYS A 114 -21.310 -2.199 -17.173 1.00 21.03 H new ATOM 0 HZ2 LYS A 114 -21.104 -0.645 -16.520 1.00 21.03 H new ATOM 0 HZ3 LYS A 114 -19.858 -1.792 -16.392 1.00 21.03 H new ATOM 1633 N THR A 115 -16.803 1.078 -11.004 1.00 1.14 N ATOM 1634 CA THR A 115 -16.396 1.802 -9.816 1.00 55.23 C ATOM 1635 C THR A 115 -17.127 3.128 -9.761 1.00 61.50 C ATOM 1636 O THR A 115 -17.805 3.512 -10.719 1.00 24.32 O ATOM 1637 CB THR A 115 -14.852 2.060 -9.788 1.00 22.32 C ATOM 1638 OG1 THR A 115 -14.458 2.576 -8.506 1.00 31.12 O ATOM 1639 CG2 THR A 115 -14.466 3.084 -10.840 1.00 44.43 C ATOM 0 H THR A 115 -16.853 1.642 -11.852 1.00 1.14 H new ATOM 0 HA THR A 115 -16.648 1.190 -8.950 1.00 55.23 H new ATOM 0 HB THR A 115 -14.352 1.112 -9.986 1.00 22.32 H new ATOM 0 HG1 THR A 115 -14.696 1.932 -7.807 1.00 31.12 H new ATOM 0 HG21 THR A 115 -13.389 3.252 -10.807 1.00 44.43 H new ATOM 0 HG22 THR A 115 -14.746 2.715 -11.827 1.00 44.43 H new ATOM 0 HG23 THR A 115 -14.985 4.022 -10.643 1.00 44.43 H new ATOM 1647 N TYR A 116 -16.989 3.810 -8.653 1.00 51.42 N ATOM 1648 CA TYR A 116 -17.585 5.101 -8.450 1.00 21.34 C ATOM 1649 C TYR A 116 -16.503 6.177 -8.361 1.00 61.00 C ATOM 1650 O TYR A 116 -15.696 6.186 -7.434 1.00 34.22 O ATOM 1651 CB TYR A 116 -18.462 5.084 -7.193 1.00 21.51 C ATOM 1652 CG TYR A 116 -19.649 4.155 -7.304 1.00 15.21 C ATOM 1653 CD1 TYR A 116 -19.510 2.792 -7.085 1.00 33.50 C ATOM 1654 CD2 TYR A 116 -20.906 4.640 -7.649 1.00 12.25 C ATOM 1655 CE1 TYR A 116 -20.592 1.941 -7.202 1.00 13.12 C ATOM 1656 CE2 TYR A 116 -21.983 3.795 -7.769 1.00 52.44 C ATOM 1657 CZ TYR A 116 -21.821 2.449 -7.540 1.00 4.43 C ATOM 1658 OH TYR A 116 -22.890 1.606 -7.681 1.00 25.31 O ATOM 0 H TYR A 116 -16.450 3.476 -7.854 1.00 51.42 H new ATOM 0 HA TYR A 116 -18.222 5.339 -9.302 1.00 21.34 H new ATOM 0 HB2 TYR A 116 -17.854 4.785 -6.339 1.00 21.51 H new ATOM 0 HB3 TYR A 116 -18.818 6.095 -6.993 1.00 21.51 H new ATOM 0 HD1 TYR A 116 -18.543 2.391 -6.820 1.00 33.50 H new ATOM 0 HD2 TYR A 116 -21.038 5.697 -7.825 1.00 12.25 H new ATOM 0 HE1 TYR A 116 -20.471 0.882 -7.028 1.00 13.12 H new ATOM 0 HE2 TYR A 116 -22.952 4.186 -8.042 1.00 52.44 H new ATOM 0 HH TYR A 116 -22.676 0.736 -7.283 1.00 25.31 H new ATOM 1668 N MET A 117 -16.477 7.043 -9.353 1.00 23.34 N ATOM 1669 CA MET A 117 -15.515 8.149 -9.422 1.00 71.41 C ATOM 1670 C MET A 117 -16.249 9.474 -9.269 1.00 55.10 C ATOM 1671 O MET A 117 -17.463 9.541 -9.499 1.00 63.24 O ATOM 1672 CB MET A 117 -14.695 8.176 -10.734 1.00 25.40 C ATOM 1673 CG MET A 117 -15.529 8.427 -11.951 1.00 44.30 C ATOM 1674 SD MET A 117 -14.593 8.751 -13.445 1.00 5.41 S ATOM 1675 CE MET A 117 -15.948 8.803 -14.617 1.00 64.02 C ATOM 0 H MET A 117 -17.121 7.008 -10.143 1.00 23.34 H new ATOM 0 HA MET A 117 -14.808 7.993 -8.607 1.00 71.41 H new ATOM 0 HB2 MET A 117 -13.931 8.950 -10.660 1.00 25.40 H new ATOM 0 HB3 MET A 117 -14.175 7.225 -10.849 1.00 25.40 H new ATOM 0 HG2 MET A 117 -16.170 7.562 -12.120 1.00 44.30 H new ATOM 0 HG3 MET A 117 -16.184 9.276 -11.757 1.00 44.30 H new ATOM 0 HE1 MET A 117 -15.788 8.054 -15.392 1.00 64.02 H new ATOM 0 HE2 MET A 117 -16.885 8.595 -14.100 1.00 64.02 H new ATOM 0 HE3 MET A 117 -15.997 9.792 -15.073 1.00 64.02 H new ATOM 1685 N TRP A 118 -15.527 10.503 -8.861 1.00 74.53 N ATOM 1686 CA TRP A 118 -16.098 11.823 -8.652 1.00 55.23 C ATOM 1687 C TRP A 118 -16.523 12.407 -10.007 1.00 24.15 C ATOM 1688 O TRP A 118 -15.796 12.256 -11.018 1.00 40.11 O ATOM 1689 CB TRP A 118 -15.065 12.734 -7.975 1.00 3.44 C ATOM 