USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 864 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 119 HIS : no HD1:sc= -0.399 X(o=-0.36,f=-0.22) USER MOD Set 1.2: A 122 LYS NZ :NH3+ -123:sc= 0.0402 (180deg=0) USER MOD Set 2.1: A 72 LYS NZ :NH3+ -131:sc= 0.726! (180deg=0.0661!) USER MOD Set 2.2: A 73 TYR OH : rot 180:sc= 0.637 USER MOD Set 3.1: A 35 ASN : amide:sc= -27.2! C(o=-28!,f=-18!) USER MOD Set 3.2: A 37 THR OG1 : rot -175:sc= -1.07! USER MOD Set 4.1: A 26 MET CE :methyl -170:sc= -4.49 (180deg=-4!) USER MOD Set 4.2: A 74 GLN : amide:sc= -58.7! C(o=-63!,f=-65!) USER MOD Set 5.1: A 21 SER OG : rot -90:sc= -4.17! USER MOD Set 5.2: A 95 GLN : amide:sc= 0 X(o=-4.2,f=-4.2) USER MOD Single : A 4 GLN : amide:sc= -0.13 X(o=-0.13,f=-0.24) USER MOD Single : A 6 TYR OH : rot 30:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 33:sc= 0.181! USER MOD Single : A 16 TYR OH : rot 150:sc= 0 USER MOD Single : A 20 HIS : no HD1:sc= -6.27! C(o=-6.3!,f=-15!) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 105:sc= 0.359 USER MOD Single : A 27 LYS NZ :NH3+ 133:sc= -9.27! (180deg=-19.4!) USER MOD Single : A 29 LYS NZ :NH3+ -161:sc= -1.63! (180deg=-2.43!) USER MOD Single : A 30 LYS NZ :NH3+ 177:sc= -5.42! (180deg=-5.65!) USER MOD Single : A 38 HIS : no HE2:sc= -40.1! C(o=-40!,f=-47!) USER MOD Single : A 41 LYS NZ :NH3+ -142:sc= -9.73! (180deg=-12.3!) USER MOD Single : A 44 ASN : amide:sc= -56! C(o=-56!,f=-62!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -160:sc= -1.98! (180deg=-3.93!) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -158:sc= 0.385 USER MOD Single : A 63 HIS : no HE2:sc= -7.78! C(o=-7.8!,f=-11!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= -3.34 K(o=-3.3,f=-1.4) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0.0522 USER MOD Single : A 81 ASN : amide:sc= -13.5! C(o=-13!,f=-36!) USER MOD Single : A 84 LYS NZ :NH3+ 163:sc= -0.0765 (180deg=-0.389) USER MOD Single : A 85 GLN : amide:sc= -0.104 X(o=-0.1,f=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -133:sc= 0.983 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 130:sc= -1.72! (180deg=-3.14!) USER MOD Single : A 117 HIS : no HD1:sc= -0.489 K(o=-0.49,f=-1.5!) USER MOD Single : A 118 HIS : no HD1:sc= -1.01! C(o=-1!,f=-1.8!) USER MOD Single : A 121 SER OG : rot 51:sc= 1 USER MOD ----------------------------------------------------------------- ATOM 26 N GLN A 4 -1.952 -2.191 8.583 1.00 1.00 N ATOM 27 CA GLN A 4 -1.843 -0.913 7.822 1.00 1.00 C ATOM 28 C GLN A 4 -2.280 -1.115 6.369 1.00 1.00 C ATOM 29 O GLN A 4 -2.725 -2.177 5.984 1.00 1.00 O ATOM 30 CB GLN A 4 -0.363 -0.542 7.886 1.00 1.00 C ATOM 31 CG GLN A 4 0.005 -0.148 9.317 1.00 1.00 C ATOM 32 CD GLN A 4 0.695 -1.324 10.011 1.00 1.00 C ATOM 33 OE1 GLN A 4 1.741 -1.768 9.583 1.00 1.00 O ATOM 34 NE2 GLN A 4 0.147 -1.852 11.071 1.00 1.00 N ATOM 0 HA GLN A 4 -2.481 -0.133 8.237 1.00 1.00 H new ATOM 0 HB2 GLN A 4 0.248 -1.384 7.561 1.00 1.00 H new ATOM 0 HB3 GLN A 4 -0.155 0.284 7.206 1.00 1.00 H new ATOM 0 HG2 GLN A 4 0.664 0.720 9.308 1.00 1.00 H new ATOM 0 HG3 GLN A 4 -0.891 0.138 9.868 1.00 1.00 H new ATOM 0 HE21 GLN A 4 -0.732 -1.479 11.430 1.00 1.00 H new ATOM 0 HE22 GLN A 4 0.597 -2.638 11.540 1.00 1.00 H new ATOM 43 N ILE A 5 -2.146 -0.100 5.556 1.00 1.00 N ATOM 44 CA ILE A 5 -2.543 -0.231 4.125 1.00 1.00 C ATOM 45 C ILE A 5 -1.297 -0.226 3.235 1.00 1.00 C ATOM 46 O ILE A 5 -0.850 0.809 2.782 1.00 1.00 O ATOM 47 CB ILE A 5 -3.411 0.995 3.839 1.00 1.00 C ATOM 48 CG1 ILE A 5 -4.510 1.097 4.897 1.00 1.00 C ATOM 49 CG2 ILE A 5 -4.047 0.860 2.455 1.00 1.00 C ATOM 50 CD1 ILE A 5 -4.535 2.514 5.473 1.00 1.00 C ATOM 0 H ILE A 5 -1.779 0.814 5.822 1.00 1.00 H new ATOM 0 HA ILE A 5 -3.076 -1.160 3.926 1.00 1.00 H new ATOM 0 HB ILE A 5 -2.793 1.892 3.867 1.00 1.00 H new ATOM 0 HG12 ILE A 5 -5.477 0.855 4.456 1.00 1.00 H new ATOM 0 HG13 ILE A 5 -4.332 0.373 5.692 1.00 1.00 H new ATOM 0 HG21 ILE A 5 -4.666 1.734 2.252 1.00 1.00 H new ATOM 0 HG22 ILE A 5 -3.264 0.786 1.700 1.00 1.00 H new ATOM 0 HG23 ILE A 5 -4.666 -0.037 2.425 1.00 1.00 H new ATOM 0 HD11 ILE A 5 -5.319 2.586 6.227 1.00 1.00 H new ATOM 0 HD12 ILE A 5 -3.571 2.739 5.929 1.00 1.00 H new ATOM 0 HD13 ILE A 5 -4.734 3.228 4.674 1.00 1.00 H new ATOM 62 N TYR A 6 -0.732 -1.374 2.985 1.00 1.00 N ATOM 63 CA TYR A 6 0.488 -1.435 2.129 1.00 1.00 C ATOM 64 C TYR A 6 0.220 -0.777 0.772 1.00 1.00 C ATOM 65 O TYR A 6 -0.901 -0.723 0.307 1.00 1.00 O ATOM 66 CB TYR A 6 0.774 -2.926 1.954 1.00 1.00 C ATOM 67 CG TYR A 6 0.264 -3.680 3.159 1.00 1.00 C ATOM 68 CD1 TYR A 6 0.107 -3.018 4.383 1.00 1.00 C ATOM 69 CD2 TYR A 6 -0.053 -5.040 3.052 1.00 1.00 C ATOM 70 CE1 TYR A 6 -0.366 -3.716 5.501 1.00 1.00 C ATOM 71 CE2 TYR A 6 -0.527 -5.737 4.171 1.00 1.00 C ATOM 72 CZ TYR A 6 -0.684 -5.075 5.394 1.00 1.00 C ATOM 73 OH TYR A 6 -1.151 -5.763 6.496 1.00 1.00 O ATOM 0 H TYR A 6 -1.061 -2.273 3.336 1.00 1.00 H new ATOM 0 HA TYR A 6 1.331 -0.907 2.575 1.00 1.00 H new ATOM 0 HB2 TYR A 6 0.292 -3.296 1.049 1.00 1.00 H new ATOM 0 HB3 TYR A 6 1.845 -3.091 1.835 1.00 1.00 H new ATOM 0 HD1 TYR A 6 0.351 -1.969 4.465 1.00 1.00 H new ATOM 0 HD2 TYR A 6 0.068 -5.551 2.108 1.00 1.00 H new ATOM 0 HE1 TYR A 6 -0.485 -3.206 6.445 1.00 1.00 H new ATOM 0 HE2 TYR A 6 -0.771 -6.786 4.090 1.00 1.00 H new ATOM 0 HH TYR A 6 -1.641 -5.149 7.082 1.00 1.00 H new ATOM 83 N SER A 7 1.244 -0.282 0.133 1.00 1.00 N ATOM 84 CA SER A 7 1.054 0.370 -1.194 1.00 1.00 C ATOM 85 C SER A 7 1.509 -0.572 -2.311 1.00 1.00 C ATOM 86 O SER A 7 2.495 -1.270 -2.184 1.00 1.00 O ATOM 87 CB SER A 7 1.933 1.619 -1.153 1.00 1.00 C ATOM 88 OG SER A 7 2.546 1.803 -2.422 1.00 1.00 O ATOM 0 H SER A 7 2.206 -0.301 0.473 1.00 1.00 H new ATOM 0 HA SER A 7 0.010 0.616 -1.389 1.00 1.00 H new ATOM 0 HB2 SER A 7 1.333 2.492 -0.896 1.00 1.00 H new ATOM 0 HB3 SER A 7 2.694 1.517 -0.380 1.00 1.00 H new ATOM 0 HG SER A 7 3.110 2.604 -2.400 1.00 1.00 H new ATOM 94 N ALA A 8 0.800 -0.598 -3.407 1.00 1.00 N ATOM 95 CA ALA A 8 1.195 -1.497 -4.528 1.00 1.00 C ATOM 96 C ALA A 8 0.776 -0.888 -5.869 1.00 1.00 C ATOM 97 O ALA A 8 -0.111 -0.061 -5.937 1.00 1.00 O ATOM 98 CB ALA A 8 0.441 -2.801 -4.274 1.00 1.00 C ATOM 0 H ALA A 8 -0.035 -0.036 -3.574 1.00 1.00 H new ATOM 0 HA ALA A 8 2.273 -1.651 -4.573 1.00 1.00 H new ATOM 0 HB1 ALA A 8 0.679 -3.518 -5.060 1.00 1.00 H new ATOM 0 HB2 ALA A 8 0.736 -3.210 -3.308 1.00 1.00 H new ATOM 0 HB3 ALA A 8 -0.632 -2.607 -4.273 1.00 1.00 H new ATOM 104 N ARG A 9 1.409 -1.290 -6.937 1.00 1.00 N ATOM 105 CA ARG A 9 1.047 -0.736 -8.273 1.00 1.00 C ATOM 106 C ARG A 9 1.132 -1.829 -9.341 1.00 1.00 C ATOM 107 O ARG A 9 2.185 -2.381 -9.594 1.00 1.00 O ATOM 108 CB ARG A 9 2.079 0.359 -8.542 1.00 1.00 C ATOM 109 CG ARG A 9 2.992 -0.071 -9.691 1.00 1.00 C ATOM 110 CD ARG A 9 2.998 1.014 -10.771 1.00 1.00 C ATOM 111 NE ARG A 9 4.115 0.642 -11.683 1.00 1.00 N ATOM 112 CZ ARG A 9 5.299 1.163 -11.510 1.00 1.00 C ATOM 113 NH1 ARG A 9 5.504 2.007 -10.537 1.00 1.00 N ATOM 114 NH2 ARG A 9 6.278 0.839 -12.309 1.00 1.00 N ATOM 0 H ARG A 9 2.162 -1.978 -6.942 1.00 1.00 H new ATOM 0 HA ARG A 9 0.028 -0.349 -8.296 1.00 1.00 H new ATOM 0 HB2 ARG A 9 1.577 1.293 -8.793 1.00 1.00 H new ATOM 0 HB3 ARG A 9 2.669 0.545 -7.645 1.00 1.00 H new ATOM 0 HG2 ARG A 9 4.004 -0.238 -9.323 1.00 1.00 H new ATOM 0 HG3 ARG A 9 2.646 -1.015 -10.111 1.00 1.00 H new ATOM 0 HD2 ARG A 9 2.047 1.046 -11.304 1.00 1.00 H new ATOM 0 HD3 ARG A 9 3.154 2.002 -10.338 1.00 1.00 H new ATOM 0 HE ARG A 9 3.955 -0.020 -12.443 1.00 1.00 H new ATOM 0 HH11 ARG A 9 4.739 2.260 -9.911 1.00 1.00 H new ATOM 0 HH12 ARG A 9 6.429 2.414 -10.402 1.00 1.00 H new ATOM 0 HH21 ARG A 9 6.118 0.178 -13.069 1.00 1.00 H new ATOM 0 HH22 ARG A 9 7.203 1.247 -12.173 1.00 1.00 H new ATOM 127 N TYR A 10 0.034 -2.146 -9.969 1.00 1.00 N ATOM 128 CA TYR A 10 0.054 -3.204 -11.021 1.00 1.00 C ATOM 129 C TYR A 10 -0.667 -2.712 -12.278 1.00 1.00 C ATOM 130 O TYR A 10 -1.487 -1.818 -12.226 1.00 1.00 O ATOM 131 CB TYR A 10 -0.690 -4.389 -10.404 1.00 1.00 C ATOM 132 CG TYR A 10 0.260 -5.188 -9.545 1.00 1.00 C ATOM 133 CD1 TYR A 10 1.525 -5.534 -10.037 1.00 1.00 C ATOM 134 CD2 TYR A 10 -0.123 -5.581 -8.258 1.00 1.00 C ATOM 135 CE1 TYR A 10 2.406 -6.274 -9.240 1.00 1.00 C ATOM 136 CE2 TYR A 10 0.759 -6.322 -7.461 1.00 1.00 C ATOM 137 CZ TYR A 10 2.023 -6.669 -7.952 1.00 1.00 C ATOM 138 OH TYR A 10 2.891 -7.399 -7.167 1.00 1.00 O ATOM 0 H TYR A 10 -0.877 -1.719 -9.800 1.00 1.00 H new ATOM 0 HA TYR A 10 1.067 -3.471 -11.321 1.00 1.00 H new ATOM 0 HB2 TYR A 10 -1.528 -4.034 -9.804 1.00 1.00 H new ATOM 0 HB3 TYR A 10 -1.105 -5.020 -11.190 1.00 1.00 H new ATOM 0 HD1 TYR A 10 1.820 -5.230 -11.030 1.00 1.00 H new ATOM 0 HD2 TYR A 10 -1.098 -5.313 -7.879 1.00 1.00 H new ATOM 0 HE1 TYR A 10 3.382 -6.541 -9.618 1.00 1.00 H new ATOM 0 HE2 TYR A 10 0.464 -6.626 -6.468 1.00 1.00 H new ATOM 0 HH TYR A 10 2.469 -7.589 -6.303 1.00 1.00 H new ATOM 148 N SER A 11 -0.367 -3.290 -13.409 1.00 1.00 N ATOM 149 CA SER A 11 -1.037 -2.853 -14.668 1.00 1.00 C ATOM 150 C SER A 11 -0.905 -1.337 -14.837 1.00 1.00 C ATOM 151 O SER A 11 -1.815 -0.672 -15.289 1.00 1.00 O ATOM 152 CB SER A 11 -2.503 -3.249 -14.493 1.00 1.00 C ATOM 153 OG SER A 11 -3.332 -2.183 -14.936 1.00 1.00 O ATOM 0 H SER A 11 0.311 -4.044 -13.516 1.00 1.00 H new ATOM 0 HA SER A 11 -0.595 -3.310 -15.553 1.00 1.00 H new ATOM 0 HB2 SER A 11 -2.718 -4.153 -15.062 1.00 1.00 H new ATOM 0 HB3 SER A 11 -2.709 -3.475 -13.447 1.00 1.00 H new ATOM 0 HG SER A 11 -2.894 -1.715 -15.677 1.00 1.00 H new ATOM 159 N GLY A 12 0.223 -0.788 -14.477 1.00 1.00 N ATOM 160 CA GLY A 12 0.412 0.685 -14.616 1.00 1.00 C ATOM 161 C GLY A 12 -0.410 1.409 -13.549 1.00 1.00 C ATOM 162 O GLY A 12 -0.274 2.600 -13.347 1.00 1.00 O ATOM 0 H GLY A 12 1.021 -1.294 -14.093 1.00 1.00 H new ATOM 0 HA2 GLY A 12 1.467 0.938 -14.511 1.00 1.00 H new ATOM 0 HA3 GLY A 12 0.104 1.010 -15.610 1.00 1.00 H new ATOM 166 N VAL A 13 -1.272 0.702 -12.871 1.00 1.00 N ATOM 167 CA VAL A 13 -2.115 1.348 -11.824 1.00 1.00 C ATOM 168 C VAL A 13 -1.398 1.334 -10.471 1.00 1.00 C ATOM 169 O VAL A 13 -0.606 0.459 -10.183 1.00 1.00 O ATOM 170 CB VAL A 13 -3.386 0.500 -11.764 1.00 1.00 C ATOM 171 CG1 VAL A 13 -3.727 0.192 -10.306 1.00 1.00 C ATOM 172 CG2 VAL A 13 -4.542 1.272 -12.405 1.00 1.00 C ATOM 0 H VAL A 13 -1.430 -0.298 -12.997 1.00 1.00 H new ATOM 0 HA VAL A 13 -2.327 2.392 -12.055 1.00 1.00 H new ATOM 0 HB VAL A 13 -3.226 -0.433 -12.304 1.00 1.00 H new ATOM 0 HG11 VAL A 13 -4.633 -0.412 -10.264 1.00 1.00 H new ATOM 0 HG12 VAL A 13 -2.904 -0.356 -9.848 1.00 1.00 H new ATOM 0 HG13 VAL A 13 -3.888 1.125 -9.765 1.00 1.00 H new ATOM 0 HG21 VAL A 13 -5.449 0.669 -12.363 1.00 1.00 H new ATOM 0 HG22 VAL A 13 -4.701 2.205 -11.864 1.00 1.00 H new ATOM 0 HG23 VAL A 13 -4.300 1.492 -13.445 1.00 1.00 H new ATOM 182 N ASP A 14 -1.688 2.291 -9.633 1.00 1.00 N ATOM 183 CA ASP A 14 -1.047 2.335 -8.287 1.00 1.00 C ATOM 184 C ASP A 14 -2.095 2.020 -7.215 1.00 1.00 C ATOM 185 O ASP A 14 -3.129 2.653 -7.147 1.00 1.00 O ATOM 186 CB ASP A 14 -0.532 3.767 -8.137 1.00 1.00 C ATOM 187 CG ASP A 14 -0.101 4.006 -6.688 1.00 1.00 C ATOM 188 OD1 ASP A 14 0.956 3.524 -6.319 1.00 1.00 O ATOM 189 OD2 ASP A 14 -0.837 4.667 -5.974 1.00 1.00 O ATOM 0 H ASP A 14 -2.344 3.048 -9.823 1.00 1.00 H new ATOM 0 HA ASP A 14 -0.242 1.608 -8.179 1.00 1.00 H new ATOM 0 HB2 ASP A 14 0.309 3.935 -8.810 1.00 1.00 H new ATOM 0 HB3 ASP A 14 -1.311 4.476 -8.417 1.00 1.00 H new ATOM 194 N VAL A 15 -1.849 1.045 -6.383 1.00 1.00 N ATOM 195 CA VAL A 15 -2.854 0.706 -5.334 1.00 1.00 C ATOM 196 C VAL A 15 -2.170 0.374 -4.005 1.00 1.00 C ATOM 197 O VAL A 15 -0.962 0.276 -3.919 1.00 1.00 O ATOM 198 CB VAL A 15 -3.587 -0.521 -5.877 1.00 1.00 C ATOM 199 CG1 VAL A 15 -4.408 -0.124 -7.105 1.00 1.00 C ATOM 200 CG2 VAL A 15 -2.565 -1.590 -6.272 1.00 1.00 C ATOM 0 H VAL A 15 -1.004 0.473 -6.383 1.00 1.00 H new ATOM 0 HA VAL A 15 -3.528 1.539 -5.134 1.00 1.00 H new ATOM 0 HB VAL A 15 -4.251 -0.917 -5.109 1.00 1.00 H new ATOM 0 HG11 VAL A 15 -4.930 -0.999 -7.492 1.00 1.00 H new ATOM 0 HG12 VAL A 15 -5.135 0.639 -6.826 1.00 1.00 H new ATOM 0 HG13 VAL A 15 -3.744 0.272 -7.874 1.00 1.00 H new ATOM 0 HG21 VAL A 15 -3.086 -2.466 -6.659 1.00 1.00 H new ATOM 0 HG22 VAL A 15 -1.902 -1.193 -7.040 1.00 1.00 H new ATOM 0 HG23 VAL A 15 -1.979 -1.874 -5.398 1.00 1.00 H new ATOM 210 N TYR A 16 -2.946 0.194 -2.970 1.00 1.00 N ATOM 211 CA TYR A 16 -2.366 -0.141 -1.638 1.00 1.00 C ATOM 212 C TYR A 16 -2.744 -1.576 -1.259 1.00 1.00 C ATOM 213 O TYR A 16 -3.768 -2.082 -1.669 1.00 1.00 O ATOM 214 CB TYR A 16 -2.995 0.857 -0.665 1.00 1.00 C ATOM 215 CG TYR A 16 -3.395 2.107 -1.410 1.00 1.00 C