USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 1077 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 Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 120:sc= 0.0472 USER MOD Single : A 10 ASN : amide:sc= -2.69! X(o=-2.7!,f=-2.3) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= 0.127 X(o=0.13,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 34:sc= 0.246 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00772) USER MOD Single : A 41 LYS NZ :NH3+ -167:sc= 0.683 (180deg=0.359) USER MOD Single : A 46 LYS NZ :NH3+ -151:sc= 1.77 (180deg=0.899) USER MOD Single : A 49 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000758) USER MOD Single : A 50 GLN : amide:sc= -0.226 X(o=-0.23,f=-0.11) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot -99:sc= -0.201 USER MOD Single : A 74 GLN : amide:sc= -0.945 K(o=-0.95,f=-0.27) USER MOD Single : A 75 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0629) USER MOD Single : A 84 LYS NZ :NH3+ -166:sc= -1.44 (180deg=-2.99!) USER MOD Single : A 87 GLN : amide:sc= -0.408 K(o=-0.41,f=-4.3!) USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.121 X(o=-0.12,f=-0.16) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 THR OG1 : rot -140:sc= -0.34 USER MOD Single : A 111 ASN : amide:sc= -4.01! K(o=-4!,f=-1.5) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 138:sc= -1.16 (180deg=-3.42!) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 137:sc= -0.117 (180deg=-1.65!) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 -3.162 -13.386 -1.981 1.00 63.41 N ATOM 21 CA GLY A 2 -1.827 -12.858 -1.653 1.00 52.41 C ATOM 22 C GLY A 2 -1.547 -11.519 -2.332 1.00 74.11 C ATOM 23 O GLY A 2 -0.906 -11.469 -3.388 1.00 1.13 O ATOM 0 HA2 GLY A 2 -1.742 -12.739 -0.573 1.00 52.41 H new ATOM 0 HA3 GLY A 2 -1.069 -13.581 -1.955 1.00 52.41 H new ATOM 27 N THR A 3 -2.059 -10.433 -1.727 1.00 4.15 N ATOM 28 CA THR A 3 -1.874 -9.063 -2.227 1.00 40.35 C ATOM 29 C THR A 3 -1.233 -8.186 -1.137 1.00 1.55 C ATOM 30 O THR A 3 -1.532 -8.347 0.055 1.00 12.01 O ATOM 31 CB THR A 3 -3.239 -8.438 -2.669 1.00 5.11 C ATOM 32 OG1 THR A 3 -3.964 -9.368 -3.490 1.00 10.31 O ATOM 33 CG2 THR A 3 -3.073 -7.119 -3.443 1.00 54.51 C ATOM 0 H THR A 3 -2.615 -10.483 -0.873 1.00 4.15 H new ATOM 0 HA THR A 3 -1.215 -9.105 -3.095 1.00 40.35 