USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 983 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 130 ASN : amide:sc= -7.23! C(o=-7.2!,f=-8!) USER MOD Set 1.2: A 133 THR OG1 : rot 180:sc= 0.00992 USER MOD Set 2.1: A 82 SER OG : rot -85:sc= 0.567 USER MOD Set 2.2: A 97 MET CE :methyl 152:sc= -1.95! (180deg=-3.51!) USER MOD Set 3.1: A 63 THR OG1 : rot -63:sc= 0.0984 USER MOD Set 3.2: A 76 LYS NZ :NH3+ 155:sc= -1.43 (180deg=-4.09!) USER MOD Set 4.1: A 40 ASN : amide:sc= -1.12 K(o=-1.1,f=-2.9!) USER MOD Set 4.2: A 62 HIS : no HD1:sc= -0.0139 X(o=-1.1,f=-1.1) USER MOD Single : A 9 LYS NZ :NH3+ -156:sc= -0.107 (180deg=-0.746) USER MOD Single : A 11 LYS NZ :NH3+ -154:sc= -0.208 (180deg=-1.16) USER MOD Single : A 12 SER OG : rot -73:sc= 1.06 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 141:sc= -3.82! USER MOD Single : A 35 THR OG1 : rot -72:sc= 0.147 USER MOD Single : A 38 GLN : amide:sc= -5.53! K(o=-5.5!,f=-2.7) USER MOD Single : A 44 SER OG : rot 20:sc= 0.786 USER MOD Single : A 49 ASN : amide:sc= -0.286 X(o=-0.29,f=-0.32) USER MOD Single : A 51 SER OG : rot -62:sc= -0.467 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 SER OG : rot 180:sc= -0.463 USER MOD Single : A 69 ASN : amide:sc= -1.87 K(o=-1.9,f=-1) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -12.3! C(o=-12!,f=-23!) USER MOD Single : A 73 THR OG1 : rot 35:sc= 0.506 USER MOD Single : A 74 ASN : amide:sc= -3.76! C(o=-3.8!,f=-9.3!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -137:sc= -3.45! (180deg=-6.1!) USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.00252) USER MOD Single : A 90 ASN : amide:sc=-0.00465 K(o=-0.0046,f=-0.84) USER MOD Single : A 92 THR OG1 : rot -2:sc= 0.167 USER MOD Single : A 94 LYS NZ :NH3+ -161:sc=-0.00424 (180deg=-0.312) USER MOD Single : A 95 TYR OH : rot 180:sc= -0.498 USER MOD Single : A 96 LYS NZ :NH3+ 149:sc= 0.112 (180deg=-0.307) USER MOD Single : A 98 THR OG1 : rot -39:sc= 0.0077 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 166:sc=-0.00291 (180deg=-0.218) USER MOD Single : A 120 GLN : amide:sc= -7.69! C(o=-7.7!,f=-13!) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot -8:sc= 0.636! USER MOD Single : A 126 CYS SG : rot -109:sc= -2.67! USER MOD Single : A 129 TYR OH : rot 146:sc= -2.05! USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ -168:sc= -1.05 (180deg=-1.31) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 100 N ILE A 7 12.685 11.177 0.624 1.00 0.00 N ATOM 101 CA ILE A 7 11.220 11.226 0.921 1.00 0.00 C ATOM 102 C ILE A 7 10.794 12.701 1.021 1.00 0.00 C ATOM 103 O ILE A 7 10.923 13.311 2.064 1.00 0.00 O ATOM 104 CB ILE A 7 10.933 10.534 2.263 1.00 0.00 C ATOM 105 CG1 ILE A 7 11.673 9.191 2.326 1.00 0.00 C ATOM 106 CG2 ILE A 7 9.423 10.298 2.392 1.00 0.00 C ATOM 107 CD1 ILE A 7 11.287 8.444 3.604 1.00 0.00 C ATOM 0 HA ILE A 7 10.668 10.717 0.130 1.00 0.00 H new ATOM 0 HB ILE A 7 11.278 11.167 3.081 1.00 0.00 H new ATOM 0 HG12 ILE A 7 11.425 8.588 1.453 1.00 0.00 H new ATOM 0 HG13 ILE A 7 12.750 9.358 2.303 1.00 0.00 H new ATOM 0 HG21 ILE A 7 9.211 9.807 3.342 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.901 11.254 2.353 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.082 9.665 1.573 1.00 0.00 H new ATOM 0 HD11 ILE A 7 11.816 7.492 3.643 1.00 0.00 H new ATOM 0 HD12 ILE A 7 11.558 9.045 4.472 1.00 0.00 H new ATOM 0 HD13 ILE A 7 10.212 8.263 3.609 1.00 0.00 H new ATOM 119 N PRO A 8 10.296 13.281 -0.051 1.00 0.00 N ATOM 120 CA PRO A 8 9.864 14.712 -0.058 1.00 0.00 C ATOM 121 C PRO A 8 8.970 15.065 1.136 1.00 0.00 C ATOM 122 O PRO A 8 8.270 14.228 1.672 1.00 0.00 O ATOM 123 CB PRO A 8 9.094 14.849 -1.378 1.00 0.00 C ATOM 124 CG PRO A 8 9.698 13.820 -2.276 1.00 0.00 C ATOM 125 CD PRO A 8 10.093 12.652 -1.370 1.00 0.00 C ATOM 0 HA PRO A 8 10.712 15.392 0.024 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.028 14.673 -1.235 1.00 0.00 H new ATOM 0 HB3 PRO A 8 9.199 15.850 -1.796 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.987 13.500 -3.038 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.567 14.220 -2.799 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.313 11.892 -1.335 1.00 0.00 H new ATOM 0 HD3 PRO A 8 11.000 12.161 -1.723 1.00 0.00 H new ATOM 133 N LYS A 9 8.983 16.304 1.550 1.00 0.00 N ATOM 134 CA LYS A 9 8.130 16.725 2.701 1.00 0.00 C ATOM 135 C LYS A 9 6.800 17.253 2.164 1.00 0.00 C ATOM 136 O LYS A 9 5.826 17.365 2.883 1.00 0.00 O ATOM 137 CB LYS A 9 8.839 17.830 3.490 1.00 0.00 C ATOM 138 CG LYS A 9 9.248 18.959 2.544 1.00 0.00 C ATOM 139 CD LYS A 9 9.917 20.078 3.345 1.00 0.00 C ATOM 140 CE LYS A 9 10.590 21.062 2.386 1.00 0.00 C ATOM 141 NZ LYS A 9 11.729 20.388 1.700 1.00 0.00 N ATOM 0 H LYS A 9 9.550 17.046 1.139 1.00 0.00 H new ATOM 0 HA LYS A 9 7.952 15.874 3.359 1.00 0.00 H new ATOM 0 HB2 LYS A 9 8.179 18.215 4.267 1.00 0.00 H new ATOM 0 HB3 LYS A 9 9.719 17.425 3.990 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.933 18.581 1.784 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.373 19.345 2.021 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.176 20.596 3.954 1.00 0.00 H new ATOM 0 HD3 LYS A 9 10.655 19.659 4.029 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.869 21.420 1.651 1.00 0.00 H new ATOM 0 HE3 LYS A 9 10.946 21.934 2.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 12.415 21.102 1.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 12.193 19.732 2.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 11.375 19.859 0.878 1.00 0.00 H new ATOM 155 N ASP A 10 6.750 17.575 0.897 1.00 0.00 N ATOM 156 CA ASP A 10 5.484 18.092 0.306 1.00 0.00 C ATOM 157 C ASP A 10 4.524 16.928 0.061 1.00 0.00 C ATOM 158 O ASP A 10 4.699 16.145 -0.852 1.00 0.00 O ATOM 159 CB ASP A 10 5.785 18.790 -1.022 1.00 0.00 C ATOM 160 CG ASP A 10 4.498 19.408 -1.572 1.00 0.00 C ATOM 161 OD1 ASP A 10 3.635 19.735 -0.776 1.00 0.00 O ATOM 162 OD2 ASP A 10 4.397 19.540 -2.781 1.00 0.00 O ATOM 0 H ASP A 10 7.533 17.501 0.247 1.00 0.00 H new ATOM 0 HA ASP A 10 5.028 18.803 0.994 1.00 0.00 H new ATOM 0 HB2 ASP A 10 6.540 19.563 -0.877 1.00 0.00 H new ATOM 0 HB3 ASP A 10 6.193 18.076 -1.737 1.00 0.00 H new ATOM 167 N LYS A 11 3.510 16.811 0.870 1.00 0.00 N ATOM 168 CA LYS A 11 2.535 15.701 0.692 1.00 0.00 C ATOM 169 C LYS A 11 1.923 15.773 -0.713 1.00 0.00 C ATOM 170 O LYS A 11 1.167 14.910 -1.112 1.00 0.00 O ATOM 171 CB LYS A 11 1.425 15.841 1.743 1.00 0.00 C ATOM 172 CG LYS A 11 1.904 15.295 3.094 1.00 0.00 C ATOM 173 CD LYS A 11 3.256 15.911 3.464 1.00 0.00 C ATOM 174 CE LYS A 11 3.585 15.580 4.921 1.00 0.00 C ATOM 175 NZ LYS A 11 2.526 16.137 5.810 1.00 0.00 N ATOM 0 H LYS A 11 3.314 17.439 1.650 1.00 0.00 H new ATOM 0 HA LYS A 11 3.041 14.743 0.813 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.141 16.888 1.846 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.536 15.300 1.418 1.00 0.00 H new ATOM 0 HG2 LYS A 11 1.169 15.521 3.867 1.00 0.00 H new ATOM 0 HG3 LYS A 11 1.992 14.210 3.045 1.00 0.00 H new ATOM 0 HD2 LYS A 11 4.036 15.525 2.807 1.00 0.00 H new ATOM 0 HD3 LYS A 11 3.226 16.991 3.323 1.00 0.00 H new ATOM 0 HE2 LYS A 11 3.654 14.500 5.053 1.00 0.00 H new ATOM 0 HE3 LYS A 11 4.556 15.997 5.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 2.924 16.315 6.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 2.171 17.029 5.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 1.743 15.456 5.886 1.00 0.00 H new ATOM 189 N SER A 12 2.240 16.801 -1.461 1.00 0.00 N ATOM 190 CA SER A 12 1.674 16.945 -2.841 1.00 0.00 C ATOM 191 C SER A 12 2.733 16.561 -3.877 1.00 0.00 C ATOM 192 O SER A 12 2.847 17.181 -4.915 1.00 0.00 O ATOM 193 CB SER A 12 1.255 18.397 -3.066 1.00 0.00 C ATOM 194 OG SER A 12 0.997 18.599 -4.449 1.00 0.00 O ATOM 0 H SER A 12 2.869 17.551 -1.175 1.00 0.00 H new ATOM 0 HA SER A 12 0.810 16.289 -2.946 1.00 0.00 H new ATOM 0 HB2 SER A 12 0.365 18.626 -2.480 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.041 19.072 -2.728 1.00 0.00 H new ATOM 0 HG SER A 12 1.845 18.619 -4.940 1.00 0.00 H new ATOM 200 N LYS A 13 3.504 15.543 -3.607 1.00 0.00 N ATOM 201 CA LYS A 13 4.554 15.119 -4.583 1.00 0.00 C ATOM 202 C LYS A 13 4.748 13.606 -4.506 1.00 0.00 C ATOM 203 O LYS A 13 4.862 13.034 -3.440 1.00 0.00 O ATOM 204 CB LYS A 13 5.875 15.818 -4.260 1.00 0.00 C ATOM 205 CG LYS A 13 6.933 15.401 -5.289 1.00 0.00 C ATOM 206 CD LYS A 13 8.125 16.369 -5.242 1.00 0.00 C ATOM 207 CE LYS A 13 7.712 17.768 -5.737 1.00 0.00 C ATOM 208 NZ LYS A 13 8.871 18.409 -6.418 1.00 0.00 N ATOM 0 H LYS A 13 3.454 14.986 -2.754 1.00 0.00 H new ATOM 0 HA LYS A 13 4.237 15.394 -5.589 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.741 16.900 -4.277 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.204 15.553 -3.255 1.00 0.00 H new ATOM 0 HG2 LYS A 13 7.271 14.385 -5.084 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.498 15.396 -6.288 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.505 16.436 -4.223 1.00 0.00 H new ATOM 0 HD3 LYS A 13 8.936 15.984 -5.860 1.00 0.00 H new ATOM 0 HE2 LYS A 13 6.869 17.690 -6.424 1.00 0.00 H new ATOM 0 HE3 LYS A 13 7.383 18.381 -4.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 8.597 19.354 -6.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.662 18.496 -5.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.164 17.825 -7.227 1.00 0.00 H new ATOM 222 N VAL A 14 4.780 12.955 -5.633 1.00 0.00 N ATOM 223 CA VAL A 14 4.959 11.477 -5.646 1.00 0.00 C ATOM 224 C VAL A 14 6.298 11.094 -5.016 1.00 0.00 C ATOM 225 O VAL A 14 7.331 11.641 -5.350 1.00 0.00 O ATOM 226 CB VAL A 14 4.933 10.975 -7.092 1.00 0.00 C ATOM 227 CG1 VAL A 14 4.984 9.440 -7.105 1.00 0.00 C ATOM 228 CG2 VAL A 14 3.656 11.468 -7.787 1.00 0.00 C ATOM 0 H VAL A 14 4.689 13.386 -6.553 1.00 0.00 H new ATOM 0 HA VAL A 14 4.150 11.024 -5.073 1.00 0.00 H new ATOM 0 HB VAL A 14 5.799 11.363 -7.628 1.00 0.00 H new ATOM 0 HG11 VAL A 14 4.965 9.084 -8.135 1.00 0.00 H new ATOM 0 HG12 VAL A 14 5.900 9.102 -6.621 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.122 9.043 -6.568 1.00 0.00 H new ATOM 0 HG21 VAL A 14 3.640 11.109 -8.816 1.00 0.00 H new ATOM 0 HG22 VAL A 14 2.783 11.088 -7.257 1.00 0.00 H new ATOM 0 HG23 VAL A 14 3.637 12.558 -7.782 1.00 0.00 H new ATOM 238 N ALA A 15 6.291 10.137 -4.125 1.00 0.00 N ATOM 239 CA ALA A 15 7.565 9.684 -3.489 1.00 0.00 C ATOM 240 C ALA A 15 8.053 8.435 -4.227 1.00 0.00 C ATOM 241 O ALA A 15 9.196 8.037 -4.108 1.00 0.00 O ATOM 242 CB ALA A 15 7.313 9.352 -2.011 1.00 0.00 C ATOM 0 H ALA A 15 5.454 9.647 -3.809 1.00 0.00 H new ATOM 0 HA ALA A 15 8.318 10.470 -3.548 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.243 9.022 -1.549 1.00 0.00 H new ATOM 0 HB2 ALA A 15 6.947 10.240 -1.496 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.570 8.558 -1.938 1.00 0.00 H new ATOM 248 N GLY A 16 7.192 7.814 -4.987 1.00 0.00 N ATOM 249 CA GLY A 16 7.602 6.592 -5.732 1.00 0.00 C ATOM 250 C GLY A 16 6.443 6.107 -6.606 1.00 0.00 C ATOM 251 O GLY A 16 5.506 6.833 -6.873 1.00 0.00 O ATOM 0 H GLY A 16 6.223 8.101 -5.123 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.472 6.807 -6.352 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.895 5.809 -5.032 1.00 0.00 H new ATOM 255 N TYR A 17 6.499 4.880 -7.053 1.00 0.00 N ATOM 256 CA TYR A 17 5.405 4.341 -7.916 1.00 0.00 C ATOM 257 C TYR A 17 5.256 2.839 -7.680 1.00 0.00 C ATOM 258 O TYR A 17 6.212 2.094 -7.767 1.00 0.00 O ATOM 259 CB TYR A 17 5.758 4.560 -9.391 1.00 0.00 C ATOM 260 CG TYR A 17 5.732 6.030 -9.733 1.00 0.00 C ATOM 261 CD1 TYR A 17 6.857 6.825 -9.486 1.00 0.00 C ATOM 262 CD2 TYR A 17 4.589 6.594 -10.314 1.00 0.00 C ATOM 263 CE1 TYR A 17 6.839 8.185 -9.817 1.00 0.00 C ATOM 264 CE2 TYR A 17 4.573 7.954 -10.647 1.00 0.00 C ATOM 265 CZ TYR A 17 5.697 8.750 -10.398 1.00 0.00 C ATOM 266 OH TYR A 17 5.680 10.089 -10.728 1.00 0.00 O ATOM 0 H TYR A 17 7.257 4.226 -6.858 1.00 0.00 H new ATOM 0 HA TYR A 17 4.477 4.856 -7.669 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.747 4.151 -9.598 1.00 0.00 H new ATOM 0 HB3 TYR A 17 5.052 4.022 -10.023 1.00 0.00 H new ATOM 0 HD1 TYR A 17 7.739 6.389 -9.040 1.00 0.00 H new ATOM 0 HD2 TYR A 17 3.721 5.981 -10.505 1.00 0.00 H new ATOM 0 HE1 TYR A 17 7.706 8.799 -9.624 1.00 0.00 H new ATOM 0 HE2 TYR A 17 3.693 8.389 -11.096 1.00 0.00 H new ATOM 0 HH TYR A 17 4.812 10.318 -11.122 1.00 0.00 H new ATOM 276 N ILE A 18 4.058 2.379 -7.414 1.00 0.00 N ATOM 277 CA ILE A 18 3.845 0.914 -7.212 1.00 0.00 C ATOM 278 C ILE A 18 3.314 0.355 -8.526 1.00 0.00 C ATOM 279 O ILE A 18 2.587 1.027 -9.224 1.00 0.00 O ATOM 280 CB ILE A 18 2.822 0.692 -6.093 1.00 0.00 C ATOM 281 CG1 ILE A 18 2.698 -0.809 -5.802 1.00 0.00 C ATOM 282 CG2 ILE A 18 1.461 1.243 -6.525 1.00 0.00 C ATOM 283 CD1 ILE A 18 2.004 -1.016 -4.454 1.00 0.00 C ATOM 0 H ILE A 18 3.220 2.955 -7.328 1.00 0.00 H new ATOM 0 HA ILE A 18 4.772 0.416 -6.928 1.00 0.00 H new ATOM 0 HB ILE A 18 3.153 1.210 -5.193 1.00 0.00 H new ATOM 0 HG12 ILE A 18 2.130 -1.297 -6.594 1.00 0.00 H new ATOM 0 HG13 ILE A 18 3.686 -1.270 -5.788 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.735 1.084 -5.728 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.549 2.310 -6.729 1.00 0.00 H new ATOM 0 HG23 ILE A 18 1.129 0.727 -7.426 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.917 -2.083 -4.250 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.590 -0.542 -3.666 1.00 0.00 H new ATOM 0 HD13 ILE A 18 1.010 -0.570 -4.484 1.00 0.00 H new ATOM 295 N GLU A 19 3.674 -0.849 -8.894 1.00 0.00 N ATOM 296 CA GLU A 19 3.183 -1.400 -10.197 1.00 0.00 C ATOM 297 C GLU A 19 2.919 -2.902 -10.085 1.00 0.00 C ATOM 298 O GLU A 19 3.586 -3.616 -9.362 1.00 0.00 O ATOM 299 CB GLU A 19 4.244 -1.150 -11.275 1.00 0.00 C ATOM 300 CG GLU A 19 4.865 0.233 -11.074 1.00 0.00 C ATOM 301 CD GLU A 19 5.812 0.542 -12.236 1.00 0.00 C ATOM 302 OE1 GLU A 19 6.309 -0.397 -12.835 1.00 0.00 O ATOM 303 OE2 GLU A 19 6.023 1.712 -12.506 1.00 0.00 O ATOM 0 H GLU A 19 4.280 -1.469 -8.357 1.00 0.00 H new ATOM 0 HA GLU A 19 2.250 -0.903 -10.462 1.00 0.00 H new ATOM 0 HB2 GLU A 19 5.016 -1.917 -11.224 1.00 0.00 H new ATOM 0 HB3 GLU A 19 3.793 -1.217 -12.265 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.083 0.990 -11.018 1.00 0.00 H new ATOM 0 HG3 GLU A 19 5.408 0.265 -10.130 1.00 0.00 H new ATOM 310 N ILE A 20 1.945 -3.379 -10.812 1.00 0.00 N ATOM 311 CA ILE A 20 1.606 -4.830 -10.789 1.00 0.00 C ATOM 312 C ILE A 20 1.042 -5.208 -12.174 1.00 0.00 C ATOM 313 O ILE A 20 0.182 -4.522 -12.688 1.00 0.00 O ATOM 314 CB ILE A 20 0.551 -5.081 -9.694 1.00 0.00 C ATOM 315 CG1 ILE A 20 1.188 -4.783 -8.324 1.00 0.00 C ATOM 316 CG2 ILE A 20 0.068 -6.547 -9.741 1.00 0.00 C ATOM 317 CD1 ILE A 20 0.308 -5.309 -7.184 1.00 0.00 C ATOM 0 H ILE A 20 1.361 -2.815 -11.430 1.00 0.00 H new ATOM 0 HA ILE A 20 2.486 -5.435 -10.572 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.309 -4.432 -9.857 