1690 CG TRP A 118 -15.658 13.981 -7.418 1.00 61.01 C ATOM 1691 CD1 TRP A 118 -15.457 15.271 -7.815 1.00 3.44 C ATOM 1692 CD2 TRP A 118 -16.578 14.028 -6.354 1.00 4.15 C ATOM 1693 NE1 TRP A 118 -16.203 16.111 -7.033 1.00 75.51 N ATOM 1694 CE2 TRP A 118 -16.905 15.365 -6.126 1.00 60.42 C ATOM 1695 CE3 TRP A 118 -17.153 13.050 -5.568 1.00 51.24 C ATOM 1696 CZ2 TRP A 118 -17.795 15.748 -5.129 1.00 64.11 C ATOM 1697 CZ3 TRP A 118 -18.021 13.410 -4.597 1.00 21.00 C ATOM 1698 CH2 TRP A 118 -18.346 14.752 -4.370 1.00 71.24 C ATOM 0 H TRP A 118 -14.528 10.447 -8.665 1.00 74.53 H new ATOM 0 HA TRP A 118 -16.972 11.750 -8.004 1.00 55.23 H new ATOM 0 HB2 TRP A 118 -14.575 12.183 -7.173 1.00 3.44 H new ATOM 0 HB3 TRP A 118 -14.293 12.998 -8.698 1.00 3.44 H new ATOM 0 HD1 TRP A 118 -14.809 15.581 -8.622 1.00 3.44 H new ATOM 0 HE1 TRP A 118 -16.231 17.127 -7.113 1.00 75.51 H new ATOM 0 HE3 TRP A 118 -16.912 12.009 -5.727 1.00 51.24 H new ATOM 0 HZ2 TRP A 118 -18.041 16.786 -4.961 1.00 64.11 H new ATOM 0 HZ3 TRP A 118 -18.474 12.646 -3.983 1.00 21.00 H new ATOM 0 HH2 TRP A 118 -19.042 15.005 -3.584 1.00 71.24 H new ATOM 1709 N ILE A 119 -17.675 13.077 -10.037 1.00 64.32 N ATOM 1710 CA ILE A 119 -18.243 13.520 -11.318 1.00 61.44 C ATOM 1711 C ILE A 119 -17.438 14.676 -11.895 1.00 22.42 C ATOM 1712 O ILE A 119 -17.078 14.674 -13.083 1.00 33.24 O ATOM 1713 CB ILE A 119 -19.683 14.061 -11.153 1.00 21.30 C ATOM 1714 CG1 ILE A 119 -20.548 13.168 -10.263 1.00 35.34 C ATOM 1715 CG2 ILE A 119 -20.311 14.182 -12.521 1.00 41.24 C ATOM 1716 CD1 ILE A 119 -20.778 11.806 -10.792 1.00 61.23 C ATOM 0 H ILE A 119 -18.225 13.322 -9.213 1.00 64.32 H new ATOM 0 HA ILE A 119 -18.226 12.645 -11.967 1.00 61.44 H new ATOM 0 HB ILE A 119 -19.625 15.033 -10.663 1.00 21.30 H new ATOM 0 HG12 ILE A 119 -20.076 13.088 -9.284 1.00 35.34 H new ATOM 0 HG13 ILE A 119 -21.513 13.653 -10.113 1.00 35.34 H new ATOM 0 HG21 ILE A 119 -21.328 14.563 -12.422 1.00 41.24 H new ATOM 0 HG22 ILE A 119 -19.724 14.869 -13.131 1.00 41.24 H new ATOM 0 HG23 ILE A 119 -20.335 13.202 -12.998 1.00 41.24 H new ATOM 0 HD11 ILE A 119 -21.401 11.245 -10.095 1.00 61.23 H new ATOM 0 HD12 ILE A 119 -21.281 11.871 -11.757 1.00 61.23 H new ATOM 0 HD13 ILE A 119 -19.822 11.297 -10.914 1.00 61.23 H new ATOM 1728 N ASN A 120 -17.108 15.624 -11.040 1.00 23.41 N ATOM 1729 CA ASN A 120 -16.367 16.809 -11.446 1.00 61.25 C ATOM 1730 C ASN A 120 -14.952 16.436 -11.781 1.00 51.21 C ATOM 1731 O ASN A 120 -14.350 16.997 -12.681 1.00 14.44 O ATOM 1732 CB ASN A 120 -16.403 17.870 -10.336 1.00 51.41 C ATOM 1733 CG ASN A 120 -15.613 19.117 -10.682 1.00 74.13 C ATOM 1734 OD1 ASN A 120 -14.424 19.203 -10.404 1.00 21.01 O ATOM 1735 ND2 ASN A 120 -16.260 20.086 -11.262 1.00 61.43 N ATOM 0 H ASN A 120 -17.343 15.598 -10.048 1.00 23.41 H new ATOM 0 HA ASN A 120 -16.835 17.233 -12.334 1.00 61.25 H new ATOM 0 HB2 ASN A 120 -17.439 18.146 -10.138 1.00 51.41 H new ATOM 0 HB3 ASN A 120 -16.007 17.439 -9.416 1.00 51.41 H new ATOM 0 HD21 ASN A 120 -15.776 20.952 -11.500 1.00 61.43 H new ATOM 0 HD22 ASN A 120 -17.251 19.979 -11.479 1.00 61.43 H new ATOM 1742 N LYS A 121 -14.441 15.470 -11.017 1.00 72.23 N ATOM 1743 CA LYS A 121 -13.103 14.843 -11.144 1.00 64.20 C ATOM 1744 C LYS A 121 -11.896 15.821 -11.095 1.00 54.43 C ATOM 1745 O LYS A 121 -10.756 15.388 -11.076 1.00 73.24 O ATOM 1746 CB LYS A 121 -13.019 13.849 -12.346 1.00 3.23 C ATOM 1747 CG LYS A 121 -13.077 14.469 -13.741 1.00 72.22 C ATOM 1748 CD LYS A 121 -13.114 13.418 -14.860 1.00 51.20 C ATOM 1749 CE LYS A 121 -14.509 12.787 -15.091 1.00 12.14 C ATOM 1750 NZ LYS A 121 -15.093 12.075 -13.920 1.00 0.55 N ATOM 0 H LYS A 121 -14.974 15.073 -10.243 1.00 72.23 H new ATOM 0 HA LYS A 121 -13.002 14.260 -10.229 1.00 64.20 H new ATOM 0 HB2 LYS A 121 -12.090 13.286 -12.260 1.00 3.23 H new ATOM 0 HB3 LYS A 121 -13.836 13.133 -12.256 1.00 3.23 H new ATOM 0 HG2 LYS A 121 -13.961 15.103 -13.815 1.00 72.22 H new ATOM 0 HG3 LYS A 121 -12.210 15.114 -13.883 1.00 72.22 H new ATOM 0 HD2 LYS A 121 -12.778 13.880 -15.788 1.00 51.20 H new ATOM 0 HD3 LYS A 121 -12.404 12.626 -14.623 1.00 51.20 H new ATOM 0 HE2 LYS A 121 -15.198 13.574 -15.396 1.00 12.14 H new ATOM 0 HE3 LYS A 121 -14.438 12.085 -15.922 1.00 12.14 H new ATOM 0 HZ1 LYS A 121 -16.039 11.719 -14.166 1.00 0.55 H new ATOM 0 HZ2 LYS A 121 -14.480 11.277 -13.658 1.00 0.55 H new ATOM 0 HZ3 LYS A 121 -15.168 12.731 -13.117 1.00 0.55 H new ATOM 1764 N ALA A 122 -12.155 17.105 -11.038 1.00 4.24 N ATOM 1765 CA ALA A 122 -11.107 18.103 -10.995 1.00 51.04 C ATOM 1766 C ALA A 122 -11.332 19.018 -9.810 1.00 5.13 C ATOM 1767 O ALA A 122 -10.898 20.176 -9.796 1.00 12.40 O ATOM 1768 CB ALA A 122 -11.103 18.897 -12.295 1.00 31.23 C ATOM 0 H ALA A 122 -13.099 17.491 -11.020 1.00 4.24 H new ATOM 0 HA ALA A 122 -10.138 17.617 -10.883 1.00 51.04 H new ATOM 0 HB1 ALA A 122 -10.313 19.648 -12.260 1.00 31.23 H new ATOM 0 HB2 ALA A 122 -10.926 18.223 -13.133 1.00 31.23 H new ATOM 0 HB3 ALA A 122 -12.067 19.390 -12.423 1.00 31.23 H new ATOM 1774 N ASP A 123 -12.004 18.482 -8.807 1.00 60.41 N ATOM 1775 CA ASP A 123 -12.307 19.214 -7.579 1.00 55.12 C ATOM 1776 C ASP A 123 -10.997 19.591 -6.868 1.00 71.53 C ATOM 1777 O ASP A 123 -10.156 18.728 -6.613 1.00 1.14 O ATOM 1778 CB ASP A 123 -13.197 18.361 -6.659 1.00 11.52 C ATOM 1779 CG ASP A 123 -13.579 19.055 -5.375 1.00 34.42 C ATOM 1780 OD1 ASP A 123 -12.750 19.136 -4.490 1.00 45.31 O ATOM 1781 OD2 ASP A 123 -14.738 19.495 -5.238 1.00 75.25 O ATOM 0 H ASP A 123 -12.358 17.525 -8.816 1.00 60.41 H new ATOM 0 HA ASP A 123 -12.849 20.127 -7.827 1.00 55.12 H new ATOM 0 HB2 ASP A 123 -14.104 18.086 -7.198 1.00 11.52 H new ATOM 0 HB3 ASP A 123 -12.675 17.434 -6.420 1.00 11.52 H new ATOM 1786 N PRO A 124 -10.801 20.876 -6.566 1.00 42.45 N ATOM 1787 CA PRO A 124 -9.563 21.369 -5.943 1.00 44.21 C ATOM 1788 C PRO A 124 -9.485 21.076 -4.437 1.00 32.51 C ATOM 1789 O PRO A 124 -8.418 21.169 -3.824 1.00 33.25 O ATOM 1790 CB PRO A 124 -9.640 22.876 -6.183 1.00 52.02 C ATOM 1791 CG PRO A 124 -11.101 23.172 -6.193 1.00 61.42 C ATOM 1792 CD PRO A 124 -11.764 21.978 -6.821 1.00 14.13 C ATOM 0 HA PRO A 124 -8.680 20.886 -6.362 1.00 44.21 H new ATOM 0 HB2 PRO A 124 -9.127 23.431 -5.398 1.00 52.02 H new ATOM 0 HB3 PRO A 124 -9.171 23.153 -7.127 1.00 52.02 H new ATOM 0 HG2 PRO A 124 -11.472 23.337 -5.181 1.00 61.42 H new ATOM 0 HG3 PRO A 124 -11.311 24.078 -6.761 1.00 61.42 H new ATOM 0 HD2 PRO A 124 -12.736 21.775 -6.371 1.00 14.13 H new ATOM 0 HD3 PRO A 124 -11.932 22.126 -7.888 1.00 14.13 H new ATOM 1800 N ASP A 125 -10.596 20.702 -3.864 1.00 32.23 N ATOM 1801 CA ASP A 125 -10.691 20.456 -2.441 1.00 34.32 C ATOM 1802 C ASP A 125 -10.359 19.001 -2.122 1.00 23.44 C ATOM 1803 O ASP A 125 -9.920 18.694 -1.026 1.00 4.24 O ATOM 1804 CB ASP A 125 -12.092 20.861 -1.936 1.00 41.44 C ATOM 1805 CG ASP A 125 -12.364 20.557 -0.467 1.00 31.23 C ATOM 1806 OD1 ASP A 125 -11.931 21.347 0.409 1.00 10.34 O ATOM 1807 OD2 ASP A 125 -13.049 19.552 -0.180 1.00 51.14 