H new ATOM 0 HB THR A 3 -3.789 -8.219 -1.753 1.00 5.11 H new ATOM 0 HG1 THR A 3 -4.817 -8.969 -3.761 1.00 10.31 H new ATOM 0 HG21 THR A 3 -4.054 -6.735 -3.722 1.00 54.51 H new ATOM 0 HG22 THR A 3 -2.563 -6.389 -2.814 1.00 54.51 H new ATOM 0 HG23 THR A 3 -2.484 -7.297 -4.343 1.00 54.51 H new ATOM 41 N VAL A 4 -0.357 -7.262 -1.558 1.00 64.04 N ATOM 42 CA VAL A 4 0.276 -6.277 -0.675 1.00 74.23 C ATOM 43 C VAL A 4 -0.271 -4.909 -1.086 1.00 23.14 C ATOM 44 O VAL A 4 0.004 -4.448 -2.195 1.00 32.11 O ATOM 45 CB VAL A 4 1.849 -6.315 -0.824 1.00 65.31 C ATOM 46 CG1 VAL A 4 2.544 -5.263 0.068 1.00 52.15 C ATOM 47 CG2 VAL A 4 2.396 -7.729 -0.527 1.00 3.20 C ATOM 0 H VAL A 4 -0.066 -7.178 -2.532 1.00 64.04 H new ATOM 0 HA VAL A 4 0.053 -6.492 0.370 1.00 74.23 H new ATOM 0 HB VAL A 4 2.078 -6.063 -1.859 1.00 65.31 H new ATOM 0 HG11 VAL A 4 3.624 -5.327 -0.068 1.00 52.15 H new ATOM 0 HG12 VAL A 4 2.201 -4.266 -0.210 1.00 52.15 H new ATOM 0 HG13 VAL A 4 2.298 -5.452 1.113 1.00 52.15 H new ATOM 0 HG21 VAL A 4 3.481 -7.730 -0.636 1.00 3.20 H new ATOM 0 HG22 VAL A 4 2.134 -8.014 0.492 1.00 3.20 H new ATOM 0 HG23 VAL A 4 1.960 -8.442 -1.227 1.00 3.20 H new ATOM 57 N VAL A 5 -1.057 -4.270 -0.204 1.00 62.24 N ATOM 58 CA VAL A 5 -1.734 -3.000 -0.523 1.00 4.31 C ATOM 59 C VAL A 5 -0.992 -1.820 0.137 1.00 20.23 C ATOM 60 O VAL A 5 -0.878 -1.746 1.356 1.00 74.34 O ATOM 61 CB VAL A 5 -3.276 -3.030 -0.157 1.00 51.12 C ATOM 62 CG1 VAL A 5 -4.041 -4.015 -1.078 1.00 64.22 C ATOM 63 CG2 VAL A 5 -3.532 -3.383 1.323 1.00 73.52 C ATOM 0 H VAL A 5 -1.240 -4.613 0.739 1.00 62.24 H new ATOM 0 HA VAL A 5 -1.694 -2.858 -1.603 1.00 4.31 H new ATOM 0 HB VAL A 5 -3.651 -2.019 -0.318 1.00 51.12 H new ATOM 0 HG11 VAL A 5 -5.097 -4.019 -0.809 1.00 64.22 H new ATOM 0 HG12 VAL A 5 -3.932 -3.701 -2.116 1.00 64.22 H new ATOM 0 HG13 VAL A 5 -3.632 -5.018 -0.958 1.00 64.22 H new ATOM 0 HG21 VAL A 5 -4.605 -3.389 1.515 1.00 73.52 H new ATOM 0 HG22 VAL A 5 -3.120 -4.369 1.539 1.00 73.52 H new ATOM 0 HG23 VAL A 5 -3.053 -2.641 1.962 1.00 73.52 H new ATOM 73 N ILE A 6 -0.440 -0.921 -0.695 1.00 34.22 N ATOM 74 CA ILE A 6 0.393 0.205 -0.228 1.00 1.13 C ATOM 75 C ILE A 6 -0.416 1.501 -0.344 1.00 63.35 C ATOM 76 O ILE A 6 -0.644 1.987 -1.454 1.00 20.20 O ATOM 77 CB ILE A 6 1.719 0.370 -1.071 1.00 31.30 C ATOM 78 