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.174 -5.244 -8.269 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.332 -3.708 -8.211 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.677 -6.710 -8.962 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -0.375 -6.753 -10.715 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.914 -7.214 -9.579 1.00 0.00 H new ATOM 0 HD11 ILE A 20 0.780 -5.086 -6.227 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -0.669 -4.828 -7.227 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.187 -6.387 -7.286 1.00 0.00 H new ATOM 329 N PRO A 21 1.507 -6.280 -12.783 1.00 0.00 N ATOM 330 CA PRO A 21 1.007 -6.706 -14.126 1.00 0.00 C ATOM 331 C PRO A 21 -0.368 -7.379 -14.040 1.00 0.00 C ATOM 332 O PRO A 21 -1.289 -7.025 -14.750 1.00 0.00 O ATOM 333 CB PRO A 21 2.073 -7.701 -14.600 1.00 0.00 C ATOM 334 CG PRO A 21 2.597 -8.313 -13.342 1.00 0.00 C ATOM 335 CD PRO A 21 2.548 -7.205 -12.282 1.00 0.00 C ATOM 0 HA PRO A 21 0.868 -5.863 -14.803 1.00 0.00 H new ATOM 0 HB2 PRO A 21 1.646 -8.455 -15.261 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.864 -7.200 -15.157 1.00 0.00 H new ATOM 0 HG2 PRO A 21 1.991 -9.168 -13.042 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.615 -8.677 -13.480 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.291 -7.602 -11.300 1.00 0.00 H new ATOM 0 HD3 PRO A 21 3.512 -6.705 -12.181 1.00 0.00 H new ATOM 343 N ASP A 22 -0.509 -8.347 -13.177 1.00 0.00 N ATOM 344 CA ASP A 22 -1.821 -9.043 -13.044 1.00 0.00 C ATOM 345 C ASP A 22 -2.929 -8.007 -12.861 1.00 0.00 C ATOM 346 O ASP A 22 -4.089 -8.276 -13.103 1.00 0.00 O ATOM 347 CB ASP A 22 -1.784 -9.972 -11.828 1.00 0.00 C ATOM 348 CG ASP A 22 -0.581 -10.909 -11.939 1.00 0.00 C ATOM 349 OD1 ASP A 22 0.524 -10.453 -11.696 1.00 0.00 O ATOM 350 OD2 ASP A 22 -0.784 -12.067 -12.266 1.00 0.00 O ATOM 0 H ASP A 22 0.227 -8.687 -12.558 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.016 -9.629 -13.942 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.719 -9.386 -10.911 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -2.706 -10.551 -11.771 1.00 0.00 H new ATOM 355 N ALA A 23 -2.574 -6.822 -12.433 1.00 0.00 N ATOM 356 CA ALA A 23 -3.587 -5.741 -12.222 1.00 0.00 C ATOM 357 C ALA A 23 -3.261 -4.569 -13.149 1.00 0.00 C ATOM 358 O ALA A 23 -3.909 -3.543 -13.114 1.00 0.00 O ATOM 359 CB ALA A 23 -3.517 -5.280 -10.768 1.00 0.00 C ATOM 0 H ALA A 23 -1.614 -6.554 -12.218 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.588 -6.111 -12.441 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.251 -4.492 -10.601 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.731 -6.121 -10.109 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -2.519 -4.898 -10.555 1.00 0.00 H new ATOM 365 N ASP A 24 -2.251 -4.722 -13.977 1.00 0.00 N ATOM 366 CA ASP A 24 -1.855 -3.630 -14.924 1.00 0.00 C ATOM 367 C ASP A 24 -1.934 -2.277 -14.218 1.00 0.00 C ATOM 368 O ASP A 24 -2.362 -1.290 -14.782 1.00 0.00 O ATOM 369 CB ASP A 24 -2.787 -3.639 -16.141 1.00 0.00 C ATOM 370 CG ASP A 24 -4.247 -3.663 -15.685 1.00 0.00 C ATOM 371 OD1 ASP A 24 -4.717 -2.640 -15.214 1.00 0.00 O ATOM 372 OD2 ASP A 24 -4.871 -4.703 -15.815 1.00 0.00 O ATOM 0 H ASP A 24 -1.680 -5.565 -14.036 1.00 0.00 H new ATOM 0 HA ASP A 24 -0.831 -3.797 -15.257 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -2.604 -2.757 -16.755 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.578 -4.510 -16.763 1.00 0.00 H new ATOM 377 N ILE A 25 -1.540 -2.237 -12.974 1.00 0.00 N ATOM 378 CA ILE A 25 -1.598 -0.968 -12.189 1.00 0.00 C ATOM 379 C ILE A 25 -0.219 -0.280 -12.174 1.00 0.00 C ATOM 380 O ILE A 25 0.811 -0.905 -12.328 1.00 0.00 O ATOM 381 CB ILE A 25 -2.091 -1.329 -10.764 1.00 0.00 C ATOM 382 CG1 ILE A 25 -3.627 -1.225 -10.727 1.00 0.00 C ATOM 383 CG2 ILE A 25 -1.479 -0.409 -9.696 1.00 0.00 C ATOM 384 CD1 ILE A 25 -4.167 -1.776 -9.409 1.00 0.00 C ATOM 0 H ILE A 25 -1.176 -3.040 -12.461 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.288 -0.255 -12.641 1.00 0.00 H new ATOM 0 HB ILE A 25 -1.773 -2.347 -10.538 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -3.930 -0.185 -10.845 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.055 -1.779 -11.563 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.851 -0.696 -8.712 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.393 -0.502 -9.715 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.759 0.624 -9.902 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.254 -1.695 -9.399 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.880 -2.823 -9.307 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.753 -1.204 -8.579 1.00 0.00 H new ATOM 396 N LYS A 26 -0.221 1.015 -11.986 1.00 0.00 N ATOM 397 CA LYS A 26 1.041 1.813 -11.945 1.00 0.00 C ATOM 398 C LYS A 26 0.681 3.140 -11.285 1.00 0.00 C ATOM 399 O LYS A 26 0.592 4.166 -11.929 1.00 0.00 O ATOM 400 CB LYS A 26 1.551 2.060 -13.368 1.00 0.00 C ATOM 401 CG LYS A 26 0.368 2.364 -14.289 1.00 0.00 C ATOM 402 CD LYS A 26 0.883 2.975 -15.594 1.00 0.00 C ATOM 403 CE LYS A 26 1.763 1.957 -16.324 1.00 0.00 C ATOM 404 NZ LYS A 26 1.923 2.369 -17.747 1.00 0.00 N ATOM 0 H LYS A 26 -1.069 1.567 -11.856 1.00 0.00 H new ATOM 0 HA LYS A 26 1.825 1.292 -11.396 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.254 2.893 -13.374 1.00 0.00 H new ATOM 0 HB3 LYS A 26 2.091 1.185 -13.729 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -0.189 1.450 -14.497 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.321 3.052 -13.799 1.00 0.00 H new ATOM 0 HD2 LYS A 26 0.045 3.266 -16.227 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.453 3.880 -15.384 1.00 0.00 H new ATOM 0 HE2 LYS A 26 2.738 1.891 -15.841 1.00 0.00 H new ATOM 0 HE3 LYS A 26 1.313 0.966 -16.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 2.521 1.678 -18.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.989 2.410 -18.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 2.371 3.307 -17.789 1.00 0.00 H new ATOM 418 N GLU A 27 0.395 3.105 -10.012 1.00 0.00 N ATOM 419 CA GLU A 27 -0.056 4.332 -9.298 1.00 0.00 C ATOM 420 C GLU A 27 1.075 4.991 -8.487 1.00 0.00 C ATOM 421 O GLU A 27 1.952 4.316 -7.986 1.00 0.00 O ATOM 422 CB GLU A 27 -1.161 3.898 -8.341 1.00 0.00 C ATOM 423 CG GLU A 27 -2.339 3.276 -9.134 1.00 0.00 C ATOM 424 CD GLU A 27 -2.916 2.074 -8.376 1.00 0.00 C ATOM 425 OE1 GLU A 27 -2.721 2.002 -7.174 1.00 0.00 O ATOM 426 OE2 GLU A 27 -3.550 1.251 -9.013 1.00 0.00 O ATOM 0 H GLU A 27 0.456 2.269 -9.431 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.394 5.068 -10.028 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -0.770 3.173 -7.627 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.512 4.755 -7.766 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -3.117 4.024 -9.289 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -1.997 2.962 -10.120 1.00 0.00 H new ATOM 433 N PRO A 28 1.032 6.304 -8.318 1.00 0.00 N ATOM 434 CA PRO A 28 2.042 7.050 -7.510 1.00 0.00 C ATOM 435 C PRO A 28 1.645 7.113 -6.025 1.00 0.00 C ATOM 436 O PRO A 28 0.492 6.941 -5.682 1.00 0.00 O ATOM 437 CB PRO A 28 1.977 8.444 -8.122 1.00 0.00 C ATOM 438 CG PRO A 28 0.528 8.623 -8.432 1.00 0.00 C ATOM 439 CD PRO A 28 0.030 7.242 -8.884 1.00 0.00 C ATOM 0 HA PRO A 28 3.029 6.589 -7.533 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.335 9.204 -7.428 1.00 0.00 H new ATOM 0 HB3 PRO A 28 2.591 8.517 -9.020 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -0.020 8.970 -7.556 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.383 9.368 -9.215 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.971 7.034 -8.506 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -0.018 7.169 -9.971 1.00 0.00 H new ATOM 447 N VAL A 29 2.584 7.367 -5.144 1.00 0.00 N ATOM 448 CA VAL A 29 2.256 7.453 -3.679 1.00 0.00 C ATOM 449 C VAL A 29 2.962 8.671 -3.062 1.00 0.00 C ATOM 450 O VAL A 29 4.149 8.861 -3.237 1.00 0.00 O ATOM 451 CB VAL A 29 2.739 6.179 -2.974 1.00 0.00 C ATOM 452 CG1 VAL A 29 1.742 5.038 -3.216 1.00 0.00 C ATOM 453 CG2 VAL A 29 4.111 5.782 -3.526 1.00 0.00 C ATOM 0 H VAL A 29 3.566 7.519 -5.374 1.00 0.00 H new ATOM 0 HA VAL A 29 1.178 7.556 -3.556 1.00 0.00 H new ATOM 0 HB VAL A 29 2.814 6.368 -1.903 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.091 4.137 -2.713 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.765 5.318 -2.822 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.660 4.847 -4.286 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.456 4.877 -3.026 1.00 0.00 H new ATOM 0 HG22 VAL A 29 4.033 5.598 -4.597 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.822 6.589 -3.348 1.00 0.00 H new ATOM 463 N TYR A 30 2.247 9.496 -2.327 1.00 0.00 N ATOM 464 CA TYR A 30 2.898 10.689 -1.692 1.00 0.00 C ATOM 465 C TYR A 30 3.316 10.323 -0.254 1.00 0.00 C ATOM 466 O TYR A 30 2.738 9.438 0.355 1.00 0.00 O ATOM 467 CB TYR A 30 1.919 11.889 -1.643 1.00 0.00 C ATOM 468 CG TYR A 30 0.817 11.724 -2.658 1.00 0.00 C ATOM 469 CD1 TYR A 30 -0.318 10.976 -2.334 1.00 0.00 C ATOM 470 CD2 TYR A 30 0.919 12.339 -3.908 1.00 0.00 C ATOM 471 CE1 TYR A 30 -1.353 10.836 -3.264 1.00 0.00 C ATOM 472 CE2 TYR A 30 -0.115 12.204 -4.839 1.00 0.00 C ATOM 473 CZ TYR A 30 -1.252 11.451 -4.518 1.00 0.00 C ATOM 474 OH TYR A 30 -2.269 11.317 -5.439 1.00 0.00 O ATOM 0 H TYR A 30 1.249 9.395 -2.141 1.00 0.00 H new ATOM 0 HA TYR A 30 3.768 10.972 -2.284 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.490 11.973 -0.645 1.00 0.00 H new ATOM 0 HB3 TYR A 30 2.461 12.815 -1.836 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -0.396 10.506 -1.365 1.00 0.00 H new ATOM 0 HD2 TYR A 30 1.796 12.918 -4.155 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -2.229 10.255 -3.016 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -0.037 12.680 -5.805 1.00 0.00 H new ATOM 0 HH TYR A 30 -2.399 12.167 -5.909 1.00 0.00 H new ATOM 484 N PRO A 31 4.292 11.009 0.295 1.00 0.00 N ATOM 485 CA PRO A 31 4.753 10.761 1.688 1.00 0.00 C ATOM 486 C PRO A 31 3.856 11.459 2.717 1.00 0.00 C ATOM 487 O PRO A 31 4.034 12.623 3.016 1.00 0.00 O ATOM 488 CB PRO A 31 6.154 11.365 1.691 1.00 0.00 C ATOM 489 CG PRO A 31 6.047 12.529 0.766 1.00 0.00 C ATOM 490 CD PRO A 31 5.079 12.091 -0.340 1.00 0.00 C ATOM 0 HA PRO A 31 4.729 9.706 1.961 1.00 0.00 H new ATOM 0 HB2 PRO A 31 6.452 11.677 2.692 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.899 10.648 1.346 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.673 13.410 1.287 1.00 0.00 H new ATOM 0 HG3 PRO A 31 7.021 12.792 0.353 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.441 12.914 -0.664 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.612 11.735 -1.222 1.00 0.00 H new ATOM 498 N GLY A 32 2.892 10.764 3.256 1.00 0.00 N ATOM 499 CA GLY A 32 1.993 11.407 4.257 1.00 0.00 C ATOM 500 C GLY A 32 1.130 10.354 4.949 1.00 0.00 C ATOM 501 O GLY A 32 1.251 9.172 4.695 1.00 0.00 O ATOM 0 H GLY A 32 2.688 9.786 3.049 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.587 11.944 4.997 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.356 12.142 3.765 1.00 0.00 H new ATOM 505 N PRO A 33 0.259 10.792 5.821 1.00 0.00 N ATOM 506 CA PRO A 33 -0.652 9.892 6.574 1.00 0.00 C ATOM 507 C PRO A 33 -1.875 9.509 5.740 1.00 0.00 C ATOM 508 O PRO A 33 -2.661 10.351 5.359 1.00 0.00 O ATOM 509 CB PRO A 33 -1.053 10.737 7.785 1.00 0.00 C ATOM 510 CG PRO A 33 -1.031 12.150 7.285 1.00 0.00 C ATOM 511 CD PRO A 33 0.046 12.206 6.187 1.00 0.00 C ATOM 0 HA PRO A 33 -0.184 8.946 6.846 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -2.042 10.461 8.151 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.357 10.599 8.613 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.005 12.437 6.889 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -0.799 12.844 8.093 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.287 12.794 5.331 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.964 12.666 6.552 1.00 0.00 H new ATOM 519 N ALA A 34 -2.025 8.247 5.447 1.00 0.00 N ATOM 520 CA ALA A 34 -3.185 7.792 4.624 1.00 0.00 C ATOM 521 C ALA A 34 -4.479 8.449 5.118 1.00 0.00 C ATOM 522 O ALA A 34 -5.197 7.899 5.929 1.00 0.00 O ATOM 523 CB ALA A 34 -3.307 6.265 4.723 1.00 0.00 C ATOM 0 H ALA A 34 -1.391 7.505 5.743 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.023 8.081 3.586 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.153 5.928 4.124 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.392 5.802 4.353 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.463 5.979 5.763 1.00 0.00 H new ATOM 529 N THR A 35 -4.782 9.620 4.615 1.00 0.00 N ATOM 530 CA THR A 35 -6.032 10.338 5.020 1.00 0.00 C ATOM 531 C THR A 35 -6.969 10.394 3.805 1.00 0.00 C ATOM 532 O THR A 35 -6.519 10.365 2.676 1.00 0.00 O ATOM 533 CB THR A 35 -5.670 11.767 5.460 1.00 0.00 C ATOM 534 OG1 THR A 35 -4.624 12.259 4.634 1.00 0.00 O ATOM 535 CG2 THR A 35 -5.204 11.760 6.918 1.00 0.00 C ATOM 0 H THR A 35 -4.209 10.116 3.932 1.00 0.00 H new ATOM 0 HA THR A 35 -6.521 9.821 5.845 1.00 0.00 H new ATOM 0 HB THR A 35 -6.548 12.407 5.367 1.00 0.00 H new ATOM 0 HG1 THR A 35 -3.788 11.799 4.856 1.00 0.00 H new ATOM 0 HG21 THR A 35 -4.949 12.775 7.223 1.00 0.00 H new ATOM 0 HG22 THR A 35 -6.004 11.380 7.554 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.327 11.120 7.017 1.00 0.00 H new ATOM 543 N PRO A 36 -8.260 10.475 4.021 1.00 0.00 N ATOM 544 CA PRO A 36 -9.249 10.536 2.903 1.00 0.00 C ATOM 545 C PRO A 36 -9.032 11.778 2.030 1.00 0.00 C ATOM 546 O PRO A 36 -9.038 11.707 0.817 1.00 0.00 O ATOM 547 CB PRO A 36 -10.618 10.581 3.612 1.00 0.00 C ATOM 548 CG PRO A 36 -10.321 11.042 5.006 1.00 0.00 C ATOM 549 CD PRO A 36 -8.923 10.521 5.334 1.00 0.00 C ATOM 0 HA PRO A 36 -9.160 9.688 2.224 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.301 11.265 3.108 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -11.093 9.600 3.614 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -10.358 12.129 5.073 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.057 10.654 5.710 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -8.400 11.182 6.025 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -8.960 9.536 5.800 1.00 0.00 H new ATOM 557 N GLU A 37 -8.833 12.912 2.641 1.00 0.00 N ATOM 558 CA GLU A 37 -8.608 14.153 1.851 1.00 0.00 C ATOM 559 C GLU A 37 -7.316 14.014 1.042 1.00 0.00 C ATOM 560 O GLU A 37 -7.091 14.728 0.086 1.00 0.00 O ATOM 561 CB GLU A 37 -8.491 15.349 2.799 1.00 0.00 C ATOM 562 CG GLU A 37 -7.506 15.018 3.921 1.00 0.00 C ATOM 563 CD GLU A 37 -7.154 16.295 4.686 1.00 0.00 C ATOM 564 OE1 GLU A 37 -7.664 17.342 4.319 1.00 0.00 O ATOM 565 OE2 GLU A 37 -6.382 16.207 5.626 1.00 0.00 O ATOM 0 H GLU A 37 -8.817 13.033 3.654 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.447 14.309 1.173 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.152 16.229 2.251 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.468 15.591 3.218 