ATOM 216 CD1 TYR A 16 -2.523 2.672 -2.349 1.00 1.00 C ATOM 217 CD2 TYR A 16 -4.636 2.703 -1.161 1.00 1.00 C ATOM 218 CE1 TYR A 16 -2.894 3.832 -3.039 1.00 1.00 C ATOM 219 CE2 TYR A 16 -5.008 3.863 -1.851 1.00 1.00 C ATOM 220 CZ TYR A 16 -4.136 4.428 -2.790 1.00 1.00 C ATOM 221 OH TYR A 16 -4.502 5.572 -3.470 1.00 1.00 O ATOM 0 H TYR A 16 -3.963 0.265 -2.991 1.00 1.00 H new ATOM 0 HA TYR A 16 -1.278 -0.079 -1.628 1.00 1.00 H new ATOM 0 HB2 TYR A 16 -3.867 0.412 -0.186 1.00 1.00 H new ATOM 0 HB3 TYR A 16 -2.287 1.104 0.126 1.00 1.00 H new ATOM 0 HD1 TYR A 16 -1.564 2.213 -2.541 1.00 1.00 H new ATOM 0 HD2 TYR A 16 -5.308 2.268 -0.436 1.00 1.00 H new ATOM 0 HE1 TYR A 16 -2.222 4.267 -3.764 1.00 1.00 H new ATOM 0 HE2 TYR A 16 -5.967 4.322 -1.659 1.00 1.00 H new ATOM 0 HH TYR A 16 -5.476 5.594 -3.572 1.00 1.00 H new ATOM 231 N GLU A 17 -1.928 -2.238 -0.488 1.00 1.00 N ATOM 232 CA GLU A 17 -2.254 -3.641 -0.101 1.00 1.00 C ATOM 233 C GLU A 17 -2.389 -3.760 1.418 1.00 1.00 C ATOM 234 O GLU A 17 -1.446 -3.551 2.156 1.00 1.00 O ATOM 235 CB GLU A 17 -1.074 -4.474 -0.602 1.00 1.00 C ATOM 236 CG GLU A 17 -0.342 -3.710 -1.708 1.00 1.00 C ATOM 237 CD GLU A 17 1.168 -3.814 -1.487 1.00 1.00 C ATOM 238 OE1 GLU A 17 1.698 -2.989 -0.762 1.00 1.00 O ATOM 239 OE2 GLU A 17 1.768 -4.717 -2.047 1.00 1.00 O ATOM 0 H GLU A 17 -1.054 -1.872 -0.110 1.00 1.00 H new ATOM 0 HA GLU A 17 -3.200 -3.975 -0.527 1.00 1.00 H new ATOM 0 HB2 GLU A 17 -0.391 -4.688 0.220 1.00 1.00 H new ATOM 0 HB3 GLU A 17 -1.427 -5.433 -0.981 1.00 1.00 H new ATOM 0 HG2 GLU A 17 -0.606 -4.119 -2.683 1.00 1.00 H new ATOM 0 HG3 GLU A 17 -0.649 -2.664 -1.707 1.00 1.00 H new ATOM 246 N PHE A 18 -3.559 -4.095 1.886 1.00 1.00 N ATOM 247 CA PHE A 18 -3.769 -4.232 3.355 1.00 1.00 C ATOM 248 C PHE A 18 -4.572 -5.503 3.649 1.00 1.00 C ATOM 249 O PHE A 18 -5.497 -5.841 2.938 1.00 1.00 O ATOM 250 CB PHE A 18 -4.566 -2.989 3.754 1.00 1.00 C ATOM 251 CG PHE A 18 -4.895 -3.048 5.228 1.00 1.00 C ATOM 252 CD1 PHE A 18 -5.271 -4.261 5.815 1.00 1.00 C ATOM 253 CD2 PHE A 18 -4.824 -1.886 6.005 1.00 1.00 C ATOM 254 CE1 PHE A 18 -5.577 -4.313 7.180 1.00 1.00 C ATOM 255 CE2 PHE A 18 -5.130 -1.938 7.370 1.00 1.00 C ATOM 256 CZ PHE A 18 -5.507 -3.150 7.957 1.00 1.00 C ATOM 0 H PHE A 18 -4.382 -4.281 1.313 1.00 1.00 H new ATOM 0 HA PHE A 18 -2.832 -4.310 3.907 1.00 1.00 H new ATOM 0 HB2 PHE A 18 -3.990 -2.090 3.536 1.00 1.00 H new ATOM 0 HB3 PHE A 18 -5.484 -2.930 3.169 1.00 1.00 H new ATOM 0 HD1 PHE A 18 -5.325 -5.157 5.215 1.00 1.00 H new ATOM 0 HD2 PHE A 18 -4.533 -0.950 5.552 1.00 1.00 H new ATOM 0 HE1 PHE A 18 -5.867 -5.249 7.634 1.00 1.00 H new ATOM 0 HE2 PHE A 18 -5.075 -1.042 7.970 1.00 1.00 H new ATOM 0 HZ PHE A 18 -5.744 -3.189 9.010 1.00 1.00 H new ATOM 266 N ILE A 19 -4.229 -6.209 4.691 1.00 1.00 N ATOM 267 CA ILE A 19 -4.979 -7.456 5.021 1.00 1.00 C ATOM 268 C ILE A 19 -6.299 -7.108 5.712 1.00 1.00 C ATOM 269 O ILE A 19 -6.341 -6.312 6.628 1.00 1.00 O ATOM 270 CB ILE A 19 -4.063 -8.231 5.968 1.00 1.00 C ATOM 271 CG1 ILE A 19 -2.779 -8.620 5.232 1.00 1.00 C ATOM 272 CG2 ILE A 19 -4.777 -9.496 6.447 1.00 1.00 C ATOM 273 CD1 ILE A 19 -2.869 -8.169 3.773 1.00 1.00 C ATOM 0 H ILE A 19 -3.465 -5.979 5.327 1.00 1.00 H new ATOM 0 HA ILE A 19 -5.229 -8.037 4.133 1.00 1.00 H new ATOM 0 HB ILE A 19 -3.816 -7.605 6.826 1.00 1.00 H new ATOM 0 HG12 ILE A 19 -1.917 -8.158 5.714 1.00 1.00 H new ATOM 0 HG13 ILE A 19 -2.632 -9.699 5.282 1.00 1.00 H new ATOM 0 HG21 ILE A 19 -4.124 -10.049 7.122 1.00 1.00 H new ATOM 0 HG22 ILE A 19 -5.692 -9.221 6.971 1.00 1.00 H new ATOM 0 HG23 ILE A 19 -5.025 -10.121 5.589 1.00 1.00 H new ATOM 0 HD11 ILE A 19 -1.954 -8.446 3.249 1.00 1.00 H new ATOM 0 HD12 ILE A 19 -3.721 -8.652 3.295 1.00 1.00 H new ATOM 0 HD13 ILE A 19 -2.996 -7.087 3.734 1.00 1.00 H new ATOM 285 N HIS A 20 -7.376 -7.701 5.279 1.00 1.00 N ATOM 286 CA HIS A 20 -8.695 -7.407 5.911 1.00 1.00 C ATOM 287 C HIS A 20 -9.607 -8.632 5.810 1.00 1.00 C ATOM 288 O HIS A 20 -9.176 -9.754 5.989 1.00 1.00 O ATOM 289 CB HIS A 20 -9.269 -6.242 5.105 1.00 1.00 C ATOM 290 CG HIS A 20 -8.933 -4.946 5.789 1.00 1.00 C ATOM 291 ND1 HIS A 20 -8.445 -3.849 5.096 1.00 1.00 N ATOM 292 CD2 HIS A 20 -9.009 -4.555 7.104 1.00 1.00 C ATOM 293 CE1 HIS A 20 -8.247 -2.861 5.988 1.00 1.00 C ATOM 294 NE2 HIS A 20 -8.575 -3.239 7.227 1.00 1.00 N ATOM 0 H HIS A 20 -7.401 -8.377 4.515 1.00 1.00 H new ATOM 0 HA HIS A 20 -8.604 -7.162 6.969 1.00 1.00 H new ATOM 0 HB2 HIS A 20 -8.861 -6.249 4.094 1.00 1.00 H new ATOM 0 HB3 HIS A 20 -10.350 -6.347 5.013 1.00 1.00 H new ATOM 0 HD2 HIS A 20 -9.353 -5.175 7.918 1.00 1.00 H new ATOM 0 HE1 HIS A 20 -7.869 -1.882 5.733 1.00 1.00 H new ATOM 0 HE2 HIS A 20 -8.519 -2.682 8.080 1.00 1.00 H new ATOM 302 N SER A 21 -10.861 -8.429 5.515 1.00 1.00 N ATOM 303 CA SER A 21 -11.791 -9.587 5.395 1.00 1.00 C ATOM 304 C SER A 21 -11.341 -10.489 4.243 1.00 1.00 C ATOM 305 O SER A 21 -11.373 -11.699 4.339 1.00 1.00 O ATOM 306 CB SER A 21 -13.157 -8.971 5.093 1.00 1.00 C ATOM 307 OG SER A 21 -14.034 -9.222 6.184 1.00 1.00 O ATOM 0 H SER A 21 -11.281 -7.514 5.352 1.00 1.00 H new ATOM 0 HA SER A 21 -11.816 -10.199 6.296 1.00 1.00 H new ATOM 0 HB2 SER A 21 -13.057 -7.898 4.930 1.00 1.00 H new ATOM 0 HB3 SER A 21 -13.566 -9.396 4.176 1.00 1.00 H new ATOM 0 HG SER A 21 -14.505 -10.069 6.037 1.00 1.00 H new ATOM 313 N THR A 22 -10.906 -9.904 3.161 1.00 1.00 N ATOM 314 CA THR A 22 -10.434 -10.718 2.007 1.00 1.00 C ATOM 315 C THR A 22 -8.915 -10.866 2.082 1.00 1.00 C ATOM 316 O THR A 22 -8.275 -11.317 1.152 1.00 1.00 O ATOM 317 CB THR A 22 -10.840 -9.924 0.765 1.00 1.00 C ATOM 318 OG1 THR A 22 -11.337 -10.816 -0.223 1.00 1.00 O ATOM 319 CG2 THR A 22 -9.625 -9.175 0.214 1.00 1.00 C ATOM 0 H THR A 22 -10.857 -8.894 3.027 1.00 1.00 H new ATOM 0 HA THR A 22 -10.860 -11.721 1.995 1.00 1.00 H new ATOM 0 HB THR A 22 -11.616 -9.206 1.031 1.00 1.00 H new ATOM 0 HG1 THR A 22 -11.599 -10.309 -1.019 1.00 1.00 H new ATOM 0 HG21 THR A 22 -9.917 -8.610 -0.671 1.00 1.00 H new ATOM 0 HG22 THR A 22 -9.245 -8.491 0.972 1.00 1.00 H new ATOM 0 HG23 THR A 22 -8.847 -9.890 -0.052 1.00 1.00 H new ATOM 327 N GLY A 23 -8.335 -10.473 3.181 1.00 1.00 N ATOM 328 CA GLY A 23 -6.857 -10.569 3.323 1.00 1.00 C ATOM 329 C GLY A 23 -6.233 -9.243 2.888 1.00 1.00 C ATOM 330 O GLY A 23 -6.506 -8.203 3.452 1.00 1.00 O ATOM 0 H GLY A 23 -8.823 -10.088 3.990 1.00 1.00 H new ATOM 0 HA2 GLY A 23 -6.591 -10.790 4.357 1.00 1.00 H new ATOM 0 HA3 GLY A 23 -6.471 -11.386 2.713 1.00 1.00 H new ATOM 334 N SER A 24 -5.402 -9.269 1.884 1.00 1.00 N ATOM 335 CA SER A 24 -4.766 -8.008 1.409 1.00 1.00 C ATOM 336 C SER A 24 -5.724 -7.242 0.495 1.00 1.00 C ATOM 337 O SER A 24 -6.396 -7.817 -0.338 1.00 1.00 O ATOM 338 CB SER A 24 -3.527 -8.457 0.633 1.00 1.00 C ATOM 339 OG SER A 24 -3.525 -9.876 0.535 1.00 1.00 O ATOM 0 H SER A 24 -5.135 -10.109 1.371 1.00 1.00 H new ATOM 0 HA SER A 24 -4.512 -7.339 2.231 1.00 1.00 H new ATOM 0 HB2 SER A 24 -3.525 -8.012 -0.362 1.00 1.00 H new ATOM 0 HB3 SER A 24 -2.623 -8.114 1.137 1.00 1.00 H new ATOM 0 HG SER A 24 -3.773 -10.141 -0.375 1.00 1.00 H new ATOM 345 N ILE A 25 -5.787 -5.948 0.642 1.00 1.00 N ATOM 346 CA ILE A 25 -6.698 -5.143 -0.219 1.00 1.00 C ATOM 347 C ILE A 25 -5.882 -4.184 -1.087 1.00 1.00 C ATOM 348 O ILE A 25 -5.063 -3.433 -0.596 1.00 1.00 O ATOM 349 CB ILE A 25 -7.581 -4.365 0.756 1.00 1.00 C ATOM 350 CG1 ILE A 25 -8.500 -5.337 1.500 1.00 1.00 C ATOM 351 CG2 ILE A 25 -8.431 -3.355 -0.019 1.00 1.00 C ATOM 352 CD1 ILE A 25 -9.694 -4.573 2.074 1.00 1.00 C ATOM 0 H ILE A 25 -5.247 -5.413 1.322 1.00 1.00 H new ATOM 0 HA ILE A 25 -7.288 -5.763 -0.894 1.00 1.00 H new ATOM 0 HB ILE A 25 -6.952 -3.838 1.473 1.00 1.00 H new ATOM 0 HG12 ILE A 25 -8.846 -6.118 0.822 1.00 1.00 H new ATOM 0 HG13 ILE A 25 -7.951 -5.831 2.302 1.00 1.00 H new ATOM 0 HG21 ILE A 25 -9.061 -2.800 0.676 1.00 1.00 H new ATOM 0 HG22 ILE A 25 -7.779 -2.662 -0.550 1.00 1.00 H new ATOM 0 HG23 ILE A 25 -9.060 -3.883 -0.736 1.00 1.00 H new ATOM 0 HD11 ILE A 25 -10.348 -5.265 2.604 1.00 1.00 H new ATOM 0 HD12 ILE A 25 -9.339 -3.809 2.765 1.00 1.00 H new ATOM 0 HD13 ILE A 25 -10.247 -4.100 1.263 1.00 1.00 H new ATOM 364 N MET A 26 -6.097 -4.202 -2.372 1.00 1.00 N ATOM 365 CA MET A 26 -5.327 -3.286 -3.262 1.00 1.00 C ATOM 366 C MET A 26 -6.215 -2.130 -3.737 1.00 1.00 C ATOM 367 O MET A 26 -7.272 -2.334 -4.299 1.00 1.00 O ATOM 368 CB MET A 26 -4.900 -4.153 -4.447 1.00 1.00 C ATOM 369 CG MET A 26 -3.397 -3.994 -4.681 1.00 1.00 C ATOM 370 SD MET A 26 -3.025 -4.273 -6.430 1.00 1.00 S ATOM 371 CE MET A 26 -2.887 -6.075 -6.349 1.00 1.00 C ATOM 0 H MET A 26 -6.769 -4.807 -2.844 1.00 1.00 H new ATOM 0 HA MET A 26 -4.474 -2.839 -2.752 1.00 1.00 H new ATOM 0 HB2 MET A 26 -5.140 -5.198 -4.251 1.00 1.00 H new ATOM 0 HB3 MET A 26 -5.451 -3.862 -5.341 1.00 1.00 H new ATOM 0 HG2 MET A 26 -3.076 -2.995 -4.385 1.00 1.00 H new ATOM 0 HG3 MET A 26 -2.845 -4.703 -4.063 1.00 1.00 H new ATOM 0 HE1 MET A 26 -2.485 -6.452 -7.289 1.00 1.00 H new ATOM 0 HE2 MET A 26 -2.221 -6.353 -5.532 1.00 1.00 H new ATOM 0 HE3 MET A 26 -3.872 -6.508 -6.176 1.00 1.00 H new ATOM 381 N LYS A 27 -5.791 -0.918 -3.504 1.00 1.00 N ATOM 382 CA LYS A 27 -6.607 0.255 -3.932 1.00 1.00 C ATOM 383 C LYS A 27 -6.078 0.822 -5.252 1.00 1.00 C ATOM 384 O LYS A 27 -4.895 0.784 -5.524 1.00 1.00 O ATOM 385 CB LYS A 27 -6.445 1.278 -2.807 1.00 1.00 C ATOM 386 CG LYS A 27 -7.498 2.378 -2.959 1.00 1.00 C ATOM 387 CD LYS A 27 -8.030 2.770 -1.579 1.00 1.00 C ATOM 388 CE LYS A 27 -9.431 3.368 -1.724 1.00 1.00 C ATOM 389 NZ LYS A 27 -9.205 4.811 -2.016 1.00 1.00 N ATOM 0 H LYS A 27 -4.914 -0.689 -3.036 1.00 1.00 H new ATOM 0 HA LYS A 27 -7.651 -0.009 -4.100 1.00 1.00 H new ATOM 0 HB2 LYS A 27 -6.552 0.789 -1.839 1.00 1.00 H new ATOM 0 HB3 LYS A 27 -5.445 1.711 -2.836 1.00 1.00 H new ATOM 0 HG2 LYS A 27 -7.063 3.247 -3.453 1.00 1.00 H new ATOM 0 HG3 LYS A 27 -8.315 2.029 -3.590 1.00 1.00 H new ATOM 0 HD2 LYS A 27 -8.061 1.896 -0.928 1.00 1.00 H new ATOM 0 HD3 LYS A 27 -7.361 3.492 -1.111 1.00 1.00 H new ATOM 0 HE2 LYS A 27 -9.985 2.885 -2.528 1.00 1.00 H new ATOM 0 HE3 LYS A 27 -10.013 3.236 -0.812 1.00 1.00 H new ATOM 0 HZ1 LYS A 27 -9.802 5.101 -2.817 1.00 1.00 H new ATOM 0 HZ2 LYS A 27 -9.450 5.377 -1.179 1.00 1.00 H new ATOM 0 HZ3 LYS A 27 -8.205 4.964 -2.256 1.00 1.00 H new ATOM 402 N ARG A 28 -6.945 1.353 -6.071 1.00 1.00 N ATOM 403 CA ARG A 28 -6.488 1.926 -7.370 1.00 1.00 C ATOM 404 C ARG A 28 -6.023 3.372 -7.167 1.00 1.00 C ATOM 405 O ARG A 28 -6.702 4.175 -6.561 1.00 1.00 O ATOM 406 CB ARG A 28 -7.714 1.875 -8.281 1.00 1.00 C ATOM 407 CG ARG A 28 -7.366 1.117 -9.565 1.00 1.00 C ATOM 408 CD ARG A 28 -8.635 0.897 -10.390 1.00 1.00 C ATOM 409 NE ARG A 28 -8.797 2.145 -11.186 1.00 1.00 N ATOM 410 CZ ARG A 28 -8.184 2.272 -12.331 1.00 1.00 C ATOM 411 NH1 ARG A 28 -7.429 1.306 -12.779 1.00 1.00 N ATOM 412 NH2 ARG A 28 -8.327 3.366 -13.029 1.00 1.00 N ATOM 0 H ARG A 28 -7.948 1.415 -5.898 1.00 1.00 H new ATOM 0 HA ARG A 28 -5.648 1.377 -7.795 1.00 1.00 H new ATOM 0 HB2 ARG A 28 -8.541 1.383 -7.769 1.00 1.00 H new ATOM 0 HB3 ARG A 28 -8.044 2.886 -8.521 1.00 1.00 H new ATOM 0 HG2 ARG A 28 -6.636 1.681 -10.146 1.00 1.00 H new ATOM 0 HG3 ARG A 28 -6.908 0.159 -9.321 1.00 1.00 H new ATOM 0 HD2 ARG A 28 -8.539 0.025 -11.037 1.00 1.00 H new ATOM 0 HD3 ARG A 28 -9.498 0.723 -9.748 1.00 1.00 H new ATOM 0 HE ARG A 28 -9.387 2.900 -10.836 1.00 1.00 H new ATOM 0 HH11 ARG A 28 -7.318 0.451 -12.234 1.00 1.00 H new ATOM 0 HH12 ARG A 28 -6.950 1.406 -13.674 1.00 1.00 H new ATOM 0 HH21 ARG A 28 -8.917 4.121 -12.679 1.00 1.00 H new ATOM 0 HH22 ARG A 28 -7.848 3.466 -13.924 1.00 1.00 H new ATOM 425 N LYS A 29 -4.865 3.703 -7.668 1.00 1.00 N ATOM 426 CA LYS A 29 -4.349 5.093 -7.504 1.00 1.00 C ATOM 427 C LYS A 29 -5.192 6.085 -8.308 1.00 1.00 C ATOM 428 O LYS A 29 -5.474 7.180 -7.864 1.00 1.00 O ATOM 429 CB LYS A 29 -2.924 5.048 -8.043 1.00 1.00 C ATOM 430 CG LYS A 29 -2.211 6.362 -7.717 1.00 1.00 C ATOM 431 CD LYS A 29 -0.758 6.287 -8.192 1.00 1.00 C ATOM 432 CE LYS A 29 -0.187 7.702 -8.315 1.00 1.00 C ATOM 433 NZ LYS A 29 -1.365 8.569 -8.593 1.00 1.00 N ATOM 0 H LYS A 29 -4.253 3.071 -8.184 1.00 1.00 H new ATOM 0 HA LYS A 29 -4.389 5.422 -6.465 1.00 1.00 H new ATOM 0 HB2 LYS A 29 -2.384 4.210 -7.602 1.00 1.00 H new ATOM 0 HB3 LYS A 29 -2.937 4.887 -9.121 1.00 1.00 H new ATOM 0 HG2 LYS A 29 -2.721 7.194 -8.202 1.00 1.00 H new ATOM 0 HG3 LYS A 29 -2.245 6.550 -6.644 1.00 1.00 H new ATOM 0 HD2 LYS A 29 -0.164 5.704 -7.488 1.00 1.00 H new ATOM 0 HD3 LYS A 29 -0.705 5.777 -9.154 1.00 1.00 H new ATOM 0 HE2 LYS A 29 0.319 8.005 -7.398 1.00 1.00 H new ATOM 0 HE3 LYS A 29 0.547 7.763 -9.119 