CG1 ILE A 6 2.448 -0.995 -1.315 1.00 23.10 C ATOM 79 CG2 ILE A 6 2.673 1.395 -0.400 1.00 4.43 C ATOM 80 CD1 ILE A 6 3.023 -1.661 -0.085 1.00 4.32 C ATOM 0 H ILE A 6 -0.557 -0.952 -1.708 1.00 34.22 H new ATOM 0 HA ILE A 6 0.675 -0.004 0.804 1.00 1.13 H new ATOM 0 HB ILE A 6 1.428 0.751 -2.050 1.00 31.30 H new ATOM 0 HG12 ILE A 6 1.744 -1.683 -1.783 1.00 23.10 H new ATOM 0 HG13 ILE A 6 3.256 -0.832 -2.028 1.00 23.10 H new ATOM 0 HG21 ILE A 6 3.580 1.493 -0.997 1.00 4.43 H new ATOM 0 HG22 ILE A 6 2.177 2.363 -0.332 1.00 4.43 H new ATOM 0 HG23 ILE A 6 2.933 1.049 0.600 1.00 4.43 H new ATOM 0 HD11 ILE A 6 3.504 -2.597 -0.369 1.00 4.32 H new ATOM 0 HD12 ILE A 6 3.758 -1.001 0.376 1.00 4.32 H new ATOM 0 HD13 ILE A 6 2.222 -1.866 0.626 1.00 4.32 H new ATOM 92 N VAL A 7 -0.851 2.055 0.789 1.00 33.32 N ATOM 93 CA VAL A 7 -1.614 3.305 0.807 1.00 62.52 C ATOM 94 C VAL A 7 -0.662 4.487 0.878 1.00 73.13 C ATOM 95 O VAL A 7 0.135 4.601 1.809 1.00 30.04 O ATOM 96 CB VAL A 7 -2.614 3.369 1.997 1.00 45.35 C ATOM 97 CG1 VAL A 7 -3.471 4.661 1.964 1.00 0.25 C ATOM 98 CG2 VAL A 7 -3.498 2.127 1.996 1.00 72.53 C ATOM 0 H VAL A 7 -0.687 1.654 1.713 1.00 33.32 H new ATOM 0 HA VAL A 7 -2.196 3.345 -0.114 1.00 62.52 H new ATOM 0 HB VAL A 7 -2.038 3.396 2.922 1.00 45.35 H new ATOM 0 HG11 VAL A 7 -4.156 4.665 2.812 1.00 0.25 H new ATOM 0 HG12 VAL A 7 -2.818 5.532 2.020 1.00 0.25 H new ATOM 0 HG13 VAL A 7 -4.042 4.695 1.036 1.00 0.25 H new ATOM 0 HG21 VAL A 7 -4.196 2.177 2.831 1.00 72.53 H new ATOM 0 HG22 VAL A 7 -4.055 2.077 1.060 1.00 72.53 H new ATOM 0 HG23 VAL A 7 -2.876 1.238 2.096 1.00 72.53 H new ATOM 108 N VAL A 8 -0.742 5.352 -0.131 1.00 13.23 N ATOM 109 CA VAL A 8 0.059 6.566 -0.207 1.00 43.31 C ATOM 110 C VAL A 8 -0.864 7.782 -0.298 1.00 13.51 C ATOM 111 O VAL A 8 -1.917 7.725 -0.942 1.00 45.24 O ATOM 112 CB VAL A 8 1.048 6.534 -1.425 1.00 54.11 C ATOM 113 CG1 VAL A 8 1.907 7.814 -1.468 1.00 62.23 C ATOM 114 CG2 VAL A 8 1.939 5.266 -1.390 1.00 31.32 C ATOM 0 H VAL A 8 -1.371 5.226 -0.924 1.00 13.23 H new ATOM 0 HA VAL A 8 0.663 6.634 0.698 1.00 43.31 H new ATOM 0 HB VAL A 8 0.454 6.496 -2.338 1.00 54.11 H new ATOM 0 HG11 VAL A 8 2.585 7.769 -2.321 1.00 62.23 H new ATOM 0 HG12 VAL A 8 1.258 8.684 -1.566 1.00 62.23 H new ATOM 0 HG13 VAL A 8 2.486 7.895 -0.548 1.00 62.23 H new