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -7.944 14.285 4.599 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.603 14.570 3.506 1.00 0.00 H new ATOM 572 N GLN A 38 -6.461 13.101 1.426 1.00 0.00 N ATOM 573 CA GLN A 38 -5.175 12.911 0.688 1.00 0.00 C ATOM 574 C GLN A 38 -5.349 11.828 -0.384 1.00 0.00 C ATOM 575 O GLN A 38 -5.328 12.107 -1.565 1.00 0.00 O ATOM 576 CB GLN A 38 -4.080 12.497 1.685 1.00 0.00 C ATOM 577 CG GLN A 38 -2.853 11.945 0.945 1.00 0.00 C ATOM 578 CD GLN A 38 -2.485 12.863 -0.225 1.00 0.00 C ATOM 579 OE1 GLN A 38 -1.762 13.825 -0.056 1.00 0.00 O ATOM 580 NE2 GLN A 38 -2.953 12.599 -1.414 1.00 0.00 N ATOM 0 H GLN A 38 -6.598 12.477 2.221 1.00 0.00 H new ATOM 0 HA GLN A 38 -4.888 13.843 0.201 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -3.790 13.355 2.291 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -4.469 11.742 2.368 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.011 11.864 1.632 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -3.062 10.941 0.577 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.560 11.791 -1.555 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -2.712 13.200 -2.202 1.00 0.00 H new ATOM 589 N LEU A 39 -5.509 10.592 0.019 1.00 0.00 N ATOM 590 CA LEU A 39 -5.672 9.493 -0.978 1.00 0.00 C ATOM 591 C LEU A 39 -6.663 9.919 -2.058 1.00 0.00 C ATOM 592 O LEU A 39 -6.719 9.342 -3.126 1.00 0.00 O ATOM 593 CB LEU A 39 -6.205 8.234 -0.295 1.00 0.00 C ATOM 594 CG LEU A 39 -5.304 7.838 0.882 1.00 0.00 C ATOM 595 CD1 LEU A 39 -6.063 6.880 1.804 1.00 0.00 C ATOM 596 CD2 LEU A 39 -4.036 7.143 0.368 1.00 0.00 C ATOM 0 H LEU A 39 -5.534 10.298 0.995 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.700 9.283 -1.424 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.221 8.408 0.060 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.254 7.416 -1.014 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.023 8.737 1.430 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.424 6.598 2.641 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.959 7.372 2.182 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.347 5.987 1.247 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.405 6.867 1.213 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.312 6.247 -0.187 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.489 7.821 -0.287 1.00 0.00 H new ATOM 608 N ASN A 40 -7.439 10.932 -1.797 1.00 0.00 N ATOM 609 CA ASN A 40 -8.411 11.391 -2.823 1.00 0.00 C ATOM 610 C ASN A 40 -7.611 11.837 -4.043 1.00 0.00 C ATOM 611 O ASN A 40 -8.089 11.825 -5.160 1.00 0.00 O ATOM 612 CB ASN A 40 -9.216 12.574 -2.266 1.00 0.00 C ATOM 613 CG ASN A 40 -10.476 12.067 -1.553 1.00 0.00 C ATOM 614 OD1 ASN A 40 -10.655 10.878 -1.382 1.00 0.00 O ATOM 615 ND2 ASN A 40 -11.361 12.927 -1.127 1.00 0.00 N ATOM 0 H ASN A 40 -7.442 11.458 -0.923 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.103 10.593 -3.091 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -8.602 13.147 -1.571 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.494 13.248 -3.076 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -12.202 12.600 -0.651 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.212 13.926 -1.270 1.00 0.00 H new ATOM 622 N ARG A 41 -6.387 12.216 -3.823 1.00 0.00 N ATOM 623 CA ARG A 41 -5.521 12.653 -4.949 1.00 0.00 C ATOM 624 C ARG A 41 -4.869 11.418 -5.568 1.00 0.00 C ATOM 625 O ARG A 41 -4.307 11.472 -6.644 1.00 0.00 O ATOM 626 CB ARG A 41 -4.433 13.595 -4.423 1.00 0.00 C ATOM 627 CG ARG A 41 -5.082 14.851 -3.834 1.00 0.00 C ATOM 628 CD ARG A 41 -4.059 15.604 -2.978 1.00 0.00 C ATOM 629 NE ARG A 41 -4.558 16.983 -2.705 1.00 0.00 N ATOM 630 CZ ARG A 41 -4.003 17.703 -1.767 1.00 0.00 C ATOM 631 NH1 ARG A 41 -3.016 17.216 -1.066 1.00 0.00 N ATOM 632 NH2 ARG A 41 -4.436 18.911 -1.530 1.00 0.00 N ATOM 0 H ARG A 41 -5.945 12.242 -2.904 1.00 0.00 H new ATOM 0 HA ARG A 41 -6.116 13.177 -5.697 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.837 13.090 -3.662 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.753 13.869 -5.230 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.445 15.495 -4.635 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.946 14.577 -3.229 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.893 15.074 -2.040 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.100 15.648 -3.494 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.332 17.363 -3.250 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -2.677 16.272 -1.250 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -2.584 17.779 -0.334 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -5.208 19.293 -2.077 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.003 19.473 -0.798 1.00 0.00 H new ATOM 646 N GLY A 42 -4.945 10.297 -4.896 1.00 0.00 N ATOM 647 CA GLY A 42 -4.329 9.056 -5.455 1.00 0.00 C ATOM 648 C GLY A 42 -4.039 8.043 -4.339 1.00 0.00 C ATOM 649 O GLY A 42 -4.938 7.457 -3.768 1.00 0.00 O ATOM 0 H GLY A 42 -5.403 10.188 -3.991 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.999 8.612 -6.191 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.404 9.306 -5.975 1.00 0.00 H new ATOM 653 N VAL A 43 -2.780 7.816 -4.045 1.00 0.00 N ATOM 654 CA VAL A 43 -2.396 6.821 -2.989 1.00 0.00 C ATOM 655 C VAL A 43 -1.369 7.456 -2.039 1.00 0.00 C ATOM 656 O VAL A 43 -0.677 8.388 -2.394 1.00 0.00 O ATOM 657 CB VAL A 43 -1.767 5.602 -3.678 1.00 0.00 C ATOM 658 CG1 VAL A 43 -1.661 4.427 -2.705 1.00 0.00 C ATOM 659 CG2 VAL A 43 -2.627 5.187 -4.873 1.00 0.00 C ATOM 0 H VAL A 43 -1.993 8.282 -4.496 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.274 6.520 -2.418 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.767 5.874 -4.015 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.213 3.573 -3.213 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.039 4.712 -1.857 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.656 4.157 -2.351 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.179 4.321 -5.361 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.629 4.931 -4.529 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.687 6.013 -5.582 1.00 0.00 H new ATOM 669 N SER A 44 -1.265 6.954 -0.836 1.00 0.00 N ATOM 670 CA SER A 44 -0.281 7.518 0.139 1.00 0.00 C ATOM 671 C SER A 44 0.117 6.419 1.128 1.00 0.00 C ATOM 672 O SER A 44 -0.630 5.491 1.360 1.00 0.00 O ATOM 673 CB SER A 44 -0.926 8.684 0.893 1.00 0.00 C ATOM 674 OG SER A 44 0.093 9.525 1.417 1.00 0.00 O ATOM 0 H SER A 44 -1.821 6.174 -0.484 1.00 0.00 H new ATOM 0 HA SER A 44 0.604 7.878 -0.386 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.573 9.251 0.224 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.554 8.307 1.701 1.00 0.00 H new ATOM 0 HG SER A 44 0.928 9.372 0.927 1.00 0.00 H new ATOM 680 N PHE A 45 1.282 6.501 1.718 1.00 0.00 N ATOM 681 CA PHE A 45 1.668 5.427 2.681 1.00 0.00 C ATOM 682 C PHE A 45 0.596 5.327 3.769 1.00 0.00 C ATOM 683 O PHE A 45 -0.299 6.145 3.847 1.00 0.00 O ATOM 684 CB PHE A 45 3.021 5.724 3.338 1.00 0.00 C ATOM 685 CG PHE A 45 4.153 5.556 2.336 1.00 0.00 C ATOM 686 CD1 PHE A 45 4.357 4.331 1.676 1.00 0.00 C ATOM 687 CD2 PHE A 45 5.007 6.632 2.073 1.00 0.00 C ATOM 688 CE1 PHE A 45 5.408 4.196 0.761 1.00 0.00 C ATOM 689 CE2 PHE A 45 6.056 6.496 1.157 1.00 0.00 C ATOM 690 CZ PHE A 45 6.256 5.278 0.501 1.00 0.00 C ATOM 0 H PHE A 45 1.967 7.244 1.580 1.00 0.00 H new ATOM 0 HA PHE A 45 1.753 4.488 2.133 1.00 0.00 H new ATOM 0 HB2 PHE A 45 3.025 6.741 3.731 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.175 5.054 4.184 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.703 3.495 1.875 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.856 7.574 2.580 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.564 3.255 0.255 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.711 7.331 0.957 1.00 0.00 H new ATOM 0 HZ PHE A 45 7.065 5.172 -0.207 1.00 0.00 H new ATOM 700 N ALA A 46 0.675 4.331 4.610 1.00 0.00 N ATOM 701 CA ALA A 46 -0.345 4.187 5.687 1.00 0.00 C ATOM 702 C ALA A 46 -0.032 5.164 6.821 1.00 0.00 C ATOM 703 O ALA A 46 -0.911 5.580 7.550 1.00 0.00 O ATOM 704 CB ALA A 46 -0.332 2.755 6.223 1.00 0.00 C ATOM 0 H ALA A 46 1.400 3.613 4.598 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.332 4.408 5.281 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.079 2.654 7.010 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -0.562 2.062 5.414 1.00 0.00 H new ATOM 0 HB3 ALA A 46 0.654 2.527 6.628 1.00 0.00 H new ATOM 710 N GLU A 47 1.216 5.536 6.973 1.00 0.00 N ATOM 711 CA GLU A 47 1.599 6.495 8.060 1.00 0.00 C ATOM 712 C GLU A 47 2.553 7.557 7.498 1.00 0.00 C ATOM 713 O GLU A 47 3.293 7.317 6.565 1.00 0.00 O ATOM 714 CB GLU A 47 2.285 5.734 9.195 1.00 0.00 C ATOM 715 CG GLU A 47 3.515 5.010 8.655 1.00 0.00 C ATOM 716 CD GLU A 47 4.145 4.169 9.768 1.00 0.00 C ATOM 717 OE1 GLU A 47 4.611 4.753 10.732 1.00 0.00 O ATOM 718 OE2 GLU A 47 4.151 2.956 9.636 1.00 0.00 O ATOM 0 H GLU A 47 1.989 5.216 6.390 1.00 0.00 H new ATOM 0 HA GLU A 47 0.704 6.984 8.443 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.575 6.425 9.986 1.00 0.00 H new ATOM 0 HB3 GLU A 47 1.593 5.017 9.636 1.00 0.00 H new ATOM 0 HG2 GLU A 47 3.235 4.372 7.817 1.00 0.00 H new ATOM 0 HG3 GLU A 47 4.238 5.733 8.277 1.00 0.00 H new ATOM 725 N GLU A 48 2.517 8.735 8.057 1.00 0.00 N ATOM 726 CA GLU A 48 3.389 9.846 7.571 1.00 0.00 C ATOM 727 C GLU A 48 4.877 9.497 7.717 1.00 0.00 C ATOM 728 O GLU A 48 5.700 9.937 6.938 1.00 0.00 O ATOM 729 CB GLU A 48 3.088 11.102 8.392 1.00 0.00 C ATOM 730 CG GLU A 48 4.049 12.223 7.989 1.00 0.00 C ATOM 731 CD GLU A 48 3.521 13.562 8.506 1.00 0.00 C ATOM 732 OE1 GLU A 48 2.507 14.012 8.000 1.00 0.00 O ATOM 733 OE2 GLU A 48 4.140 14.114 9.402 1.00 0.00 O ATOM 0 H GLU A 48 1.912 8.980 8.841 1.00 0.00 H new ATOM 0 HA GLU A 48 3.181 10.012 6.514 1.00 0.00 H new ATOM 0 HB2 GLU A 48 2.057 11.417 8.229 1.00 0.00 H new ATOM 0 HB3 GLU A 48 3.191 10.886 9.456 1.00 0.00 H new ATOM 0 HG2 GLU A 48 5.041 12.030 8.397 1.00 0.00 H new ATOM 0 HG3 GLU A 48 4.152 12.255 6.904 1.00 0.00 H new ATOM 740 N ASN A 49 5.239 8.746 8.720 1.00 0.00 N ATOM 741 CA ASN A 49 6.685 8.415 8.921 1.00 0.00 C ATOM 742 C ASN A 49 7.082 7.186 8.096 1.00 0.00 C ATOM 743 O ASN A 49 8.151 6.637 8.270 1.00 0.00 O ATOM 744 CB ASN A 49 6.932 8.128 10.406 1.00 0.00 C ATOM 745 CG ASN A 49 8.433 8.178 10.698 1.00 0.00 C ATOM 746 OD1 ASN A 49 9.071 9.189 10.486 1.00 0.00 O ATOM 747 ND2 ASN A 49 9.026 7.121 11.182 1.00 0.00 N ATOM 0 H ASN A 49 4.602 8.347 9.409 1.00 0.00 H new ATOM 0 HA ASN A 49 7.287 9.263 8.594 1.00 0.00 H new ATOM 0 HB2 ASN A 49 6.408 8.860 11.020 1.00 0.00 H new ATOM 0 HB3 ASN A 49 6.533 7.148 10.668 1.00 0.00 H new ATOM 0 HD21 ASN A 49 10.026 7.144 11.382 1.00 0.00 H new ATOM 0 HD22 ASN A 49 8.490 6.272 11.360 1.00 0.00 H new ATOM 754 N GLU A 50 6.243 6.749 7.199 1.00 0.00 N ATOM 755 CA GLU A 50 6.599 5.558 6.373 1.00 0.00 C ATOM 756 C GLU A 50 7.817 5.872 5.503 1.00 0.00 C ATOM 757 O GLU A 50 8.016 6.985 5.059 1.00 0.00 O ATOM 758 CB GLU A 50 5.416 5.172 5.473 1.00 0.00 C ATOM 759 CG GLU A 50 5.644 3.769 4.834 1.00 0.00 C ATOM 760 CD GLU A 50 4.404 2.884 5.033 1.00 0.00 C ATOM 761 OE1 GLU A 50 4.148 2.505 6.163 1.00 0.00 O ATOM 762 OE2 GLU A 50 3.737 2.602 4.052 1.00 0.00 O ATOM 0 H GLU A 50 5.331 7.161 7.001 1.00 0.00 H new ATOM 0 HA GLU A 50 6.834 4.727 7.038 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.496 5.166 6.057 1.00 0.00 H new ATOM 0 HB3 GLU A 50 5.291 5.918 4.688 1.00 0.00 H new ATOM 0 HG2 GLU A 50 5.855 3.877 3.770 1.00 0.00 H new ATOM 0 HG3 GLU A 50 6.515 3.293 5.285 1.00 0.00 H new ATOM 769 N SER A 51 8.625 4.882 5.261 1.00 0.00 N ATOM 770 CA SER A 51 9.840 5.065 4.422 1.00 0.00 C ATOM 771 C SER A 51 10.108 3.756 3.677 1.00 0.00 C ATOM 772 O SER A 51 9.777 2.688 4.155 1.00 0.00 O ATOM 773 CB SER A 51 11.033 5.396 5.325 1.00 0.00 C ATOM 774 OG SER A 51 10.943 4.627 6.517 1.00 0.00 O ATOM 0 H SER A 51 8.493 3.935 5.616 1.00 0.00 H new ATOM 0 HA SER A 51 9.694 5.878 3.711 1.00 0.00 H new ATOM 0 HB2 SER A 51 11.968 5.179 4.808 1.00 0.00 H new ATOM 0 HB3 SER A 51 11.040 6.460 5.564 1.00 0.00 H new ATOM 0 HG SER A 51 10.125 4.868 7.000 1.00 0.00 H new ATOM 780 N LEU A 52 10.716 3.812 2.528 1.00 0.00 N ATOM 781 CA LEU A 52 11.005 2.550 1.801 1.00 0.00 C ATOM 782 C LEU A 52 12.014 1.770 2.636 1.00 0.00 C ATOM 783 O LEU A 52 12.356 0.643 2.339 1.00 0.00 O ATOM 784 CB LEU A 52 11.580 2.854 0.402 1.00 0.00 C ATOM 785 CG LEU A 52 12.327 4.209 0.412 1.00 0.00 C ATOM 786 CD1 LEU A 52 13.453 4.186 -0.630 1.00 0.00 C ATOM 787 CD2 LEU A 52 11.350 5.352 0.077 1.00 0.00 C ATOM 0 H LEU A 52 11.022 4.668 2.065 1.00 0.00 H new ATOM 0 HA LEU A 52 10.094 1.969 1.659 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.261 2.058 0.100 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.775 2.880 -0.332 1.00 0.00 H new ATOM 0 HG LEU A 52 12.748 4.372 1.404 1.00 0.00 H new ATOM 0 HD11 LEU A 52 13.977 5.142 -0.620 1.00 0.00 H new ATOM 0 HD12 LEU A 52 14.153 3.386 -0.391 1.00 0.00 H new ATOM 0 HD13 LEU A 52 13.030 4.014 -1.620 1.00 0.00 H new ATOM 0 HD21 LEU A 52 11.884 6.302 0.086 1.00 0.00 H new ATOM 0 HD22 LEU A 52 10.921 5.186 -0.911 1.00 0.00 H new ATOM 0 HD23 LEU A 52 10.552 5.378 0.819 1.00 0.00 H new ATOM 799 N ASP A 53 12.485 2.375 3.695 1.00 0.00 N ATOM 800 CA ASP A 53 13.466 1.696 4.580 1.00 0.00 C ATOM 801 C ASP A 53 12.712 0.964 5.688 1.00 0.00 C ATOM 802 O ASP A 53 13.216 0.032 6.282 1.00 0.00 O ATOM 803 CB ASP A 53 14.399 2.735 5.206 1.00 0.00 C ATOM 804 CG ASP A 53 15.615 2.033 5.812 1.00 0.00 C ATOM 805 OD1 ASP A 53 16.512 1.690 5.060 1.00 0.00 O ATOM 806 OD2 ASP A 53 15.630 1.853 7.019 1.00 0.00 O ATOM 0 H ASP A 53 12.227 3.319 3.984 1.00 0.00 H new ATOM 0 HA ASP A 53 14.054 0.987 3.998 1.00 0.00 H new ATOM 0 HB2 ASP A 53 14.720 3.453 4.451 1.00 0.00 H new ATOM 0 HB3 ASP A 53 13.870 3.297 5.976 1.00 0.00 H new ATOM 811 N ASP A 54 11.505 1.377 5.975 1.00 0.00 N ATOM 812 CA ASP A 54 10.737 0.695 7.042 1.00 0.00 C ATOM 813 C ASP A 54 10.561 -0.773 6.662 1.00 0.00 C ATOM 814 O ASP A 54 9.715 -1.114 5.858 1.00 0.00 O ATOM 815 CB ASP A 54 9.366 1.357 7.190 1.00 0.00 C ATOM 816 CG ASP A 54 9.523 2.703 7.900 1.00 0.00 C ATOM 817 OD1 ASP A 54 10.251 2.753 8.879 1.00 0.00 O ATOM 818 OD2 ASP A 54 8.917 3.662 7.453 1.00 0.00 O ATOM 0 H ASP A 54 11.026 2.152 5.517 1.00 0.00 H new ATOM 0 HA ASP A 54 11.272 0.769 7.989 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.913 1.502 6.209 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.697 0.710 7.758 1.00 0.00 H new ATOM 823 N GLN A 55 11.356 -1.645 7.231 1.00 0.00 N ATOM 824 CA GLN A 55 11.242 -3.103 6.907 1.00 0.00 C ATOM 825 C GLN A 55 9.765 -3.503 6.862 1.00 0.00 C ATOM 826 O GLN A 55 9.398 -4.497 6.270 1.00 0.00 O ATOM 827 CB GLN A 55 11.958 -3.923 7.986 1.00 0.00 C ATOM 828 CG GLN A 55 12.178 -5.359 7.487 1.00 0.00 C ATOM 829 CD GLN A 55 12.411 -6.292 8.678 1.00 0.00 C ATOM 830 OE1 GLN A 55 13.477 -6.301 9.260 1.00 0.00 O ATOM 831 NE2 GLN A 55 11.448 -7.083 9.067 1.00 0.00 N ATOM 0 H GLN A 55 12.082 -1.410 7.908 1.00 0.00 H new ATOM 0 HA GLN A 55 11.701 -3.296 5.937 1.00 0.00 H new ATOM 0 HB2 GLN A 55 12.915 -3.462 8.231 1.00 0.00 H new ATOM 0 HB3 GLN A 55 11.366 -3.933 8.901 1.00 0.00 H new ATOM 0 HG2 GLN A 55 11.311 -5.692 6.916 1.00 0.00 H new ATOM 0 HG3 GLN A 55 13.035 -5.393 6.814 1.00 0.00 H new ATOM 0 HE21 GLN A 55 10.553 -7.075 8.578 1.00 0.00 H new ATOM 0 HE22 GLN A 55 11.591 -7.709 9.860 1.00 0.00 H new ATOM 840 N ASN A 56 8.918 -2.713 7.479 1.00 0.00 N ATOM 841 CA ASN A 56 7.449 -3.002 7.487 1.00 0.00 C ATOM 842 C ASN A 56 6.725 -1.866 6.767 1.00 0.00 C ATOM 843 O ASN A 56 6.461 -0.827 7.339 1.00 0.00 O ATOM 844 CB ASN A 56 6.956 -3.083 8.933 1.00 0.00 C ATOM 845 CG ASN A 56 5.444 -3.321 8.944 1.00 0.00 C ATOM 846 OD1 ASN A 56 4.685 -2.463 9.349 1.00 0.00 O ATOM 847 ND2 ASN A 56 4.972 -4.460 8.513 1.00 0.00 N ATOM 0 H ASN A 56 9.187 -1.869 7.984 1.00 0.00 H new ATOM 0 HA ASN A 56 7.251 -3.949 6.985 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.466 -3.891 9.458 1.00 0.00 H new ATOM 0 HB3 ASN A 56 7.193 -2.160 9.462 1.00 0.00 H new ATOM 0 HD21 ASN A 56 3.966 -4.629 8.516 1.00 0.00 H new ATOM 0 HD22 ASN A 56 5.609 -5.180 8.173 1.00 0.00 H new ATOM 854 N ILE A 57 6.407 -2.047 5.510 1.00 0.00 N ATOM 855 CA ILE A 57 5.708 -0.967 4.749 1.00 0.00 C ATOM 856 C ILE A 57 4.202 -1.216 4.765 1.00 0.00 C ATOM 857 O ILE A 57 3.743 -2.342 4.760 1.00 0.00 O ATOM 858 CB ILE A 57 6.198 -0.961 3.298 1.00 0.00 C ATOM 859 CG1 ILE A 57 7.675 -0.559 3.262 1.00 0.00 C ATOM 860 CG2 ILE A 57 5.376 0.043 2.479 1.00 0.00 C ATOM 861 CD1 ILE A 57 8.241 -0.816 1.864 1.00 0.00 C ATOM 0 H ILE A 57 6.601 -2.895 4.978 1.00 0.00 H new ATOM 0 HA ILE A 57 5.925 -0.006 5.215 1.00 0.00 H new ATOM 0 HB ILE A 57 6.079 -1.957 2.872 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.782 0.494 3.521 1.00 0.00 H new ATOM 0 HG13 ILE A 57 8.236 -1.128 4.003 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.727 0.045 1.447 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.324 -0.242 2.504 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.492 1.040 2.903 1.00 0.00 H new ATOM 0 HD11 ILE A 57 9.292 -0.530 1.839 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.147 -1.875 1.623 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.687 -0.227 1.133 1.00 0.00 H new ATOM 873 N SER A 58 3.432 -0.163 4.775 1.00 0.00 N ATOM 874 CA SER A 58 1.949 -0.304 4.780 1.00 0.00 C ATOM 875 C SER A 58 1.356 0.835 3.950 1.00 0.00 C ATOM 876 O SER A 58 1.402 1.983 4.343 1.00 0.00 O ATOM 877 CB SER A 58 1.435 -0.222 6.219 1.00 0.00 C ATOM 878 OG SER A 58 1.658 -1.467 6.868 1.00 0.00 O ATOM 0 H SER A 58 3.771 0.799 4.780 1.00 0.00 H new ATOM 0 HA SER A 58 1.657 -1.265 4.356 1.00 0.00 H new ATOM 0 HB2 SER A 58 1.946 0.578 6.755 1.00 0.00 H new ATOM 0 HB3 SER A 58 0.372 0.019 6.225 1.00 0.00 H new ATOM 0 HG SER A 58 1.332 -1.418 7.791 1.00 0.00 H new ATOM 884 N ILE A 59 0.817 0.530 2.793 1.00 0.00 N ATOM 885 CA ILE A 59 0.236 1.599 1.914 1.00 0.00 C ATOM 886 C ILE A 59 -1.293 1.490 1.899 1.00 0.00 C ATOM 887 O ILE A 59 -1.864 0.511 2.338 1.00 0.00 O ATOM 888 CB ILE A 59 0.791 1.439 0.479 1.00 0.00 C ATOM 889 CG1 ILE A 59 2.198 0.827 0.539 1.00 0.00 C ATOM 890 CG2 ILE A 59 0.864 2.804 -0.224 1.00 0.00 C ATOM 891 CD1 ILE A 59 2.806 0.794 -0.865 1.00 0.00 C ATOM 0 H ILE A 59 0.754 -0.416 2.417 1.00 0.00 H new ATOM 0 HA ILE A 59 0.514 2.579 2.303 1.00 0.00 H new ATOM 0 HB ILE A 59 0.124 0.785 -0.083 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.831 1.412 1.206 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.149 -0.182 0.948 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.257 2.673 -1.232 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -0.134 3.240 -0.277 1.00 0.00 H new ATOM 0 HG23 ILE A 59 1.521 3.468 0.338 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.804 0.359 -0.819 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.177 0.191 -1.520 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.870 1.809 -1.258 1.00 0.00 H new ATOM 903 N ALA A 60 -1.951 2.498 1.390 1.00 0.00 N ATOM 904 CA ALA A 60 -3.443 2.488 1.326 1.00 0.00 C ATOM 905 C ALA A 60 -3.879 3.158 0.017 1.00 0.00 C ATOM 906 O ALA A 60 -3.354 4.188 -0.355 1.00 0.00 O ATOM 907 CB ALA A 60 -4.001 3.266 2.521 1.00 0.00 C ATOM 0 H ALA A 60 -1.513 3.338 1.011 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.819 1.466 1.358 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.090 3.263 2.481 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.671 2.796 3.447 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.640 4.294 2.487 1.00 0.00 H new ATOM 913 N GLY A 61 -4.823 2.581 -0.696 1.00 0.00 N ATOM 914 CA GLY A 61 -5.261 3.197 -1.995 1.00 0.00 C ATOM 915 C GLY A 61 -6.772 3.024 -2.199 1.00 0.00 C ATOM 916 O GLY A 61 -7.397 2.157 -1.621 1.00 0.00 O ATOM 0 H GLY A 61 -5.304 1.720 -0.438 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -5.008 4.257 -2.003 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -4.723 2.734 -2.822 1.00 0.00 H new ATOM 920 N HIS A 62 -7.357 3.861 -3.019 1.00 0.00 N ATOM 921 CA HIS A 62 -8.833 3.777 -3.279 1.00 0.00 C ATOM 922 C HIS A 62 -9.157 2.564 -4.172 1.00 0.00 C ATOM 923 O HIS A 62 -8.302 1.757 -4.475 1.00 0.00 O ATOM 924 CB HIS A 62 -9.302 5.073 -3.970 1.00 0.00 C ATOM 925 CG HIS A 62 -9.646 6.118 -2.938 1.00 0.00 C ATOM 926 ND1 HIS A 62 -10.903 6.193 -2.355 1.00 0.00 N ATOM 927 CD2 HIS A 62 -8.913 7.134 -2.378 1.00 0.00 C ATOM 928 CE1 HIS A 62 -10.886 7.222 -1.488 1.00 0.00 C ATOM 929 NE2 HIS A 62 -9.698 7.829 -1.462 1.00 0.00 N ATOM 0 H HIS A 62 -6.875 4.605 -3.524 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.354 3.656 -2.329 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -8.518 5.446 -4.629 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.172 4.867 -4.594 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -7.883 7.360 -2.612 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -11.732 7.520 -0.886 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -9.424 8.630 -0.893 1.00 0.00 H new ATOM 937 N THR A 63 -10.396 2.442 -4.600 1.00 0.00 N ATOM 938 CA THR A 63 -10.793 1.297 -5.476 1.00 0.00 C ATOM 939 C THR A 63 -12.249 1.467 -5.928 1.00 0.00 C ATOM 940 O THR A 63 -13.145 0.826 -5.417 1.00 0.00 O ATOM 941 CB THR A 63 -10.654 -0.031 -4.714 1.00 0.00 C ATOM 942 OG1 THR A 63 -11.404 -1.038 -5.379 1.00 0.00 O ATOM 943 CG2 THR A 63 -11.180 0.113 -3.291 1.00 0.00 C ATOM 0 H THR A 63 -11.150 3.092 -4.377 1.00 0.00 H new ATOM 0 HA THR A 63 -10.137 1.283 -6.346 1.00 0.00 H new ATOM 0 HB THR A 63 -9.599 -0.304 -4.681 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.354 -0.798 -5.370 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.074 -0.836 -2.766 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.611 0.882 -2.769 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.232 0.397 -3.319 1.00 0.00 H new ATOM 951 N PHE A 64 -12.497 2.321 -6.889 1.00 0.00 N ATOM 952 CA PHE A 64 -13.899 2.519 -7.372 1.00 0.00 C ATOM 953 C PHE A 64 -14.187 1.513 -8.493 1.00 0.00 C ATOM 954 O PHE A 64 -13.541 1.508 -9.519 1.00 0.00 O ATOM 955 CB PHE A 64 -14.064 3.955 -7.901 1.00 0.00 C ATOM 956 CG PHE A 64 -14.388 4.891 -6.754 1.00 0.00 C ATOM 957 CD1 PHE A 64 -15.652 4.848 -6.155 1.00 0.00 C ATOM 958 CD2 PHE A 64 -13.427 5.797 -6.291 1.00 0.00 C ATOM 959 CE1 PHE A 64 -15.956 5.710 -5.095 1.00 0.00 C ATOM 960 CE2 PHE A 64 -13.730 6.660 -5.231 1.00 0.00 C ATOM 961 CZ PHE A 64 -14.994 6.616 -4.633 1.00 0.00 C ATOM 0 H PHE A 64 -11.792 2.889 -7.359 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.599 2.361 -6.552 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -13.149 4.277 -8.397 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -14.859 3.989 -8.646 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -16.394 4.149 -6.511 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -12.451 5.830 -6.752 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -16.932 5.676 -4.634 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -12.988 7.360 -4.875 1.00 0.00 H new ATOM 0 HZ PHE A 64 -15.228 7.281 -3.815 1.00 0.00 H new ATOM 971 N ILE A 65 -15.153 0.658 -8.292 1.00 0.00 N ATOM 972 CA ILE A 65 -15.493 -0.362 -9.329 1.00 0.00 C ATOM 973 C ILE A 65 -15.927 0.321 -10.624 1.00 0.00 C ATOM 974 O ILE A 65 -15.821 -0.235 -11.699 1.00 0.00 O ATOM 975 CB ILE A 65 -16.657 -1.226 -8.839 1.00 0.00 C ATOM 976 CG1 ILE A 65 -16.425 -1.655 -7.394 1.00 0.00 C ATOM 977 CG2 ILE A 65 -16.778 -2.468 -9.722 1.00 0.00 C ATOM 978 CD1 ILE A 65 -17.591 -2.535 -6.950 1.00 0.00 C ATOM 0 H ILE A 65 -15.726 0.621 -7.449 1.00 0.00 H new ATOM 0 HA ILE A 65 -14.609 -0.974 -9.509 1.00 0.00 H new ATOM 0 HB ILE A 65 -17.576 -0.643 -8.894 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.486 -2.201 -7.308 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -16.345 -0.780 -6.749 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -17.607 -3.083 -9.373 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -16.960 -2.165 -10.753 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -15.853 -3.042 -9.671 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.437 -2.849 -5.918 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -18.521 -1.971 -7.023 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -17.648 -3.414 -7.592 1.00 0.00 H new ATOM 990 N ASP A 66 -16.446 1.509 -10.529 1.00 0.00 N ATOM 991 CA ASP A 66 -16.924 2.210 -11.746 1.00 0.00 C ATOM 992 C ASP A 66 -15.749 2.874 -12.448 1.00 0.00 C ATOM 993 O ASP A 66 -15.915 3.709 -13.315 1.00 0.00 O ATOM 994 CB ASP A 66 -17.956 3.265 -11.345 1.00 0.00 C ATOM 995 CG ASP A 66 -18.497 3.958 -12.597 1.00 0.00 C ATOM 996 OD1 ASP A 66 -19.022 3.267 -13.453 1.00 0.00 O ATOM 997 OD2 ASP A 66 -18.379 5.170 -12.676 1.00 0.00 O ATOM 0 H ASP A 66 -16.560 2.026 -9.657 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.384 1.494 -12.427 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -18.773 2.798 -10.794 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -17.501 3.998 -10.679 1.00 0.00 H new ATOM 1002 N ARG A 67 -14.560 2.495 -12.084 1.00 0.00 N ATOM 1003 CA ARG A 67 -13.352 3.083 -12.728 1.00 0.00 C ATOM 1004 C ARG A 67 -12.215 2.058 -12.708 1.00 0.00 C ATOM 1005 O ARG A 67 -11.309 2.157 -11.906 1.00 0.00 O ATOM 1006 CB ARG A 67 -12.916 4.339 -11.968 1.00 0.00 C ATOM 1007 CG ARG A 67 -13.985 5.429 -12.107 1.00 0.00 C ATOM 1008 CD ARG A 67 -13.380 6.789 -11.751 1.00 0.00 C ATOM 1009 NE ARG A 67 -14.403 7.853 -11.946 1.00 0.00 N ATOM 1010 CZ ARG A 67 -14.217 9.039 -11.434 1.00 0.00 C ATOM 1011 NH1 ARG A 67 -13.133 9.292 -10.752 1.00 0.00 N ATOM 1012 NH2 ARG A 67 -15.113 9.971 -11.603 1.00 0.00 N ATOM 0 H ARG A 67 -14.369 1.799 -11.363 1.00 0.00 H new ATOM 0 HA ARG A 67 -13.589 3.350 -13.758 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -12.760 4.102 -10.916 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -11.964 4.699 -12.358 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -14.371 5.447 -13.126 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -14.828 5.212 -11.451 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -13.035 6.786 -10.717 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -12.510 6.987 -12.377 1.00 0.00 H new ATOM 0 HE ARG A 67 -15.249 7.655 -12.480 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -12.432 8.563 -10.620 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -12.987 10.219 -10.352 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -15.960 9.773 -12.136 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -14.967 10.898 -11.202 1.00 0.00 H new ATOM 1026 N PRO A 68 -12.272 1.079 -13.583 1.00 0.00 N ATOM 1027 CA PRO A 68 -11.240 -0.011 -13.683 1.00 0.00 C ATOM 1028 C PRO A 68 -9.787 0.503 -13.734 1.00 0.00 C ATOM 1029 O PRO A 68 -8.871 -0.240 -14.026 1.00 0.00 O ATOM 1030 CB PRO A 68 -11.603 -0.728 -14.993 1.00 0.00 C ATOM 1031 CG PRO A 68 -13.069 -0.491 -15.163 1.00 0.00 C ATOM 1032 CD PRO A 68 -13.341 0.899 -14.583 1.00 0.00 C ATOM 0 HA PRO A 68 -11.262 -0.649 -12.799 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -11.037 -0.327 -15.834 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -11.378 -1.793 -14.937 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -13.353 -0.537 -16.214 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -13.650 -1.252 -14.642 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -13.301 1.669 -15.354 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -14.329 0.956 -14.127 1.00 0.00 H new ATOM 1040 N ASN A 69 -9.567 1.755 -13.444 1.00 0.00 N ATOM 1041 CA ASN A 69 -8.185 2.312 -13.461 1.00 0.00 C ATOM 1042 C ASN A 69 -8.089 3.382 -12.369 1.00 0.00 C ATOM 1043 O ASN A 69 -7.703 4.506 -12.619 1.00 0.00 O ATOM 1044 CB ASN A 69 -7.900 2.933 -14.841 1.00 0.00 C ATOM 1045 CG ASN A 69 -8.664 2.160 -15.917 1.00 0.00 C ATOM 1046 OD1 ASN A 69 -8.095 1.348 -16.619 1.00 0.00 O ATOM 1047 ND2 ASN A 69 -9.941 2.382 -16.077 1.00 0.00 N ATOM 0 H ASN A 69 -10.295 2.424 -13.193 1.00 0.00 H new ATOM 0 HA ASN A 69 -7.452 1.527 -13.276 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -8.200 3.981 -14.849 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -6.830 2.906 -15.050 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.461 1.873 -16.792 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -10.418 3.064 -15.487 1.00 0.00 H new ATOM 1054 N TYR A 70 -8.460 3.040 -11.158 1.00 0.00 N ATOM 1055 CA TYR A 70 -8.419 4.032 -10.038 1.00 0.00 C ATOM 1056 C TYR A 70 -7.844 3.374 -8.776 1.00 0.00 C ATOM 1057 O TYR A 70 -8.527 2.671 -8.060 1.00 0.00 O ATOM 1058 CB TYR A 70 -9.848 4.524 -9.762 1.00 0.00 C ATOM 1059 CG TYR A 70 -9.815 5.860 -9.054 1.00 0.00 C ATOM 1060 CD1 TYR A 70 -9.586 7.033 -9.782 1.00 0.00 C ATOM 1061 CD2 TYR A 70 -10.024 5.926 -7.670 1.00 0.00 C ATOM 1062 CE1 TYR A 70 -9.562 8.271 -9.128 1.00 0.00 C ATOM 1063 CE2 TYR A 70 -10.002 7.164 -7.016 1.00 0.00 C ATOM 1064 CZ TYR A 70 -9.771 8.336 -7.745 1.00 0.00 C ATOM 1065 OH TYR A 70 -9.749 9.556 -7.100 1.00 0.00 O ATOM 0 H TYR A 70 -8.791 2.111 -10.897 1.00 0.00 H new ATOM 0 HA TYR A 70 -7.783 4.873 -10.314 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -10.396 4.615 -10.700 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -10.380 3.794 -9.152 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -9.428 6.983 -10.849 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -10.202 5.022 -7.107 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -9.382 9.175 -9.690 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -10.163 7.214 -5.949 1.00 0.00 H new ATOM 0 HH TYR A 70 -9.912 9.423 -6.143 1.00 0.00 H new ATOM 1075 N GLN A 71 -6.594 3.621 -8.500 1.00 0.00 N ATOM 1076 CA GLN A 71 -5.952 3.045 -7.283 1.00 0.00 C ATOM 1077 