1.00 1.00 H new ATOM 0 HZ1 LYS A 29 -1.044 9.470 -9.002 1.00 1.00 H new ATOM 0 HZ2 LYS A 29 -1.998 8.090 -9.265 1.00 1.00 H new ATOM 0 HZ3 LYS A 29 -1.877 8.754 -7.707 1.00 1.00 H new ATOM 446 N LYS A 30 -5.589 5.712 -9.493 1.00 1.00 N ATOM 447 CA LYS A 30 -6.406 6.637 -10.330 1.00 1.00 C ATOM 448 C LYS A 30 -7.499 7.298 -9.487 1.00 1.00 C ATOM 449 O LYS A 30 -7.501 8.495 -9.284 1.00 1.00 O ATOM 450 CB LYS A 30 -7.024 5.748 -11.410 1.00 1.00 C ATOM 451 CG LYS A 30 -5.948 4.830 -11.995 1.00 1.00 C ATOM 452 CD LYS A 30 -4.706 5.655 -12.341 1.00 1.00 C ATOM 453 CE LYS A 30 -4.772 6.087 -13.808 1.00 1.00 C ATOM 454 NZ LYS A 30 -6.226 6.199 -14.109 1.00 1.00 N ATOM 0 H LYS A 30 -5.384 4.808 -9.918 1.00 1.00 H new ATOM 0 HA LYS A 30 -5.808 7.443 -10.755 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -7.833 5.153 -10.987 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -7.459 6.364 -12.197 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -5.691 4.050 -11.278 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -6.326 4.331 -12.887 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -4.647 6.531 -11.695 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -3.805 5.067 -12.164 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -4.262 7.038 -13.963 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -4.289 5.357 -14.457 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -6.354 6.541 -15.083 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -6.674 5.266 -14.008 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -6.667 6.869 -13.447 1.00 1.00 H new ATOM 467 N ASP A 31 -8.430 6.528 -8.997 1.00 1.00 N ATOM 468 CA ASP A 31 -9.526 7.117 -8.172 1.00 1.00 C ATOM 469 C ASP A 31 -9.480 6.564 -6.745 1.00 1.00 C ATOM 470 O ASP A 31 -10.438 6.657 -6.003 1.00 1.00 O ATOM 471 CB ASP A 31 -10.819 6.695 -8.868 1.00 1.00 C ATOM 472 CG ASP A 31 -11.949 7.644 -8.466 1.00 1.00 C ATOM 473 OD1 ASP A 31 -12.466 7.489 -7.371 1.00 1.00 O ATOM 474 OD2 ASP A 31 -12.278 8.511 -9.259 1.00 1.00 O ATOM 0 H ASP A 31 -8.481 5.518 -9.131 1.00 1.00 H new ATOM 0 HA ASP A 31 -9.440 8.201 -8.092 1.00 1.00 H new ATOM 0 HB2 ASP A 31 -10.684 6.711 -9.949 1.00 1.00 H new ATOM 0 HB3 ASP A 31 -11.075 5.672 -8.594 1.00 1.00 H new ATOM 479 N ASP A 32 -8.378 5.989 -6.352 1.00 1.00 N ATOM 480 CA ASP A 32 -8.282 5.433 -4.973 1.00 1.00 C ATOM 481 C ASP A 32 -9.548 4.639 -4.633 1.00 1.00 C ATOM 482 O ASP A 32 -10.243 4.938 -3.683 1.00 1.00 O ATOM 483 CB ASP A 32 -8.154 6.655 -4.062 1.00 1.00 C ATOM 484 CG ASP A 32 -7.702 7.862 -4.886 1.00 1.00 C ATOM 485 OD1 ASP A 32 -6.520 7.943 -5.181 1.00 1.00 O ATOM 486 OD2 ASP A 32 -8.544 8.683 -5.208 1.00 1.00 O ATOM 0 H ASP A 32 -7.541 5.880 -6.925 1.00 1.00 H new ATOM 0 HA ASP A 32 -7.440 4.750 -4.860 1.00 1.00 H new ATOM 0 HB2 ASP A 32 -9.110 6.866 -3.583 1.00 1.00 H new ATOM 0 HB3 ASP A 32 -7.436 6.455 -3.267 1.00 1.00 H new ATOM 491 N TRP A 33 -9.849 3.627 -5.401 1.00 1.00 N ATOM 492 CA TRP A 33 -11.066 2.812 -5.117 1.00 1.00 C ATOM 493 C TRP A 33 -10.717 1.665 -4.167 1.00 1.00 C ATOM 494 O TRP A 33 -9.572 1.282 -4.037 1.00 1.00 O ATOM 495 CB TRP A 33 -11.520 2.261 -6.471 1.00 1.00 C ATOM 496 CG TRP A 33 -10.874 3.027 -7.580 1.00 1.00 C ATOM 497 CD1 TRP A 33 -9.542 3.115 -7.794 1.00 1.00 C ATOM 498 CD2 TRP A 33 -11.510 3.806 -8.635 1.00 1.00 C ATOM 499 NE1 TRP A 33 -9.318 3.901 -8.909 1.00 1.00 N ATOM 500 CE2 TRP A 33 -10.500 4.350 -9.465 1.00 1.00 C ATOM 501 CE3 TRP A 33 -12.851 4.091 -8.949 1.00 1.00 C ATOM 502 CZ2 TRP A 33 -10.811 5.148 -10.566 1.00 1.00 C ATOM 503 CZ3 TRP A 33 -13.166 4.895 -10.057 1.00 1.00 C ATOM 504 CH2 TRP A 33 -12.148 5.422 -10.864 1.00 1.00 C ATOM 0 H TRP A 33 -9.306 3.329 -6.212 1.00 1.00 H new ATOM 0 HA TRP A 33 -11.849 3.403 -4.641 1.00 1.00 H new ATOM 0 HB2 TRP A 33 -11.260 1.205 -6.548 1.00 1.00 H new ATOM 0 HB3 TRP A 33 -12.605 2.329 -6.555 1.00 1.00 H new ATOM 0 HD1 TRP A 33 -8.777 2.647 -7.192 1.00 1.00 H new ATOM 0 HE1 TRP A 33 -8.393 4.122 -9.276 1.00 1.00 H new ATOM 0 HE3 TRP A 33 -13.643 3.689 -8.335 1.00 1.00 H new ATOM 0 HZ2 TRP A 33 -10.023 5.552 -11.184 1.00 1.00 H new ATOM 0 HZ3 TRP A 33 -14.199 5.109 -10.289 1.00 1.00 H new ATOM 0 HH2 TRP A 33 -12.397 6.039 -11.715 1.00 1.00 H new ATOM 515 N VAL A 34 -11.694 1.110 -3.504 1.00 1.00 N ATOM 516 CA VAL A 34 -11.412 -0.015 -2.569 1.00 1.00 C ATOM 517 C VAL A 34 -12.170 -1.268 -3.017 1.00 1.00 C ATOM 518 O VAL A 34 -13.253 -1.185 -3.562 1.00 1.00 O ATOM 519 CB VAL A 34 -11.920 0.464 -1.209 1.00 1.00 C ATOM 520 CG1 VAL A 34 -10.940 0.032 -0.117 1.00 1.00 C ATOM 521 CG2 VAL A 34 -12.034 1.990 -1.218 1.00 1.00 C ATOM 0 H VAL A 34 -12.674 1.386 -3.569 1.00 1.00 H new ATOM 0 HA VAL A 34 -10.354 -0.275 -2.537 1.00 1.00 H new ATOM 0 HB VAL A 34 -12.899 0.027 -1.011 1.00 1.00 H new ATOM 0 HG11 VAL A 34 -11.302 0.374 0.853 1.00 1.00 H new ATOM 0 HG12 VAL A 34 -10.858 -1.055 -0.111 1.00 1.00 H new ATOM 0 HG13 VAL A 34 -9.961 0.469 -0.313 1.00 1.00 H new ATOM 0 HG21 VAL A 34 -12.396 2.334 -0.249 1.00 1.00 H new ATOM 0 HG22 VAL A 34 -11.055 2.427 -1.415 1.00 1.00 H new ATOM 0 HG23 VAL A 34 -12.732 2.298 -1.996 1.00 1.00 H new ATOM 531 N ASN A 35 -11.612 -2.425 -2.794 1.00 1.00 N ATOM 532 CA ASN A 35 -12.308 -3.676 -3.210 1.00 1.00 C ATOM 533 C ASN A 35 -13.653 -3.794 -2.490 1.00 1.00 C ATOM 534 O ASN A 35 -13.722 -4.208 -1.350 1.00 1.00 O ATOM 535 CB ASN A 35 -11.371 -4.809 -2.790 1.00 1.00 C ATOM 536 CG ASN A 35 -12.108 -6.145 -2.897 1.00 1.00 C ATOM 537 OD1 ASN A 35 -11.606 -7.165 -2.467 1.00 1.00 O ATOM 538 ND2 ASN A 35 -13.286 -6.184 -3.458 1.00 1.00 N ATOM 0 H ASN A 35 -10.707 -2.559 -2.343 1.00 1.00 H new ATOM 0 HA ASN A 35 -12.518 -3.698 -4.279 1.00 1.00 H new ATOM 0 HB2 ASN A 35 -10.486 -4.818 -3.426 1.00 1.00 H new ATOM 0 HB3 ASN A 35 -11.028 -4.652 -1.768 1.00 1.00 H new ATOM 0 HD21 ASN A 35 -13.785 -7.070 -3.535 1.00 1.00 H new ATOM 0 HD22 ASN A 35 -13.708 -5.328 -3.819 1.00 1.00 H new ATOM 545 N ALA A 36 -14.722 -3.434 -3.146 1.00 1.00 N ATOM 546 CA ALA A 36 -16.060 -3.527 -2.496 1.00 1.00 C ATOM 547 C ALA A 36 -16.126 -4.760 -1.590 1.00 1.00 C ATOM 548 O ALA A 36 -16.856 -4.787 -0.620 1.00 1.00 O ATOM 549 CB ALA A 36 -17.054 -3.656 -3.651 1.00 1.00 C ATOM 0 H ALA A 36 -14.727 -3.080 -4.103 1.00 1.00 H new ATOM 0 HA ALA A 36 -16.274 -2.662 -1.869 1.00 1.00 H new ATOM 0 HB1 ALA A 36 -18.066 -3.730 -3.253 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -16.980 -2.779 -4.294 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -16.825 -4.551 -4.230 1.00 1.00 H new ATOM 555 N THR A 37 -15.365 -5.779 -1.893 1.00 1.00 N ATOM 556 CA THR A 37 -15.391 -6.996 -1.033 1.00 1.00 C ATOM 557 C THR A 37 -14.904 -6.641 0.371 1.00 1.00 C ATOM 558 O THR A 37 -15.562 -6.914 1.355 1.00 1.00 O ATOM 559 CB THR A 37 -14.438 -7.988 -1.700 1.00 1.00 C ATOM 560 OG1 THR A 37 -14.662 -7.989 -3.103 1.00 1.00 O ATOM 561 CG2 THR A 37 -14.688 -9.387 -1.138 1.00 1.00 C ATOM 0 H THR A 37 -14.732 -5.821 -2.692 1.00 1.00 H new ATOM 0 HA THR A 37 -16.393 -7.414 -0.934 1.00 1.00 H new ATOM 0 HB THR A 37 -13.407 -7.696 -1.500 1.00 1.00 H new ATOM 0 HG1 THR A 37 -14.107 -8.680 -3.522 1.00 1.00 H new ATOM 0 HG21 THR A 37 -14.010 -10.096 -1.612 1.00 1.00 H new ATOM 0 HG22 THR A 37 -14.515 -9.383 -0.062 1.00 1.00 H new ATOM 0 HG23 THR A 37 -15.718 -9.681 -1.339 1.00 1.00 H new ATOM 569 N HIS A 38 -13.762 -6.016 0.470 1.00 1.00 N ATOM 570 CA HIS A 38 -13.247 -5.627 1.812 1.00 1.00 C ATOM 571 C HIS A 38 -14.278 -4.731 2.498 1.00 1.00 C ATOM 572 O HIS A 38 -14.387 -4.696 3.708 1.00 1.00 O ATOM 573 CB HIS A 38 -11.955 -4.856 1.536 1.00 1.00 C ATOM 574 CG HIS A 38 -11.898 -3.640 2.422 1.00 1.00 C ATOM 575 ND1 HIS A 38 -11.300 -2.459 2.015 1.00 1.00 N ATOM 576 CD2 HIS A 38 -12.360 -3.410 3.694 1.00 1.00 C ATOM 577 CE1 HIS A 38 -11.415 -1.577 3.026 1.00 1.00 C ATOM 578 NE2 HIS A 38 -12.054 -2.106 4.074 1.00 1.00 N ATOM 0 H HIS A 38 -13.166 -5.759 -0.317 1.00 1.00 H new ATOM 0 HA HIS A 38 -13.066 -6.481 2.464 1.00 1.00 H new ATOM 0 HB2 HIS A 38 -11.091 -5.495 1.721 1.00 1.00 H new ATOM 0 HB3 HIS A 38 -11.913 -4.558 0.488 1.00 1.00 H new ATOM 0 HD1 HIS A 38 -10.854 -2.288 1.114 1.00 1.00 H new ATOM 0 HD2 HIS A 38 -12.881 -4.131 4.307 1.00 1.00 H new ATOM 0 HE1 HIS A 38 -11.037 -0.566 2.994 1.00 1.00 H new ATOM 586 N ILE A 39 -15.043 -4.015 1.721 1.00 1.00 N ATOM 587 CA ILE A 39 -16.086 -3.123 2.300 1.00 1.00 C ATOM 588 C ILE A 39 -17.398 -3.898 2.440 1.00 1.00 C ATOM 589 O ILE A 39 -18.040 -3.877 3.471 1.00 1.00 O ATOM 590 CB ILE A 39 -16.237 -1.992 1.283 1.00 1.00 C ATOM 591 CG1 ILE A 39 -15.261 -0.866 1.624 1.00 1.00 C ATOM 592 CG2 ILE A 39 -17.668 -1.457 1.319 1.00 1.00 C ATOM 593 CD1 ILE A 39 -14.154 -0.820 0.569 1.00 1.00 C ATOM 0 H ILE A 39 -14.990 -4.010 0.702 1.00 1.00 H new ATOM 0 HA ILE A 39 -15.823 -2.748 3.289 1.00 1.00 H new ATOM 0 HB ILE A 39 -16.019 -2.372 0.285 1.00 1.00 H new ATOM 0 HG12 ILE A 39 -15.786 0.088 1.658 1.00 1.00 H new ATOM 0 HG13 ILE A 39 -14.831 -1.029 2.612 1.00 1.00 H new ATOM 0 HG21 ILE A 39 -17.773 -0.651 0.593 1.00 1.00 H new ATOM 0 HG22 ILE A 39 -18.363 -2.260 1.073 1.00 1.00 H new ATOM 0 HG23 ILE A 39 -17.890 -1.078 2.317 1.00 1.00 H new ATOM 0 HD11 ILE A 39 -13.456 -0.018 0.809 1.00 1.00 H new ATOM 0 HD12 ILE A 39 -13.623 -1.772 0.557 1.00 1.00 H new ATOM 0 HD13 ILE A 39 -14.593 -0.637 -0.412 1.00 1.00 H new ATOM 605 N LEU A 40 -17.788 -4.592 1.407 1.00 1.00 N ATOM 606 CA LEU A 40 -19.049 -5.384 1.467 1.00 1.00 C ATOM 607 C LEU A 40 -18.748 -6.807 1.950 1.00 1.00 C ATOM 608 O LEU A 40 -19.397 -7.323 2.838 1.00 1.00 O ATOM 609 CB LEU A 40 -19.576 -5.404 0.031 1.00 1.00 C ATOM 610 CG LEU A 40 -21.095 -5.228 0.043 1.00 1.00 C ATOM 611 CD1 LEU A 40 -21.458 -3.869 -0.559 1.00 1.00 C ATOM 612 CD2 LEU A 40 -21.742 -6.340 -0.785 1.00 1.00 C ATOM 0 H LEU A 40 -17.286 -4.645 0.521 1.00 1.00 H new ATOM 0 HA LEU A 40 -19.776 -4.957 2.158 1.00 1.00 H new ATOM 0 HB2 LEU A 40 -19.111 -4.607 -0.549 1.00 1.00 H new ATOM 0 HB3 LEU A 40 -19.312 -6.345 -0.452 1.00 1.00 H new ATOM 0 HG LEU A 40 -21.458 -5.278 1.070 1.00 1.00 H new ATOM 0 HD11 LEU A 40 -22.541 -3.745 -0.550 1.00 1.00 H new ATOM 0 HD12 LEU A 40 -20.997 -3.076 0.029 1.00 1.00 H new ATOM 0 HD13 LEU A 40 -21.095 -3.817 -1.586 1.00 1.00 H new ATOM 0 HD21 LEU A 40 -22.825 -6.216 -0.778 1.00 1.00 H new ATOM 0 HD22 LEU A 40 -21.378 -6.288 -1.811 1.00 1.00 H new ATOM 0 HD23 LEU A 40 -21.485 -7.309 -0.357 1.00 1.00 H new ATOM 624 N LYS A 41 -17.761 -7.440 1.375 1.00 1.00 N ATOM 625 CA LYS A 41 -17.412 -8.825 1.803 1.00 1.00 C ATOM 626 C LYS A 41 -16.898 -8.812 3.244 1.00 1.00 C ATOM 627 O LYS A 41 -17.055 -9.766 3.980 1.00 1.00 O ATOM 628 CB LYS A 41 -16.310 -9.273 0.843 1.00 1.00 C ATOM 629 CG LYS A 41 -15.077 -9.696 1.643 1.00 1.00 C ATOM 630 CD LYS A 41 -15.259 -11.128 2.147 1.00 1.00 C ATOM 631 CE LYS A 41 -16.634 -11.649 1.721 1.00 1.00 C ATOM 632 NZ LYS A 41 -17.037 -12.596 2.796 1.00 1.00 N ATOM 0 H LYS A 41 -17.182 -7.058 0.628 1.00 1.00 H new ATOM 0 HA LYS A 41 -18.270 -9.497 1.775 1.00 1.00 H new ATOM 0 HB2 LYS A 41 -16.662 -10.103 0.231 1.00 1.00 H new ATOM 0 HB3 LYS A 41 -16.054 -8.461 0.162 1.00 1.00 H new ATOM 0 HG2 LYS A 41 -14.186 -9.630 1.019 1.00 1.00 H new ATOM 0 HG3 LYS A 41 -14.928 -9.020 2.485 1.00 1.00 H new ATOM 0 HD2 LYS A 41 -14.475 -11.769 1.744 1.00 1.00 H new ATOM 0 HD3 LYS A 41 -15.168 -11.157 3.233 1.00 1.00 H new ATOM 0 HE2 LYS A 41 -17.352 -10.834 1.623 1.00 1.00 H new ATOM 0 HE3 LYS A 41 -16.584 -12.148 0.753 1.00 1.00 H new ATOM 0 HZ1 LYS A 41 -17.529 -13.410 2.375 1.00 1.00 H new ATOM 0 HZ2 LYS A 41 -16.191 -12.927 3.302 1.00 1.00 H new ATOM 0 HZ3 LYS A 41 -17.673 -12.114 3.463 1.00 1.00 H new ATOM 645 N ALA A 42 -16.292 -7.732 3.653 1.00 1.00 N ATOM 646 CA ALA A 42 -15.778 -7.653 5.049 1.00 1.00 C ATOM 647 C ALA A 42 -16.924 -7.910 6.028 1.00 1.00 C ATOM 648 O ALA A 42 -16.716 -8.310 7.156 1.00 1.00 O ATOM 649 CB ALA A 42 -15.247 -6.227 5.199 1.00 1.00 C ATOM 0 H ALA A 42 -16.131 -6.902 3.082 1.00 1.00 H new ATOM 0 HA ALA A 42 -15.003 -8.391 5.255 1.00 1.00 H new ATOM 0 HB1 ALA A 42 -14.850 -6.091 6.205 1.00 1.00 H new ATOM 0 HB2 ALA A 42 -14.455 -6.055 4.470 1.00 1.00 H new ATOM 0 HB3 ALA A 42 -16.057 -5.517 5.029 1.00 1.00 H new ATOM 655 N ALA A 43 -18.135 -7.678 5.599 1.00 1.00 N ATOM 656 CA ALA A 43 -19.301 -7.906 6.497 1.00 1.00 C ATOM 657 C ALA A 43 -20.527 -8.326 5.680 1.00 1.00 C ATOM 658 O ALA A 43 -21.650 -8.040 6.041 1.00 1.00 O ATOM 659 CB ALA A 43 -19.546 -6.559 7.177 1.00 1.00 C ATOM 0 H ALA A 43 -18.366 -7.340 4.665 1.00 1.00 H new ATOM 0 HA ALA A 43 -19.115 -8.701 7.220 1.00 1.00 H new ATOM 0 HB1 ALA A 43 -20.393 -6.644 7.858 1.00 1.00 H new ATOM 0 HB2 ALA A 43 -18.658 -6.267 7.737 1.00 1.00 H new ATOM 0 HB3 ALA A 43 -19.762 -5.804 6.421 1.00 1.00 H new ATOM 665 N ASN A 44 -20.322 -9.003 4.582 1.00 1.00 N ATOM 666 CA ASN A 44 -21.482 -9.436 3.751 1.00 1.00 C ATOM 667 C ASN A 44 -21.178 -10.773 3.071 1.00 1.00 C ATOM 668 O ASN A 44 -21.939 -11.250 2.252 1.00 1.00 O ATOM 669 CB ASN A 44 -21.656 -8.332 2.708 1.00 1.00 C ATOM 670 CG ASN A 44 -21.034 -8.779 1.384 1.00 1.00 C ATOM 671 OD1 ASN A 44 -21.047 -9.949 1.058 1.00 1.00 O ATOM 672 ND2 ASN A 44 -20.486 -7.889 0.602 1.00 1.00 N ATOM 0 H ASN A 44 -19.405 -9.274 4.226 1.00 1.00 H new ATOM 0 HA ASN A 44 -22.384 -9.581 4.346 1.00 1.00 H new ATOM 0 HB2 ASN A 44 -22.714 -8.112 2.569 1.00 1.00 H new ATOM 0 HB3 ASN A 44 -21.182 -7.413 3.053 1.00 1.00 H new ATOM 0 HD21 ASN A 44 -20.068 -8.176 -0.283 1.00 1.00 H new ATOM 0 HD22 ASN A 44 -20.475 -6.907 0.876 1.00 1.00 H new ATOM 679 N PHE A 45 -20.071 -11.383 3.399 1.00 1.00 N ATOM 680 CA PHE A 45 -19.725 -12.688 2.766 1.00 1.00 C ATOM 681 C PHE A 45 -19.845 -12.579 1.243 1.00 1.00 C ATOM 682 O PHE A 45 -20.827 -12.088 0.723 1.00 1.00 O ATOM 683 CB PHE A 45 -20.749 -13.680 3.317 1.00 1.00 C ATOM 684 CG PHE A 45 -20.128 -14.474 4.442 1.00 1.00 C ATOM 685 CD1 PHE A 45 -18.759 -14.762 4.422 1.00 1.00 C ATOM 686 CD2 PHE A 45 -20.922 -14.920 5.505 1.00 1.00 C ATOM 687 CE1 PHE A 45 -18.183 -15.497 5.466 1.00 1.00 C ATOM 688 CE2 PHE A 45 -20.347 -15.655 6.548 1.00 1.00 C ATOM 689 CZ PHE A 45 -18.977 -15.943 6.528 1.00 1.00 C ATOM 0 H PHE A 45 -19.393 -11.035 4.077 1.00 1.00 H new ATOM 0 HA PHE A 45 -18.703 -12.998 2.984 1.00 1.00 H new ATOM 0 HB2 PHE A 45 -21.630 -13.148 3.677 1.00 1.00 H new ATOM 0 HB3 PHE A 45 -21.083 -14.351 2.526 1.00 1.00 H new ATOM 0 HD1 PHE A 45 -18.147 -14.418 3.602 1.00 1.00 H new ATOM 0 HD2 PHE A 45 -21.979 -14.697 5.520 1.00 1.00 H new ATOM 0 HE1 PHE A 45 -17.126 -15.719 5.451 1.00 1.00 H new ATOM 0 HE2 PHE A 45 -20.960 -16.000 7.368 1.00 1.00 H new ATOM 0 HZ PHE A 45 -18.533 -16.510 7.333 1.00 1.00 H new ATOM 699 N ALA A 46 -18.854 -13.030 0.524 1.00 1.00 N ATOM 700 CA ALA A 46 -18.918 -12.946 -0.963 1.00 1.00 C ATOM 701 C ALA A 46 -19.466 -14.247 -1.552 1.00 1.00 C ATOM 702 O ALA A 46 -18.737 -15.178 -1.828 1.00 1.00 O ATOM 703 CB ALA A 46 -17.473 -12.720 -1.411 1.00 1.00 C ATOM 0 H ALA A 46 -18.005 -13.452 0.900 1.00 1.00 H new ATOM 0 HA ALA A 46 -19.580 -12.148 -1.299 1.00 1.00 H new ATOM 0 HB1 ALA A 46 -17.436 -12.647 -2.498 1.00 1.00 H new ATOM 0 HB2 ALA A 46 -17.096 -11.796 -0.972 1.00 1.00 H new ATOM 0 HB3 ALA A 46 -16.855 -13.556 -1.082 1.00 1.00 H new ATOM 709 N LYS A 47 -20.751 -14.305 -1.753 1.00 1.00 N ATOM 710 CA LYS A 47 -21.375 -15.525 -2.334 1.00 1.00 C ATOM 711 C LYS A 47 -22.299 -15.112 -3.477 1.00 1.00 C ATOM 712 O LYS A 47 -22.265 -13.984 -3.927 1.00 1.00 O ATOM 713 CB LYS A 47 -22.173 -16.152 -1.190 1.00 1.00 C ATOM 714 CG LYS A 47 -21.844 -17.643 -1.093 1.00 1.00 C ATOM 715 CD LYS A 47 -22.453 -18.219 0.187 1.00 1.00 C ATOM 716 CE LYS A 47 -23.942 -17.873 0.245 1.00 1.00 C ATOM 717 NZ LYS A 47 -24.633 -19.052 -0.349 1.00 1.00 N ATOM 0 H LYS A 47 -21.403 -13.551 -1.537 1.00 1.00 H new ATOM 0 HA LYS A 47 -20.645 -16.227 -2.736 1.00 1.00 H new ATOM 0 HB2 LYS A 47 -21.933 -15.654 -0.250 1.00 1.00 H new ATOM 0 HB3 LYS A 47 -23.241 -16.015 -1.360 1.00 1.00 H new ATOM 0 HG2 LYS A 47 -22.235 -18.170 -1.963 1.00 1.00 H new ATOM 0 HG3 LYS A 47 -20.764 -17.788 -1.092 1.00 1.00 H new ATOM 0 HD2 LYS A 47 -22.319 -19.300 0.211 1.00 1.00 H new ATOM 0 HD3 LYS A 47 -21.941 -17.815 1.060 1.00 1.00 H new ATOM 0 HE2 LYS A 47 -24.268 -17.700 1.271 1.00 1.00 H new ATOM 0 HE3 LYS A 47 -24.159 -16.964 -0.316 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 -25.660 -18.891 -0.345 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 -24.308 -19.188 -1.327 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 -24.414 -19.901 0.210 1.00 1.00 H new ATOM 730 N ALA A 48 -23.134 -15.995 -3.949 1.00 1.00 N ATOM 731 CA ALA A 48 -24.047 -15.597 -5.055 1.00 1.00 C ATOM 732 C ALA A 48 -24.765 -14.318 -4.639 1.00 1.00 C ATOM 733 O ALA A 48 -25.195 -13.532 -5.460 1.00 1.00 O ATOM 734 CB ALA A 48 -25.033 -16.755 -5.204 1.00 1.00 C ATOM 0 H ALA A 48 -23.224 -16.958 -3.624 1.00 1.00 H new ATOM 0 HA ALA A 48 -23.532 -15.406 -5.996 1.00 1.00 H new ATOM 0 HB1 ALA A 48 -25.739 -16.531 -6.004 1.00 1.00 H new ATOM 0 HB2 ALA A 48 -24.488 -17.668 -5.446 1.00 1.00 H new ATOM 0 HB3 ALA A 48 -25.576 -16.893 -4.269 1.00 1.00 H new ATOM 740 N LYS A 49 -24.863 -14.091 -3.359 1.00 1.00 N ATOM 741 CA LYS A 49 -25.511 -12.847 -2.868 1.00 1.00 C ATOM 742 C LYS A 49 -24.627 -11.650 -3.227 1.00 1.00 C ATOM 743 O LYS A 49 -25.078 -10.683 -3.810 1.00 1.00 O ATOM 744 CB LYS A 49 -25.601 -13.015 -1.351 1.00 1.00 C ATOM 745 CG LYS A 49 -27.064 -13.202 -0.943 1.00 1.00 C ATOM 746 CD LYS A 49 -27.222 -14.529 -0.200 1.00 1.00 C ATOM 747 CE LYS A 49 -28.476 -15.249 -0.699 1.00 1.00 C ATOM 748 NZ LYS A 49 -29.275 -14.196 -1.386 1.00 1.00 N ATOM 0 H LYS A 49 -24.520 -14.717 -2.630 1.00 1.00 H new ATOM 0 HA LYS A 49 -26.494 -12.677 -3.308 1.00 1.00 H new ATOM 0 HB2 LYS A 49 -25.011 -13.875 -1.034 1.00 1.00 H new ATOM 0 HB3 LYS A 49 -25.182 -12.141 -0.852 1.00 1.00 H new ATOM 0 HG2 LYS A 49 -27.383 -12.377 -0.307 1.00 1.00 H new ATOM 0 HG3 LYS A 49 -27.703 -13.189 -1.826 1.00 1.00 H new ATOM 0 HD2 LYS A 49 -26.343 -15.154 -0.360 1.00 1.00 H new ATOM 0 HD3 LYS A 49 -27.295 -14.350 0.873 1.00 1.00 H new ATOM 0 HE2 LYS A 49 -28.221 -16.060 -1.382 1.00 1.00 H new ATOM 0 HE3 LYS A 49 -29.033 -15.691 0.127 1.00 1.00 H new ATOM 0 HZ1 LYS A 49 -30.266 -14.502 -1.455 1.00 1.00 H new ATOM 0 HZ2 LYS A 49 -29.223 -13.311 -0.842 1.00 1.00 H new ATOM 0 HZ3 LYS A 49 -28.894 -14.039 -2.341 1.00 1.00 H new ATOM 761 N ARG A 50 -23.364 -11.714 -2.887 1.00 1.00 N ATOM 762 CA ARG A 50 -22.447 -10.586 -3.211 1.00 1.00 C ATOM 763 C ARG A 50 -22.369 -10.398 -4.726 1.00 1.00 C ATOM 764 O ARG A 50 -22.126 -9.312 -5.215 1.00 1.00 O ATOM 765 CB ARG A 50 -21.088 -11.006 -2.650 1.00 1.00 C ATOM 766 CG ARG A 50 -21.158 -11.045 -1.123 1.00 1.00 C ATOM 767 CD ARG A 50 -22.427 -10.332 -0.651 1.00 1.00 C ATOM 768 NE ARG A 50 -22.719 -10.915 0.688 1.00 1.00 N ATOM 769 CZ ARG A 50 -23.380 -12.037 0.782 1.00 1.00 C ATOM 770 NH1 ARG A 50 -23.784 -12.649 -0.297 1.00 1.00 N ATOM 771 NH2 ARG A 50 -23.636 -12.547 1.956 1.00 1.00 N ATOM 0 H ARG A 50 -22.931 -12.499 -2.400 1.00 1.00 H new ATOM 0 HA ARG A 50 -22.784 -9.640 -2.788 1.00 1.00 H new ATOM 0 HB2 ARG A 50 -20.810 -11.986 -3.037 1.00 1.00 H new ATOM 0 HB3 ARG A 50 -20.317 -10.306 -2.972 1.00 1.00 H new ATOM 0 HG2 ARG A 50 -21.158 -12.078 -0.775 1.00 1.00 H new ATOM 0 HG3 ARG A 50 -20.278 -10.564 -0.696 1.00 1.00 H new ATOM 0 HD2 ARG A 50 -22.275 -9.255 -0.588 1.00 1.00 H new ATOM 0 HD3 ARG A 50 -23.253 -10.497 -1.342 1.00 1.00 H new ATOM 0 HE ARG A 50 -22.402 -10.438 1.532 1.00 1.00 H new ATOM 0 HH11 ARG A 50 -23.583 -12.251 -1.214 1.00 1.00 H new ATOM 0 HH12 ARG A 50 -24.300 -13.526 -0.223 1.00 1.00 H new ATOM 0 HH21 ARG A 50 -23.320 -12.069 2.800 1.00 1.00 H new ATOM 0 HH22 ARG A 50 -24.152 -13.424 2.030 1.00 1.00 H new ATOM 784 N THR A 51 -22.587 -11.443 -5.477 1.00 1.00 N ATOM 785 CA THR A 51 -22.536 -11.311 -6.959 1.00 1.00 C ATOM 786 C THR A 51 -23.695 -10.433 -7.431 1.00 1.00 C ATOM 787 O THR A 51 -23.577 -9.684 -8.380 1.00 1.00 O ATOM 788 CB THR A 51 -22.684 -12.736 -7.493 1.00 1.00 C ATOM 789 OG1 THR A 51 -21.554 -13.061 -8.291 1.00 1.00 O ATOM 790 CG2 THR A 51 -23.953 -12.837 -8.340 1.00 1.00 C ATOM 0 H THR A 51 -22.797 -12.379 -5.129 1.00 1.00 H new ATOM 0 HA THR A 51 -21.613 -10.848 -7.309 1.00 1.00 H new ATOM 0 HB THR A 51 -22.752 -13.432 -6.657 1.00 1.00 H new ATOM 0 HG1 THR A 51 -21.647 -13.975 -8.633 1.00 1.00 H new ATOM 0 HG21 THR A 51 -24.057 -13.853 -8.720 1.00 1.00 H new ATOM 0 HG22 THR A 51 -24.820 -12.588 -7.728 1.00 1.00 H new ATOM 0 HG23 THR A 51 -23.888 -12.142 -9.177 1.00 1.00 H new ATOM 798 N ARG A 52 -24.812 -10.516 -6.762 1.00 1.00 N ATOM 799 CA ARG A 52 -25.980 -9.681 -7.157 1.00 1.00 C ATOM 800 C ARG A 52 -25.975 -8.376 -6.356 1.00 1.00 C ATOM 801 O ARG A 52 -25.747 -7.309 -6.890 1.00 1.00 O ATOM 802 CB ARG A 52 -27.207 -10.524 -6.808 1.00 1.00 C ATOM 803 CG ARG A 52 -27.301 -11.709 -7.770 1.00 1.00 C ATOM 804 CD ARG A 52 -27.653 -12.978 -6.988 1.00 1.00 C ATOM 805 NE ARG A 52 -28.217 -12.490 -5.699 1.00 1.00 N ATOM 806 CZ ARG A 52 -29.145 -11.572 -5.699 1.00 1.00 C ATOM 807 NH1 ARG A 52 -29.576 -11.080 -6.828 1.00 1.00 N ATOM 808 NH2 ARG A 52 -29.642 -11.147 -4.570 1.00 1.00 N ATOM 0 H ARG A 52 -24.966 -11.126 -5.959 1.00 1.00 H new ATOM 0 HA ARG A 52 -25.965 -9.411 -8.213 1.00 1.00 H new ATOM 0 HB2 ARG A 52 -27.136 -10.881 -5.780 1.00 1.00 H new ATOM 0 HB3 ARG A 52 -28.110 -9.916 -6.873 1.00 1.00 H new ATOM 0 HG2 ARG A 52 -28.059 -11.515 -8.529 1.00 1.00 H new ATOM 0 HG3 ARG A 52 -26.354 -11.842 -8.292 1.00 1.00 H new ATOM 0 HD2 ARG A 52 -28.376 -13.588 -7.530 1.00 1.00 H new ATOM 0 HD3 ARG A 52 -26.772 -13.598 -6.824 1.00 1.00 H new ATOM 0 HE ARG A 52 -27.878 -12.873 -4.816 1.00 1.00 H new ATOM 0 HH11 ARG A 52 -29.188 -11.413 -7.711 1.00 1.00 H new ATOM 0 HH12 ARG A 52 -30.301 -10.363 -6.828 1.00 1.00 H new ATOM 0 HH21 ARG A 52 -29.305 -11.532 -3.687 1.00 1.00 H new ATOM 0 HH22 ARG A 52 -30.367 -10.430 -4.570 1.00 1.00 H new ATOM 821 N ILE A 53 -26.221 -8.456 -5.076 1.00 1.00 N ATOM 822 CA ILE A 53 -26.226 -7.222 -4.240 1.00 1.00 C ATOM 823 C ILE A 53 -24.978 -6.383 -4.531 1.00 1.00 C ATOM 824 O ILE A 53 -25.046 -5.177 -4.660 1.00 1.00 O ATOM 825 CB ILE A 53 -26.210 -7.722 -2.796 1.00 1.00 C ATOM 826 CG1 ILE A 53 -27.636 -7.725 -2.242 1.00 1.00 C ATOM 827 CG2 ILE A 53 -25.336 -6.799 -1.945 1.00 1.00 C ATOM 828 CD1 ILE A 53 -27.813 -8.909 -1.291 1.00 1.00 C ATOM 0 H ILE A 53 -26.418 -9.322 -4.574 1.00 1.00 H new ATOM 0 HA ILE A 53 -27.090 -6.589 -4.442 1.00 1.00 H new ATOM 0 HB ILE A 53 -25.806 -8.734 -2.767 1.00 1.00 H new ATOM 0 HG12 ILE A 53 -27.835 -6.791 -1.717 1.00 1.00 H new ATOM 0 HG13 ILE A 53 -28.354 -7.791 -3.059 1.00 1.00 H new ATOM 0 HG21 ILE A 53 -25.325 -7.156 -0.915 1.00 1.00 H new ATOM 0 HG22 ILE A 53 -24.320 -6.795 -2.339 1.00 1.00 H new ATOM 0 HG23 ILE A 53 -25.740 -5.787 -1.974 1.00 1.00 H new ATOM 0 HD11 ILE A 53 -28.829 -8.910 -0.897 1.00 1.00 H new ATOM 0 HD12 ILE A 53 -27.632 -9.839 -1.830 1.00 1.00 H new ATOM 0 HD13 ILE A 53 -27.104 -8.823 -0.467 1.00 1.00 H new ATOM 840 N LEU A 54 -23.841 -7.014 -4.655 1.00 1.00 N ATOM 841 CA LEU A 54 -22.599 -6.247 -4.960 1.00 1.00 C ATOM 842 C LEU A 54 -22.691 -5.676 -6.378 1.00 1.00 C ATOM 843 O LEU A 54 -22.605 -4.482 -6.589 1.00 1.00 O ATOM 844 CB LEU A 54 -21.464 -7.267 -4.857 1.00 1.00 C ATOM 845 CG LEU A 54 -20.286 -6.647 -4.106 1.00 1.00 C ATOM 846 CD1 LEU A 54 -19.093 -7.603 -4.145 1.00 1.00 C ATOM 847 CD2 LEU A 54 -19.900 -5.325 -4.771 1.00 1.00 C ATOM 0 H LEU A 54 -23.719 -8.022 -4.559 1.00 1.00 H new ATOM 0 HA LEU A 54 -22.443 -5.408 -4.281 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -21.810 -8.160 -4.337 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -21.150 -7.579 -5.853 1.00 1.00 H new ATOM 0 HG LEU A 54 -20.571 -6.466 -3.070 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -18.254 -7.160 -3.609 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -19.367 -8.546 -3.673 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -18.807 -7.785 -5.181 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -19.060 -4.881 -4.237 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -19.615 -5.508 -5.807 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -20.749 -4.642 -4.743 1.00 1.00 H new ATOM 859 N GLU A 55 -22.863 -6.530 -7.348 1.00 1.00 N ATOM 860 CA GLU A 55 -22.956 -6.052 -8.757 1.00 1.00 C ATOM 861 C GLU A 55 -24.004 -4.943 -8.864 1.00 1.00 C ATOM 862 O GLU A 55 -23.817 -3.967 -9.563 1.00 1.00 O ATOM 863 CB GLU A 55 -23.389 -7.274 -9.566 1.00 1.00 C ATOM 864 CG GLU A 55 -24.662 -6.946 -10.347 1.00 1.00 C ATOM 865 CD GLU A 55 -24.436 -7.224 -11.835 1.00 1.00 C ATOM 866 OE1 GLU A 55 -23.287 -7.253 -12.243 1.00 1.00 O ATOM 867 OE2 GLU A 55 -25.415 -7.405 -12.539 1.00 1.00 O ATOM 0 H GLU A 55 -22.943 -7.540 -7.226 1.00 1.00 H new ATOM 0 HA GLU A 55 -22.013 -5.641 -9.117 1.00 1.00 H new ATOM 0 HB2 GLU A 55 -22.595 -7.569 -10.252 1.00 1.00 H new ATOM 0 HB3 GLU A 55 -23.566 -8.119 -8.901 1.00 1.00 H new ATOM 0 HG2 GLU A 55 -25.493 -7.546 -9.976 1.00 1.00 H new ATOM 0 HG3 GLU A 55 -24.933 -5.901 -10.199 1.00 1.00 H new ATOM 874 N LYS A 56 -25.097 -5.070 -8.163 1.00 1.00 N ATOM 875 CA LYS A 56 -26.138 -4.005 -8.219 1.00 1.00 C ATOM 876 C LYS A 56 -25.666 -2.799 -7.408 1.00 1.00 C ATOM 877 O LYS A 56 -26.044 -1.674 -7.667 1.00 1.00 O ATOM 878 CB LYS A 56 -27.385 -4.628 -7.592 1.00 1.00 C ATOM 879 CG LYS A 56 -28.513 -3.594 -7.564 1.00 1.00 C ATOM 880 CD LYS A 56 -28.619 -2.990 -6.161 1.00 1.00 C ATOM 881 CE LYS A 56 -29.694 -1.901 -6.153 1.00 1.00 C ATOM 882 NZ LYS A 56 -28.943 -0.623 -6.008 1.00 1.00 N ATOM 0 H LYS A 56 -25.314 -5.861 -7.557 1.00 1.00 H new ATOM 0 HA LYS A 56 -26.337 -3.660 -9.234 1.00 1.00 H new ATOM 0 HB2 LYS A 56 -27.694 -5.503 -8.163 1.00 1.00 H new ATOM 0 HB3 LYS A 56 -27.165 -4.969 -6.580 1.00 1.00 H new ATOM 0 HG2 LYS A 56 -28.319 -2.809 -8.295 1.00 1.00 H new ATOM 0 HG3 LYS A 56 -29.457 -4.063 -7.842 1.00 1.00 H new ATOM 0 HD2 LYS A 56 -28.868 -3.766 -5.437 1.00 1.00 H new ATOM 0 HD3 LYS A 56 -27.659 -2.570 -5.861 1.00 1.00 H new ATOM 0 HE2 LYS A 56 -30.277 -1.914 -7.074 1.00 1.00 H new ATOM 0 HE3 LYS A 56 -30.395 -2.043 -5.330 1.00 1.00 H new ATOM 0 HZ1 LYS A 56 -29.612 0.173 -5.994 1.00 1.00 H new ATOM 0 HZ2 LYS A 56 -28.403 -0.637 -5.119 1.00 1.00 H new ATOM 0 HZ3 LYS A 56 -28.289 -0.512 -6.809 1.00 1.00 H new ATOM 895 N GLU A 57 -24.823 -3.029 -6.440 1.00 1.00 N ATOM 896 CA GLU A 57 -24.302 -1.900 -5.622 1.00 1.00 C ATOM 897 C GLU A 57 -23.114 -1.270 -6.348 1.00 1.00 C ATOM 898 O GLU A 57 -23.017 -0.066 -6.480 1.00 1.00 O ATOM 899 CB GLU A 57 -23.858 -2.533 -4.303 1.00 1.00 C ATOM 900 CG GLU A 57 -23.386 -1.439 -3.344 1.00 1.00 C ATOM 901 CD GLU A 57 -24.582 -0.587 -2.914 1.00 1.00 C ATOM 902 OE1 GLU A 57 -25.653 -1.146 -2.745 1.00 1.00 O ATOM 903 OE2 GLU A 57 -24.406 0.610 -2.760 1.00 1.00 O ATOM 0 H GLU A 57 -24.472 -3.951 -6.180 1.00 1.00 H new ATOM 0 HA GLU A 57 -25.041 -1.117 -5.455 1.00 1.00 H new ATOM 0 HB2 GLU A 57 -24.683 -3.089 -3.859 1.00 1.00 H new ATOM 0 HB3 GLU A 57 -23.053 -3.246 -4.482 1.00 1.00 H new ATOM 0 HG2 GLU A 57 -22.912 -1.886 -2.470 1.00 1.00 H new ATOM 0 HG3 GLU A 57 -22.636 -0.814 -3.829 1.00 1.00 H new ATOM 910 N VAL A 58 -22.211 -2.082 -6.828 1.00 1.00 N ATOM 911 CA VAL A 58 -21.030 -1.542 -7.557 1.00 1.00 C ATOM 912 C VAL A 58 -21.336 -1.445 -9.054 1.00 1.00 C ATOM 913 O VAL A 58 -21.056 -0.447 -9.688 1.00 1.00 O ATOM 914 CB VAL A 58 -19.911 -2.550 -7.303 1.00 1.00 C ATOM 915 CG1 VAL A 58 -18.684 -1.824 -6.749 1.00 1.00 C ATOM 916 CG2 VAL A 58 -20.386 -3.593 -6.289 1.00 1.00 C ATOM 0 H VAL A 58 -22.241 -3.098 -6.746 1.00 1.00 H new ATOM 0 HA VAL A 58 -20.758 -0.541 -7.221 1.00 1.00 H new ATOM 0 HB VAL A 58 -19.649 -3.044 -8.239 1.00 1.00 H new ATOM 0 HG11 VAL A 58 -17.886 -2.544 -6.568 1.00 1.00 H new ATOM 0 HG12 VAL A 58 -18.345 -1.080 -7.470 1.00 1.00 H new ATOM 0 HG13 VAL A 58 -18.945 -1.329 -5.813 1.00 1.00 H new ATOM 0 HG21 VAL A 58 -19.588 -4.313 -6.107 1.00 1.00 H new ATOM 0 HG22 VAL A 58 -20.649 -3.098 -5.354 1.00 1.00 H new ATOM 0 HG23 VAL A 58 -21.260 -4.112 -6.683 1.00 1.00 H new ATOM 926 N LEU A 59 -21.909 -2.471 -9.629 1.00 1.00 N ATOM 927 CA LEU A 59 -22.222 -2.416 -11.087 1.00 1.00 C ATOM 928 C LEU A 59 -22.688 -1.009 -11.454 1.00 1.00 C ATOM 929 O LEU A 59 -22.227 -0.420 -12.411 1.00 1.00 O ATOM 930 CB LEU A 59 -23.349 -3.423 -11.303 1.00 1.00 C ATOM 931 CG LEU A 59 -23.687 -3.481 -12.792 1.00 1.00 C ATOM 932 CD1 LEU A 59 -24.375 -2.180 -13.208 1.00 1.00 C ATOM 933 CD2 LEU A 59 -22.396 -3.653 -13.597 1.00 1.00 C ATOM 0 H LEU A 59 -22.171 -3.336 -9.157 1.00 1.00 H new ATOM 0 HA LEU A 59 -21.356 -2.650 -11.706 1.00 1.00 H new ATOM 0 HB2 LEU A 59 -23.047 -4.408 -10.947 1.00 1.00 H new ATOM 0 HB3 LEU A 59 -24.229 -3.132 -10.728 1.00 1.00 H new ATOM 0 HG LEU A 59 -24.353 -4.322 -12.984 1.00 1.00 H new ATOM 0 HD11 LEU A 59 -24.617 -2.220 -14.270 1.00 1.00 H new ATOM 0 HD12 LEU A 59 -25.291 -2.053 -12.632 1.00 1.00 H new ATOM 0 HD13 LEU A 59 -23.708 -1.339 -13.019 1.00 1.00 H new ATOM 0 HD21 LEU A 59 -22.633 -3.695 -14.660 1.00 1.00 H new ATOM 0 HD22 LEU A 59 -21.733 -2.809 -13.406 1.00 1.00 H new ATOM 0 HD23 LEU A 59 -21.902 -4.578 -13.299 1.00 1.00 H new ATOM 945 N LYS A 60 -23.580 -0.452 -10.681 1.00 1.00 N ATOM 946 CA LYS A 60 -24.048 0.930 -10.971 1.00 1.00 C ATOM 947 C LYS A 60 -22.918 1.898 -10.631 1.00 1.00 C ATOM 948 O LYS A 60 -22.968 3.075 -10.927 1.00 1.00 O ATOM 949 CB LYS A 60 -25.251 1.152 -10.054 1.00 1.00 C ATOM 950 CG LYS A 60 -26.521 1.278 -10.898 1.00 1.00 C ATOM 951 CD LYS A 60 -27.022 2.723 -10.856 1.00 1.00 C ATOM 952 CE LYS A 60 -26.975 3.322 -12.263 1.00 1.00 C ATOM 953 NZ LYS A 60 -28.168 4.209 -12.344 1.00 1.00 N ATOM 0 H LYS A 60 -24.003 -0.893 -9.864 1.00 1.00 H new ATOM 0 HA LYS A 60 -24.323 1.083 -12.015 1.00 1.00 H new ATOM 0 HB2 LYS A 60 -25.347 0.321 -9.355 1.00 1.00 H new ATOM 0 HB3 LYS A 60 -25.106 2.054 -9.459 1.00 1.00 H new ATOM 0 HG2 LYS A 60 -26.317 0.983 -11.927 1.00 1.00 H new ATOM 0 HG3 LYS A 60 -27.290 0.604 -10.520 1.00 1.00 H new ATOM 0 HD2 LYS A 60 -28.041 2.754 -10.470 1.00 1.00 H new ATOM 0 HD3 LYS A 60 -26.406 3.313 -10.178 1.00 1.00 H new ATOM 0 HE2 LYS A 60 -26.054 3.883 -12.422 1.00 1.00 H new ATOM 0 HE3 LYS A 60 -27.010 2.543 -13.025 1.00 1.00 H new ATOM 0 HZ1 LYS A 60 -28.205 4.657 -13.282 1.00 1.00 H new ATOM 0 HZ2 LYS A 60 -29.030 3.646 -12.195 1.00 1.00 H new ATOM 0 HZ3 LYS A 60 -28.104 4.945 -11.612 1.00 1.00 H new ATOM 966 N GLU A 61 -21.892 1.384 -10.014 1.00 1.00 N ATOM 967 CA GLU A 61 -20.725 2.234 -9.645 1.00 1.00 C ATOM 968 C GLU A 61 -19.507 1.831 -10.481 1.00 1.00 C ATOM 969 O GLU A 61 -19.626 1.135 -11.471 1.00 1.00 O ATOM 970 CB GLU A 61 -20.478 1.949 -8.162 1.00 1.00 C ATOM 971 CG GLU A 61 -21.671 2.445 -7.342 1.00 1.00 C ATOM 972 CD GLU A 61 -22.283 3.673 -8.018 1.00 1.00 C ATOM 973 OE1 GLU A 61 -23.048 3.492 -8.950 1.00 1.00 O ATOM 974 OE2 GLU A 61 -21.975 4.774 -7.591 1.00 1.00 O ATOM 0 H GLU A 61 -21.811 0.403 -9.747 1.00 1.00 H new ATOM 0 HA GLU A 61 -20.905 3.293 -9.827 1.00 1.00 H new ATOM 0 HB2 GLU A 61 -20.334 0.880 -8.005 1.00 1.00 H new ATOM 0 HB3 GLU A 61 -19.565 2.445 -7.832 1.00 1.00 H new ATOM 0 HG2 GLU A 61 -22.418 1.656 -7.254 1.00 1.00 H new ATOM 0 HG3 GLU A 61 -21.351 2.696 -6.331 1.00 1.00 H new ATOM 981 N THR A 62 -18.339 2.260 -10.095 1.00 1.00 N ATOM 982 CA THR A 62 -17.118 1.900 -10.872 1.00 1.00 C ATOM 983 C THR A 62 -16.523 0.588 -10.349 1.00 1.00 C ATOM 984 O THR A 62 -15.342 0.496 -10.080 1.00 1.00 O ATOM 985 CB THR A 62 -16.147 3.058 -10.641 1.00 1.00 C ATOM 986 OG1 THR A 62 -15.477 3.361 -11.858 1.00 1.00 O ATOM 987 CG2 THR A 62 -15.121 2.664 -9.577 1.00 1.00 C ATOM 0 H THR A 62 -18.175 2.844 -9.275 1.00 1.00 H new ATOM 0 HA THR A 62 -17.332 1.751 -11.930 1.00 1.00 H new ATOM 0 HB THR A 62 -16.700 3.933 -10.301 1.00 1.00 H new ATOM 0 HG1 THR A 62 -14.637 3.826 -11.662 1.00 1.00 H new ATOM 0 HG21 THR A 62 -14.430 3.491 -9.414 1.00 1.00 H new ATOM 0 HG22 THR A 62 -15.635 2.432 -8.644 1.00 1.00 H new ATOM 0 HG23 THR A 62 -14.566 1.788 -9.913 1.00 1.00 H new ATOM 995 N HIS A 63 -17.332 -0.427 -10.208 1.00 1.00 N ATOM 996 CA HIS A 63 -16.810 -1.731 -9.705 1.00 1.00 C ATOM 997 C HIS A 63 -15.785 -2.302 -10.690 1.00 1.00 C ATOM 998 O HIS A 63 -16.096 -2.586 -11.830 1.00 1.00 O ATOM 999 CB HIS A 63 -18.035 -2.640 -9.618 1.00 1.00 C ATOM 1000 CG HIS A 63 -18.448 -3.063 -11.001 1.00 1.00 C ATOM 1001 ND1 HIS A 63 -18.081 -2.349 -12.131 1.00 1.00 N ATOM 1002 CD2 HIS A 63 -19.197 -4.120 -11.451 1.00 1.00 C ATOM 1003 CE1 HIS A 63 -18.606 -2.982 -13.198 1.00 1.00 C ATOM 1004 NE2 HIS A 63 -19.295 -4.068 -12.839 1.00 1.00 N ATOM 0 H HIS A 63 -18.330 -0.410 -10.419 1.00 1.00 H new ATOM 0 HA HIS A 63 -16.307 -1.633 -8.743 1.00 1.00 H new ATOM 0 HB2 HIS A 63 -17.808 -3.517 -9.011 1.00 1.00 H new ATOM 0 HB3 HIS A 63 -18.855 -2.116 -9.127 1.00 1.00 H new ATOM 0 HD1 HIS A 63 -17.517 -1.500 -12.151 1.00 1.00 H new ATOM 0 HD2 HIS A 63 -19.643 -4.878 -10.824 1.00 1.00 H new ATOM 0 HE1 HIS A 63 -18.484 -2.651 -14.219 1.00 1.00 H new ATOM 1012 N GLU A 64 -14.563 -2.470 -10.262 1.00 1.00 N ATOM 1013 CA GLU A 64 -13.521 -3.018 -11.177 1.00 1.00 C ATOM 1014 C GLU A 64 -13.045 -4.388 -10.690 1.00 1.00 C ATOM 1015 O GLU A 64 -12.647 -4.550 -9.553 1.00 1.00 O ATOM 1016 CB GLU A 64 -12.376 -2.007 -11.121 1.00 1.00 C ATOM 1017 CG GLU A 64 -12.555 -0.969 -12.229 1.00 1.00 C ATOM 1018 CD GLU A 64 -11.707 -1.361 -13.439 1.00 1.00 C ATOM 1019 OE1 GLU A 64 -11.554 -2.550 -13.671 1.00 1.00 O ATOM 1020 OE2 GLU A 64 -11.224 -0.467 -14.116 1.00 1.00 O ATOM 0 H GLU A 64 -14.241 -2.252 -9.319 1.00 1.00 H new ATOM 0 HA GLU A 64 -13.899 -3.158 -12.190 1.00 1.00 H new ATOM 0 HB2 GLU A 64 -12.358 -1.516 -10.148 1.00 1.00 H new ATOM 0 HB3 GLU A 64 -11.420 -2.518 -11.238 1.00 1.00 H new ATOM 0 HG2 GLU A 64 -13.605 -0.903 -12.514 1.00 1.00 H new ATOM 0 HG3 GLU A 64 -12.260 0.017 -11.869 1.00 1.00 H new ATOM 1027 N LYS A 65 -13.075 -5.375 -11.545 1.00 1.00 N ATOM 1028 CA LYS A 65 -12.616 -6.733 -11.133 1.00 1.00 C ATOM 1029 C LYS A 65 -11.158 -6.939 -11.552 1.00 1.00 C ATOM 1030 O LYS A 65 -10.787 -6.697 -12.683 1.00 1.00 O ATOM 1031 CB LYS A 65 -13.532 -7.704 -11.881 1.00 1.00 C ATOM 1032 CG LYS A 65 -13.576 -7.328 -13.363 1.00 1.00 C ATOM 1033 CD LYS A 65 -15.010 -7.448 -13.879 1.00 1.00 C ATOM 1034 CE LYS A 65 -15.537 -6.059 -14.251 1.00 1.00 C ATOM 1035 NZ LYS A 65 -15.453 -6.001 -15.736 1.00 1.00 N ATOM 0 H LYS A 65 -13.397 -5.300 -12.510 1.00 1.00 H new ATOM 0 HA LYS A 65 -12.664 -6.880 -10.054 1.00 1.00 H new ATOM 0 HB2 LYS A 65 -13.169 -8.725 -11.765 1.00 1.00 H new ATOM 0 HB3 LYS A 65 -14.536 -7.673 -11.457 1.00 1.00 H new ATOM 0 HG2 LYS A 65 -13.213 -6.310 -13.501 1.00 1.00 H new ATOM 0 HG3 LYS A 65 -12.917 -7.982 -13.934 1.00 1.00 H new ATOM 0 HD2 LYS A 65 -15.041 -8.105 -14.748 1.00 1.00 H new ATOM 0 HD3 LYS A 65 -15.646 -7.898 -13.116 1.00 1.00 H new ATOM 0 HE2 LYS A 65 -16.562 -5.921 -13.908 1.00 1.00 H new ATOM 0 HE3 LYS A 65 -14.938 -5.273 -13.791 1.00 1.00 H new ATOM 0 HZ1 LYS A 65 -15.797 -5.077 -16.067 1.00 1.00 H new ATOM 0 HZ2 LYS A 65 -14.465 -6.129 -16.033 1.00 1.00 H new ATOM 0 HZ3 LYS A 65 -16.038 -6.756 -16.147 1.00 1.00 H new ATOM 1048 N VAL A 66 -10.325 -7.378 -10.648 1.00 1.00 N ATOM 1049 CA VAL A 66 -8.891 -7.589 -10.996 1.00 1.00 C ATOM 1050 C VAL A 66 -8.670 -9.011 -11.522 1.00 1.00 C ATOM 1051 O VAL A 66 -9.098 -9.978 -10.924 1.00 1.00 O ATOM 1052 CB VAL A 66 -8.136 -7.390 -9.685 1.00 1.00 C ATOM 1053 CG1 VAL A 66 -8.830 -6.309 -8.853 1.00 1.00 C ATOM 1054 CG2 VAL A 66 -8.125 -8.706 -8.904 1.00 1.00 C ATOM 0 H VAL A 66 -10.575 -7.599 -9.684 1.00 1.00 H new ATOM 0 HA VAL A 66 -8.555 -6.906 -11.776 1.00 1.00 H new ATOM 0 HB VAL A 66 -7.112 -7.081 -9.897 1.00 1.00 H new ATOM 0 HG11 VAL A 66 -8.290 -6.168 -7.917 1.00 1.00 H new ATOM 0 HG12 VAL A 66 -8.841 -5.372 -9.410 1.00 1.00 H new ATOM 0 HG13 VAL A 66 -9.854 -6.616 -8.639 1.00 1.00 H new ATOM 0 HG21 VAL A 66 -7.586 -8.568 -7.966 1.00 1.00 H new ATOM 0 HG22 VAL A 66 -9.150 -9.012 -8.692 1.00 1.00 H new ATOM 0 HG23 VAL A 66 -7.631 -9.476 -9.496 1.00 1.00 H new ATOM 1064 N GLN A 67 -7.999 -9.143 -12.634 1.00 1.00 N ATOM 1065 CA GLN A 67 -7.746 -10.501 -13.194 1.00 1.00 C ATOM 1066 C GLN A 67 -6.352 -10.561 -13.826 1.00 1.00 C ATOM 1067 O GLN A 67 -5.896 -9.615 -14.439 1.00 1.00 O ATOM 1068 CB GLN A 67 -8.828 -10.699 -14.256 1.00 1.00 C ATOM 1069 CG GLN A 67 -9.638 -11.955 -13.931 1.00 1.00 C ATOM 1070 CD GLN A 67 -10.485 -11.708 -12.681 1.00 1.00 C ATOM 1071 OE1 GLN A 67 -10.642 -12.587 -11.857 1.00 1.00 O ATOM 1072 NE2 GLN A 67 -11.038 -10.539 -12.504 1.00 1.00 N ATOM 0 H GLN A 67 -7.616 -8.370 -13.178 1.00 1.00 H new ATOM 0 HA GLN A 67 -7.780 -11.277 -12.429 1.00 1.00 H new ATOM 0 HB2 GLN A 67 -9.484 -9.829 -14.289 1.00 1.00 H new ATOM 0 HB3 GLN A 67 -8.372 -10.792 -15.242 1.00 1.00 H new ATOM 0 HG2 GLN A 67 -10.280 -12.214 -14.773 1.00 1.00 H new ATOM 0 HG3 GLN A 67 -8.969 -12.800 -13.769 1.00 1.00 H new ATOM 0 HE21 GLN A 67 -10.905 -9.802 -13.197 1.00 1.00 H new ATOM 0 HE22 GLN A 67 -11.603 -10.363 -11.673 1.00 1.00 H new ATOM 1081 N GLY A 68 -5.672 -11.667 -13.685 1.00 1.00 N ATOM 1082 CA GLY A 68 -4.309 -11.785 -14.278 1.00 1.00 C ATOM 1083 C GLY A 68 -3.253 -11.420 -13.232 1.00 1.00 C ATOM 1084 O GLY A 68 -2.090 -11.253 -13.544 1.00 1.00 O ATOM 0 H GLY A 68 -6.001 -12.493 -13.185 1.00 1.00 H new ATOM 0 HA2 GLY A 68 -4.145 -12.802 -14.634 1.00 1.00 H new ATOM 0 HA3 GLY A 68 -4.220 -11.127 -15.142 1.00 1.00 H new ATOM 1088 N GLY A 69 -3.642 -11.304 -11.991 1.00 1.00 N ATOM 1089 CA GLY A 69 -2.653 -10.960 -10.929 1.00 1.00 C ATOM 1090 C GLY A 69 -2.633 -9.447 -10.705 1.00 1.00 C ATOM 1091 O GLY A 69 -1.879 -8.941 -9.896 1.00 1.00 O ATOM 0 H GLY A 69 -4.601 -11.432 -11.667 1.00 1.00 H new ATOM 0 HA2 GLY A 69 -2.911 -11.470 -10.001 1.00 1.00 H new ATOM 0 HA3 GLY A 69 -1.661 -11.307 -11.218 1.00 1.00 H new ATOM 1095 N PHE A 70 -3.454 -8.717 -11.409 1.00 1.00 N ATOM 1096 CA PHE A 70 -3.476 -7.237 -11.228 1.00 1.00 C ATOM 1097 C PHE A 70 -4.686 -6.831 -10.384 1.00 1.00 C ATOM 1098 O PHE A 70 -5.760 -6.589 -10.898 1.00 1.00 O ATOM 1099 CB PHE A 70 -3.592 -6.667 -12.641 1.00 1.00 C ATOM 1100 CG PHE A 70 -5.042 -6.384 -12.952 1.00 1.00 C ATOM 1101 CD1 PHE A 70 -5.665 -5.252 -12.414 1.00 1.00 C ATOM 1102 CD2 PHE A 70 -5.764 -7.254 -13.778 1.00 1.00 C ATOM 1103 CE1 PHE A 70 -7.009 -4.989 -12.702 1.00 1.00 C ATOM 1104 CE2 PHE A 70 -7.109 -6.992 -14.065 1.00 1.00 C ATOM 1105 CZ PHE A 70 -7.732 -5.859 -13.527 1.00 1.00 C ATOM 0 H PHE A 70 -4.110 -9.080 -12.101 1.00 1.00 H new ATOM 0 HA PHE A 70 -2.589 -6.868 -10.713 1.00 1.00 H new ATOM 0 HB2 PHE A 70 -3.006 -5.752 -12.725 1.00 1.00 H new ATOM 0 HB3 PHE A 70 -3.185 -7.374 -13.364 1.00 1.00 H new ATOM 0 HD1 PHE A 70 -5.108 -4.581 -11.776 1.00 1.00 H new ATOM 0 HD2 PHE A 70 -5.283 -8.127 -14.194 1.00 1.00 H new ATOM 0 HE1 PHE A 70 -7.489 -4.115 -12.288 1.00 1.00 H new ATOM 0 HE2 PHE A 70 -7.666 -7.664 -14.701 1.00 1.00 H new ATOM 0 HZ PHE A 70 -8.769 -5.656 -13.748 1.00 1.00 H new ATOM 1115 N GLY A 71 -4.525 -6.757 -9.090 1.00 1.00 N ATOM 1116 CA GLY A 71 -5.672 -6.369 -8.221 1.00 1.00 C ATOM 1117 C GLY A 71 -6.446 -7.624 -7.814 1.00 1.00 C ATOM 1118 O GLY A 71 -7.621 -7.566 -7.499 1.00 1.00 O ATOM 0 H GLY A 71 -3.652 -6.948 -8.599 1.00 1.00 H new ATOM 0 HA2 GLY A 71 -5.311 -5.847 -7.335 1.00 1.00 H new ATOM 0 HA3 GLY A 71 -6.328 -5.679 -8.752 1.00 1.00 H new ATOM 1122 N LYS A 72 -5.797 -8.759 -7.819 1.00 1.00 N ATOM 1123 CA LYS A 72 -6.502 -10.019 -7.444 1.00 1.00 C ATOM 1124 C LYS A 72 -6.772 -10.030 -5.943 1.00 1.00 C ATOM 1125 O LYS A 72 -7.167 -11.029 -5.374 1.00 1.00 O ATOM 1126 CB LYS A 72 -5.538 -11.141 -7.826 1.00 1.00 C ATOM 1127 CG LYS A 72 -5.671 -12.292 -6.826 1.00 1.00 C ATOM 1128 CD LYS A 72 -5.011 -11.897 -5.503 1.00 1.00 C ATOM 1129 CE LYS A 72 -3.899 -12.892 -5.169 1.00 1.00 C ATOM 1130 NZ LYS A 72 -2.816 -12.603 -6.150 1.00 1.00 N ATOM 0 H LYS A 72 -4.813 -8.867 -8.066 1.00 1.00 H new ATOM 0 HA LYS A 72 -7.464 -10.126 -7.945 1.00 1.00 H new ATOM 0 HB2 LYS A 72 -5.756 -11.494 -8.834 1.00 1.00 H new ATOM 0 HB3 LYS A 72 -4.514 -10.768 -7.833 1.00 1.00 H new ATOM 0 HG2 LYS A 72 -6.723 -12.527 -6.664 1.00 1.00 H new ATOM 0 HG3 LYS A 72 -5.201 -13.191 -7.225 1.00 1.00 H new ATOM 0 HD2 LYS A 72 -4.602 -10.889 -5.575 1.00 1.00 H new ATOM 0 HD3 LYS A 72 -5.753 -11.883 -4.704 1.00 1.00 H new ATOM 0 HE2 LYS A 72 -3.549 -12.763 -4.145 1.00 1.00 H new ATOM 0 HE3 LYS A 72 -4.249 -13.920 -5.259 1.00 1.00 H new ATOM 0 HZ1 LYS A 72 -2.500 -13.491 -6.590 1.00 1.00 H new ATOM 0 HZ2 LYS A 72 -3.175 -11.961 -6.885 1.00 1.00 H new ATOM 0 HZ3 LYS A 72 -2.015 -12.155 -5.661 1.00 1.00 H new ATOM 1143 N TYR A 73 -6.589 -8.910 -5.306 1.00 1.00 N ATOM 1144 CA TYR A 73 -6.860 -8.822 -3.849 1.00 1.00 C ATOM 1145 C TYR A 73 -8.049 -7.887 -3.630 1.00 1.00 C ATOM 1146 O TYR A 73 -8.770 -7.992 -2.659 1.00 1.00 O ATOM 1147 CB TYR A 73 -5.588 -8.236 -3.235 1.00 1.00 C ATOM 1148 CG TYR A 73 -4.440 -9.193 -3.444 1.00 1.00 C ATOM 1149 CD1 TYR A 73 -4.431 -10.429 -2.788 1.00 1.00 C ATOM 1150 CD2 TYR A 73 -3.384 -8.846 -4.296 1.00 1.00 C ATOM 1151 CE1 TYR A 73 -3.367 -11.318 -2.981 1.00 1.00 C ATOM 1152 CE2 TYR A 73 -2.320 -9.733 -4.490 1.00 1.00 C ATOM 1153 CZ TYR A 73 -2.311 -10.970 -3.833 1.00 1.00 C ATOM 1154 OH TYR A 73 -1.261 -11.845 -4.024 1.00 1.00 O ATOM 0 H TYR A 73 -6.261 -8.046 -5.737 1.00 1.00 H new ATOM 0 HA TYR A 73 -7.103 -9.785 -3.400 1.00 1.00 H new ATOM 0 HB2 TYR A 73 -5.361 -7.273 -3.693 1.00 1.00 H new ATOM 0 HB3 TYR A 73 -5.735 -8.055 -2.170 1.00 1.00 H new ATOM 0 HD1 TYR A 73 -5.246 -10.697 -2.132 1.00 1.00 H new ATOM 0 HD2 TYR A 73 -3.391 -7.893 -4.804 1.00 1.00 H new ATOM 0 HE1 TYR A 73 -3.360 -12.271 -2.473 1.00 1.00 H new ATOM 0 HE2 TYR A 73 -1.506 -9.464 -5.146 1.00 1.00 H new ATOM 0 HH TYR A 73 -0.614 -11.449 -4.645 1.00 1.00 H new ATOM 1164 N GLN A 74 -8.257 -6.974 -4.542 1.00 1.00 N ATOM 1165 CA GLN A 74 -9.401 -6.028 -4.410 1.00 1.00 C ATOM 1166 C GLN A 74 -10.614 -6.558 -5.181 1.00 1.00 C ATOM 1167 O GLN A 74 -11.736 -6.492 -4.718 1.00 1.00 O ATOM 1168 CB GLN A 74 -8.906 -4.718 -5.023 1.00 1.00 C ATOM 1169 CG GLN A 74 -7.494 -4.418 -4.515 1.00 1.00 C ATOM 1170 CD GLN A 74 -6.759 -5.732 -4.242 1.00 1.00 C ATOM 1171 OE1 GLN A 74 -6.779 -6.235 -3.136 1.00 1.00 O ATOM 1172 NE2 GLN A 74 -6.107 -6.314 -5.212 1.00 1.00 N ATOM 0 H GLN A 74 -7.682 -6.843 -5.374 1.00 1.00 H new ATOM 0 HA GLN A 74 -9.714 -5.899 -3.374 1.00 1.00 H new ATOM 0 HB2 GLN A 74 -8.905 -4.791 -6.111 1.00 1.00 H new ATOM 0 HB3 GLN A 74 -9.580 -3.903 -4.759 1.00 1.00 H new ATOM 0 HG2 GLN A 74 -6.948 -3.830 -5.253 1.00 1.00 H new ATOM 0 HG3 GLN A 74 -7.543 -3.821 -3.605 1.00 1.00 H new ATOM 0 HE21 GLN A 74 -6.090 -5.892 -6.140 1.00 1.00 H new ATOM 0 HE22 GLN A 74 -5.615 -7.191 -5.041 1.00 1.00 H new ATOM 1181 N GLY A 75 -10.397 -7.078 -6.358 1.00 1.00 N ATOM 1182 CA GLY A 75 -11.536 -7.607 -7.160 1.00 1.00 C ATOM 1183 C GLY A 75 -12.325 -6.435 -7.746 1.00 1.00 C ATOM 1184 O GLY A 75 -12.070 -5.993 -8.848 1.00 1.00 O ATOM 0 H GLY A 75 -9.481 -7.159 -6.799 1.00 1.00 H new ATOM 0 HA2 GLY A 75 -11.166 -8.248 -7.960 1.00 1.00 H new ATOM 0 HA3 GLY A 75 -12.184 -8.220 -6.534 1.00 1.00 H new ATOM 1188 N THR A 76 -13.277 -5.926 -7.014 1.00 1.00 N ATOM 1189 CA THR A 76 -14.078 -4.779 -7.529 1.00 1.00 C ATOM 1190 C THR A 76 -13.737 -3.508 -6.745 1.00 1.00 C ATOM 1191 O THR A 76 -14.143 -3.339 -5.612 1.00 1.00 O ATOM 1192 CB THR A 76 -15.537 -5.176 -7.300 1.00 1.00 C ATOM 1193 OG1 THR A 76 -15.602 -6.178 -6.294 1.00 1.00 O ATOM 1194 CG2 THR A 76 -16.130 -5.718 -8.602 1.00 1.00 C ATOM 0 H THR A 76 -13.535 -6.254 -6.083 1.00 1.00 H new ATOM 0 HA THR A 76 -13.875 -4.571 -8.580 1.00 1.00 H new ATOM 0 HB THR A 76 -16.106 -4.303 -6.980 1.00 1.00 H new ATOM 0 HG1 THR A 76 -16.537 -6.432 -6.145 1.00 1.00 H new ATOM 0 HG21 THR A 76 -17.170 -6.001 -8.438 1.00 1.00 H new ATOM 0 HG22 THR A 76 -16.080 -4.949 -9.372 1.00 1.00 H new ATOM 0 HG23 THR A 76 -15.563 -6.591 -8.924 1.00 1.00 H new ATOM 1202 N TRP A 77 -12.990 -2.617 -7.336 1.00 1.00 N ATOM 1203 CA TRP A 77 -12.620 -1.364 -6.620 1.00 1.00 C ATOM 1204 C TRP A 77 -13.803 -0.395 -6.593 1.00 1.00 C ATOM 1205 O TRP A 77 -14.526 -0.252 -7.558 1.00 1.00 O ATOM 1206 CB TRP A 77 -11.466 -0.766 -7.424 1.00 1.00 C ATOM 1207 CG TRP A 77 -10.766 -1.850 -8.177 1.00 1.00 C ATOM 1208 CD1 TRP A 77 -10.386 -3.037 -7.655 1.00 1.00 C ATOM 1209 CD2 TRP A 77 -10.355 -1.868 -9.575 1.00 1.00 C ATOM 1210 NE1 TRP A 77 -9.768 -3.783 -8.642 1.00 1.00 N ATOM 1211 CE2 TRP A 77 -9.725 -3.105 -9.844 1.00 1.00 C ATOM 1212 CE3 TRP A 77 -10.466 -0.939 -10.627 1.00 1.00 C ATOM 1213 CZ2 TRP A 77 -9.223 -3.412 -11.109 1.00 1.00 C ATOM 1214 CZ3 TRP A 77 -9.963 -1.244 -11.902 1.00 1.00 C ATOM 1215 CH2 TRP A 77 -9.342 -2.479 -12.142 1.00 1.00 C ATOM 0 H TRP A 77 -12.620 -2.702 -8.283 1.00 1.00 H new ATOM 0 HA TRP A 77 -12.341 -1.557 -5.584 1.00 1.00 H new ATOM 0 HB2 TRP A 77 -11.843 -0.013 -8.116 1.00 1.00 H new ATOM 0 HB3 TRP A 77 -10.767 -0.263 -6.756 1.00 1.00 H new ATOM 0 HD1 TRP A 77 -10.540 -3.352 -6.633 1.00 1.00 H new ATOM 0 HE1 TRP A 77 -9.390 -4.720 -8.499 1.00 1.00 H new ATOM 0 HE3 TRP A 77 -10.941 0.015 -10.452 1.00 1.00 H new ATOM 0 HZ2 TRP A 77 -8.746 -4.364 -11.288 1.00 1.00 H new ATOM 0 HZ3 TRP A 77 -10.055 -0.524 -12.702 1.00 1.00 H new ATOM 0 HH2 TRP A 77 -8.956 -2.708 -13.124 1.00 1.00 H new ATOM 1226 N VAL A 78 -13.996 0.280 -5.494 1.00 1.00 N ATOM 1227 CA VAL A 78 -15.121 1.252 -5.402 1.00 1.00 C ATOM 1228 C VAL A 78 -14.586 2.622 -4.983 1.00 1.00 C ATOM 1229 O VAL A 78 -13.588 2.714 -4.297 1.00 1.00 O ATOM 1230 CB VAL A 78 -16.052 0.688 -4.328 1.00 1.00 C ATOM 1231 CG1 VAL A 78 -17.240 -0.007 -4.995 1.00 1.00 C ATOM 1232 CG2 VAL A 78 -15.286 -0.322 -3.470 1.00 1.00 C ATOM 0 H VAL A 78 -13.422 0.200 -4.654 1.00 1.00 H new ATOM 0 HA VAL A 78 -15.637 1.383 -6.353 1.00 1.00 H new ATOM 0 HB VAL A 78 -16.414 1.500 -3.698 1.00 1.00 H new ATOM 0 HG11 VAL A 78 -17.903 -0.409 -4.229 1.00 1.00 H new ATOM 0 HG12 VAL A 78 -17.785 0.712 -5.607 1.00 1.00 H new ATOM 0 HG13 VAL A 78 -16.879 -0.820 -5.625 1.00 1.00 H new ATOM 0 HG21 VAL A 78 -15.948 -0.725 -2.704 1.00 1.00 H new ATOM 0 HG22 VAL A 78 -14.924 -1.134 -4.100 1.00 1.00 H new ATOM 0 HG23 VAL A 78 -14.440 0.173 -2.994 1.00 1.00 H new ATOM 1242 N PRO A 79 -15.271 3.645 -5.412 1.00 1.00 N ATOM 1243 CA PRO A 79 -14.856 5.026 -5.074 1.00 1.00 C ATOM 1244 C PRO A 79 -14.729 5.173 -3.556 1.00 1.00 C ATOM 1245 O PRO A 79 -15.703 5.098 -2.833 1.00 1.00 O ATOM 1246 CB PRO A 79 -15.985 5.907 -5.618 1.00 1.00 C ATOM 1247 CG PRO A 79 -17.089 4.971 -6.016 1.00 1.00 C ATOM 1248 CD PRO A 79 -16.478 3.615 -6.234 1.00 1.00 C ATOM 0 HA PRO A 79 -13.889 5.297 -5.497 1.00 1.00 H new ATOM 0 HB2 PRO A 79 -16.327 6.613 -4.862 1.00 1.00 H new ATOM 0 HB3 PRO A 79 -15.645 6.494 -6.471 1.00 1.00 H new ATOM 0 HG2 PRO A 79 -17.852 4.927 -5.239 1.00 1.00 H new ATOM 0 HG3 PRO A 79 -17.579 5.321 -6.925 1.00 1.00 H new ATOM 0 HD2 PRO A 79 -17.153 2.817 -5.925 1.00 1.00 H new ATOM 0 HD3 PRO A 79 -16.243 3.445 -7.285 1.00 1.00 H new ATOM 1256 N LEU A 80 -13.537 5.377 -3.064 1.00 1.00 N ATOM 1257 CA LEU A 80 -13.359 5.520 -1.592 1.00 1.00 C ATOM 1258 C LEU A 80 -14.372 6.524 -1.038 1.00 1.00 C ATOM 1259 O LEU A 80 -14.859 6.379 0.068 1.00 1.00 O ATOM 1260 CB LEU A 80 -11.933 6.043 -1.415 1.00 1.00 C ATOM 1261 CG LEU A 80 -11.834 7.463 -1.973 1.00 1.00 C ATOM 1262 CD1 LEU A 80 -10.744 8.234 -1.226 1.00 1.00 C ATOM 1263 CD2 LEU A 80 -11.484 7.401 -3.462 1.00 1.00 C ATOM 0 H LEU A 80 -12.682 5.450 -3.616 1.00 1.00 H new ATOM 0 HA LEU A 80 -13.516 4.581 -1.061 1.00 1.00 H new ATOM 0 HB2 LEU A 80 -11.661 6.037 -0.359 1.00 1.00 H new ATOM 0 HB3 LEU A 80 -11.229 5.389 -1.930 1.00 1.00 H new ATOM 0 HG LEU A 80 -12.790 7.970 -1.843 1.00 1.00 H new ATOM 0 HD11 LEU A 80 -10.675 9.246 -1.625 1.00 1.00 H new ATOM 0 HD12 LEU A 80 -10.992 8.279 -0.165 1.00 1.00 H new ATOM 0 HD13 LEU A 80 -9.787 7.728 -1.354 1.00 1.00 H new ATOM 0 HD21 LEU A 80 -11.413 8.413 -3.862 1.00 1.00 H new ATOM 0 HD22 LEU A 80 -10.529 6.892 -3.590 1.00 1.00 H new ATOM 0 HD23 LEU A 80 -12.261 6.854 -3.996 1.00 1.00 H new ATOM 1275 N ASN A 81 -14.705 7.529 -1.801 1.00 1.00 N ATOM 1276 CA ASN A 81 -15.698 8.531 -1.321 1.00 1.00 C ATOM 1277 C ASN A 81 -17.041 7.842 -1.079 1.00 1.00 C ATOM 1278 O ASN A 81 -17.780 8.191 -0.180 1.00 1.00 O ATOM 1279 CB ASN A 81 -15.813 9.552 -2.454 1.00 1.00 C ATOM 1280 CG ASN A 81 -15.922 8.818 -3.791 1.00 1.00 C ATOM 1281 OD1 ASN A 81 -15.730 7.620 -3.859 1.00 1.00 O ATOM 1282 ND2 ASN A 81 -16.227 9.491 -4.868 1.00 1.00 N ATOM 0 H ASN A 81 -14.333 7.699 -2.735 1.00 1.00 H new ATOM 0 HA ASN A 81 -15.401 9.003 -0.384 1.00 1.00 H new ATOM 0 HB2 ASN A 81 -16.688 10.184 -2.301 1.00 1.00 H new ATOM 0 HB3 ASN A 81 -14.943 10.208 -2.457 1.00 1.00 H new ATOM 0 HD21 ASN A 81 -16.304 9.011 -5.765 1.00 1.00 H new ATOM 0 HD22 ASN A 81 -16.388 10.497 -4.812 1.00 1.00 H new ATOM 1289 N ILE A 82 -17.356 6.857 -1.875 1.00 1.00 N ATOM 1290 CA ILE A 82 -18.644 6.131 -1.695 1.00 1.00 C ATOM 1291 C ILE A 82 -18.374 4.755 -1.087 1.00 1.00 C ATOM 1292 O ILE A 82 -19.180 4.217 -0.351 1.00 1.00 O ATOM 1293 CB ILE A 82 -19.221 5.993 -3.103 1.00 1.00 C ATOM 1294 CG1 ILE A 82 -19.321 4.510 -3.469 1.00 1.00 C ATOM 1295 CG2 ILE A 82 -18.307 6.703 -4.103 1.00 1.00 C ATOM 1296 CD1 ILE A 82 -20.756 4.025 -3.248 1.00 1.00 C ATOM 0 H ILE A 82 -16.775 6.523 -2.644 1.00 1.00 H new ATOM 0 HA ILE A 82 -19.331 6.652 -1.028 1.00 1.00 H new ATOM 0 HB ILE A 82 -20.213 6.444 -3.134 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -19.032 4.361 -4.509 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -18.631 3.927 -2.859 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -18.720 6.604 -5.107 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -18.234 7.759 -3.843 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -17.315 6.253 -4.072 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -20.827 2.969 -3.509 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -21.028 4.160 -2.201 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -21.435 4.601 -3.877 1.00 1.00 H new ATOM 1308 N ALA A 83 -17.236 4.183 -1.381 1.00 1.00 N ATOM 1309 CA ALA A 83 -16.909 2.847 -0.813 1.00 1.00 C ATOM 1310 C ALA A 83 -16.831 2.941 0.711 1.00 1.00 C ATOM 1311 O ALA A 83 -17.555 2.268 1.419 1.00 1.00 O ATOM 1312 CB ALA A 83 -15.544 2.487 -1.401 1.00 1.00 C ATOM 0 H ALA A 83 -16.522 4.584 -1.989 1.00 1.00 H new ATOM 0 HA ALA A 83 -17.661 2.095 -1.053 1.00 1.00 H new ATOM 0 HB1 ALA A 83 -15.233 1.511 -1.028 1.00 