O ATOM 0 H ASP A 125 -11.470 20.557 -4.370 1.00 32.23 H new ATOM 0 HA ASP A 125 -9.957 21.068 -1.916 1.00 34.32 H new ATOM 0 HB2 ASP A 125 -12.225 21.930 -2.100 1.00 41.44 H new ATOM 0 HB3 ASP A 125 -12.841 20.350 -2.541 1.00 41.44 H new ATOM 1812 N MET A 126 -10.530 18.106 -3.112 1.00 12.01 N ATOM 1813 CA MET A 126 -10.193 16.671 -2.915 1.00 11.13 C ATOM 1814 C MET A 126 -8.694 16.480 -2.687 1.00 15.05 C ATOM 1815 O MET A 126 -8.265 15.461 -2.146 1.00 44.12 O ATOM 1816 CB MET A 126 -10.630 15.763 -4.090 1.00 1.02 C ATOM 1817 CG MET A 126 -9.838 15.969 -5.378 1.00 11.30 C ATOM 1818 SD MET A 126 -10.213 14.749 -6.664 1.00 55.40 S ATOM 1819 CE MET A 126 -11.930 15.084 -6.992 1.00 20.54 C ATOM 0 H MET A 126 -10.890 18.336 -4.038 1.00 12.01 H new ATOM 0 HA MET A 126 -10.755 16.369 -2.031 1.00 11.13 H new ATOM 0 HB2 MET A 126 -10.535 14.722 -3.783 1.00 1.02 H new ATOM 0 HB3 MET A 126 -11.686 15.939 -4.296 1.00 1.02 H new ATOM 0 HG2 MET A 126 -10.043 16.967 -5.765 1.00 11.30 H new ATOM 0 HG3 MET A 126 -8.773 15.928 -5.150 1.00 11.30 H new ATOM 0 HE1 MET A 126 -12.409 14.184 -7.376 1.00 20.54 H new ATOM 0 HE2 MET A 126 -12.423 15.392 -6.070 1.00 20.54 H new ATOM 0 HE3 MET A 126 -12.010 15.881 -7.731 1.00 20.54 H new ATOM 2066 N LYS A 140 2.844 1.273 -4.175 1.00 25.30 N ATOM 2067 CA LYS A 140 4.205 0.747 -4.380 1.00 13.22 C ATOM 2068 C LYS A 140 4.407 0.111 -5.766 1.00 15.55 C ATOM 2069 O LYS A 140 5.418 0.374 -6.415 1.00 22.51 O ATOM 2070 CB LYS A 140 4.464 -0.344 -3.335 1.00 42.41 C ATOM 2071 CG LYS A 140 5.834 -1.008 -3.420 1.00 13.52 C ATOM 2072 CD LYS A 140 5.916 -2.265 -2.559 1.00 12.41 C ATOM 2073 CE LYS A 140 4.919 -3.324 -3.045 1.00 52.22 C ATOM 2074 NZ LYS A 140 5.047 -4.602 -2.325 1.00 70.21 N ATOM 0 HA LYS A 140 4.890 1.591 -4.292 1.00 13.22 H new ATOM 0 HB2 LYS A 140 4.349 0.091 -2.342 1.00 42.41 H new ATOM 0 HB3 LYS A 140 3.698 -1.113 -3.437 1.00 42.41 H new ATOM 0 HG2 LYS A 140 6.048 -1.265 -4.457 1.00 13.52 H new ATOM 0 HG3 LYS A 140 6.600 -0.301 -3.102 1.00 13.52 H new ATOM 0 HD2 LYS A 140 6.928 -2.669 -2.593 1.00 12.41 H new ATOM 0 HD3 LYS A 140 5.708 -2.013 -1.519 1.00 12.41 H new ATOM 0 HE2 LYS A 140 3.905 -2.944 -2.924 1.00 52.22 H new ATOM 0 HE3 LYS A 140 5.070 -3.496 -4.111 1.00 52.22 H new ATOM 0 HZ1 LYS A 140 4.350 -5.280 -2.694 1.00 70.21 H new ATOM 0 HZ2 LYS A 140 6.005 -4.983 -2.461 1.00 70.21 H new ATOM 0 HZ3 LYS A 140 4.876 -4.448 -1.311 1.00 70.21 H new ATOM 2088 N LYS A 141 3.432 -0.696 -6.220 1.00 1.33 N ATOM 2089 CA LYS A 141 3.564 -1.463 -7.477 1.00 72.12 C ATOM 2090 C LYS A 141 3.928 -0.574 -8.679 1.00 40.44 C ATOM 2091 O LYS A 141 4.692 -0.989 -9.543 1.00 24.31 O ATOM 2092 CB LYS A 141 2.298 -2.294 -7.776 1.00 63.24 C ATOM 2093 CG LYS A 141 2.432 -3.193 -9.013 1.00 64.14 C ATOM 2094 CD LYS A 141 1.165 -3.993 -9.294 1.00 41.10 C ATOM 2095 CE LYS A 141 1.347 -4.884 -10.522 1.00 23.23 C ATOM 2096 NZ LYS A 141 0.122 -5.648 -10.861 1.00 3.01 N ATOM 0 H LYS A 141 2.544 -0.836 -5.738 1.00 1.33 H new ATOM 0 HA LYS A 141 4.395 -2.152 -7.323 1.00 72.12 H new ATOM 0 HB2 LYS A 141 2.067 -2.914 -6.910 1.00 63.24 H new ATOM 0 HB3 LYS A 141 1.455 -1.618 -7.918 1.00 63.24 H new ATOM 0 HG2 LYS A 141 2.669 -2.578 -9.881 1.00 64.14 H new ATOM 0 HG3 LYS A 141 3.267 -3.879 -8.871 1.00 64.14 H new ATOM 0 HD2 LYS A 141 0.917 -4.606 -8.428 1.00 41.10 H new ATOM 0 HD3 LYS A 141 0.328 -3.313 -9.453 1.00 41.10 H new ATOM 0 HE2 LYS A 141 1.633 -4.267 -11.374 1.00 23.23 H new ATOM 0 HE3 LYS A 141 2.166 -5.580 -10.343 