ATOM 0 HG21 VAL A 8 2.614 5.272 -2.246 1.00 31.32 H new ATOM 0 HG22 VAL A 8 2.522 5.256 -0.469 1.00 31.32 H new ATOM 0 HG23 VAL A 8 1.309 4.377 -1.430 1.00 31.32 H new ATOM 124 N SER A 9 -0.464 8.874 0.364 1.00 64.13 N ATOM 125 CA SER A 9 -1.195 10.145 0.324 1.00 64.11 C ATOM 126 C SER A 9 -0.236 11.311 0.564 1.00 43.50 C ATOM 127 O SER A 9 0.796 11.158 1.226 1.00 31.25 O ATOM 128 CB SER A 9 -2.334 10.149 1.373 1.00 30.44 C ATOM 129 OG SER A 9 -3.040 11.378 1.377 1.00 22.41 O ATOM 0 H SER A 9 0.376 8.901 0.942 1.00 64.13 H new ATOM 0 HA SER A 9 -1.642 10.261 -0.663 1.00 64.11 H new ATOM 0 HB2 SER A 9 -3.025 9.333 1.162 1.00 30.44 H new ATOM 0 HB3 SER A 9 -1.917 9.966 2.363 1.00 30.44 H new ATOM 0 HG SER A 9 -3.983 11.214 1.165 1.00 22.41 H new ATOM 135 N ASN A 10 -0.614 12.490 0.035 1.00 71.11 N ATOM 136 CA ASN A 10 0.142 13.747 0.221 1.00 24.13 C ATOM 137 C ASN A 10 -0.169 14.384 1.598 1.00 11.22 C ATOM 138 O ASN A 10 0.339 15.466 1.917 1.00 22.23 O ATOM 139 CB ASN A 10 -0.162 14.751 -0.933 1.00 34.21 C ATOM 140 CG ASN A 10 0.228 14.224 -2.329 1.00 10.03 C ATOM 141 OD1 ASN A 10 1.143 13.409 -2.477 1.00 2.14 O ATOM 142 ND2 ASN A 10 -0.435 14.717 -3.367 1.00 44.20 N ATOM 0 H ASN A 10 -1.453 12.600 -0.534 1.00 71.11 H new ATOM 0 HA ASN A 10 1.205 13.507 0.194 1.00 24.13 H new ATOM 0 HB2 ASN A 10 -1.226 14.987 -0.927 1.00 34.21 H new ATOM 0 HB3 ASN A 10 0.372 15.682 -0.743 1.00 34.21 H new ATOM 0 HD21 ASN A 10 -0.192 14.424 -4.313 1.00 44.20 H new ATOM 0 HD22 ASN A 10 -1.187 15.389 -3.219 1.00 44.20 H new ATOM 149 N ASP A 11 -0.990 13.690 2.407 1.00 11.43 N ATOM 150 CA ASP A 11 -1.346 14.107 3.770 1.00 44.42 C ATOM 151 C ASP A 11 -1.201 12.916 4.744 1.00 15.22 C ATOM 152 O ASP A 11 -1.597 11.785 4.424 1.00 1.00 O ATOM 153 CB ASP A 11 -2.787 14.668 3.792 1.00 42.52 C ATOM 154 CG ASP A 11 -3.241 15.129 5.190 1.00 51.10 C ATOM 155 OD1 ASP A 11 -2.873 16.244 5.609 1.00 71.02 O ATOM 156 OD2 ASP A 11 -3.957 14.382 5.871 1.00 4.51 O ATOM 0 H ASP A 11 -1.429 12.813 2.126 1.00 11.43 H new ATOM 0 HA ASP A 11 -0.667 14.896 4.093 1.00 44.42 H new ATOM 0 HB2 ASP A 11 -2.853 15.508 3.101 1.00 42.52 H new ATOM 0 HB3 ASP A 11 -3.473 13.903 3.429 1.00 42.52 H new ATOM 161 N GLU A 12 -0.637 13.204 5.934 1.00 75.12 N ATOM 162 CA GLU A 12 -0.338 12.200 6.973 1.00 44.31 C ATOM 163 