1.00 H new ATOM 0 HB2 ALA A 83 -15.613 2.455 -2.488 1.00 1.00 H new ATOM 0 HB3 ALA A 83 -14.811 3.238 -1.106 1.00 1.00 H new ATOM 1318 N LYS A 84 -15.965 3.772 1.225 1.00 1.00 N ATOM 1319 CA LYS A 84 -15.855 3.904 2.704 1.00 1.00 C ATOM 1320 C LYS A 84 -17.195 4.356 3.288 1.00 1.00 C ATOM 1321 O LYS A 84 -17.540 4.026 4.404 1.00 1.00 O ATOM 1322 CB LYS A 84 -14.783 4.971 2.927 1.00 1.00 C ATOM 1323 CG LYS A 84 -13.644 4.769 1.926 1.00 1.00 C ATOM 1324 CD LYS A 84 -12.316 5.162 2.576 1.00 1.00 C ATOM 1325 CE LYS A 84 -12.289 6.674 2.808 1.00 1.00 C ATOM 1326 NZ LYS A 84 -12.440 6.839 4.280 1.00 1.00 N ATOM 0 H LYS A 84 -15.332 4.363 0.686 1.00 1.00 H new ATOM 0 HA LYS A 84 -15.596 2.963 3.189 1.00 1.00 H new ATOM 0 HB2 LYS A 84 -15.214 5.965 2.807 1.00 1.00 H new ATOM 0 HB3 LYS A 84 -14.401 4.910 3.946 1.00 1.00 H new ATOM 0 HG2 LYS A 84 -13.609 3.728 1.604 1.00 1.00 H new ATOM 0 HG3 LYS A 84 -13.818 5.373 1.035 1.00 1.00 H new ATOM 0 HD2 LYS A 84 -12.193 4.636 3.523 1.00 1.00 H new ATOM 0 HD3 LYS A 84 -11.484 4.867 1.936 1.00 1.00 H new ATOM 0 HE2 LYS A 84 -11.355 7.111 2.455 1.00 1.00 H new ATOM 0 HE3 LYS A 84 -13.096 7.171 2.270 1.00 1.00 H new ATOM 0 HZ1 LYS A 84 -12.148 7.799 4.554 1.00 1.00 H new ATOM 0 HZ2 LYS A 84 -13.434 6.691 4.546 1.00 1.00 H new ATOM 0 HZ3 LYS A 84 -11.843 6.143 4.770 1.00 1.00 H new ATOM 1339 N GLN A 85 -17.958 5.102 2.538 1.00 1.00 N ATOM 1340 CA GLN A 85 -19.277 5.565 3.053 1.00 1.00 C ATOM 1341 C GLN A 85 -20.217 4.370 3.216 1.00 1.00 C ATOM 1342 O GLN A 85 -21.080 4.357 4.070 1.00 1.00 O ATOM 1343 CB GLN A 85 -19.805 6.528 1.989 1.00 1.00 C ATOM 1344 CG GLN A 85 -21.328 6.620 2.094 1.00 1.00 C ATOM 1345 CD GLN A 85 -21.912 6.992 0.731 1.00 1.00 C ATOM 1346 OE1 GLN A 85 -22.471 8.058 0.565 1.00 1.00 O ATOM 1347 NE2 GLN A 85 -21.806 6.151 -0.262 1.00 1.00 N ATOM 0 H GLN A 85 -17.726 5.410 1.594 1.00 1.00 H new ATOM 0 HA GLN A 85 -19.199 6.047 4.027 1.00 1.00 H new ATOM 0 HB2 GLN A 85 -19.360 7.514 2.123 1.00 1.00 H new ATOM 0 HB3 GLN A 85 -19.519 6.182 0.996 1.00 1.00 H new ATOM 0 HG2 GLN A 85 -21.738 5.667 2.429 1.00 1.00 H new ATOM 0 HG3 GLN A 85 -21.607 7.367 2.837 1.00 1.00 H new ATOM 0 HE21 GLN A 85 -21.337 5.256 -0.124 1.00 1.00 H new ATOM 0 HE22 GLN A 85 -22.192 6.389 -1.176 1.00 1.00 H new ATOM 1356 N LEU A 86 -20.047 3.360 2.408 1.00 1.00 N ATOM 1357 CA LEU A 86 -20.922 2.159 2.525 1.00 1.00 C ATOM 1358 C LEU A 86 -20.361 1.213 3.586 1.00 1.00 C ATOM 1359 O LEU A 86 -21.094 0.601 4.337 1.00 1.00 O ATOM 1360 CB LEU A 86 -20.890 1.505 1.147 1.00 1.00 C ATOM 1361 CG LEU A 86 -22.290 1.008 0.786 1.00 1.00 C ATOM 1362 CD1 LEU A 86 -22.637 1.448 -0.637 1.00 1.00 C ATOM 1363 CD2 LEU A 86 -22.325 -0.520 0.869 1.00 1.00 C ATOM 0 H LEU A 86 -19.341 3.314 1.673 1.00 1.00 H new ATOM 0 HA LEU A 86 -21.939 2.411 2.825 1.00 1.00 H new ATOM 0 HB2 LEU A 86 -20.543 2.220 0.401 1.00 1.00 H new ATOM 0 HB3 LEU A 86 -20.185 0.674 1.144 1.00 1.00 H new ATOM 0 HG LEU A 86 -23.015 1.428 1.483 1.00 1.00 H new ATOM 0 HD11 LEU A 86 -23.635 1.094 -0.894 1.00 1.00 H new ATOM 0 HD12 LEU A 86 -22.611 2.536 -0.698 1.00 1.00 H new ATOM 0 HD13 LEU A 86 -21.912 1.028 -1.335 1.00 1.00 H new ATOM 0 HD21 LEU A 86 -23.323 -0.876 0.612 1.00 1.00 H new ATOM 0 HD22 LEU A 86 -21.600 -0.939 0.172 1.00 1.00 H new ATOM 0 HD23 LEU A 86 -22.078 -0.835 1.883 1.00 1.00 H new ATOM 1375 N ALA A 87 -19.063 1.094 3.660 1.00 1.00 N ATOM 1376 CA ALA A 87 -18.456 0.194 4.680 1.00 1.00 C ATOM 1377 C ALA A 87 -18.190 0.972 5.972 1.00 1.00 C ATOM 1378 O ALA A 87 -18.718 0.654 7.018 1.00 1.00 O ATOM 1379 CB ALA A 87 -17.142 -0.282 4.059 1.00 1.00 C ATOM 0 H ALA A 87 -18.398 1.581 3.059 1.00 1.00 H new ATOM 0 HA ALA A 87 -19.108 -0.641 4.938 1.00 1.00 H new ATOM 0 HB1 ALA A 87 -16.634 -0.952 4.752 1.00 1.00 H new ATOM 0 HB2 ALA A 87 -17.350 -0.811 3.129 1.00 1.00 H new ATOM 0 HB3 ALA A 87 -16.505 0.578 3.852 1.00 1.00 H new ATOM 1385 N GLU A 88 -17.372 1.990 5.908 1.00 1.00 N ATOM 1386 CA GLU A 88 -17.070 2.784 7.127 1.00 1.00 C ATOM 1387 C GLU A 88 -18.281 2.803 8.057 1.00 1.00 C ATOM 1388 O GLU A 88 -18.155 2.981 9.252 1.00 1.00 O ATOM 1389 CB GLU A 88 -16.760 4.184 6.612 1.00 1.00 C ATOM 1390 CG GLU A 88 -17.954 5.104 6.869 1.00 1.00 C ATOM 1391 CD GLU A 88 -17.464 6.542 7.044 1.00 1.00 C ATOM 1392 OE1 GLU A 88 -16.662 6.770 7.935 1.00 1.00 O ATOM 1393 OE2 GLU A 88 -17.899 7.393 6.285 1.00 1.00 O ATOM 0 H GLU A 88 -16.901 2.304 5.060 1.00 1.00 H new ATOM 0 HA GLU A 88 -16.241 2.369 7.701 1.00 1.00 H new ATOM 0 HB2 GLU A 88 -15.873 4.576 7.109 1.00 1.00 H new ATOM 0 HB3 GLU A 88 -16.539 4.149 5.545 1.00 1.00 H new ATOM 0 HG2 GLU A 88 -18.656 5.047 6.037 1.00 1.00 H new ATOM 0 HG3 GLU A 88 -18.490 4.780 7.761 1.00 1.00 H new ATOM 1400 N LYS A 89 -19.452 2.604 7.523 1.00 1.00 N ATOM 1401 CA LYS A 89 -20.662 2.589 8.387 1.00 1.00 C ATOM 1402 C LYS A 89 -20.647 1.335 9.262 1.00 1.00 C ATOM 1403 O LYS A 89 -19.957 1.267 10.260 1.00 1.00 O ATOM 1404 CB LYS A 89 -21.844 2.558 7.417 1.00 1.00 C ATOM 1405 CG LYS A 89 -22.809 3.697 7.751 1.00 1.00 C ATOM 1406 CD LYS A 89 -24.007 3.648 6.801 1.00 1.00 C ATOM 1407 CE LYS A 89 -25.285 3.385 7.601 1.00 1.00 C ATOM 1408 NZ LYS A 89 -26.160 4.557 7.322 1.00 1.00 N ATOM 0 H LYS A 89 -19.623 2.452 6.529 1.00 1.00 H new ATOM 0 HA LYS A 89 -20.715 3.450 9.054 1.00 1.00 H new ATOM 0 HB2 LYS A 89 -21.489 2.657 6.391 1.00 1.00 H new ATOM 0 HB3 LYS A 89 -22.359 1.600 7.485 1.00 1.00 H new ATOM 0 HG2 LYS A 89 -23.147 3.610 8.784 1.00 1.00 H new ATOM 0 HG3 LYS A 89 -22.300 4.657 7.662 1.00 1.00 H new ATOM 0 HD2 LYS A 89 -24.093 4.589 6.258 1.00 1.00 H new ATOM 0 HD3 LYS A 89 -23.863 2.864 6.058 1.00 1.00 H new ATOM 0 HE2 LYS A 89 -25.760 2.454 7.291 1.00 1.00 H new ATOM 0 HE3 LYS A 89 -25.073 3.295 8.666 1.00 1.00 H new ATOM 0 HZ1 LYS A 89 -27.058 4.450 7.836 1.00 1.00 H new ATOM 0 HZ2 LYS A 89 -25.684 5.428 7.633 1.00 1.00 H new ATOM 0 HZ3 LYS A 89 -26.350 4.613 6.301 1.00 1.00 H new ATOM 1421 N PHE A 90 -21.397 0.339 8.883 1.00 1.00 N ATOM 1422 CA PHE A 90 -21.428 -0.924 9.678 1.00 1.00 C ATOM 1423 C PHE A 90 -20.766 -2.063 8.893 1.00 1.00 C ATOM 1424 O PHE A 90 -20.854 -3.216 9.266 1.00 1.00 O ATOM 1425 CB PHE A 90 -22.912 -1.217 9.900 1.00 1.00 C ATOM 1426 CG PHE A 90 -23.438 -2.050 8.757 1.00 1.00 C ATOM 1427 CD1 PHE A 90 -22.912 -1.884 7.470 1.00 1.00 C ATOM 1428 CD2 PHE A 90 -24.450 -2.990 8.983 1.00 1.00 C ATOM 1429 CE1 PHE A 90 -23.400 -2.657 6.409 1.00 1.00 C ATOM 1430 CE2 PHE A 90 -24.938 -3.763 7.923 1.00 1.00 C ATOM 1431 CZ PHE A 90 -24.412 -3.597 6.636 1.00 1.00 C ATOM 0 H PHE A 90 -21.992 0.343 8.055 1.00 1.00 H new ATOM 0 HA PHE A 90 -20.886 -0.832 10.619 1.00 1.00 H new ATOM 0 HB2 PHE A 90 -23.052 -1.745 10.843 1.00 1.00 H new ATOM 0 HB3 PHE A 90 -23.471 -0.284 9.971 1.00 1.00 H new ATOM 0 HD1 PHE A 90 -22.130 -1.160 7.296 1.00 1.00 H new ATOM 0 HD2 PHE A 90 -24.855 -3.119 9.976 1.00 1.00 H new ATOM 0 HE1 PHE A 90 -22.996 -2.528 5.416 1.00 1.00 H new ATOM 0 HE2 PHE A 90 -25.720 -4.487 8.098 1.00 1.00 H new ATOM 0 HZ PHE A 90 -24.787 -4.194 5.818 1.00 1.00 H new ATOM 1441 N SER A 91 -20.121 -1.754 7.799 1.00 1.00 N ATOM 1442 CA SER A 91 -19.478 -2.822 6.986 1.00 1.00 C ATOM 1443 C SER A 91 -17.992 -2.969 7.336 1.00 1.00 C ATOM 1444 O SER A 91 -17.568 -3.975 7.869 1.00 1.00 O ATOM 1445 CB SER A 91 -19.643 -2.366 5.537 1.00 1.00 C ATOM 1446 OG SER A 91 -20.010 -3.479 4.734 1.00 1.00 O ATOM 0 H SER A 91 -20.013 -0.807 7.435 1.00 1.00 H new ATOM 0 HA SER A 91 -19.932 -3.796 7.170 1.00 1.00 H new ATOM 0 HB2 SER A 91 -20.405 -1.589 5.473 1.00 1.00 H new ATOM 0 HB3 SER A 91 -18.713 -1.931 5.172 1.00 1.00 H new ATOM 0 HG SER A 91 -19.453 -3.499 3.928 1.00 1.00 H new ATOM 1452 N VAL A 92 -17.197 -1.980 7.032 1.00 1.00 N ATOM 1453 CA VAL A 92 -15.739 -2.075 7.341 1.00 1.00 C ATOM 1454 C VAL A 92 -15.323 -0.968 8.314 1.00 1.00 C ATOM 1455 O VAL A 92 -14.232 -0.978 8.849 1.00 1.00 O ATOM 1456 CB VAL A 92 -15.038 -1.896 5.995 1.00 1.00 C ATOM 1457 CG1 VAL A 92 -14.052 -3.044 5.775 1.00 1.00 C ATOM 1458 CG2 VAL A 92 -16.081 -1.901 4.875 1.00 1.00 C ATOM 0 H VAL A 92 -17.491 -1.112 6.584 1.00 1.00 H new ATOM 0 HA VAL A 92 -15.481 -3.022 7.815 1.00 1.00 H new ATOM 0 HB VAL A 92 -14.499 -0.949 5.989 1.00 1.00 H new ATOM 0 HG11 VAL A 92 -13.552 -2.916 4.815 1.00 1.00 H new ATOM 0 HG12 VAL A 92 -13.310 -3.044 6.573 1.00 1.00 H new ATOM 0 HG13 VAL A 92 -14.590 -3.992 5.780 1.00 1.00 H new ATOM 0 HG21 VAL A 92 -15.583 -1.773 3.914 1.00 1.00 H new ATOM 0 HG22 VAL A 92 -16.618 -2.849 4.882 1.00 1.00 H new ATOM 0 HG23 VAL A 92 -16.785 -1.084 5.030 1.00 1.00 H new ATOM 1468 N TYR A 93 -16.180 -0.013 8.542 1.00 1.00 N ATOM 1469 CA TYR A 93 -15.831 1.096 9.474 1.00 1.00 C ATOM 1470 C TYR A 93 -14.836 0.614 10.534 1.00 1.00 C ATOM 1471 O TYR A 93 -14.040 1.378 11.041 1.00 1.00 O ATOM 1472 CB TYR A 93 -17.155 1.490 10.128 1.00 1.00 C ATOM 1473 CG TYR A 93 -17.027 2.864 10.738 1.00 1.00 C ATOM 1474 CD1 TYR A 93 -16.135 3.794 10.190 1.00 1.00 C ATOM 1475 CD2 TYR A 93 -17.800 3.211 11.853 1.00 1.00 C ATOM 1476 CE1 TYR A 93 -16.016 5.069 10.756 1.00 1.00 C ATOM 1477 CE2 TYR A 93 -17.681 4.486 12.419 1.00 1.00 C ATOM 1478 CZ TYR A 93 -16.788 5.415 11.870 1.00 1.00 C ATOM 1479 OH TYR A 93 -16.671 6.672 12.429 1.00 1.00 O ATOM 0 H TYR A 93 -17.108 0.048 8.123 1.00 1.00 H new ATOM 0 HA TYR A 93 -15.360 1.933 8.958 1.00 1.00 H new ATOM 0 HB2 TYR A 93 -17.955 1.483 9.387 1.00 1.00 H new ATOM 0 HB3 TYR A 93 -17.424 0.764 10.895 1.00 1.00 H new ATOM 0 HD1 TYR A 93 -15.538 3.528 9.330 1.00 1.00 H new ATOM 0 HD2 TYR A 93 -18.488 2.495 12.277 1.00 1.00 H new ATOM 0 HE1 TYR A 93 -15.328 5.786 10.332 1.00 1.00 H new ATOM 0 HE2 TYR A 93 -18.278 4.753 13.279 1.00 1.00 H new ATOM 0 HH TYR A 93 -17.278 6.748 13.194 1.00 1.00 H new ATOM 1489 N ASP A 94 -14.877 -0.644 10.873 1.00 1.00 N ATOM 1490 CA ASP A 94 -13.933 -1.170 11.901 1.00 1.00 C ATOM 1491 C ASP A 94 -12.644 -1.672 11.241 1.00 1.00 C ATOM 1492 O ASP A 94 -11.561 -1.208 11.538 1.00 1.00 O ATOM 1493 CB ASP A 94 -14.678 -2.325 12.568 1.00 1.00 C ATOM 1494 CG ASP A 94 -15.837 -1.774 13.401 1.00 1.00 C ATOM 1495 OD1 ASP A 94 -15.679 -0.702 13.963 1.00 1.00 O ATOM 1496 OD2 ASP A 94 -16.861 -2.433 13.464 1.00 1.00 O ATOM 0 H ASP A 94 -15.522 -1.331 10.484 1.00 1.00 H new ATOM 0 HA ASP A 94 -13.640 -0.403 12.618 1.00 1.00 H new ATOM 0 HB2 ASP A 94 -15.055 -3.013 11.811 1.00 1.00 H new ATOM 0 HB3 ASP A 94 -13.997 -2.892 13.203 1.00 1.00 H new ATOM 1501 N GLN A 95 -12.754 -2.622 10.353 1.00 1.00 N ATOM 1502 CA GLN A 95 -11.535 -3.162 9.681 1.00 1.00 C ATOM 1503 C GLN A 95 -10.806 -2.057 8.911 1.00 1.00 C ATOM 1504 O GLN A 95 -9.618 -2.139 8.671 1.00 1.00 O ATOM 1505 CB GLN A 95 -12.055 -4.230 8.718 1.00 1.00 C ATOM 1506 CG GLN A 95 -11.427 -5.580 9.065 1.00 1.00 C ATOM 1507 CD GLN A 95 -12.496 -6.509 9.644 1.00 1.00 C ATOM 1508 OE1 GLN A 95 -12.992 -6.281 10.729 1.00 1.00 O ATOM 1509 NE2 GLN A 95 -12.875 -7.553 8.960 1.00 1.00 N ATOM 0 H GLN A 95 -13.634 -3.048 10.063 1.00 1.00 H new ATOM 0 HA GLN A 95 -10.820 -3.566 10.398 1.00 1.00 H new ATOM 0 HB2 GLN A 95 -13.141 -4.295 8.783 1.00 1.00 H new ATOM 0 HB3 GLN A 95 -11.812 -3.958 7.691 1.00 1.00 H new ATOM 0 HG2 GLN A 95 -10.986 -6.027 8.174 1.00 1.00 H new ATOM 0 HG3 GLN A 95 -10.621 -5.443 9.786 1.00 1.00 H new ATOM 0 HE21 GLN A 95 -12.458 -7.744 8.049 1.00 1.00 H new ATOM 0 HE22 GLN A 95 -13.588 -8.178 9.336 1.00 1.00 H new ATOM 1518 N LEU A 96 -11.504 -1.028 8.517 1.00 1.00 N ATOM 1519 CA LEU A 96 -10.838 0.072 7.759 1.00 1.00 C ATOM 1520 C LEU A 96 -10.194 1.074 8.721 1.00 1.00 C ATOM 1521 O LEU A 96 -9.963 2.215 8.377 1.00 1.00 O ATOM 1522 CB LEU A 96 -11.956 0.743 6.961 1.00 1.00 C ATOM 1523 CG LEU A 96 -12.974 -0.310 6.519 1.00 1.00 C ATOM 1524 CD1 LEU A 96 -13.368 -0.058 5.062 1.00 1.00 C ATOM 1525 CD2 LEU A 96 -12.353 -1.702 6.644 1.00 1.00 C ATOM 0 H LEU A 96 -12.502 -0.900 8.685 1.00 1.00 H new ATOM 0 HA LEU A 96 -10.043 -0.302 7.114 1.00 1.00 H new ATOM 0 HB2 LEU A 96 -12.445 1.503 7.570 1.00 1.00 H new ATOM 0 HB3 LEU A 96 -11.541 1.250 6.090 1.00 1.00 H new ATOM 0 HG LEU A 96 -13.859 -0.248 7.152 1.00 1.00 H new ATOM 0 HD11 LEU A 96 -14.093 -0.808 4.746 1.00 1.00 H new ATOM 0 HD12 LEU A 96 -13.809 0.935 4.971 1.00 1.00 H new ATOM 0 HD13 LEU A 96 -12.482 -0.121 4.430 1.00 1.00 H new ATOM 0 HD21 LEU A 96 -13.077 -2.453 6.329 1.00 1.00 H new ATOM 0 HD22 LEU A 96 -11.468 -1.764 6.011 1.00 1.00 H new ATOM 0 HD23 LEU A 96 -12.070 -1.883 7.681 1.00 1.00 H new ATOM 1537 N LYS A 97 -9.898 0.658 9.923 1.00 1.00 N ATOM 1538 CA LYS A 97 -9.266 1.596 10.894 1.00 1.00 C ATOM 1539 C LYS A 97 -8.016 2.225 10.273 1.00 1.00 C ATOM 1540 O LYS A 97 -7.927 3.430 10.138 1.00 