1.00 23.23 H new ATOM 0 HZ1 LYS A 141 0.300 -6.235 -11.701 1.00 3.01 H new ATOM 0 HZ2 LYS A 141 -0.139 -6.258 -10.061 1.00 3.01 H new ATOM 0 HZ3 LYS A 141 -0.656 -4.987 -11.060 1.00 3.01 H new ATOM 2110 N LYS A 142 3.416 0.654 -8.691 1.00 60.31 N ATOM 2111 CA LYS A 142 3.681 1.600 -9.777 1.00 12.40 C ATOM 2112 C LYS A 142 5.189 1.839 -9.886 1.00 71.44 C ATOM 2113 O LYS A 142 5.761 1.849 -10.984 1.00 1.35 O ATOM 2114 CB LYS A 142 2.919 2.937 -9.497 1.00 35.43 C ATOM 2115 CG LYS A 142 2.909 3.992 -10.636 1.00 72.44 C ATOM 2116 CD LYS A 142 4.269 4.626 -10.904 1.00 21.02 C ATOM 2117 CE LYS A 142 4.211 5.579 -12.083 1.00 52.20 C ATOM 2118 NZ LYS A 142 5.521 6.205 -12.349 1.00 51.05 N ATOM 0 H LYS A 142 2.811 1.021 -7.957 1.00 60.31 H new ATOM 0 HA LYS A 142 3.327 1.193 -10.724 1.00 12.40 H new ATOM 0 HB2 LYS A 142 1.885 2.693 -9.251 1.00 35.43 H new ATOM 0 HB3 LYS A 142 3.357 3.398 -8.612 1.00 35.43 H new ATOM 0 HG2 LYS A 142 2.553 3.520 -11.552 1.00 72.44 H new ATOM 0 HG3 LYS A 142 2.196 4.777 -10.384 1.00 72.44 H new ATOM 0 HD2 LYS A 142 4.604 5.163 -10.016 1.00 21.02 H new ATOM 0 HD3 LYS A 142 5.004 3.845 -11.101 1.00 21.02 H new ATOM 0 HE2 LYS A 142 3.880 5.039 -12.970 1.00 52.20 H new ATOM 0 HE3 LYS A 142 3.471 6.355 -11.887 1.00 52.20 H new ATOM 0 HZ1 LYS A 142 5.439 6.849 -13.162 1.00 51.05 H new ATOM 0 HZ2 LYS A 142 5.826 6.741 -11.512 1.00 51.05 H new ATOM 0 HZ3 LYS A 142 6.222 5.467 -12.561 1.00 51.05 H new ATOM 2132 N PHE A 143 5.822 2.009 -8.749 1.00 34.32 N ATOM 2133 CA PHE A 143 7.240 2.288 -8.696 1.00 64.43 C ATOM 2134 C PHE A 143 8.027 1.011 -8.949 1.00 73.30 C ATOM 2135 O PHE A 143 9.101 1.033 -9.542 1.00 51.15 O ATOM 2136 CB PHE A 143 7.613 2.890 -7.345 1.00 0.43 C ATOM 2137 CG PHE A 143 6.771 4.083 -6.974 1.00 64.04 C ATOM 2138 CD1 PHE A 143 6.805 5.241 -7.734 1.00 71.32 C ATOM 2139 CD2 PHE A 143 5.934 4.035 -5.875 1.00 60.41 C ATOM 2140 CE1 PHE A 143 6.022 6.329 -7.398 1.00 23.31 C ATOM 2141 CE2 PHE A 143 5.149 5.116 -5.535 1.00 2.32 C ATOM 2142 CZ PHE A 143 5.195 6.267 -6.298 1.00 61.34 C ATOM 0 H PHE A 143 5.371 1.958 -7.836 1.00 34.32 H new ATOM 0 HA PHE A 143 7.488 3.012 -9.472 1.00 64.43 H new ATOM 0 HB2 PHE A 143 7.510 2.127 -6.574 1.00 0.43 H new ATOM 0 HB3 PHE A 143 8.662 3.185 -7.363 1.00 0.43 H new ATOM 0 HD1 PHE A 143 7.450 5.294 -8.598 1.00 71.32 H new ATOM 0 HD2 PHE A 143 5.894 3.138 -5.274 1.00 60.41 H new ATOM 0 HE1 PHE A 143 6.058 7.227 -7.997 1.00 23.31 H new ATOM 0 HE2 PHE A 143 4.499 5.063 -4.674 1.00 2.32 H new ATOM 0 HZ PHE A 143 4.584 7.117 -6.032 1.00 61.34 H new ATOM 2152 N ILE A 144 7.468 -0.099 -8.510 1.00 62.53 N ATOM 2153 CA ILE A 144 8.092 -1.404 -8.683 1.00 63.41 C ATOM 2154 C ILE A 144 8.216 -1.746 -10.164 1.00 65.15 C ATOM 2155 O ILE A 144 9.171 -2.364 -10.571 1.00 72.33 O ATOM 2156 CB ILE A 144 7.320 -2.529 -7.925 1.00 13.03 C ATOM 2157 CG1 ILE A 144 7.223 -2.195 -6.436 1.00 11.22 C ATOM 2158 CG2 ILE A 144 7.987 -3.893 -8.111 1.00 61.11 C ATOM 2159 CD1 ILE A 144 8.562 -2.008 -5.737 1.00 62.52 C ATOM 0 H ILE A 144 6.571 -0.127 -8.024 1.00 62.53 H new ATOM 0 HA ILE A 144 9.090 -1.346 -8.248 1.00 63.41 H new ATOM 0 HB ILE A 144 6.317 -2.584 -8.349 1.00 13.03 H new ATOM 0 HG12 ILE A 144 6.637 -1.283 -6.320 1.00 11.22 H new ATOM 0 HG13 ILE A 144 6.675 -2.992 -5.934 1.00 11.22 H new ATOM 0 HG21 ILE A 144 7.422 -4.651 -7.569 1.00 61.11 H new ATOM 0 HG22 ILE A 144 8.009 -4.146 -9.171 1.00 61.11 H new ATOM 0 HG23 ILE A 144 9.006 -3.855 -7.725 1.00 61.11 H new ATOM 0 HD11 ILE A 144 