C GLU A 12 -1.616 11.732 7.689 1.00 15.25 C ATOM 164 O GLU A 12 -1.722 10.568 8.075 1.00 62.43 O ATOM 165 CB GLU A 12 0.649 12.780 8.021 1.00 41.42 C ATOM 166 CG GLU A 12 1.956 13.341 7.436 1.00 3.25 C ATOM 167 CD GLU A 12 2.885 13.946 8.504 1.00 74.55 C ATOM 168 OE1 GLU A 12 3.470 13.177 9.292 1.00 12.54 O ATOM 169 OE2 GLU A 12 3.043 15.184 8.555 1.00 42.12 O ATOM 0 H GLU A 12 -0.373 14.152 6.203 1.00 75.12 H new ATOM 0 HA GLU A 12 0.116 11.344 6.474 1.00 44.31 H new ATOM 0 HB2 GLU A 12 0.145 13.573 8.574 1.00 41.42 H new ATOM 0 HB3 GLU A 12 0.895 11.998 8.739 1.00 41.42 H new ATOM 0 HG2 GLU A 12 2.484 12.544 6.913 1.00 3.25 H new ATOM 0 HG3 GLU A 12 1.717 14.105 6.696 1.00 3.25 H new ATOM 176 N ARG A 13 -2.570 12.659 7.893 1.00 31.11 N ATOM 177 CA ARG A 13 -3.832 12.364 8.597 1.00 34.35 C ATOM 178 C ARG A 13 -4.748 11.451 7.771 1.00 51.45 C ATOM 179 O ARG A 13 -5.567 10.743 8.349 1.00 22.34 O ATOM 180 CB ARG A 13 -4.590 13.660 9.007 1.00 63.31 C ATOM 181 CG ARG A 13 -4.341 14.141 10.464 1.00 14.00 C ATOM 182 CD ARG A 13 -5.565 14.889 11.031 1.00 22.01 C ATOM 183 NE ARG A 13 -6.825 14.144 10.779 1.00 11.40 N ATOM 184 CZ ARG A 13 -7.188 12.990 11.373 1.00 73.42 C ATOM 185 NH1 ARG A 13 -6.426 12.427 12.299 1.00 24.14 N ATOM 186 NH2 ARG A 13 -8.290 12.366 10.971 1.00 73.14 N ATOM 0 H ARG A 13 -2.489 13.626 7.578 1.00 31.11 H new ATOM 0 HA ARG A 13 -3.555 11.834 9.508 1.00 34.35 H new ATOM 0 HB2 ARG A 13 -4.305 14.460 8.324 1.00 63.31 H new ATOM 0 HB3 ARG A 13 -5.659 13.494 8.874 1.00 63.31 H new ATOM 0 HG2 ARG A 13 -4.112 13.284 11.097 1.00 14.00 H new ATOM 0 HG3 ARG A 13 -3.470 14.796 10.488 1.00 14.00 H new ATOM 0 HD2 ARG A 13 -5.437 15.037 12.103 1.00 22.01 H new ATOM 0 HD3 ARG A 13 -5.630 15.878 10.578 1.00 22.01 H new ATOM 0 HE ARG A 13 -7.472 14.540 10.097 1.00 11.40 H new ATOM 0 HH11 ARG A 13 -5.548 12.867 12.574 1.00 24.14 H new ATOM 0 HH12 ARG A 13 -6.718 11.553 12.737 1.00 24.14 H new ATOM 0 HH21 ARG A 13 -8.854 12.761 10.218 1.00 73.14 H new ATOM 0 HH22 ARG A 13 -8.572 11.492 11.415 1.00 73.14 H new ATOM 200 N ILE A 14 -4.631 11.500 6.431 1.00 33.21 N ATOM 201 CA ILE A 14 -5.344 10.565 5.552 1.00 11.53 C ATOM 202 C ILE A 14 -4.815 9.145 5.805 1.00 52.54 C ATOM 203 O ILE A 14 -5.588 8.212 5.957 1.00 3.42 O ATOM 204 CB ILE A 14 -5.205 10.959 4.032 