C GLN A 71 -6.106 1.513 -7.259 1.00 0.00 C ATOM 1078 O GLN A 71 -5.704 0.831 -8.180 1.00 0.00 O ATOM 1079 CB GLN A 71 -6.576 3.678 -6.027 1.00 0.00 C ATOM 1080 CG GLN A 71 -6.136 5.156 -5.900 1.00 0.00 C ATOM 1081 CD GLN A 71 -7.068 6.070 -6.702 1.00 0.00 C ATOM 1082 OE1 GLN A 71 -7.424 5.769 -7.822 1.00 0.00 O ATOM 1083 NE2 GLN A 71 -7.471 7.191 -6.170 1.00 0.00 N ATOM 0 H GLN A 71 -5.982 4.204 -9.071 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.886 3.270 -7.301 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -7.663 3.618 -6.082 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -6.270 3.122 -5.140 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -6.141 5.453 -4.851 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -5.113 5.268 -6.258 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -7.172 7.445 -5.228 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -8.085 7.813 -6.696 1.00 0.00 H new ATOM 1092 N PHE A 72 -6.652 0.958 -6.204 1.00 0.00 N ATOM 1093 CA PHE A 72 -6.783 -0.532 -6.118 1.00 0.00 C ATOM 1094 C PHE A 72 -8.122 -0.977 -6.710 1.00 0.00 C ATOM 1095 O PHE A 72 -8.719 -1.929 -6.252 1.00 0.00 O ATOM 1096 CB PHE A 72 -6.748 -0.987 -4.644 1.00 0.00 C ATOM 1097 CG PHE A 72 -5.356 -0.898 -4.053 1.00 0.00 C ATOM 1098 CD1 PHE A 72 -4.644 0.312 -4.084 1.00 0.00 C ATOM 1099 CD2 PHE A 72 -4.784 -2.030 -3.451 1.00 0.00 C ATOM 1100 CE1 PHE A 72 -3.367 0.386 -3.520 1.00 0.00 C ATOM 1101 CE2 PHE A 72 -3.508 -1.950 -2.888 1.00 0.00 C ATOM 1102 CZ PHE A 72 -2.798 -0.742 -2.923 1.00 0.00 C ATOM 0 H PHE A 72 -7.012 1.471 -5.399 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.955 -0.975 -6.671 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -7.430 -0.370 -4.058 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.106 -2.014 -4.573 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -5.083 1.185 -4.543 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -5.330 -2.962 -3.423 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -2.819 1.316 -3.546 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -3.068 -2.821 -2.425 1.00 0.00 H new ATOM 0 HZ PHE A 72 -1.811 -0.683 -2.488 1.00 0.00 H new ATOM 1112 N THR A 73 -8.611 -0.318 -7.717 1.00 0.00 N ATOM 1113 CA THR A 73 -9.914 -0.754 -8.287 1.00 0.00 C ATOM 1114 C THR A 73 -9.814 -2.213 -8.729 1.00 0.00 C ATOM 1115 O THR A 73 -10.801 -2.920 -8.780 1.00 0.00 O ATOM 1116 CB THR A 73 -10.288 0.102 -9.493 1.00 0.00 C ATOM 1117 OG1 THR A 73 -10.416 1.457 -9.089 1.00 0.00 O ATOM 1118 CG2 THR A 73 -11.619 -0.402 -10.054 1.00 0.00 C ATOM 0 H THR A 73 -8.177 0.489 -8.165 1.00 0.00 H new ATOM 0 HA THR A 73 -10.680 -0.643 -7.520 1.00 0.00 H new ATOM 0 HB THR A 73 -9.515 0.033 -10.259 1.00 0.00 H new ATOM 0 HG1 THR A 73 -9.759 1.653 -8.389 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.901 0.200 -10.918 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.515 -1.444 -10.356 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.390 -0.322 -9.288 1.00 0.00 H new ATOM 1126 N ASN A 74 -8.635 -2.670 -9.062 1.00 0.00 N ATOM 1127 CA ASN A 74 -8.477 -4.087 -9.515 1.00 0.00 C ATOM 1128 C ASN A 74 -7.186 -4.678 -8.939 1.00 0.00 C ATOM 1129 O ASN A 74 -6.834 -5.805 -9.223 1.00 0.00 O ATOM 1130 CB ASN A 74 -8.475 -4.125 -11.059 1.00 0.00 C ATOM 1131 CG ASN A 74 -7.069 -3.885 -11.619 1.00 0.00 C ATOM 1132 OD1 ASN A 74 -6.193 -4.703 -11.445 1.00 0.00 O ATOM 1133 ND2 ASN A 74 -6.820 -2.794 -12.290 1.00 0.00 N ATOM 0 H ASN A 74 -7.774 -2.124 -9.040 1.00 0.00 H new ATOM 0 HA ASN A 74 -9.309 -4.692 -9.153 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -8.845 -5.091 -11.402 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -9.157 -3.367 -11.445 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -5.887 -2.630 -12.668 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -7.558 -2.105 -12.436 1.00 0.00 H new ATOM 1140 N LEU A 75 -6.486 -3.945 -8.113 1.00 0.00 N ATOM 1141 CA LEU A 75 -5.244 -4.514 -7.520 1.00 0.00 C ATOM 1142 C LEU A 75 -5.609 -5.823 -6.835 1.00 0.00 C ATOM 1143 O LEU A 75 -4.780 -6.684 -6.619 1.00 0.00 O ATOM 1144 CB LEU A 75 -4.642 -3.551 -6.490 1.00 0.00 C ATOM 1145 CG LEU A 75 -3.358 -4.178 -5.879 1.00 0.00 C ATOM 1146 CD1 LEU A 75 -2.343 -3.071 -5.488 1.00 0.00 C ATOM 1147 CD2 LEU A 75 -3.698 -5.079 -4.653 1.00 0.00 C ATOM 0 H LEU A 75 -6.717 -2.993 -7.828 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.505 -4.677 -8.305 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.404 -2.598 -6.963 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.368 -3.344 -5.703 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.899 -4.812 -6.638 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.451 -3.530 -5.062 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.069 -2.499 -6.374 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.795 -2.406 -4.752 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.780 -5.503 -4.247 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -4.190 -4.480 -3.887 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.362 -5.884 -4.966 1.00 0.00 H new ATOM 1159 N LYS A 76 -6.859 -5.974 -6.505 1.00 0.00 N ATOM 1160 CA LYS A 76 -7.315 -7.220 -5.845 1.00 0.00 C ATOM 1161 C LYS A 76 -7.559 -8.264 -6.927 1.00 0.00 C ATOM 1162 O LYS A 76 -7.607 -9.452 -6.673 1.00 0.00 O ATOM 1163 CB LYS A 76 -8.626 -6.952 -5.109 1.00 0.00 C ATOM 1164 CG LYS A 76 -8.449 -5.819 -4.090 1.00 0.00 C ATOM 1165 CD LYS A 76 -9.832 -5.250 -3.708 1.00 0.00 C ATOM 1166 CE LYS A 76 -10.226 -4.115 -4.663 1.00 0.00 C ATOM 1167 NZ LYS A 76 -9.598 -2.845 -4.203 1.00 0.00 N ATOM 0 H LYS A 76 -7.589 -5.280 -6.667 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.565 -7.569 -5.135 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -9.404 -6.687 -5.825 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -8.956 -7.858 -4.601 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -7.939 -6.191 -3.201 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -7.823 -5.032 -4.511 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -10.581 -6.041 -3.745 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -9.810 -4.880 -2.683 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -9.901 -4.348 -5.677 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.310 -4.008 -4.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -9.491 -2.198 -5.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -10.201 -2.401 -3.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -8.663 -3.048 -3.796 1.00 0.00 H new ATOM 1181 N ALA A 77 -7.704 -7.817 -8.145 1.00 0.00 N ATOM 1182 CA ALA A 77 -7.934 -8.760 -9.268 1.00 0.00 C ATOM 1183 C ALA A 77 -6.717 -9.662 -9.374 1.00 0.00 C ATOM 1184 O ALA A 77 -6.772 -10.760 -9.892 1.00 0.00 O ATOM 1185 CB ALA A 77 -8.098 -7.962 -10.560 1.00 0.00 C ATOM 0 H ALA A 77 -7.672 -6.832 -8.408 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.831 -9.356 -9.100 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.267 -8.646 -11.391 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -8.949 -7.288 -10.466 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.194 -7.382 -10.746 1.00 0.00 H new ATOM 1191 N ALA A 78 -5.617 -9.191 -8.868 1.00 0.00 N ATOM 1192 CA ALA A 78 -4.367 -9.991 -8.905 1.00 0.00 C ATOM 1193 C ALA A 78 -4.627 -11.362 -8.264 1.00 0.00 C ATOM 1194 O ALA A 78 -5.754 -11.725 -7.991 1.00 0.00 O ATOM 1195 CB ALA A 78 -3.282 -9.239 -8.126 1.00 0.00 C ATOM 0 H ALA A 78 -5.529 -8.276 -8.426 1.00 0.00 H new ATOM 0 HA ALA A 78 -4.039 -10.139 -9.934 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.356 -9.814 -8.144 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.113 -8.265 -8.586 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.604 -9.102 -7.094 1.00 0.00 H new ATOM 1201 N LYS A 79 -3.595 -12.125 -8.025 1.00 0.00 N ATOM 1202 CA LYS A 79 -3.784 -13.471 -7.405 1.00 0.00 C ATOM 1203 C LYS A 79 -2.502 -13.872 -6.670 1.00 0.00 C ATOM 1204 O LYS A 79 -1.433 -13.374 -6.961 1.00 0.00 O ATOM 1205 CB LYS A 79 -4.085 -14.495 -8.503 1.00 0.00 C ATOM 1206 CG LYS A 79 -2.886 -14.596 -9.457 1.00 0.00 C ATOM 1207 CD LYS A 79 -3.316 -15.249 -10.786 1.00 0.00 C ATOM 1208 CE LYS A 79 -3.853 -14.184 -11.753 1.00 0.00 C ATOM 1209 NZ LYS A 79 -4.708 -14.837 -12.784 1.00 0.00 N ATOM 0 H LYS A 79 -2.628 -11.876 -8.232 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.614 -13.439 -6.699 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -4.292 -15.469 -8.059 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -4.978 -14.200 -9.055 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -2.478 -13.603 -9.647 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -2.093 -15.183 -8.995 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -2.468 -15.765 -11.237 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -4.083 -16.000 -10.599 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -4.430 -13.438 -11.206 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.025 -13.660 -12.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -5.072 -14.117 -13.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -4.144 -15.533 -13.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -5.505 -15.318 -12.320 1.00 0.00 H new ATOM 1223 N LYS A 80 -2.597 -14.763 -5.717 1.00 0.00 N ATOM 1224 CA LYS A 80 -1.376 -15.184 -4.968 1.00 0.00 C ATOM 1225 C LYS A 80 -0.289 -15.608 -5.958 1.00 0.00 C ATOM 1226 O LYS A 80 -0.177 -16.760 -6.324 1.00 0.00 O ATOM 1227 CB LYS A 80 -1.714 -16.351 -4.034 1.00 0.00 C ATOM 1228 CG LYS A 80 -0.485 -16.707 -3.178 1.00 0.00 C ATOM 1229 CD LYS A 80 -0.930 -17.441 -1.906 1.00 0.00 C ATOM 1230 CE LYS A 80 -1.752 -18.679 -2.280 1.00 0.00 C ATOM 1231 NZ LYS A 80 -3.139 -18.266 -2.640 1.00 0.00 N ATOM 0 H LYS A 80 -3.464 -15.216 -5.426 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.013 -14.347 -4.372 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.552 -16.083 -3.390 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -2.025 -17.217 -4.618 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.198 -17.334 -3.750 1.00 0.00 H new ATOM 0 HG3 LYS A 80 0.060 -15.801 -2.914 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.058 -17.735 -1.321 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.524 -16.775 -1.280 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -1.287 -19.198 -3.118 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.775 -19.379 -1.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.820 -18.924 -2.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -3.317 -17.304 -2.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -3.249 -18.282 -3.674 1.00 0.00 H new ATOM 1245 N GLY A 81 0.507 -14.672 -6.395 1.00 0.00 N ATOM 1246 CA GLY A 81 1.593 -14.984 -7.367 1.00 0.00 C ATOM 1247 C GLY A 81 1.897 -13.723 -8.176 1.00 0.00 C ATOM 1248 O GLY A 81 2.911 -13.622 -8.838 1.00 0.00 O ATOM 0 H GLY A 81 0.451 -13.692 -6.117 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.486 -15.321 -6.841 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.288 -15.794 -8.029 1.00 0.00 H new ATOM 1252 N SER A 82 1.021 -12.755 -8.115 1.00 0.00 N ATOM 1253 CA SER A 82 1.239 -11.490 -8.859 1.00 0.00 C ATOM 1254 C SER A 82 2.470 -10.797 -8.296 1.00 0.00 C ATOM 1255 O SER A 82 2.524 -10.451 -7.133 1.00 0.00 O ATOM 1256 CB SER A 82 0.021 -10.582 -8.693 1.00 0.00 C ATOM 1257 OG SER A 82 -0.031 -10.105 -7.354 1.00 0.00 O ATOM 0 H SER A 82 0.157 -12.792 -7.575 1.00 0.00 H new ATOM 0 HA SER A 82 1.384 -11.703 -9.918 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.080 -9.744 -9.388 1.00 0.00 H new ATOM 0 HB3 SER A 82 -0.891 -11.130 -8.932 1.00 0.00 H new ATOM 0 HG SER A 82 -0.485 -10.764 -6.789 1.00 0.00 H new ATOM 1263 N MET A 83 3.464 -10.595 -9.100 1.00 0.00 N ATOM 1264 CA MET A 83 4.682 -9.931 -8.587 1.00 0.00 C ATOM 1265 C MET A 83 4.401 -8.443 -8.383 1.00 0.00 C ATOM 1266 O MET A 83 3.310 -7.967 -8.629 1.00 0.00 O ATOM 1267 CB MET A 83 5.829 -10.111 -9.585 1.00 0.00 C ATOM 1268 CG MET A 83 6.306 -11.565 -9.557 1.00 0.00 C ATOM 1269 SD MET A 83 7.268 -11.856 -8.052 1.00 0.00 S ATOM 1270 CE MET A 83 8.891 -11.441 -8.738 1.00 0.00 C ATOM 0 H MET A 83 3.487 -10.859 -10.085 1.00 0.00 H new ATOM 0 HA MET A 83 4.966 -10.379 -7.635 1.00 0.00 H new ATOM 0 HB2 MET A 83 5.497 -9.845 -10.589 1.00 0.00 H new ATOM 0 HB3 MET A 83 6.652 -9.442 -9.334 1.00 0.00 H new ATOM 0 HG2 MET A 83 5.451 -12.240 -9.591 1.00 0.00 H new ATOM 0 HG3 MET A 83 6.914 -11.776 -10.437 1.00 0.00 H new ATOM 0 HE1 MET A 83 9.652 -11.554 -7.966 1.00 0.00 H new ATOM 0 HE2 MET A 83 9.116 -12.109 -9.570 1.00 0.00 H new ATOM 0 HE3 MET A 83 8.883 -10.410 -9.092 1.00 0.00 H new ATOM 1280 N VAL A 84 5.375 -7.701 -7.929 1.00 0.00 N ATOM 1281 CA VAL A 84 5.170 -6.240 -7.700 1.00 0.00 C ATOM 1282 C VAL A 84 6.470 -5.497 -7.998 1.00 0.00 C ATOM 1283 O VAL A 84 7.536 -6.079 -8.032 1.00 0.00 O ATOM 1284 CB VAL A 84 4.776 -6.006 -6.240 1.00 0.00 C ATOM 1285 CG1 VAL A 84 4.381 -4.541 -6.039 1.00 0.00 C ATOM 1286 CG2 VAL A 84 3.591 -6.905 -5.880 1.00 0.00 C ATOM 0 H VAL A 84 6.309 -8.045 -7.706 1.00 0.00 H new ATOM 0 HA VAL A 84 4.379 -5.873 -8.355 1.00 0.00 H new ATOM 0 HB VAL A 84 5.624 -6.243 -5.597 1.00 0.00 H new ATOM 0 HG11 VAL A 84 4.101 -4.379 -4.998 1.00 0.00 H new ATOM 0 HG12 VAL A 84 5.224 -3.899 -6.292 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.536 -4.300 -6.684 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.311 -6.738 -4.840 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.746 -6.669 -6.526 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.872 -7.949 -6.017 1.00 0.00 H new ATOM 1296 N TYR A 85 6.393 -4.210 -8.208 1.00 0.00 N ATOM 1297 CA TYR A 85 7.626 -3.422 -8.499 1.00 0.00 C ATOM 1298 C TYR A 85 7.471 -2.012 -7.932 1.00 0.00 C ATOM 1299 O TYR A 85 6.795 -1.173 -8.494 1.00 0.00 O ATOM 1300 CB TYR A 85 7.839 -3.347 -10.013 1.00 0.00 C ATOM 1301 CG TYR A 85 8.270 -4.698 -10.528 1.00 0.00 C ATOM 1302 CD1 TYR A 85 7.309 -5.663 -10.848 1.00 0.00 C ATOM 1303 CD2 TYR A 85 9.632 -4.987 -10.686 1.00 0.00 C ATOM 1304 CE1 TYR A 85 7.707 -6.917 -11.326 1.00 0.00 C ATOM 1305 CE2 TYR A 85 10.030 -6.240 -11.164 1.00 0.00 C ATOM 1306 CZ TYR A 85 9.067 -7.205 -11.485 1.00 0.00 C ATOM 1307 OH TYR A 85 9.461 -8.441 -11.958 1.00 0.00 O ATOM 0 H TYR A 85 5.528 -3.670 -8.191 1.00 0.00 H new ATOM 0 HA TYR A 85 8.487 -3.906 -8.038 1.00 0.00 H new ATOM 0 HB2 TYR A 85 6.918 -3.035 -10.506 1.00 0.00 H new ATOM 0 HB3 TYR A 85 8.595 -2.598 -10.248 1.00 0.00 H new ATOM 0 HD1 TYR A 85 6.259 -5.440 -10.726 1.00 0.00 H new ATOM 0 HD2 TYR A 85 10.374 -4.243 -10.439 1.00 0.00 H new ATOM 0 HE1 TYR A 85 6.965 -7.662 -11.572 1.00 0.00 H new ATOM 0 HE2 TYR A 85 11.080 -6.463 -11.285 1.00 0.00 H new ATOM 0 HH TYR A 85 10.439 -8.475 -12.009 1.00 0.00 H new ATOM 1317 N PHE A 86 8.103 -1.743 -6.819 1.00 0.00 N ATOM 1318 CA PHE A 86 8.011 -0.387 -6.204 1.00 0.00 C ATOM 1319 C PHE A 86 9.206 0.437 -6.678 1.00 0.00 C ATOM 1320 O PHE A 86 10.339 0.156 -6.339 1.00 0.00 O ATOM 1321 CB PHE A 86 8.046 -0.518 -4.680 1.00 0.00 C ATOM 1322 CG PHE A 86 7.656 0.797 -4.044 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.324 1.224 -4.087 1.00 0.00 C ATOM 1324 CD2 PHE A 86 8.624 1.587 -3.410 1.00 0.00 C ATOM 1325 CE1 PHE A 86 5.959 2.438 -3.497 1.00 0.00 C ATOM 1326 CE2 PHE A 86 8.258 2.802 -2.818 1.00 0.00 C ATOM 1327 CZ PHE A 86 6.926 3.228 -2.862 1.00 0.00 C ATOM 0 H PHE A 86 8.682 -2.409 -6.307 1.00 0.00 H new ATOM 0 HA PHE A 86 7.081 0.101 -6.497 1.00 0.00 H new ATOM 0 HB2 PHE A 86 7.364 -1.305 -4.358 1.00 0.00 H new ATOM 0 HB3 PHE A 86 9.045 -0.808 -4.354 1.00 0.00 H new ATOM 0 HD1 PHE A 86 5.578 0.616 -4.576 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.652 1.259 -3.378 1.00 0.00 H new ATOM 0 HE1 PHE A 86 4.931 2.767 -3.531 1.00 0.00 H new ATOM 0 HE2 PHE A 86 9.004 3.410 -2.328 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.643 4.166 -2.407 1.00 0.00 H new ATOM 1337 N LYS A 87 8.967 1.444 -7.475 1.00 0.00 N ATOM 1338 CA LYS A 87 10.095 2.279 -7.991 1.00 0.00 C ATOM 1339 C LYS A 87 10.278 3.516 -7.113 1.00 0.00 C ATOM 1340 O LYS A 87 9.329 4.085 -6.610 1.00 0.00 O ATOM 1341 CB LYS A 87 9.784 2.717 -9.424 1.00 0.00 C ATOM 1342 CG LYS A 87 9.406 1.490 -10.264 1.00 0.00 C ATOM 1343 CD LYS A 87 9.035 1.919 -11.697 1.00 0.00 C ATOM 1344 CE LYS A 87 10.296 2.015 -12.568 1.00 0.00 C ATOM 1345 NZ LYS A 87 10.678 0.653 -13.038 1.00 0.00 N ATOM 0 H LYS A 87 8.040 1.726 -7.792 1.00 0.00 H new ATOM 0 HA LYS A 87 11.012 1.691 -7.973 1.00 0.00 H new ATOM 0 HB2 LYS A 87 8.966 3.438 -9.426 1.00 0.00 H new ATOM 0 HB3 LYS A 87 10.650 3.216 -9.859 1.00 0.00 H new ATOM 0 HG2 LYS A 87 10.240 0.788 -10.291 1.00 0.00 H new ATOM 0 HG3 LYS A 87 8.566 0.970 -9.803 1.00 0.00 H new ATOM 0 HD2 LYS A 87 8.339 1.200 -12.130 1.00 0.00 H new ATOM 0 HD3 LYS A 87 8.526 2.882 -11.675 1.00 0.00 H new ATOM 0 HE2 LYS A 87 10.113 2.668 -13.421 1.00 0.00 H new ATOM 0 HE3 LYS A 87 11.113 2.457 -11.