8.394 -1.774 -4.686 1.00 62.52 H new ATOM 0 HD12 ILE A 144 9.145 -2.926 -5.816 1.00 62.52 H new ATOM 0 HD13 ILE A 144 9.107 -1.190 -6.208 1.00 62.52 H new ATOM 2171 N GLU A 145 7.254 -1.298 -10.958 1.00 10.41 N ATOM 2172 CA GLU A 145 7.240 -1.534 -12.409 1.00 54.04 C ATOM 2173 C GLU A 145 8.554 -1.134 -13.103 1.00 33.33 C ATOM 2174 O GLU A 145 9.024 -1.841 -14.002 1.00 54.24 O ATOM 2175 CB GLU A 145 6.051 -0.823 -13.052 1.00 11.45 C ATOM 2176 CG GLU A 145 4.707 -1.415 -12.669 1.00 34.51 C ATOM 2177 CD GLU A 145 4.519 -2.804 -13.229 1.00 71.41 C ATOM 2178 OE1 GLU A 145 5.097 -3.774 -12.710 1.00 54.14 O ATOM 2179 OE2 GLU A 145 3.778 -2.946 -14.218 1.00 52.54 O ATOM 0 H GLU A 145 6.456 -0.759 -10.621 1.00 10.41 H new ATOM 0 HA GLU A 145 7.137 -2.610 -12.549 1.00 54.04 H new ATOM 0 HB2 GLU A 145 6.070 0.229 -12.766 1.00 11.45 H new ATOM 0 HB3 GLU A 145 6.159 -0.861 -14.136 1.00 11.45 H new ATOM 0 HG2 GLU A 145 4.622 -1.448 -11.583 1.00 34.51 H new ATOM 0 HG3 GLU A 145 3.909 -0.767 -13.032 1.00 34.51 H new ATOM 2186 N THR A 146 9.154 -0.033 -12.684 1.00 33.21 N ATOM 2187 CA THR A 146 10.408 0.377 -13.277 1.00 15.03 C ATOM 2188 C THR A 146 11.584 -0.418 -12.662 1.00 65.53 C ATOM 2189 O THR A 146 12.491 -0.859 -13.375 1.00 43.43 O ATOM 2190 CB THR A 146 10.644 1.927 -13.209 1.00 14.13 C ATOM 2191 OG1 THR A 146 11.866 2.275 -13.861 1.00 32.34 O ATOM 2192 CG2 THR A 146 10.687 2.429 -11.785 1.00 64.24 C ATOM 0 H THR A 146 8.799 0.580 -11.950 1.00 33.21 H new ATOM 0 HA THR A 146 10.354 0.139 -14.339 1.00 15.03 H new ATOM 0 HB THR A 146 9.803 2.399 -13.717 1.00 14.13 H new ATOM 0 HG1 THR A 146 11.998 3.245 -13.812 1.00 32.34 H new ATOM 0 HG21 THR A 146 10.852 3.506 -11.784 1.00 64.24 H new ATOM 0 HG22 THR A 146 9.741 2.206 -11.292 1.00 64.24 H new ATOM 0 HG23 THR A 146 11.499 1.937 -11.250 1.00 64.24 H new ATOM 2200 N PHE A 147 11.526 -0.652 -11.350 1.00 22.15 N ATOM 2201 CA PHE A 147 12.566 -1.403 -10.653 1.00 41.34 C ATOM 2202 C PHE A 147 12.596 -2.850 -11.050 1.00 22.21 C ATOM 2203 O PHE A 147 13.628 -3.486 -11.000 1.00 72.40 O ATOM 2204 CB PHE A 147 12.528 -1.206 -9.147 1.00 54.14 C ATOM 2205 CG PHE A 147 12.976 0.162 -8.766 1.00 2.43 C ATOM 2206 CD1 PHE A 147 14.320 0.461 -8.770 1.00 62.11 C ATOM 2207 CD2 PHE A 147 12.072 1.152 -8.439 1.00 53.23 C ATOM 2208 CE1 PHE A 147 14.768 1.713 -8.450 1.00 70.51 C ATOM 2209 CE2 PHE A 147 12.510 2.421 -8.119 1.00 22.41 C ATOM 2210 CZ PHE A 147 13.862 2.702 -8.125 1.00 72.20 C ATOM 0 H PHE A 147 10.767 -0.330 -10.749 1.00 22.15 H new ATOM 0 HA PHE A 147 13.515 -0.980 -10.983 1.00 41.34 H new ATOM 0 HB2 PHE A 147 11.515 -1.373 -8.782 1.00 54.14 H new ATOM 0 HB3 PHE A 147 13.166 -1.947 -8.666 1.00 54.14 H new ATOM 0 HD1 PHE A 147 15.033 -0.307 -9.031 1.00 62.11 H new ATOM 0 HD2 PHE A 147 11.015 0.932 -8.433 1.00 53.23 H new ATOM 0 HE1 PHE A 147 15.827 1.927 -8.452 1.00 70.51 H new ATOM 0 HE2 PHE A 147 11.798 3.192 -7.865 1.00 22.41 H new ATOM 0 HZ PHE A 147 14.210 3.694 -7.876 1.00 72.20 H new ATOM 2220 N LYS A 148 11.453 -3.355 -11.422 1.00 33.35 N ATOM 2221 CA LYS A 148 11.292 -4.689 -11.960 1.00 51.33 C ATOM 2222 C LYS A 148 12.247 -4.876 -13.150 1.00 4.12 C ATOM 2223 O LYS A 148 12.898 -5.909 -13.289 1.00 4.24 O ATOM 2224 CB LYS A 148 9.842 -4.824 -12.425 1.00 32.42 C ATOM 2225 CG LYS A 148 9.450 -6.146 -13.066 1.00 34.40 C ATOM 2226 CD LYS A 148 7.979 -6.118 -13.488 1.00 33.40 C ATOM 2227 CE LYS A 148 7.704 -5.008 -14.506 1.00 51.21 C ATOM 2228 NZ LYS A 148 6.283 -4.928 -14.879 1.00 