1.00 15.12 C ATOM 205 CG1 ILE A 14 -5.807 12.375 3.772 1.00 54.13 C ATOM 206 CG2 ILE A 14 -5.852 9.909 3.092 1.00 50.44 C ATOM 207 CD1 ILE A 14 -7.277 12.534 4.139 1.00 35.50 C ATOM 0 H ILE A 14 -4.050 12.177 5.938 1.00 33.21 H new ATOM 0 HA ILE A 14 -6.408 10.608 5.785 1.00 11.53 H new ATOM 0 HB ILE A 14 -4.140 10.982 3.803 1.00 15.12 H new ATOM 0 HG12 ILE A 14 -5.228 13.107 4.335 1.00 54.13 H new ATOM 0 HG13 ILE A 14 -5.685 12.615 2.716 1.00 54.13 H new ATOM 0 HG21 ILE A 14 -5.731 10.225 2.056 1.00 50.44 H new ATOM 0 HG22 ILE A 14 -5.367 8.944 3.236 1.00 50.44 H new ATOM 0 HG23 ILE A 14 -6.914 9.820 3.322 1.00 50.44 H new ATOM 0 HD11 ILE A 14 -7.598 13.552 3.921 1.00 35.50 H new ATOM 0 HD12 ILE A 14 -7.875 11.832 3.558 1.00 35.50 H new ATOM 0 HD13 ILE A 14 -7.411 12.331 5.202 1.00 35.50 H new ATOM 219 N LEU A 15 -3.483 9.022 5.921 1.00 11.21 N ATOM 220 CA LEU A 15 -2.810 7.746 6.228 1.00 64.14 C ATOM 221 C LEU A 15 -3.169 7.235 7.644 1.00 31.21 C ATOM 222 O LEU A 15 -3.279 6.028 7.859 1.00 71.30 O ATOM 223 CB LEU A 15 -1.278 7.919 6.090 1.00 51.05 C ATOM 224 CG LEU A 15 -0.769 8.305 4.671 1.00 45.20 C ATOM 225 CD1 LEU A 15 0.748 8.564 4.677 1.00 33.04 C ATOM 226 CD2 LEU A 15 -1.154 7.221 3.638 1.00 0.05 C ATOM 0 H LEU A 15 -2.840 9.805 5.805 1.00 11.21 H new ATOM 0 HA LEU A 15 -3.158 6.999 5.515 1.00 64.14 H new ATOM 0 HB2 LEU A 15 -0.952 8.685 6.794 1.00 51.05 H new ATOM 0 HB3 LEU A 15 -0.797 6.987 6.388 1.00 51.05 H new ATOM 0 HG LEU A 15 -1.256 9.234 4.376 1.00 45.20 H new ATOM 0 HD11 LEU A 15 1.075 8.832 3.672 1.00 33.04 H new ATOM 0 HD12 LEU A 15 0.975 9.381 5.362 1.00 33.04 H new ATOM 0 HD13 LEU A 15 1.270 7.663 5.001 1.00 33.04 H new ATOM 0 HD21 LEU A 15 -0.788 7.511 2.653 1.00 0.05 H new ATOM 0 HD22 LEU A 15 -0.707 6.269 3.925 1.00 0.05 H new ATOM 0 HD23 LEU A 15 -2.239 7.117 3.606 1.00 0.05 H new ATOM 238 N GLU A 16 -3.345 8.173 8.595 1.00 21.12 N ATOM 239 CA GLU A 16 -3.657 7.859 10.007 1.00 62.32 C ATOM 240 C GLU A 16 -5.115 7.384 10.145 1.00 74.42 C ATOM 241 O GLU A 16 -5.388 6.385 10.809 1.00 40.41 O ATOM 242 CB GLU A 16 -3.407 9.101 10.897 1.00 63.04 C ATOM 243 CG GLU A 16 -3.596 8.864 12.411 1.00 11.04 C ATOM 244 CD GLU A 16 -3.449 10.152 13.234 1.00 71.15 C ATOM 245 OE1 GLU A 16 -2.302 10.587 13.485 1.00 45.01 O ATOM 246 OE2 GLU A 16 -4.475 