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 11.677 0.653 -13.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 10.540 -0.032 -12.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.084 0.386 -13.849 1.00 0.00 H new ATOM 1359 N VAL A 88 11.500 3.939 -6.935 1.00 0.00 N ATOM 1360 CA VAL A 88 11.776 5.144 -6.099 1.00 0.00 C ATOM 1361 C VAL A 88 12.976 5.893 -6.680 1.00 0.00 C ATOM 1362 O VAL A 88 14.114 5.559 -6.417 1.00 0.00 O ATOM 1363 CB VAL A 88 12.098 4.718 -4.666 1.00 0.00 C ATOM 1364 CG1 VAL A 88 12.075 5.945 -3.747 1.00 0.00 C ATOM 1365 CG2 VAL A 88 11.056 3.700 -4.192 1.00 0.00 C ATOM 0 H VAL A 88 12.327 3.497 -7.337 1.00 0.00 H new ATOM 0 HA VAL A 88 10.898 5.790 -6.096 1.00 0.00 H new ATOM 0 HB VAL A 88 13.089 4.265 -4.635 1.00 0.00 H new ATOM 0 HG11 VAL A 88 12.305 5.639 -2.726 1.00 0.00 H new ATOM 0 HG12 VAL A 88 12.818 6.667 -4.085 1.00 0.00 H new ATOM 0 HG13 VAL A 88 11.086 6.402 -3.775 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.284 3.395 -3.171 1.00 0.00 H new ATOM 0 HG22 VAL A 88 10.065 4.152 -4.223 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.077 2.827 -4.845 1.00 0.00 H new ATOM 1375 N GLY A 89 12.733 6.903 -7.470 1.00 0.00 N ATOM 1376 CA GLY A 89 13.862 7.672 -8.066 1.00 0.00 C ATOM 1377 C GLY A 89 14.877 6.703 -8.678 1.00 0.00 C ATOM 1378 O GLY A 89 14.526 5.804 -9.416 1.00 0.00 O ATOM 0 H GLY A 89 11.802 7.229 -7.728 1.00 0.00 H new ATOM 0 HA2 GLY A 89 13.488 8.353 -8.830 1.00 0.00 H new ATOM 0 HA3 GLY A 89 14.342 8.283 -7.302 1.00 0.00 H new ATOM 1382 N ASN A 90 16.135 6.879 -8.376 1.00 0.00 N ATOM 1383 CA ASN A 90 17.174 5.971 -8.938 1.00 0.00 C ATOM 1384 C ASN A 90 17.241 4.693 -8.098 1.00 0.00 C ATOM 1385 O ASN A 90 18.294 4.292 -7.644 1.00 0.00 O ATOM 1386 CB ASN A 90 18.534 6.672 -8.909 1.00 0.00 C ATOM 1387 CG ASN A 90 18.515 7.866 -9.865 1.00 0.00 C ATOM 1388 OD1 ASN A 90 17.958 7.786 -10.942 1.00 0.00 O ATOM 1389 ND2 ASN A 90 19.103 8.977 -9.515 1.00 0.00 N ATOM 0 H ASN A 90 16.488 7.614 -7.763 1.00 0.00 H new ATOM 0 HA ASN A 90 16.918 5.718 -9.967 1.00 0.00 H new ATOM 0 HB2 ASN A 90 18.760 7.007 -7.897 1.00 0.00 H new ATOM 0 HB3 ASN A 90 19.320 5.975 -9.197 1.00 0.00 H new ATOM 0 HD21 ASN A 90 19.095 9.779 -10.146 1.00 0.00 H new ATOM 0 HD22 ASN A 90 19.570 9.044 -8.611 1.00 0.00 H new ATOM 1396 N GLU A 91 16.125 4.049 -7.891 1.00 0.00 N ATOM 1397 CA GLU A 91 16.125 2.797 -7.084 1.00 0.00 C ATOM 1398 C GLU A 91 14.835 2.025 -7.357 1.00 0.00 C ATOM 1399 O GLU A 91 13.783 2.605 -7.540 1.00 0.00 O ATOM 1400 CB GLU A 91 16.207 3.148 -5.597 1.00 0.00 C ATOM 1401 CG GLU A 91 16.562 1.894 -4.797 1.00 0.00 C ATOM 1402 CD GLU A 91 16.573 2.224 -3.303 1.00 0.00 C ATOM 1403 OE1 GLU A 91 17.067 3.284 -2.955 1.00 0.00 O ATOM 1404 OE2 GLU A 91 16.089 1.412 -2.533 1.00 0.00 O ATOM 0 H GLU A 91 15.213 4.336 -8.246 1.00 0.00 H new ATOM 0 HA GLU A 91 16.984 2.184 -7.357 1.00 0.00 H new ATOM 0 HB2 GLU A 91 16.959 3.921 -5.436 1.00 0.00 H new ATOM 0 HB3 GLU A 91 15.255 3.553 -5.255 1.00 0.00 H new ATOM 0 HG2 GLU A 91 15.839 1.104 -5.000 1.00 0.00 H new ATOM 0 HG3 GLU A 91 17.538 1.519 -5.104 1.00 0.00 H new ATOM 1411 N THR A 92 14.902 0.721 -7.393 1.00 0.00 N ATOM 1412 CA THR A 92 13.672 -0.079 -7.663 1.00 0.00 C ATOM 1413 C THR A 92 13.797 -1.463 -7.022 1.00 0.00 C ATOM 1414 O THR A 92 14.869 -2.028 -6.935 1.00 0.00 O ATOM 1415 CB THR A 92 13.490 -0.232 -9.176 1.00 0.00 C ATOM 1416 OG1 THR A 92 13.308 1.051 -9.758 1.00 0.00 O ATOM 1417 CG2 THR A 92 12.267 -1.103 -9.461 1.00 0.00 C ATOM 0 H THR A 92 15.752 0.177 -7.248 1.00 0.00 H new ATOM 0 HA THR A 92 12.809 0.434 -7.238 1.00 0.00 H new ATOM 0 HB THR A 92 14.374 -0.705 -9.604 1.00 0.00 H new ATOM 0 HG1 THR A 92 13.302 1.732 -9.053 1.00 0.00 H new ATOM 0 HG21 THR A 92 12.140 -1.210 -10.538 1.00 0.00 H new ATOM 0 HG22 THR A 92 12.408 -2.086 -9.013 1.00 0.00 H new ATOM 0 HG23 THR A 92 11.380 -0.634 -9.036 1.00 0.00 H new ATOM 1425 N ARG A 93 12.696 -2.013 -6.576 1.00 0.00 N ATOM 1426 CA ARG A 93 12.722 -3.368 -5.937 1.00 0.00 C ATOM 1427 C ARG A 93 11.463 -4.138 -6.354 1.00 0.00 C ATOM 1428 O ARG A 93 10.624 -3.625 -7.070 1.00 0.00 O ATOM 1429 CB ARG A 93 12.758 -3.225 -4.404 1.00 0.00 C ATOM 1430 CG ARG A 93 11.863 -2.047 -3.952 1.00 0.00 C ATOM 1431 CD ARG A 93 12.668 -0.727 -3.900 1.00 0.00 C ATOM 1432 NE ARG A 93 13.179 -0.486 -2.506 1.00 0.00 N ATOM 1433 CZ ARG A 93 12.371 -0.376 -1.484 1.00 0.00 C ATOM 1434 NH1 ARG A 93 11.078 -0.356 -1.664 1.00 0.00 N ATOM 1435 NH2 ARG A 93 12.860 -0.247 -0.280 1.00 0.00 N ATOM 0 H ARG A 93 11.774 -1.580 -6.627 1.00 0.00 H new ATOM 0 HA ARG A 93 13.611 -3.908 -6.261 1.00 0.00 H new ATOM 0 HB2 ARG A 93 12.417 -4.149 -3.938 1.00 0.00 H new ATOM 0 HB3 ARG A 93 13.783 -3.060 -4.072 1.00 0.00 H new ATOM 0 HG2 ARG A 93 11.024 -1.939 -4.639 1.00 0.00 H new ATOM 0 HG3 ARG A 93 11.444 -2.260 -2.969 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.503 -0.774 -4.599 1.00 0.00 H new ATOM 0 HD3 ARG A 93 12.037 0.105 -4.213 1.00 0.00 H new ATOM 0 HE ARG A 93 14.184 -0.406 -2.354 1.00 0.00 H new ATOM 0 HH11 ARG A 93 10.693 -0.426 -2.606 1.00 0.00 H new ATOM 0 HH12 ARG A 93 10.453 -0.270 -0.863 1.00 0.00 H new ATOM 0 HH21 ARG A 93 13.870 -0.232 -0.139 1.00 0.00 H new ATOM 0 HH22 ARG A 93 12.232 -0.161 0.519 1.00 0.00 H new ATOM 1449 N LYS A 94 11.325 -5.368 -5.924 1.00 0.00 N ATOM 1450 CA LYS A 94 10.121 -6.170 -6.312 1.00 0.00 C ATOM 1451 C LYS A 94 9.689 -7.076 -5.155 1.00 0.00 C ATOM 1452 O LYS A 94 10.449 -7.359 -4.251 1.00 0.00 O ATOM 1453 CB LYS A 94 10.467 -7.035 -7.525 1.00 0.00 C ATOM 1454 CG LYS A 94 11.540 -8.053 -7.133 1.00 0.00 C ATOM 1455 CD LYS A 94 12.138 -8.678 -8.396 1.00 0.00 C ATOM 1456 CE LYS A 94 12.975 -9.899 -8.012 1.00 0.00 C ATOM 1457 NZ LYS A 94 14.038 -9.491 -7.052 1.00 0.00 N ATOM 0 H LYS A 94 11.992 -5.851 -5.322 1.00 0.00 H new ATOM 0 HA LYS A 94 9.304 -5.491 -6.554 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.576 -7.549 -7.885 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.825 -6.409 -8.342 1.00 0.00 H new ATOM 0 HG2 LYS A 94 12.322 -7.566 -6.550 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.107 -8.828 -6.501 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.343 -8.970 -9.082 1.00 0.00 H new ATOM 0 HD3 LYS A 94 12.757 -7.948 -8.918 1.00 0.00 H new ATOM 0 HE2 LYS A 94 12.339 -10.663 -7.564 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.424 -10.340 -8.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 14.787 -10.212 -7.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 14.441 -8.579 -7.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 13.629 -9.397 -6.101 1.00 0.00 H new ATOM 1471 N TYR A 95 8.464 -7.541 -5.191 1.00 0.00 N ATOM 1472 CA TYR A 95 7.951 -8.441 -4.113 1.00 0.00 C ATOM 1473 C TYR A 95 7.070 -9.516 -4.753 1.00 0.00 C ATOM 1474 O TYR A 95 6.889 -9.542 -5.955 1.00 0.00 O ATOM 1475 CB TYR A 95 7.111 -7.633 -3.116 1.00 0.00 C ATOM 1476 CG TYR A 95 7.896 -6.433 -2.635 1.00 0.00 C ATOM 1477 CD1 TYR A 95 8.112 -5.348 -3.494 1.00 0.00 C ATOM 1478 CD2 TYR A 95 8.404 -6.403 -1.327 1.00 0.00 C ATOM 1479 CE1 TYR A 95 8.838 -4.235 -3.047 1.00 0.00 C ATOM 1480 CE2 TYR A 95 9.127 -5.291 -0.883 1.00 0.00 C ATOM 1481 CZ TYR A 95 9.345 -4.209 -1.742 1.00 0.00 C ATOM 1482 OH TYR A 95 10.057 -3.112 -1.300 1.00 0.00 O ATOM 0 H TYR A 95 7.792 -7.333 -5.929 1.00 0.00 H new ATOM 0 HA TYR A 95 8.789 -8.899 -3.588 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.184 -7.307 -3.588 1.00 0.00 H new ATOM 0 HB3 TYR A 95 6.833 -8.260 -2.269 1.00 0.00 H new ATOM 0 HD1 TYR A 95 7.720 -5.369 -4.500 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.237 -7.238 -0.663 1.00 0.00 H new ATOM 0 HE1 TYR A 95 9.006 -3.398 -3.709 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.517 -5.268 0.124 1.00 0.00 H new ATOM 0 HH TYR A 95 10.336 -3.255 -0.372 1.00 0.00 H new ATOM 1492 N LYS A 96 6.518 -10.406 -3.971 1.00 0.00 N ATOM 1493 CA LYS A 96 5.648 -11.475 -4.551 1.00 0.00 C ATOM 1494 C LYS A 96 4.545 -11.828 -3.557 1.00 0.00 C ATOM 1495 O LYS A 96 4.802 -12.070 -2.393 1.00 0.00 O ATOM 1496 CB LYS A 96 6.490 -12.719 -4.835 1.00 0.00 C ATOM 1497 CG LYS A 96 5.682 -13.699 -5.688 1.00 0.00 C ATOM 1498 CD LYS A 96 6.509 -14.961 -5.940 1.00 0.00 C ATOM 1499 CE LYS A 96 5.690 -15.952 -6.769 1.00 0.00 C ATOM 1500 NZ LYS A 96 5.499 -15.408 -8.143 1.00 0.00 N ATOM 0 H LYS A 96 6.631 -10.440 -2.958 1.00 0.00 H new ATOM 0 HA LYS A 96 5.202 -11.116 -5.479 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.407 -12.440 -5.354 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.785 -13.193 -3.899 1.00 0.00 H new ATOM 0 HG2 LYS A 96 4.752 -13.957 -5.182 1.00 0.00 H new ATOM 0 HG3 LYS A 96 5.411 -13.234 -6.636 1.00 0.00 H new ATOM 0 HD2 LYS A 96 7.430 -14.706 -6.464 1.00 0.00 H new ATOM 0 HD3 LYS A 96 6.797 -15.415 -4.992 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.200 -16.914 -6.814 1.00 0.00 H new ATOM 0 HE3 LYS A 96 4.723 -16.126 -6.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 5.441 -16.193 -8.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 4.619 -14.854 -8.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 6.303 -14.796 -8.389 1.00 0.00 H new ATOM 1514 N MET A 97 3.312 -11.863 -4.000 1.00 0.00 N ATOM 1515 CA MET A 97 2.208 -12.207 -3.057 1.00 0.00 C ATOM 1516 C MET A 97 2.584 -13.464 -2.272 1.00 0.00 C ATOM 1517 O MET A 97 3.309 -14.313 -2.753 1.00 0.00 O ATOM 1518 CB MET A 97 0.916 -12.482 -3.826 1.00 0.00 C ATOM 1519 CG MET A 97 0.464 -11.224 -4.567 1.00 0.00 C ATOM 1520 SD MET A 97 -1.275 -11.401 -5.043 1.00 0.00 S ATOM 1521 CE MET A 97 -1.743 -9.662 -4.867 1.00 0.00 C ATOM 0 H MET A 97 3.027 -11.671 -4.960 1.00 0.00 H new ATOM 0 HA MET A 97 2.055 -11.367 -2.380 1.00 0.00 H new ATOM 0 HB2 MET A 97 1.073 -13.294 -4.536 1.00 0.00 H new ATOM 0 HB3 MET A 97 0.136 -12.807 -3.137 1.00 0.00 H new ATOM 0 HG2 MET A 97 0.591 -10.348 -3.931 1.00 0.00 H new ATOM 0 HG3 MET A 97 1.081 -11.068 -5.452 1.00 0.00 H new ATOM 0 HE1 MET A 97 -2.567 -9.436 -5.544 1.00 0.00 H new ATOM 0 HE2 MET A 97 -2.055 -9.471 -3.840 1.00 0.00 H new ATOM 0 HE3 MET A 97 -0.890 -9.029 -5.110 1.00 0.00 H new ATOM 1531 N THR A 98 2.093 -13.594 -1.074 1.00 0.00 N ATOM 1532 CA THR A 98 2.418 -14.799 -0.265 1.00 0.00 C ATOM 1533 C THR A 98 1.467 -14.873 0.929 1.00 0.00 C ATOM 1534 O THR A 98 1.554 -15.764 1.749 1.00 0.00 O ATOM 1535 CB THR A 98 3.866 -14.701 0.231 1.00 0.00 C ATOM 1536 OG1 THR A 98 4.713 -14.351 -0.854 1.00 0.00 O ATOM 1537 CG2 THR A 98 4.315 -16.044 0.818 1.00 0.00 C ATOM 0 H THR A 98 1.480 -12.917 -0.619 1.00 0.00 H new ATOM 0 HA THR A 98 2.306 -15.696 -0.874 1.00 0.00 H new ATOM 0 HB THR A 98 3.926 -13.937 1.007 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.421 -14.823 -1.662 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.344 -15.963 1.167 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.668 -16.310 1.654 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.252 -16.816 0.051 1.00 0.00 H new ATOM 1545 N SER A 99 0.557 -13.944 1.033 1.00 0.00 N ATOM 1546 CA SER A 99 -0.394 -13.968 2.173 1.00 0.00 C ATOM 1547 C SER A 99 -1.513 -12.965 1.912 1.00 0.00 C ATOM 1548 O SER A 99 -1.274 -11.797 1.685 1.00 0.00 O ATOM 1549 CB SER A 99 0.344 -13.594 3.456 1.00 0.00 C ATOM 1550 OG SER A 99 -0.596 -13.163 4.431 1.00 0.00 O ATOM 0 H SER A 99 0.433 -13.172 0.378 1.00 0.00 H new ATOM 0 HA SER A 99 -0.818 -14.966 2.280 1.00 0.00 H new ATOM 0 HB2 SER A 99 0.905 -14.451 3.829 1.00 0.00 H new ATOM 0 HB3 SER A 99 1.066 -12.803 3.256 1.00 0.00 H new ATOM 0 HG SER A 99 -0.125 -12.924 5.256 1.00 0.00 H new ATOM 1556 N ILE A 100 -2.736 -13.420 1.937 1.00 0.00 N ATOM 1557 CA ILE A 100 -3.894 -12.514 1.686 1.00 0.00 C ATOM 1558 C ILE A 100 -4.993 -12.834 2.698 1.00 0.00 C ATOM 1559 O ILE A 100 -5.337 -13.978 2.919 1.00 0.00 O ATOM 1560 CB ILE A 100 -4.390 -12.735 0.247 1.00 0.00 C ATOM 1561 CG1 ILE A 100 -3.440 -12.023 -0.732 1.00 0.00 C ATOM 1562 CG2 ILE A 100 -5.804 -12.173 0.080 1.00 0.00 C ATOM 1563 CD1 ILE A 100 -3.551 -12.650 -2.121 1.00 0.00 C ATOM 0 H ILE A 100 -2.985 -14.391 2.123 1.00 0.00 H new ATOM 0 HA ILE A 100 -3.605 -11.469 1.800 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.408 -13.805 0.038 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -3.686 -10.962 -0.783 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -2.414 -12.096 -0.373 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -6.142 -12.336 -0.943 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -6.480 -12.678 0.770 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.798 -11.104 0.294 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -2.875 -12.139 -2.806 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.283 -13.705 -2.066 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.575 -12.554 -2.483 1.00 0.00 H new ATOM 1842 N ASP A 118 11.072 -10.394 7.111 1.00 0.00 N ATOM 1843 CA ASP A 118 11.848 -9.874 5.942 1.00 0.00 C ATOM 1844 C ASP A 118 11.066 -8.729 5.300 1.00 0.00 C ATOM 1845 O ASP A 118 9.873 -8.604 5.496 1.00 0.00 O ATOM 1846 CB ASP A 118 12.033 -10.997 4.919 1.00 0.00 C ATOM 1847 CG ASP A 118 13.065 -12.001 5.439 1.00 0.00 C ATOM 1848 OD1 ASP A 118 13.755 -11.673 6.390 1.00 0.00 O ATOM 1849 OD2 ASP A 118 13.145 -13.081 4.879 1.00 0.00 O ATOM 0 HA ASP A 118 12.824 -9.518 6.272 1.00 0.00 H new ATOM 0 HB2 ASP A 118 11.082 -11.498 4.738 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.361 -10.583 3.965 1.00 0.00 H new ATOM 1854 N LYS A 119 11.722 -7.894 4.533 1.00 0.00 N ATOM 1855 CA LYS A 119 11.007 -6.760 3.877 1.00 0.00 C ATOM 1856 C LYS A 119 9.691 -7.267 3.282 1.00 0.00 C ATOM 1857 O LYS A 119 9.665 -8.226 2.536 1.00 0.00 O ATOM 1858 CB LYS A 119 11.878 -6.181 2.756 1.00 0.00 C ATOM 1859 CG LYS A 119 13.090 -5.461 3.353 1.00 0.00 C ATOM 1860 CD LYS A 119 13.750 -4.602 2.274 1.00 0.00 C ATOM 1861 CE LYS A 119 14.923 -3.828 2.878 1.00 0.00 C ATOM 1862 NZ LYS A 119 16.016 -4.777 3.231 1.00 0.00 N ATOM 0 H LYS A 119 12.721 -7.950 4.334 1.00 0.00 H new ATOM 0 HA LYS A 119 10.803 -5.985 4.616 1.00 0.00 H new ATOM 0 HB2 LYS A 119 12.210 -6.980 2.093 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.294 -5.487 2.152 1.00 0.00 H new ATOM 0 HG2 LYS A 119 12.780 -4.837 4.191 1.00 0.00 H new ATOM 0 HG3 LYS A 119 13.803 -6.187 3.743 1.00 0.00 H new ATOM 0 HD2 LYS A 119 14.100 -5.233 1.457 1.00 0.00 H new ATOM 0 HD3 LYS A 119 13.023 -3.908 1.852 1.00 0.00 H new ATOM 0 HE2 LYS A 119 15.287 -3.086 2.168 1.00 0.00 H new ATOM 0 HE3 LYS A 119 14.596 -3.286 3.