1.00 O ATOM 1541 CB LYS A 97 -8.891 0.732 12.097 1.00 1.00 C ATOM 1542 CG LYS A 97 -10.021 0.777 13.128 1.00 1.00 C ATOM 1543 CD LYS A 97 -9.464 0.437 14.512 1.00 1.00 C ATOM 1544 CE LYS A 97 -9.641 -1.060 14.781 1.00 1.00 C ATOM 1545 NZ LYS A 97 -8.258 -1.612 14.800 1.00 1.00 N ATOM 0 H LYS A 97 -10.065 -0.285 10.273 1.00 1.00 H new ATOM 0 HA LYS A 97 -9.931 2.413 11.175 1.00 1.00 H new ATOM 0 HB2 LYS A 97 -8.714 -0.296 11.780 1.00 1.00 H new ATOM 0 HB3 LYS A 97 -7.963 1.092 12.542 1.00 1.00 H new ATOM 0 HG2 LYS A 97 -10.476 1.767 13.141 1.00 1.00 H new ATOM 0 HG3 LYS A 97 -10.804 0.069 12.856 1.00 1.00 H new ATOM 0 HD2 LYS A 97 -8.409 0.705 14.567 1.00 1.00 H new ATOM 0 HD3 LYS A 97 -9.980 1.018 15.276 1.00 1.00 H new ATOM 0 HE2 LYS A 97 -10.149 -1.234 15.730 1.00 1.00 H new ATOM 0 HE3 LYS A 97 -10.244 -1.532 14.006 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 -8.295 -2.636 14.979 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 -7.802 -1.438 13.882 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 -7.710 -1.149 15.552 1.00 1.00 H new ATOM 1558 N PRO A 98 -7.092 1.380 9.907 1.00 1.00 N ATOM 1559 CA PRO A 98 -5.833 1.854 9.282 1.00 1.00 C ATOM 1560 C PRO A 98 -6.146 2.611 7.990 1.00 1.00 C ATOM 1561 O PRO A 98 -5.742 3.742 7.807 1.00 1.00 O ATOM 1562 CB PRO A 98 -5.055 0.570 8.983 1.00 1.00 C ATOM 1563 CG PRO A 98 -5.710 -0.502 9.798 1.00 1.00 C ATOM 1564 CD PRO A 98 -7.133 -0.077 10.040 1.00 1.00 C ATOM 0 HA PRO A 98 -5.272 2.537 9.919 1.00 1.00 H new ATOM 0 HB2 PRO A 98 -5.090 0.330 7.920 1.00 1.00 H new ATOM 0 HB3 PRO A 98 -4.004 0.678 9.251 1.00 1.00 H new ATOM 0 HG2 PRO A 98 -5.679 -1.457 9.273 1.00 1.00 H new ATOM 0 HG3 PRO A 98 -5.185 -0.641 10.743 1.00 1.00 H new ATOM 0 HD2 PRO A 98 -7.813 -0.525 9.315 1.00 1.00 H new ATOM 0 HD3 PRO A 98 -7.477 -0.378 11.029 1.00 1.00 H new ATOM 1572 N LEU A 99 -6.870 1.996 7.093 1.00 1.00 N ATOM 1573 CA LEU A 99 -7.216 2.681 5.816 1.00 1.00 C ATOM 1574 C LEU A 99 -7.857 4.039 6.109 1.00 1.00 C ATOM 1575 O LEU A 99 -7.562 5.028 5.469 1.00 1.00 O ATOM 1576 CB LEU A 99 -8.216 1.752 5.128 1.00 1.00 C ATOM 1577 CG LEU A 99 -7.971 1.762 3.618 1.00 1.00 C ATOM 1578 CD1 LEU A 99 -7.565 0.363 3.157 1.00 1.00 C ATOM 1579 CD2 LEU A 99 -9.255 2.182 2.898 1.00 1.00 C ATOM 0 H LEU A 99 -7.236 1.049 7.190 1.00 1.00 H new ATOM 0 HA LEU A 99 -6.341 2.868 5.193 1.00 1.00 H new ATOM 0 HB2 LEU A 99 -8.113 0.739 5.517 1.00 1.00 H new ATOM 0 HB3 LEU A 99 -9.235 2.074 5.343 1.00 1.00 H new ATOM 0 HG LEU A 99 -7.173 2.467 3.384 1.00 1.00 H new ATOM 0 HD11 LEU A 99 -7.391 0.371 2.081 1.00 1.00 H new ATOM 0 HD12 LEU A 99 -6.652 0.061 3.670 1.00 1.00 H new ATOM 0 HD13 LEU A 99 -8.362 -0.343 3.390 1.00 1.00 H new ATOM 0 HD21 LEU A 99 -9.083 2.190 1.822 1.00 1.00 H new ATOM 0 HD22 LEU A 99 -10.051 1.476 3.133 1.00 1.00 H new ATOM 0 HD23 LEU A 99 -9.546 3.180 3.226 1.00 1.00 H new ATOM 1591 N PHE A 100 -8.731 4.094 7.077 1.00 1.00 N ATOM 1592 CA PHE A 100 -9.388 5.388 7.415 1.00 1.00 C ATOM 1593 C PHE A 100 -8.339 6.403 7.875 1.00 1.00 C ATOM 1594 O PHE A 100 -8.436 7.581 7.591 1.00 1.00 O ATOM 1595 CB PHE A 100 -10.352 5.056 8.555 1.00 1.00 C ATOM 1596 CG PHE A 100 -11.679 4.623 7.980 1.00 1.00 C ATOM 1597 CD1 PHE A 100 -11.718 3.839 6.821 1.00 1.00 C ATOM 1598 CD2 PHE A 100 -12.871 5.005 8.605 1.00 1.00 C ATOM 1599 CE1 PHE A 100 -12.948 3.436 6.287 1.00 1.00 C ATOM 1600 CE2 PHE A 100 -14.102 4.605 8.072 1.00 1.00 C ATOM 1601 CZ PHE A 100 -14.140 3.820 6.912 1.00 1.00 C ATOM 0 H PHE A 100 -9.018 3.299 7.648 1.00 1.00 H new ATOM 0 HA PHE A 100 -9.905 5.828 6.562 1.00 1.00 H new ATOM 0 HB2 PHE A 100 -9.937 4.263 9.178 1.00 1.00 H new ATOM 0 HB3 PHE A 100 -10.488 5.927 9.196 1.00 1.00 H new ATOM 0 HD1 PHE A 100 -10.798 3.545 6.338 1.00 1.00 H new ATOM 0 HD2 PHE A 100 -12.841 5.609 9.500 1.00 1.00 H new ATOM 0 HE1 PHE A 100 -12.977 2.830 5.394 1.00 1.00 H new ATOM 0 HE2 PHE A 100 -15.022 4.901 8.554 1.00 1.00 H new ATOM 0 HZ PHE A 100 -15.089 3.511 6.500 1.00 1.00 H new ATOM 1611 N ASP A 101 -7.334 5.957 8.577 1.00 1.00 N ATOM 1612 CA ASP A 101 -6.278 6.898 9.048 1.00 1.00 C ATOM 1613 C ASP A 101 -5.432 7.368 7.862 1.00 1.00 C ATOM 1614 O ASP A 101 -4.872 8.446 7.873 1.00 1.00 O ATOM 1615 CB ASP A 101 -5.428 6.085 10.026 1.00 1.00 C ATOM 1616 CG ASP A 101 -6.108 6.060 11.396 1.00 1.00 C ATOM 1617 OD1 ASP A 101 -7.114 6.733 11.549 1.00 1.00 O ATOM 1618 OD2 ASP A 101 -5.611 5.368 12.269 1.00 1.00 O ATOM 0 H ASP A 101 -7.198 4.982 8.845 1.00 1.00 H new ATOM 0 HA ASP A 101 -6.694 7.789 9.518 1.00 1.00 H new ATOM 0 HB2 ASP A 101 -5.299 5.069 9.654 1.00 1.00 H new ATOM 0 HB3 ASP A 101 -4.433 6.522 10.110 1.00 1.00 H new ATOM 1805 N LYS A 116 7.881 0.303 6.506 1.00 1.00 N ATOM 1806 CA LYS A 116 8.149 0.433 7.967 1.00 1.00 C ATOM 1807 C LYS A 116 9.009 1.671 8.233 1.00 1.00 C ATOM 1808 O LYS A 116 10.205 1.576 8.428 1.00 1.00 O ATOM 1809 CB LYS A 116 8.906 -0.839 8.348 1.00 1.00 C ATOM 1810 CG LYS A 116 9.285 -0.783 9.829 1.00 1.00 C ATOM 1811 CD LYS A 116 10.113 -2.018 10.192 1.00 1.00 C ATOM 1812 CE LYS A 116 10.151 -2.975 9.000 1.00 1.00 C ATOM 1813 NZ LYS A 116 8.840 -3.681 9.032 1.00 1.00 N ATOM 0 HA LYS A 116 7.234 0.548 8.548 1.00 1.00 H new ATOM 0 HB2 LYS A 116 8.288 -1.715 8.153 1.00 1.00 H new ATOM 0 HB3 LYS A 116 9.802 -0.939 7.736 1.00 1.00 H new ATOM 0 HG2 LYS A 116 9.855 0.123 10.035 1.00 1.00 H new ATOM 0 HG3 LYS A 116 8.386 -0.741 10.444 1.00 1.00 H new ATOM 0 HD2 LYS A 116 11.125 -1.722 10.467 1.00 1.00 H new ATOM 0 HD3 LYS A 116 9.680 -2.517 11.059 1.00 1.00 H new ATOM 0 HE2 LYS A 116 10.285 -2.434 8.063 1.00 1.00 H new ATOM 0 HE3 LYS A 116 10.980 -3.678 9.084 1.00 1.00 H new ATOM 0 HZ1 LYS A 116 8.401 -3.641 8.090 1.00 1.00 H new ATOM 0 HZ2 LYS A 116 8.987 -4.674 9.304 1.00 1.00 H new ATOM 0 HZ3 LYS A 116 8.215 -3.222 9.725 1.00 1.00 H new ATOM 1826 N HIS A 117 8.412 2.830 8.241 1.00 1.00 N ATOM 1827 CA HIS A 117 9.199 4.072 8.493 1.00 1.00 C ATOM 1828 C HIS A 117 8.560 4.884 9.621 1.00 1.00 C ATOM 1829 O HIS A 117 7.371 4.812 9.855 1.00 1.00 O ATOM 1830 CB HIS A 117 9.145 4.848 7.176 1.00 1.00 C ATOM 1831 CG HIS A 117 10.541 5.202 6.744 1.00 1.00 C ATOM 1832 ND1 HIS A 117 11.638 5.031 7.574 1.00 1.00 N ATOM 1833 CD2 HIS A 117 11.035 5.718 5.571 1.00 1.00 C ATOM 1834 CE1 HIS A 117 12.727 5.436 6.896 1.00 1.00 C ATOM 1835 NE2 HIS A 117 12.416 5.865 5.669 1.00 1.00 N ATOM 0 H HIS A 117 7.414 2.972 8.084 1.00 1.00 H new ATOM 0 HA HIS A 117 10.223 3.857 8.799 1.00 1.00 H new ATOM 0 HB2 HIS A 117 8.657 4.248 6.408 1.00 1.00 H new ATOM 0 HB3 HIS A 117 8.551 5.753 7.299 1.00 1.00 H new ATOM 0 HD2 HIS A 117 10.442 5.971 4.704 1.00 1.00 H new ATOM 0 HE1 HIS A 117 13.731 5.417 7.295 1.00 1.00 H new ATOM 0 HE2 HIS A 117 13.053 6.223 4.958 1.00 1.00 H new ATOM 1843 N HIS A 118 9.343 5.659 10.322 1.00 1.00 N ATOM 1844 CA HIS A 118 8.779 6.478 11.433 1.00 1.00 C ATOM 1845 C HIS A 118 8.095 7.726 10.870 1.00 1.00 C ATOM 1846 O HIS A 118 8.650 8.437 10.056 1.00 1.00 O ATOM 1847 CB HIS A 118 9.983 6.863 12.291 1.00 1.00 C ATOM 1848 CG HIS A 118 11.195 6.107 11.821 1.00 1.00 C ATOM 1849 ND1 HIS A 118 11.307 4.732 11.957 1.00 1.00 N ATOM 1850 CD2 HIS A 118 12.356 6.519 11.216 1.00 1.00 C ATOM 1851 CE1 HIS A 118 12.496 4.369 11.444 1.00 1.00 C ATOM 1852 NE2 HIS A 118 13.177 5.420 10.979 1.00 1.00 N ATOM 0 H HIS A 118 10.347 5.760 10.174 1.00 1.00 H new ATOM 0 HA HIS A 118 8.028 5.937 12.009 1.00 1.00 H new ATOM 0 HB2 HIS A 118 10.162 7.936 12.225 1.00 1.00 H new ATOM 0 HB3 HIS A 118 9.784 6.637 13.339 1.00 1.00 H new ATOM 0 HD2 HIS A 118 12.596 7.541 10.962 1.00 1.00 H new ATOM 0 HE1 HIS A 118 12.856 3.351 11.412 1.00 1.00 H new ATOM 0 HE2 HIS A 118 14.100 5.418 10.544 1.00 1.00 H new ATOM 1860 N HIS A 119 6.889 7.996 11.291 1.00 1.00 N ATOM 1861 CA HIS A 119 6.169 9.194 10.773 1.00 1.00 C ATOM 1862 C HIS A 119 6.878 10.478 11.214 1.00 1.00 C ATOM 1863 O HIS A 119 7.471 10.541 12.271 1.00 1.00 O ATOM 1864 CB HIS A 119 4.773 9.113 11.391 1.00 1.00 C ATOM 1865 CG HIS A 119 3.737 9.287 10.314 1.00 1.00 C ATOM 1866 ND1 HIS A 119 2.439 9.684 10.595 1.00 1.00 N ATOM 1867 CD2 HIS A 119 3.793 9.123 8.952 1.00 1.00 C ATOM 1868 CE1 HIS A 119 1.772 9.743 9.428 1.00 1.00 C ATOM 1869 NE2 HIS A 119 2.551 9.411 8.395 1.00 1.00 N ATOM 0 H HIS A 119 6.372 7.439 11.971 1.00 1.00 H new ATOM 0 HA HIS A 119 6.135 9.213 9.684 1.00 1.00 H new ATOM 0 HB2 HIS A 119 4.639 8.152 11.888 1.00 1.00 H new ATOM 0 HB3 HIS A 119 4.655 9.884 12.152 1.00 1.00 H new ATOM 0 HD2 HIS A 119 4.668 8.817 8.398 1.00 1.00 H new ATOM 0 HE1 HIS A 119 0.733 10.025 9.338 1.00 1.00 H new ATOM 0 HE2 HIS A 119 2.291 9.376 7.409 1.00 1.00 H new ATOM 1877 N ALA A 120 6.818 11.501 10.405 1.00 1.00 N ATOM 1878 CA ALA A 120 7.484 12.785 10.769 1.00 1.00 C ATOM 1879 C ALA A 120 7.504 12.967 12.288 1.00 1.00 C ATOM 1880 O ALA A 120 6.851 12.249 13.019 1.00 1.00 O ATOM 1881 CB ALA A 120 6.634 13.871 10.110 1.00 1.00 C ATOM 0 H ALA A 120 6.336 11.503 9.506 1.00 1.00 H new ATOM 0 HA ALA A 120 8.521 12.818 10.436 1.00 1.00 H new ATOM 0 HB1 ALA A 120 7.059 14.850 10.331 1.00 1.00 H new ATOM 0 HB2 ALA A 120 6.619 13.717 9.031 1.00 1.00 H new ATOM 0 HB3 ALA A 120 5.616 13.822 10.497 1.00 1.00 H new ATOM 1887 N SER A 121 8.245 13.928 12.766 1.00 1.00 N ATOM 1888 CA SER A 121 8.307 14.165 14.236 1.00 1.00 C ATOM 1889 C SER A 121 7.309 15.257 14.628 1.00 1.00 C ATOM 1890 O SER A 121 7.464 16.408 14.275 1.00 1.00 O ATOM 1891 CB SER A 121 9.739 14.625 14.505 1.00 1.00 C ATOM 1892 OG SER A 121 9.982 15.838 13.804 1.00 1.00 O ATOM 0 H SER A 121 8.811 14.561 12.201 1.00 1.00 H new ATOM 0 HA SER A 121 8.054 13.275 14.812 1.00 1.00 H new ATOM 0 HB2 SER A 121 9.891 14.773 15.574 1.00 1.00 H new ATOM 0 HB3 SER A 121 10.445 13.859 14.185 1.00 1.00 H new ATOM 0 HG SER A 121 9.268 16.479 14.003 1.00 1.00 H new ATOM 1898 N LYS A 122 6.286 14.904 15.356 1.00 1.00 N ATOM 1899 CA LYS A 122 5.283 15.925 15.767 1.00 1.00 C ATOM 1900 C LYS A 122 5.325 16.129 17.284 1.00 1.00 C ATOM 1901 O LYS A 122 4.639 15.457 18.029 1.00 1.00 O ATOM 1902 CB LYS A 122 3.933 15.347 15.341 1.00 1.00 C ATOM 1903 CG LYS A 122 4.029 13.822 15.272 1.00 1.00 C ATOM 1904 CD LYS A 122 4.134 13.381 13.811 1.00 1.00 C ATOM 1905 CE LYS A 122 2.733 13.114 13.255 1.00 1.00 C ATOM 1906 NZ LYS A 122 2.936 12.879 11.798 1.00 1.00 N ATOM 0 H LYS A 122 6.102 13.956 15.683 1.00 1.00 H new ATOM 0 HA LYS A 122 5.473 16.897 15.311 1.00 1.00 H new ATOM 0 HB2 LYS A 122 3.159 15.641 16.050 1.00 1.00 H new ATOM 0 HB3 LYS A 122 3.644 15.748 14.369 1.00 1.00 H new ATOM 0 HG2 LYS A 122 4.899 13.477 15.830 1.00 1.00 H new ATOM 0 HG3 LYS A 122 3.152 13.371 15.737 1.00 1.00 H new ATOM 0 HD2 LYS A 122 4.629 14.153 13.222 1.00 1.00 H new ATOM 0 HD3 LYS A 122 4.744 12.481 13.735 1.00 1.00 H new ATOM 0 HE2 LYS A 122 2.276 12.248 13.735 1.00 1.00 H new ATOM 0 HE3 LYS A 122 2.071 13.962 13.430 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 2.362 13.554 11.254 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 3.940 13.010 11.562 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 2.648 11.909 11.559 1.00 1.00 H new ATOM 1919 N VAL A 123 6.125 17.050 17.749 1.00 1.00 N ATOM 1920 CA VAL A 123 6.206 17.290 19.219 1.00 1.00 C ATOM 1921 C VAL A 123 5.615 18.659 19.566 1.00 1.00 C ATOM 1922 O VAL A 123 5.754 19.612 18.824 1.00 1.00 O ATOM 1923 CB VAL A 123 7.699 17.252 19.545 1.00 1.00 C ATOM 1924 CG1 VAL A 123 8.437 18.275 18.679 1.00 1.00 C ATOM 1925 CG2 VAL A 123 7.905 17.594 21.023 1.00 1.00 C ATOM 0 H VAL A 123 6.724 17.645 17.177 1.00 1.00 H new ATOM 0 HA VAL A 123 5.645 16.549 19.789 1.00 1.00 H new ATOM 0 HB VAL A 123 8.090 16.255 19.343 1.00 1.00 H new ATOM 0 HG11 VAL A 123 9.502 18.248 18.911 1.00 1.00 H new ATOM 0 HG12 VAL A 123 8.289 18.035 17.626 1.00 1.00 H new ATOM 0 HG13 VAL A 123 8.047 19.272 18.882 1.00 1.00 H new ATOM 0 HG21 VAL A 123 8.969 17.567 21.258 1.00 1.00 H new ATOM 0 HG22 VAL A 123 7.514 18.591 21.224 1.00 1.00 H new ATOM 0 HG23 VAL A 123 7.379 16.867 21.641 1.00 1.00 H new ATOM 1935 N ASP A 124 4.955 18.764 20.687 1.00 1.00 N ATOM 1936 CA ASP A 124 4.356 20.072 21.080 1.00 1.00 C ATOM 1937 C ASP A 124 5.337 20.864 21.948 1.00 1.00 C ATOM 1938 O ASP A 124 6.053 20.243 22.715 1.00 1.00 O ATOM 1939 CB ASP A 124 3.104 19.708 21.878 1.00 1.00 C ATOM 1940 CG ASP A 124 2.651 18.295 21.504 1.00 1.00 C ATOM 1941 OD1 ASP A 124 3.221 17.353 22.030 1.00 1.00 O ATOM 1942 OD2 ASP A 124 1.744 18.180 20.698 1.00 1.00 O ATOM 0 H ASP A 124 4.804 18.001 21.348 1.00 1.00 H new ATOM 0 HA ASP A 124 4.123 20.696 20.218 1.00 1.00 H new ATOM 0 HB2 ASP A 124 3.312 19.763 22.946 1.00 1.00 H new ATOM 0 HB3 ASP A 124 2.308 20.423 21.671 1.00 1.00 H new