52.23 N ATOM 0 H LYS A 148 10.576 -2.838 -11.360 1.00 33.35 H new ATOM 0 HA LYS A 148 11.522 -5.445 -11.209 1.00 51.33 H new ATOM 0 HB2 LYS A 148 9.192 -4.657 -11.566 1.00 32.42 H new ATOM 0 HB3 LYS A 148 9.638 -4.026 -13.139 1.00 32.42 H new ATOM 0 HG2 LYS A 148 10.081 -6.338 -13.934 1.00 34.40 H new ATOM 0 HG3 LYS A 148 9.618 -6.962 -12.363 1.00 34.40 H new ATOM 0 HD2 LYS A 148 7.705 -7.082 -13.917 1.00 33.40 H new ATOM 0 HD3 LYS A 148 7.351 -5.970 -12.609 1.00 33.40 H new ATOM 0 HE2 LYS A 148 8.022 -4.052 -14.091 1.00 51.21 H new ATOM 0 HE3 LYS A 148 8.302 -5.183 -15.400 1.00 51.21 H new ATOM 0 HZ1 LYS A 148 6.127 -4.091 -15.476 1.00 52.23 H new ATOM 0 HZ2 LYS A 148 6.014 -5.783 -15.406 1.00 52.23 H new ATOM 0 HZ3 LYS A 148 5.702 -4.853 -14.020 1.00 52.23 H new ATOM 2242 N LYS A 149 12.331 -3.847 -13.985 1.00 43.14 N ATOM 2243 CA LYS A 149 13.211 -3.860 -15.135 1.00 1.11 C ATOM 2244 C LYS A 149 14.657 -3.656 -14.692 1.00 2.34 C ATOM 2245 O LYS A 149 15.567 -4.335 -15.165 1.00 61.34 O ATOM 2246 CB LYS A 149 12.781 -2.793 -16.152 1.00 32.04 C ATOM 2247 CG LYS A 149 11.355 -2.982 -16.664 1.00 14.30 C ATOM 2248 CD LYS A 149 10.965 -1.915 -17.674 1.00 40.13 C ATOM 2249 CE LYS A 149 9.530 -2.112 -18.150 1.00 41.24 C ATOM 2250 NZ LYS A 149 9.126 -1.096 -19.147 1.00 33.13 N ATOM 0 H LYS A 149 11.792 -2.987 -13.880 1.00 43.14 H new ATOM 0 HA LYS A 149 13.142 -4.831 -15.625 1.00 1.11 H new ATOM 0 HB2 LYS A 149 12.866 -1.808 -15.692 1.00 32.04 H new ATOM 0 HB3 LYS A 149 13.468 -2.810 -16.998 1.00 32.04 H new ATOM 0 HG2 LYS A 149 11.262 -3.966 -17.123 1.00 14.30 H new ATOM 0 HG3 LYS A 149 10.662 -2.956 -15.823 1.00 14.30 H new ATOM 0 HD2 LYS A 149 11.071 -0.928 -17.224 1.00 40.13 H new ATOM 0 HD3 LYS A 149 11.643 -1.951 -18.527 1.00 40.13 H new ATOM 0 HE2 LYS A 149 9.427 -3.106 -18.585 1.00 41.24 H new ATOM 0 HE3 LYS A 149 8.856 -2.067 -17.295 1.00 41.24 H new ATOM 0 HZ1 LYS A 149 8.144 -1.270 -19.441 1.00 33.13 H new ATOM 0 HZ2 LYS A 149 9.198 -0.148 -18.726 1.00 33.13 H new ATOM 0 HZ3 LYS A 149 9.751 -1.155 -19.976 1.00 33.13 H new ATOM 2264 N ILE A 150 14.848 -2.737 -13.758 1.00 63.14 N ATOM 2265 CA ILE A 150 16.170 -2.419 -13.219 1.00 63.24 C ATOM 2266 C ILE A 150 16.809 -3.635 -12.530 1.00 63.10 C ATOM 2267 O ILE A 150 18.007 -3.879 -12.676 1.00 62.20 O ATOM 2268 CB ILE A 150 16.109 -1.199 -12.245 1.00 64.22 C ATOM 2269 CG1 ILE A 150 15.601 0.031 -13.004 1.00 45.32 C ATOM 2270 CG2 ILE A 150 17.477 -0.927 -11.630 1.00 53.53 C ATOM 2271 CD1 ILE A 150 15.409 1.256 -12.149 1.00 51.21 C ATOM 0 H ILE A 150 14.092 -2.187 -13.349 1.00 63.14 H new ATOM 0 HA ILE A 150 16.803 -2.146 -14.063 1.00 63.24 H new ATOM 0 HB ILE A 150 15.421 -1.427 -11.431 1.00 64.22 H new ATOM 0 HG12 ILE A 150 16.305 0.267 -13.802 1.00 45.32 H new ATOM 0 HG13 ILE A 150 14.652 -0.217 -13.480 1.00 45.32 H new ATOM 0 HG21 ILE A 150 17.410 -0.073 -10.956 1.00 53.53 H new ATOM 0 HG22 ILE A 150 17.806 -1.804 -11.073 1.00 53.53 H new ATOM 0 HG23 ILE A 150 18.195 -0.709 -12.421 1.00 53.53 H new ATOM 0 HD11 ILE A 150 15.048 2.078 -12.767 1.00 51.21 H new ATOM 0 HD12 ILE A 150 14.681 1.043 -11.367 1.00 51.21 H new ATOM 0 HD13 ILE A 150 16.359 1.535 -11.694 1.00 51.21 H new ATOM 2283 N MET A 151 16.008 -4.399 -11.812 1.00 60.35 N ATOM 2284 CA MET A 151 16.462 -5.578 -11.131 1.00 31.14 C ATOM 2285 C MET A 151 16.988 -6.595 -12.138 1.00 31.52 C ATOM 2286 O MET A 151 18.072 -7.156 -11.960 1.00 45.21 O ATOM 2287 CB MET A 151 15.318 -6.169 -10.314 1.00 52.04 C ATOM 2288 CG MET