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 16.891 -4.246 3.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 15.750 -5.312 4.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 16.171 -5.436 2.442 1.00 0.00 H new ATOM 1876 N GLN A 120 8.598 -6.639 3.618 1.00 0.00 N ATOM 1877 CA GLN A 120 7.280 -7.093 3.084 1.00 0.00 C ATOM 1878 C GLN A 120 6.333 -5.900 2.946 1.00 0.00 C ATOM 1879 O GLN A 120 6.606 -4.816 3.424 1.00 0.00 O ATOM 1880 CB GLN A 120 6.683 -8.155 4.026 1.00 0.00 C ATOM 1881 CG GLN A 120 6.136 -7.516 5.308 1.00 0.00 C ATOM 1882 CD GLN A 120 7.206 -6.633 5.943 1.00 0.00 C ATOM 1883 OE1 GLN A 120 7.516 -5.583 5.431 1.00 0.00 O ATOM 1884 NE2 GLN A 120 7.784 -7.018 7.049 1.00 0.00 N ATOM 0 H GLN A 120 8.559 -5.831 4.239 1.00 0.00 H new ATOM 0 HA GLN A 120 7.419 -7.536 2.098 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.884 -8.691 3.514 1.00 0.00 H new ATOM 0 HB3 GLN A 120 7.447 -8.890 4.280 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.250 -6.923 5.080 1.00 0.00 H new ATOM 0 HG3 GLN A 120 5.829 -8.292 6.009 1.00 0.00 H new ATOM 0 HE21 GLN A 120 7.521 -7.904 7.480 1.00 0.00 H new ATOM 0 HE22 GLN A 120 8.498 -6.432 7.482 1.00 0.00 H new ATOM 1893 N LEU A 121 5.227 -6.095 2.273 1.00 0.00 N ATOM 1894 CA LEU A 121 4.248 -4.983 2.065 1.00 0.00 C ATOM 1895 C LEU A 121 2.916 -5.314 2.742 1.00 0.00 C ATOM 1896 O LEU A 121 2.553 -6.460 2.902 1.00 0.00 O ATOM 1897 CB LEU A 121 3.996 -4.818 0.565 1.00 0.00 C ATOM 1898 CG LEU A 121 5.325 -4.791 -0.192 1.00 0.00 C ATOM 1899 CD1 LEU A 121 5.047 -4.609 -1.685 1.00 0.00 C ATOM 1900 CD2 LEU A 121 6.186 -3.626 0.313 1.00 0.00 C ATOM 0 H LEU A 121 4.958 -6.985 1.855 1.00 0.00 H new ATOM 0 HA LEU A 121 4.657 -4.068 2.494 1.00 0.00 H new ATOM 0 HB2 LEU A 121 3.377 -5.638 0.200 1.00 0.00 H new ATOM 0 HB3 LEU A 121 3.445 -3.896 0.380 1.00 0.00 H new ATOM 0 HG LEU A 121 5.857 -5.728 -0.027 1.00 0.00 H new ATOM 0 HD11 LEU A 121 5.990 -4.589 -2.231 1.00 0.00 H new ATOM 0 HD12 LEU A 121 4.437 -5.437 -2.045 1.00 0.00 H new ATOM 0 HD13 LEU A 121 4.515 -3.671 -1.844 1.00 0.00 H new ATOM 0 HD21 LEU A 121 7.132 -3.611 -0.229 1.00 0.00 H new ATOM 0 HD22 LEU A 121 5.659 -2.686 0.149 1.00 0.00 H new ATOM 0 HD23 LEU A 121 6.380 -3.752 1.378 1.00 0.00 H new ATOM 1912 N THR A 122 2.177 -4.303 3.103 1.00 0.00 N ATOM 1913 CA THR A 122 0.840 -4.509 3.736 1.00 0.00 C ATOM 1914 C THR A 122 -0.091 -3.446 3.160 1.00 0.00 C ATOM 1915 O THR A 122 -0.235 -2.369 3.698 1.00 0.00 O ATOM 1916 CB THR A 122 0.956 -4.335 5.253 1.00 0.00 C ATOM 1917 OG1 THR A 122 2.007 -5.155 5.741 1.00 0.00 O ATOM 1918 CG2 THR A 122 -0.361 -4.736 5.919 1.00 0.00 C ATOM 0 H THR A 122 2.445 -3.326 2.985 1.00 0.00 H new ATOM 0 HA THR A 122 0.459 -5.510 3.536 1.00 0.00 H new ATOM 0 HB THR A 122 1.171 -3.292 5.484 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.084 -5.044 6.712 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.276 -4.611 6.998 1.00 0.00 H new ATOM 0 HG22 THR A 122 -1.166 -4.104 5.543 1.00 0.00 H new ATOM 0 HG23 THR A 122 -0.581 -5.779 5.691 1.00 0.00 H new ATOM 1926 N LEU A 123 -0.694 -3.725 2.040 1.00 0.00 N ATOM 1927 CA LEU A 123 -1.573 -2.709 1.396 1.00 0.00 C ATOM 1928 C LEU A 123 -2.992 -2.764 1.967 1.00 0.00 C ATOM 1929 O LEU A 123 -3.414 -3.749 2.542 1.00 0.00 O ATOM 1930 CB LEU A 123 -1.610 -2.962 -0.116 1.00 0.00 C ATOM 1931 CG LEU A 123 -0.237 -3.450 -0.596 1.00 0.00 C ATOM 1932 CD1 LEU A 123 -0.244 -3.577 -2.120 1.00 0.00 C ATOM 1933 CD2 LEU A 123 0.842 -2.447 -0.187 1.00 0.00 C ATOM 0 H LEU A 123 -0.617 -4.612 1.542 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.167 -1.718 1.599 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -2.372 -3.705 -0.351 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -1.884 -2.047 -0.640 1.00 0.00 H new ATOM 0 HG LEU A 123 -0.026 -4.419 -0.143 1.00 0.00 H new ATOM 0 HD11 LEU A 123 0.732 -3.924 -2.461 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -1.009 -4.292 -2.422 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -0.460 -2.606 -2.565 1.00 0.00 H new ATOM 0 HD21 LEU A 123 1.815 -2.799 -0.530 1.00 0.00 H new ATOM 0 HD22 LEU A 123 0.627 -1.478 -0.637 1.00 0.00 H new ATOM 0 HD23 LEU A 123 0.854 -2.348 0.898 1.00 0.00 H new ATOM 1945 N ILE A 124 -3.725 -1.693 1.799 1.00 0.00 N ATOM 1946 CA ILE A 124 -5.127 -1.626 2.307 1.00 0.00 C ATOM 1947 C ILE A 124 -5.988 -0.907 1.267 1.00 0.00 C ATOM 1948 O ILE A 124 -5.679 0.189 0.851 1.00 0.00 O ATOM 1949 CB ILE A 124 -5.166 -0.824 3.613 1.00 0.00 C ATOM 1950 CG1 ILE A 124 -4.061 -1.302 4.558 1.00 0.00 C ATOM 1951 CG2 ILE A 124 -6.525 -1.013 4.289 1.00 0.00 C ATOM 1952 CD1 ILE A 124 -4.047 -0.412 5.800 1.00 0.00 C ATOM 0 H ILE A 124 -3.405 -0.849 1.324 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.500 -2.634 2.486 1.00 0.00 H new ATOM 0 HB ILE A 124 -5.011 0.231 3.385 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.232 -2.341 4.841 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -3.094 -1.263 4.056 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.552 -0.443 5.217 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.314 -0.662 3.624 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.679 -2.070 4.508 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -3.262 -0.746 6.478 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.857 0.620 5.506 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -5.012 -0.474 6.303 1.00 0.00 H new ATOM 1964 N THR A 125 -7.068 -1.501 0.843 1.00 0.00 N ATOM 1965 CA THR A 125 -7.932 -0.822 -0.167 1.00 0.00 C ATOM 1966 C THR A 125 -8.982 0.016 0.559 1.00 0.00 C ATOM 1967 O THR A 125 -9.787 -0.490 1.316 1.00 0.00 O ATOM 1968 CB THR A 125 -8.613 -1.868 -1.049 1.00 0.00 C ATOM 1969 OG1 THR A 125 -9.781 -2.347 -0.398 1.00 0.00 O ATOM 1970 CG2 THR A 125 -7.651 -3.036 -1.304 1.00 0.00 C ATOM 0 H THR A 125 -7.390 -2.420 1.148 1.00 0.00 H new ATOM 0 HA THR A 125 -7.324 -0.174 -0.798 1.00 0.00 H new ATOM 0 HB THR A 125 -8.887 -1.414 -2.001 1.00 0.00 H new ATOM 0 HG1 THR A 125 -9.809 -2.002 0.519 1.00 0.00 H new ATOM 0 HG21 THR A 125 -8.140 -3.780 -1.933 1.00 0.00 H new ATOM 0 HG22 THR A 125 -6.757 -2.668 -1.806 1.00 0.00 H new ATOM 0 HG23 THR A 125 -7.372 -3.492 -0.354 1.00 0.00 H new ATOM 1978 N CYS A 126 -8.962 1.302 0.342 1.00 0.00 N ATOM 1979 CA CYS A 126 -9.939 2.208 1.024 1.00 0.00 C ATOM 1980 C CYS A 126 -11.098 2.538 0.081 1.00 0.00 C ATOM 1981 O CYS A 126 -10.955 2.518 -1.121 1.00 0.00 O ATOM 1982 CB CYS A 126 -9.216 3.501 1.417 1.00 0.00 C ATOM 1983 SG CYS A 126 -8.267 3.224 2.933 1.00 0.00 S ATOM 0 H CYS A 126 -8.307 1.771 -0.283 1.00 0.00 H new ATOM 0 HA CYS A 126 -10.338 1.715 1.910 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -8.552 3.818 0.613 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -9.939 4.303 1.569 1.00 0.00 H new ATOM 0 HG CYS A 126 -8.826 3.862 3.918 1.00 0.00 H new ATOM 1989 N ASP A 127 -12.245 2.857 0.623 1.00 0.00 N ATOM 1990 CA ASP A 127 -13.415 3.205 -0.236 1.00 0.00 C ATOM 1991 C ASP A 127 -14.615 3.530 0.660 1.00 0.00 C ATOM 1992 O ASP A 127 -14.932 2.804 1.581 1.00 0.00 O ATOM 1993 CB ASP A 127 -13.751 2.028 -1.169 1.00 0.00 C ATOM 1994 CG ASP A 127 -15.165 2.185 -1.743 1.00 0.00 C ATOM 1995 OD1 ASP A 127 -15.357 3.076 -2.555 1.00 0.00 O ATOM 1996 OD2 ASP A 127 -16.027 1.413 -1.359 1.00 0.00 O ATOM 0 H ASP A 127 -12.422 2.891 1.627 1.00 0.00 H new ATOM 0 HA ASP A 127 -13.174 4.074 -0.849 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -13.025 1.981 -1.981 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.677 1.089 -0.621 1.00 0.00 H new ATOM 2001 N ASP A 128 -15.281 4.619 0.390 1.00 0.00 N ATOM 2002 CA ASP A 128 -16.462 5.004 1.213 1.00 0.00 C ATOM 2003 C ASP A 128 -16.028 5.186 2.666 1.00 0.00 C ATOM 2004 O ASP A 128 -16.331 4.378 3.516 1.00 0.00 O ATOM 2005 CB ASP A 128 -17.527 3.902 1.129 1.00 0.00 C ATOM 2006 CG ASP A 128 -18.884 4.463 1.565 1.00 0.00 C ATOM 2007 OD1 ASP A 128 -19.215 5.557 1.138 1.00 0.00 O ATOM 2008 OD2 ASP A 128 -19.568 3.789 2.316 1.00 0.00 O ATOM 0 H ASP A 128 -15.057 5.262 -0.369 1.00 0.00 H new ATOM 0 HA ASP A 128 -16.879 5.938 0.838 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -17.590 3.521 0.110 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -17.247 3.063 1.766 1.00 0.00 H new ATOM 2013 N TYR A 129 -15.317 6.235 2.962 1.00 0.00 N ATOM 2014 CA TYR A 129 -14.873 6.442 4.364 1.00 0.00 C ATOM 2015 C TYR A 129 -16.094 6.676 5.260 1.00 0.00 C ATOM 2016 O TYR A 129 -16.869 7.584 5.036 1.00 0.00 O ATOM 2017 CB TYR A 129 -13.931 7.649 4.439 1.00 0.00 C ATOM 2018 CG TYR A 129 -13.432 7.818 5.854 1.00 0.00 C ATOM 2019 CD1 TYR A 129 -14.247 8.417 6.821 1.00 0.00 C ATOM 2020 CD2 TYR A 129 -12.149 7.376 6.199 1.00 0.00 C ATOM 2021 CE1 TYR A 129 -13.780 8.574 8.132 1.00 0.00 C ATOM 2022 CE2 TYR A 129 -11.680 7.533 7.507 1.00 0.00 C ATOM 2023 CZ TYR A 129 -12.497 8.131 8.475 1.00 0.00 C ATOM 2024 OH TYR A 129 -12.035 8.287 9.766 1.00 0.00 O ATOM 0 H TYR A 129 -15.026 6.953 2.299 1.00 0.00 H new ATOM 0 HA TYR A 129 -14.340 5.555 4.708 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -13.089 7.508 3.761 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -14.453 8.550 4.117 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -15.237 8.758 6.556 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.520 6.913 5.453 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.409 9.037 8.878 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.689 7.194 7.771 1.00 0.00 H new ATOM 0 HH TYR A 129 -11.454 7.533 9.999 1.00 0.00 H new ATOM 2034 N ASN A 130 -16.281 5.865 6.276 1.00 0.00 N ATOM 2035 CA ASN A 130 -17.462 6.060 7.170 1.00 0.00 C ATOM 2036 C ASN A 130 -17.117 7.084 8.256 1.00 0.00 C ATOM 2037 O ASN A 130 -16.109 6.982 8.926 1.00 0.00 O ATOM 2038 CB ASN A 130 -17.851 4.717 7.815 1.00 0.00 C ATOM 2039 CG ASN A 130 -16.870 4.352 8.937 1.00 0.00 C ATOM 2040 OD1 ASN A 130 -16.841 4.995 9.967 1.00 0.00 O ATOM 2041 ND2 ASN A 130 -16.065 3.337 8.780 1.00 0.00 N ATOM 0 H ASN A 130 -15.672 5.085 6.521 1.00 0.00 H new ATOM 0 HA ASN A 130 -18.305 6.429 6.585 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -18.863 4.779 8.215 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -17.855 3.932 7.059 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -15.412 3.084 9.522 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -16.089 2.796 7.915 1.00 0.00 H new ATOM 2048 N GLU A 131 -17.952 8.072 8.433 1.00 0.00 N ATOM 2049 CA GLU A 131 -17.689 9.110 9.472 1.00 0.00 C ATOM 2050 C GLU A 131 -18.354 8.683 10.780 1.00 0.00 C ATOM 2051 O GLU A 131 -18.353 9.406 11.756 1.00 0.00 O ATOM 2052 CB GLU A 131 -18.272 10.450 9.014 1.00 0.00 C ATOM 2053 CG GLU A 131 -19.675 10.229 8.445 1.00 0.00 C ATOM 2054 CD GLU A 131 -20.372 11.580 8.266 1.00 0.00 C ATOM 2055 OE1 GLU A 131 -19.675 12.568 8.104 1.00 0.00 O ATOM 2056 OE2 GLU A 131 -21.592 11.603 8.293 1.00 0.00 O ATOM 0 H GLU A 131 -18.811 8.206 7.899 1.00 0.00 H new ATOM 0 HA GLU A 131 -16.615 9.218 9.623 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -18.313 11.146 9.852 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.628 10.899 8.258 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.613 9.710 7.488 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -20.255 9.595 9.115 1.00 0.00 H new ATOM 2063 N LYS A 132 -18.920 7.508 10.805 1.00 0.00 N ATOM 2064 CA LYS A 132 -19.585 7.024 12.047 1.00 0.00 C ATOM 2065 C LYS A 132 -18.516 6.682 13.086 1.00 0.00 C ATOM 2066 O LYS A 132 -18.447 7.276 14.143 1.00 0.00 O ATOM 2067 CB LYS A 132 -20.414 5.773 11.732 1.00 0.00 C ATOM 2068 CG LYS A 132 -21.164 5.968 10.412 1.00 0.00 C ATOM 2069 CD LYS A 132 -22.050 7.211 10.503 1.00 0.00 C ATOM 2070 CE LYS A 132 -23.047 7.214 9.343 1.00 0.00 C ATOM 2071 NZ LYS A 132 -23.903 8.431 9.427 1.00 0.00 N ATOM 0 H LYS A 132 -18.951 6.861 10.017 1.00 0.00 H new ATOM 0 HA LYS A 132 -20.242 7.801 12.438 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -19.763 4.901 11.666 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -21.122 5.582 12.538 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -20.454 6.074 9.591 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -21.773 5.090 10.195 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -22.583 7.222 11.454 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -21.436 8.111 10.471 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -22.515 7.196 8.392 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -23.666 6.318 9.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -24.581 8.434 8.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -24.421 8.430 10.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -23.305 9.280 9.372 1.00 0.00 H new ATOM 2085 N THR A 133 -17.678 5.725 12.785 1.00 0.00 N ATOM 2086 CA THR A 133 -16.600 5.332 13.744 1.00 0.00 C ATOM 2087 C THR A 133 -15.289 6.007 13.336 1.00 0.00 C ATOM 2088 O THR A 133 -14.280 5.878 14.000 1.00 0.00 O ATOM 2089 CB THR A 133 -16.421 3.812 13.705 1.00 0.00 C ATOM 2090 OG1 THR A 133 -16.276 3.390 12.356 1.00 0.00 O ATOM 2091 CG2 THR A 133 -17.645 3.136 14.326 1.00 0.00 C ATOM 0 H THR A 133 -17.693 5.196 11.913 1.00 0.00 H new ATOM 0 HA THR A 133 -16.873 5.644 14.752 1.00 0.00 H new ATOM 0 HB THR A 133 -15.531 3.535 14.271 1.00 0.00 H new ATOM 0 HG1 THR A 133 -16.160 2.417 12.328 1.00 0.00 H new ATOM 0 HG21 THR A 133 -17.517 2.054 14.298 1.00 0.00 H new ATOM 0 HG22 THR A 133 -17.755 3.461 15.360 1.00 0.00 H new ATOM 0 HG23 THR A 133 -18.537 3.410 13.763 1.00 0.00 H new ATOM 2099 N GLY A 134 -15.295 6.723 12.245 1.00 0.00 N ATOM 2100 CA GLY A 134 -14.048 7.401 11.793 1.00 0.00 C ATOM 2101 C GLY A 134 -13.083 6.360 11.222 1.00 0.00 C ATOM 2102 O GLY A 134 -11.915 6.333 11.555 1.00 0.00 O ATOM 0 H GLY A 134 -16.109 6.868 11.648 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -14.282 8.150 11.036 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -13.583 7.925 12.628 1.00 0.00 H new ATOM 2106 N VAL A 135 -13.567 5.498 10.365 1.00 0.00 N ATOM 2107 CA VAL A 135 -12.686 4.449 9.768 1.00 0.00 C ATOM 2108 C VAL A 135 -13.143 4.158 8.338 1.00 0.00 C ATOM 2109 O VAL A 135 -14.197 4.586 7.914 1.00 0.00 O ATOM 2110 CB VAL A 135 -12.799 3.162 10.599 1.00 0.00 C ATOM 2111 CG1 VAL A 135 -11.606 2.243 10.310 1.00 0.00 C ATOM 2112 CG2 VAL A 135 -12.817 3.514 12.087 1.00 0.00 C ATOM 0 H VAL A 135 -14.537 5.475 10.052 1.00 0.00 H new ATOM 0 HA VAL A 135 -11.654 4.799 9.762 1.00 0.00 H new ATOM 0 HB VAL A 135 -13.722 2.647 10.331 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -11.695 1.333 10.904 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -11.593 1.985 9.251 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -10.680 2.756 10.569 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -12.897 2.600 12.676 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -11.896 4.035 12.349 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -13.671 4.158 12.298 1.00 0.00 H new ATOM 2122 N TRP A 136 -12.365 3.422 7.594 1.00 0.00 N ATOM 2123 CA TRP A 136 -12.767 3.096 6.208 1.00 0.00 C ATOM 2124 C TRP A 136 -13.897 2.067 6.248 1.00 0.00 C ATOM 2125 O TRP A 136 -13.714 0.949 6.688 1.00 0.00 O ATOM 2126 CB TRP A 136 -11.557 2.543 5.448 1.00 0.00 C ATOM 2127 CG TRP A 136 -10.708 3.689 5.002 1.00 0.00 C ATOM 2128 CD1 TRP A 136 -9.524 4.049 5.544 1.00 0.00 C ATOM 2129 CD2 TRP A 136 -10.979 4.644 3.941 1.00 0.00 C ATOM 2130 NE1 TRP A 136 -9.052 5.165 4.877 1.00 0.00 N ATOM 2131 CE2 TRP A 136 -9.912 5.567 3.879 1.00 0.00 C ATOM 2132 CE3 TRP A 136 -12.039 4.791 3.034 1.00 0.00 C ATOM 2133 CZ2 TRP A 136 -9.895 6.605 2.947 1.00 0.00 C ATOM 2134 CZ3 TRP A 136 -12.030 5.832 2.091 1.00 0.00 C ATOM 2135 CH2 TRP A 136 -10.958 6.738 2.049 1.00 0.00 C ATOM 0 H TRP A 136 -11.469 3.035 7.891 1.00 0.00 H new ATOM 0 HA TRP A 136 -13.121 3.990 5.695 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -10.982 1.873 6.088 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -11.885 1.959 4.588 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -9.028 3.548 6.362 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -8.173 5.634 5.098 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -12.868 4.099 3.061 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -9.068 7.299 2.920 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -12.850 5.936 1.396 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -10.955 7.538 1.323 1.00 0.00 H new ATOM 2146 N GLU A 137 -15.068 2.460 5.806 1.00 0.00 N ATOM 2147 CA GLU A 137 -16.255 1.546 5.816 1.00 0.00 C ATOM 2148 C GLU A 137 -15.831 0.103 5.521 1.00 0.00 C ATOM 2149 O GLU A 137 -15.771 -0.727 6.407 1.00 0.00 O ATOM 2150 CB GLU A 137 -17.263 2.005 4.752 1.00 0.00 C ATOM 2151 CG GLU A 137 -18.521 1.126 4.792 1.00 0.00 C ATOM 2152 CD GLU A 137 -19.219 1.285 6.144 1.00 0.00 C ATOM 2153 OE1 GLU A 137 -18.878 0.549 7.054 1.00 0.00 O ATOM 2154 OE2 GLU A 137 -20.083 2.141 6.244 1.00 0.00 O ATOM 0 H GLU A 137 -15.254 3.391 5.433 1.00 0.00 H new ATOM 0 HA GLU A 137 -16.712 1.582 6.805 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -17.534 3.047 4.924 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.807 1.953 3.763 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -19.199 1.408 3.987 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -18.252 0.082 4.631 1.00 0.00 H new ATOM 2161 N LYS A 138 -15.543 -0.197 4.278 1.00 0.00 N ATOM 2162 CA LYS A 138 -15.128 -1.586 3.898 1.00 0.00 C ATOM 2163 C LYS A 138 -13.728 -1.552 3.282 1.00 0.00 C ATOM 2164 O LYS A 138 -13.326 -0.579 2.677 1.00 0.00 O ATOM 2165 CB LYS A 138 -16.118 -2.140 2.871 1.00 0.00 C ATOM 2166 CG LYS A 138 -15.790 -3.604 2.576 1.00 0.00 C ATOM 2167 CD LYS A 138 -16.960 -4.246 1.827 1.00 0.00 C ATOM 2168 CE LYS A 138 -16.585 -5.672 1.421 1.00 0.00 C ATOM 2169 NZ LYS A 138 -15.634 -5.627 0.276 1.00 0.00 N ATOM 0 H LYS A 138 -15.578 0.466 3.503 1.00 0.00 H new ATOM 0 HA LYS A 138 -15.119 -2.220 4.784 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -17.136 -2.055 3.251 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -16.070 -1.554 1.953 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -14.881 -3.671 1.979 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -15.601 -4.140 3.506 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -17.848 -4.258 2.459 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -17.206 -3.658 0.943 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -16.132 -6.194 2.264 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -17.479 -6.230 1.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -15.536 -6.579 -0.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -15.995 -4.976 -0.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -14.706 -5.295 0.608 1.00 0.00 H new ATOM 2183 N ARG A 139 -12.981 -2.613 3.433 1.00 0.00 N ATOM 2184 CA ARG A 139 -11.607 -2.649 2.858 1.00 0.00 C ATOM 2185 C ARG A 139 -11.082 -4.087 2.889 1.00 0.00 C ATOM 2186 O ARG A 139 -11.622 -4.939 3.566 1.00 0.00 O ATOM 2187 CB ARG A 139 -10.680 -1.749 3.681 1.00 0.00 C ATOM 2188 CG ARG A 139 -10.793 -2.108 5.171 1.00 0.00 C ATOM 2189 CD ARG A 139 -9.957 -1.129 6.026 1.00 0.00 C ATOM 2190 NE ARG A 139 -9.190 -1.886 7.067 1.00 0.00 N ATOM 2191 CZ ARG A 139 -9.766 -2.804 7.802 1.00 0.00 C ATOM 2192 NH1 ARG A 139 -11.053 -3.001 7.728 1.00 0.00 N ATOM 2193 NH2 ARG A 139 -9.052 -3.500 8.643 1.00 0.00 N ATOM 0 H ARG A 139 -13.264 -3.457 3.931 1.00 0.00 H new ATOM 0 HA ARG A 139 -11.635 -2.292 1.829 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -9.650 -1.869 3.346 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -10.945 -0.703 3.529 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -11.837 -2.072 5.482 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -10.447 -3.129 5.333 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -9.270 -0.572 5.389 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -10.611 -0.399 6.503 1.00 0.00 H new ATOM 0 HE ARG A 139 -8.200 -1.682 7.206 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -11.620 -2.438 7.094 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -11.493 -3.718 8.304 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -8.050 -3.328 8.726 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -9.496 -4.216 9.218 1.00 0.00 H new ATOM 2207 N LYS A 140 -10.029 -4.359 2.158 1.00 0.00 N ATOM 2208 CA LYS A 140 -9.447 -5.739 2.130 1.00 0.00 C ATOM 2209 C LYS A 140 -7.939 -5.651 2.368 1.00 0.00 C ATOM 2210 O LYS A 140 -7.254 -4.838 1.779 1.00 0.00 O ATOM 2211 CB LYS A 140 -9.709 -6.373 0.761 1.00 0.00 C ATOM 2212 CG LYS A 140 -11.163 -6.127 0.355 1.00 0.00 C ATOM 2213 CD LYS A 140 -11.510 -6.994 -0.857 1.00 0.00 C ATOM 2214 CE LYS A 140 -12.832 -6.519 -1.462 1.00 0.00 C ATOM 2215 NZ LYS A 140 -13.348 -7.552 -2.405 1.00 0.00 N ATOM 0 H LYS A 140 -9.543 -3.678 1.574 1.00 0.00 H new ATOM 0 HA LYS A 140 -9.908 -6.349 2.907 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -9.036 -5.948 0.017 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -9.507 -7.443 0.799 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -11.828 -6.362 1.186 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -11.312 -5.074 0.116 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -10.715 -6.934 -1.600 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -11.589 -8.040 -0.559 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -13.561 -6.336 -0.672 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -12.686 -5.574 -1.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -14.247 -7.229 -2.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -12.655 -7.705 -3.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -13.503 -8.444 -1.892 1.00 0.00 H new ATOM 2229 N ILE A 141 -7.415 -6.476 3.236 1.00 0.00 N ATOM 2230 CA ILE A 141 -5.949 -6.440 3.525 1.00 0.00 C ATOM 2231 C ILE A 141 -5.219 -7.468 2.654 1.00 0.00 C ATOM 2232 O ILE A 141 -5.736 -8.525 2.346 1.00 0.00 O ATOM 2233 CB ILE A 141 -5.721 -6.764 5.003 1.00 0.00 C ATOM 2234 CG1 ILE A 141 -6.723 -5.983 5.862 1.00 0.00 C ATOM 2235 CG2 ILE A 141 -4.293 -6.384 5.403 1.00 0.00 C ATOM 2236 CD1 ILE A 141 -6.674 -4.492 5.508 1.00 0.00 C ATOM 0 H ILE A 141 -7.940 -7.176 3.760 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.560 -5.447 3.301 1.00 0.00 H new ATOM 0 HB ILE A 141 -5.865 -7.833 5.162 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -7.729 -6.369 5.702 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -6.493 -6.121 6.918 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -4.136 -6.617 6.456 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -3.583 -6.947 4.797 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -4.141 -5.317 5.241 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -7.390 -3.948 6.124 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -5.671 -4.107 5.692 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -6.927 -4.359 4.456 1.00 0.00 H new ATOM 2248 N PHE A 142 -4.014 -7.157 2.263 1.00 0.00 N ATOM 2249 CA PHE A 142 -3.213 -8.089 1.411 1.00 0.00 C ATOM 2250 C PHE A 142 -1.733 -7.909 1.784 1.00 0.00 C ATOM 2251 O PHE A 142 -1.286 -6.811 2.048 1.00 0.00 O ATOM 2252 CB PHE A 142 -3.485 -7.754 -0.079 1.00 0.00 C ATOM 2253 CG PHE A 142 -2.233 -7.890 -0.933 1.00 0.00 C ATOM 2254 CD1 PHE A 142 -1.467 -9.060 -0.881 1.00 0.00 C ATOM 2255 CD2 PHE A 142 -1.846 -6.839 -1.777 1.00 0.00 C ATOM 2256 CE1 PHE A 142 -0.317 -9.179 -1.668 1.00 0.00 C ATOM 2257 CE2 PHE A 142 -0.695 -6.961 -2.565 1.00 0.00 C ATOM 2258 CZ PHE A 142 0.069 -8.129 -2.510 1.00 0.00 C ATOM 0 H PHE A 142 -3.541 -6.285 2.500 1.00 0.00 H new ATOM 0 HA PHE A 142 -3.488 -9.131 1.572 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -4.260 -8.417 -0.464 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -3.868 -6.737 -0.157 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -1.764 -9.871 -0.233 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -2.436 -5.935 -1.819 1.00 0.00 H new ATOM 0 HE1 PHE A 142 0.274 -10.082 -1.626 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -0.398 -6.152 -3.216 1.00 0.00 H new ATOM 0 HZ PHE A 142 0.957 -8.222 -3.117 1.00 0.00 H new ATOM 2268 N VAL A 143 -0.978 -8.982 1.833 1.00 0.00 N ATOM 2269 CA VAL A 143 0.467 -8.879 2.219 1.00 0.00 C ATOM 2270 C VAL A 143 1.347 -9.674 1.247 1.00 0.00 C ATOM 2271 O VAL A 143 0.960 -10.705 0.728 1.00 0.00 O ATOM 2272 CB VAL A 143 0.637 -9.450 3.629 1.00 0.00 C ATOM 2273 CG1 VAL A 143 2.006 -9.049 4.190 1.00 0.00 C ATOM 2274 CG2 VAL A 143 -0.469 -8.905 4.535 1.00 0.00 C ATOM 0 H VAL A 143 -1.301 -9.926 1.622 1.00 0.00 H new ATOM 0 HA VAL A 143 0.771 -7.833 2.187 1.00 0.00 H new ATOM 0 HB VAL A 143 0.572 -10.537 3.588 1.00 0.00 H new ATOM 0 HG11 VAL A 143 2.122 -9.458 5.194 1.00 0.00 H new ATOM 0 HG12 VAL A 143 2.792 -9.441 3.545 1.00 0.00 H new ATOM 0 HG13 VAL A 143 2.078 -7.962 4.230 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -0.349 -9.311 5.540 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -0.405 -7.818 4.573 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -1.441 -9.198 4.139 1.00 0.00 H new ATOM 2284 N ALA A 144 2.546 -9.195 1.017 1.00 0.00 N ATOM 2285 CA ALA A 144 3.497 -9.896 0.100 1.00 0.00 C ATOM 2286 C ALA A 144 4.904 -9.766 0.684 1.00 0.00 C ATOM 2287 O ALA A 144 5.237 -8.759 1.274 1.00 0.00 O ATOM 2288 CB ALA A 144 3.460 -9.233 -1.276 1.00 0.00 C ATOM 0 H ALA A 144 2.910 -8.337 1.432 1.00 0.00 H new ATOM 0 HA ALA A 144 3.221 -10.946 -0.000 1.00 0.00 H new ATOM 0 HB1 ALA A 144 4.153 -9.744 -1.945 1.00 0.00 H new ATOM 0 HB2 ALA A 144 2.451 -9.295 -1.683 1.00 0.00 H new ATOM 0 HB3 ALA A 144 3.750 -8.186 -1.183 1.00 0.00 H new ATOM 2294 N THR A 145 5.734 -10.777 0.535 1.00 0.00 N ATOM 2295 CA THR A 145 7.126 -10.710 1.101 1.00 0.00 C ATOM 2296 C THR A 145 8.161 -10.809 -0.022 1.00 0.00 C ATOM 2297 O THR A 145 7.942 -11.445 -1.035 1.00 0.00 O ATOM 2298 CB THR A 145 7.329 -11.852 2.112 1.00 0.00 C ATOM 2299 OG1 THR A 145 8.469 -11.570 2.911 1.00 0.00 O ATOM 2300 CG2 THR A 145 7.537 -13.186 1.388 1.00 0.00 C ATOM 0 H THR A 145 5.509 -11.644 0.047 1.00 0.00 H new ATOM 0 HA THR A 145 7.257 -9.755 1.609 1.00 0.00 H new ATOM 0 HB THR A 145 6.440 -11.929 2.737 1.00 0.00 H new ATOM 0 HG1 THR A 145 8.602 -12.294 3.558 1.00 0.00 H new ATOM 0 HG21 THR A 145 7.679 -13.980 2.121 1.00 0.00 H new ATOM 0 HG22 THR A 145 6.662 -13.408 0.777 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.418 -13.120 0.750 1.00 0.00 H new ATOM 2308 N GLU A 146 9.290 -10.176 0.159 1.00 0.00 N ATOM 2309 CA GLU A 146 10.355 -10.220 -0.882 1.00 0.00 C ATOM 2310 C GLU A 146 10.817 -11.666 -1.076 1.00 0.00 C ATOM 2311 O GLU A 146 11.003 -12.403 -0.127 1.00 0.00 O ATOM 2312 CB GLU A 146 11.536 -9.350 -0.430 1.00 0.00 C ATOM 2313 CG GLU A 146 12.713 -9.492 -1.405 1.00 0.00 C ATOM 2314 CD GLU A 146 12.252 -9.183 -2.832 1.00 0.00 C ATOM 2315 OE1 GLU A 146 11.661 -10.057 -3.445 1.00 0.00 O ATOM 2316 OE2 GLU A 146 12.497 -8.077 -3.286 1.00 0.00 O ATOM 0 H GLU A 146 9.520 -9.628 0.988 1.00 0.00 H new ATOM 0 HA GLU A 146 9.966 -9.840 -1.827 1.00 0.00 H new ATOM 0 HB2 GLU A 146 11.226 -8.306 -0.374 1.00 0.00 H new ATOM 0 HB3 GLU A 146 11.849 -9.643 0.572 1.00 0.00 H new ATOM 0 HG2 GLU A 146 13.517 -8.814 -1.119 1.00 0.00 H new ATOM 0 HG3 GLU A 146 13.117 -10.503 -1.356 1.00 0.00 H new ATOM 2323 N VAL A 147 11.006 -12.080 -2.302 1.00 0.00 N ATOM 2324 CA VAL A 147 11.460 -13.476 -2.570 1.00 0.00 C ATOM 2325 C VAL A 147 12.988 -13.502 -2.673 1.00 0.00 C ATOM 2326 O VAL A 147 13.652 -12.507 -2.462 1.00 0.00 O ATOM 2327 CB VAL A 147 10.852 -13.955 -3.891 1.00 0.00 C ATOM 2328 CG1 VAL A 147 9.375 -14.300 -3.682 1.00 0.00 C ATOM 2329 CG2 VAL A 147 10.974 -12.845 -4.941 1.00 0.00 C ATOM 0 H VAL A 147 10.864 -11.507 -3.134 1.00 0.00 H new ATOM 0 HA VAL A 147 11.140 -14.130 -1.759 1.00 0.00 H new ATOM 0 HB VAL A 147 11.385 -14.842 -4.234 1.00 0.00 H new ATOM 0 HG11 VAL A 147 8.944 -14.641 -4.624 1.00 0.00 H new ATOM 0 HG12 VAL A 147 9.288 -15.090 -2.936 1.00 0.00 H new ATOM 0 HG13 VAL A 147 8.840 -13.415 -3.337 1.00 0.00 H new ATOM 0 HG21 VAL A 147 10.541 -13.185 -5.882 1.00 0.00 H new ATOM 0 HG22 VAL A 147 10.442 -11.958 -4.597 1.00 0.00 H new ATOM 0 HG23 VAL A 147 12.026 -12.601 -5.092 1.00 0.00 H new