A 151 15.720 -7.364 -9.501 1.00 61.23 C ATOM 2289 SD MET A 151 14.356 -8.058 -8.523 1.00 2.02 S ATOM 2290 CE MET A 151 13.211 -8.542 -9.827 1.00 34.11 C ATOM 0 H MET A 151 15.013 -4.209 -11.689 1.00 60.35 H new ATOM 0 HA MET A 151 17.276 -5.315 -10.455 1.00 31.14 H new ATOM 0 HB2 MET A 151 14.923 -5.402 -9.648 1.00 52.04 H new ATOM 0 HB3 MET A 151 14.509 -6.453 -10.988 1.00 52.04 H new ATOM 0 HG2 MET A 151 16.109 -8.134 -10.167 1.00 61.23 H new ATOM 0 HG3 MET A 151 16.532 -7.082 -8.831 1.00 61.23 H new ATOM 0 HE1 MET A 151 12.745 -9.492 -9.567 1.00 34.11 H new ATOM 0 HE2 MET A 151 12.441 -7.778 -9.937 1.00 34.11 H new ATOM 0 HE3 MET A 151 13.753 -8.649 -10.766 1.00 34.11 H new ATOM 2300 N GLU A 152 16.231 -6.802 -13.211 1.00 33.22 N ATOM 2301 CA GLU A 152 16.639 -7.718 -14.269 1.00 15.44 C ATOM 2302 C GLU A 152 17.884 -7.175 -14.985 1.00 65.42 C ATOM 2303 O GLU A 152 18.723 -7.932 -15.461 1.00 60.42 O ATOM 2304 CB GLU A 152 15.502 -7.936 -15.278 1.00 62.43 C ATOM 2305 CG GLU A 152 14.238 -8.592 -14.708 1.00 30.23 C ATOM 2306 CD GLU A 152 14.463 -10.005 -14.191 1.00 14.24 C ATOM 2307 OE1 GLU A 152 14.536 -10.946 -15.011 1.00 0.41 O ATOM 2308 OE2 GLU A 152 14.543 -10.202 -12.971 1.00 53.32 O ATOM 0 H GLU A 152 15.332 -6.348 -13.370 1.00 33.22 H new ATOM 0 HA GLU A 152 16.879 -8.679 -13.814 1.00 15.44 H new ATOM 0 HB2 GLU A 152 15.229 -6.972 -15.707 1.00 62.43 H new ATOM 0 HB3 GLU A 152 15.876 -8.554 -16.094 1.00 62.43 H new ATOM 0 HG2 GLU A 152 13.853 -7.975 -13.896 1.00 30.23 H new ATOM 0 HG3 GLU A 152 13.471 -8.616 -15.482 1.00 30.23 H new ATOM 2315 N CYS A 153 17.998 -5.856 -15.039 1.00 1.55 N ATOM 2316 CA CYS A 153 19.132 -5.192 -15.667 1.00 45.22 C ATOM 2317 C CYS A 153 20.419 -5.403 -14.849 1.00 42.43 C ATOM 2318 O CYS A 153 21.511 -5.501 -15.411 1.00 2.43 O ATOM 2319 CB CYS A 153 18.837 -3.696 -15.855 1.00 22.32 C ATOM 2320 SG CYS A 153 20.130 -2.761 -16.704 1.00 1.33 S ATOM 0 H CYS A 153 17.307 -5.215 -14.649 1.00 1.55 H new ATOM 0 HA CYS A 153 19.289 -5.637 -16.649 1.00 45.22 H new ATOM 0 HB2 CYS A 153 17.908 -3.592 -16.415 1.00 22.32 H new ATOM 0 HB3 CYS A 153 18.670 -3.248 -14.875 1.00 22.32 H new ATOM 0 HG CYS A 153 19.770 -1.516 -16.806 1.00 1.33 H new ATOM 2326 N LYS A 154 20.280 -5.478 -13.531 1.00 74.31 N ATOM 2327 CA LYS A 154 21.414 -5.742 -12.654 1.00 44.22 C ATOM 2328 C LYS A 154 21.770 -7.205 -12.695 1.00 62.54 C ATOM 2329 O LYS A 154 22.914 -7.594 -12.458 1.00 43.25 O ATOM 2330 CB LYS A 154 21.099 -5.339 -11.236 1.00 15.02 C ATOM 2331 CG LYS A 154 20.829 -3.870 -11.075 1.00 2.32 C ATOM 2332 CD LYS A 154 20.604 -3.541 -9.635 1.00 2.13 C ATOM 2333 CE LYS A 154 20.345 -2.064 -9.426 1.00 75.45 C ATOM 2334 NZ LYS A 154 20.080 -1.749 -8.007 1.00 51.55 N ATOM 0 H LYS A 154 19.391 -5.359 -13.045 1.00 74.31 H new ATOM 0 HA LYS A 154 22.261 -5.152 -13.006 1.00 44.22 H new ATOM 0 HB2 LYS A 154 20.230 -5.900 -10.892 1.00 15.02 H new ATOM 0 HB3 LYS A 154 21.934 -5.619 -10.593 1.00 15.02 H new ATOM 0 HG2 LYS A 154 21.670 -3.294 -11.460 1.00 2.32 H new ATOM 0 HG3 LYS A 154 19.955 -3.587 -11.661 1.00 2.32 H new ATOM 0 HD2 LYS A 154 19.756 -4.115 -9.260 1.00 2.13 H new ATOM 0 HD3 LYS A 154 21.475 -3.842 -9.054 1.00 2.13 H new ATOM 0 HE2 LYS A 154 21.206 -1.492 -9.771 1.00 75.45 H new ATOM 0 HE3 LYS A 154 19.493 -1.755 -10.032 1.00 75.45 H new ATOM 0 HZ1 LYS A 154 19.907 -0.729 -7.904 1.00 51.55 H new ATOM 0 HZ2 LYS A 154 19.243 -2.276 -7.685 1.00 51.55 H new ATOM 0 HZ3 LYS A 154 20.903 -2.021 -7.432 1.00 51.55 H new