10.758 13.608 1.00 54.25 O ATOM 0 H GLU A 16 -3.275 9.173 8.407 1.00 21.12 H new ATOM 0 HA GLU A 16 -3.001 7.054 10.338 1.00 62.32 H new ATOM 0 HB2 GLU A 16 -2.391 9.456 10.724 1.00 63.04 H new ATOM 0 HB3 GLU A 16 -4.081 9.898 10.582 1.00 63.04 H new ATOM 0 HG2 GLU A 16 -4.583 8.435 12.587 1.00 11.04 H new ATOM 0 HG3 GLU A 16 -2.865 8.132 12.754 1.00 11.04 H new ATOM 253 N GLU A 17 -6.031 8.120 9.492 1.00 55.15 N ATOM 254 CA GLU A 17 -7.470 7.805 9.470 1.00 2.14 C ATOM 255 C GLU A 17 -7.704 6.428 8.829 1.00 54.34 C ATOM 256 O GLU A 17 -8.400 5.574 9.389 1.00 34.22 O ATOM 257 CB GLU A 17 -8.224 8.915 8.688 1.00 21.51 C ATOM 258 CG GLU A 17 -9.760 8.814 8.738 1.00 74.35 C ATOM 259 CD GLU A 17 -10.331 8.950 10.156 1.00 25.32 C ATOM 260 OE1 GLU A 17 -10.068 9.973 10.815 1.00 74.41 O ATOM 261 OE2 GLU A 17 -11.037 8.038 10.627 1.00 25.12 O ATOM 0 H GLU A 17 -5.791 8.957 8.960 1.00 55.15 H new ATOM 0 HA GLU A 17 -7.852 7.768 10.490 1.00 2.14 H new ATOM 0 HB2 GLU A 17 -7.925 9.885 9.084 1.00 21.51 H new ATOM 0 HB3 GLU A 17 -7.906 8.885 7.646 1.00 21.51 H new ATOM 0 HG2 GLU A 17 -10.189 9.591 8.105 1.00 74.35 H new ATOM 0 HG3 GLU A 17 -10.068 7.856 8.320 1.00 74.35 H new ATOM 268 N LEU A 18 -7.067 6.235 7.668 1.00 42.11 N ATOM 269 CA LEU A 18 -7.139 4.999 6.876 1.00 4.32 C ATOM 270 C LEU A 18 -6.462 3.819 7.603 1.00 22.31 C ATOM 271 O LEU A 18 -6.861 2.669 7.405 1.00 15.31 O ATOM 272 CB LEU A 18 -6.512 5.239 5.471 1.00 12.32 C ATOM 273 CG LEU A 18 -7.468 5.776 4.352 1.00 33.22 C ATOM 274 CD1 LEU A 18 -8.269 7.015 4.794 1.00 44.51 C ATOM 275 CD2 LEU A 18 -6.672 6.066 3.069 1.00 32.43 C ATOM 0 H LEU A 18 -6.474 6.948 7.243 1.00 42.11 H new ATOM 0 HA LEU A 18 -8.187 4.728 6.749 1.00 4.32 H new ATOM 0 HB2 LEU A 18 -5.689 5.945 5.583 1.00 12.32 H new ATOM 0 HB3 LEU A 18 -6.081 4.299 5.127 1.00 12.32 H new ATOM 0 HG LEU A 18 -8.200 4.993 4.151 1.00 33.22 H new ATOM 0 HD11 LEU A 18 -8.913 7.342 3.978 1.00 44.51 H new ATOM 0 HD12 LEU A 18 -8.880 6.763 5.661 1.00 44.51 H new ATOM 0 HD13 LEU A 18 -7.581 7.818 5.057 1.00 44.51 H new ATOM 0 HD21 LEU A 18 -7.347 6.439 2.298 1.00 32.43 H new ATOM 0 HD22 LEU A 18 -5.909 6.816 3.276 1.00 32.43 H new ATOM 0 HD23 LEU A 18 -6.195 5.149 2.721 1.00 32.43 H new ATOM 287 N LEU A 19 -5.437 4.118 8.436 1.00 62.11 N ATOM 288 CA LEU A 19 -4.773 3.114 9.300 1.00 44.24 C ATOM 289 C LEU A 19 -5.806 2.445 10.203 1.00 21.44 C ATOM 290 O LEU A 19 -5.873 1.215 10.304 1.00 4.12 O ATOM 291 CB LEU A 19 -3.688 3.780 10.178 1.00 31.21 C ATOM 292 CG LEU A 19 -2.914 2.834 11.157 1.00 22.01 C ATOM 293 CD1 LEU A 19 -1.809 2.053 10.433 1.00 32.03 C ATOM 294 CD2 LEU A 19 -2.361 3.608 12.365 1.00 24.23 C ATOM 0 H LEU A 19 -5.049 5.057 8.528 1.00 62.11 H new ATOM 0 HA LEU A 19 -4.302 2.369 8.659 1.00 44.24 H new ATOM 0 HB2 LEU A 19 -2.963 4.260 9.521 1.00 31.21 H new ATOM 0 HB3 LEU A 19 -4.159 4.569 10.765 1.00 31.21 H new ATOM 0 HG LEU A 19 -3.628 2.104 11.537 1.00 22.01 H new ATOM 0 HD11 LEU A 19 -1.294 1.407 11.144 1.00 32.03 H new ATOM 0 HD12 LEU A 19 -2.251 1.444 9.644 1.00 32.03 H new ATOM 0 HD13 LEU A 19 -1.096 2.752 9.995 1.00 32.03 H new ATOM 0 HD21 LEU A 19 -1.830 2.922 13.024 1.00 24.23 H new ATOM 0 HD22 LEU A 19 -1.676 4.382 12.019 1.00 24.23 H new ATOM 0 HD23 LEU A 19 -3.185 4.070 12.909 1.00 24.23 H new ATOM 306 N GLU A 20 -6.618 3.299 10.829 1.00 21.51 N ATOM 307 CA GLU A 20 -7.625 2.897 11.804 1.00 31.21 C ATOM 308 C GLU A 20 -8.797 2.195 11.118 1.00 64.22 C ATOM 309 O GLU A 20 -9.397 1.313 11.715 1.00 42.11 O ATOM 310 CB GLU A 20 -8.089 4.125 12.606 1.00 10.14 C ATOM 311 CG GLU A 20 -6.925 4.935 13.207 1.00 35.21 C ATOM 312 CD GLU A 20 -7.399 6.125 14.047 1.00 25.21 C ATOM 313 OE1 GLU A 20 -7.750 7.165 13.467 1.00 62.04 O ATOM 314 OE2 GLU A 20 -7.430 6.017 15.295 1.00 13.15 O ATOM 0 H GLU A 20 -6.591 4.306 10.668 1.00 21.51 H new ATOM 0 HA GLU A 20 -7.185 2.181 12.498 1.00 31.21 H new ATOM 0 HB2 GLU A 20 -8.677 4.774 11.956 1.00 10.14 H new ATOM 0 HB3 GLU A 20 -8.748 3.797 13.410 1.00 10.14 H new ATOM 0 HG2 GLU A 20 -6.314 4.279 13.827 1.00 35.21 H new ATOM 0 HG3 GLU A 20 -6.286 5.297 12.401 1.00 35.21 H new ATOM 321 N VAL A 21 -9.093 2.580 9.854 1.00 24.43 N ATOM 322 CA VAL A 21 -10.107 1.894 9.019 1.00 11.50 C ATOM 323 C VAL A 21 -9.744 0.402 8.850 1.00 42.52 C ATOM 324 O VAL A 21 -10.622 -0.460 8.908 1.00 73.23 O ATOM 325 CB VAL A 21 -10.275 2.583 7.605 1.00 43.55 C ATOM 326 CG1 VAL A 21 -11.235 1.793 6.681 1.00 72.12 C ATOM 327 CG2 VAL A 21 -10.760 4.043 7.754 1.00 53.13 C ATOM 0 H VAL A 21 -8.641 3.367 9.388 1.00 24.43 H new ATOM 0 HA VAL A 21 -11.063 1.973 9.536 1.00 11.50 H new ATOM 0 HB VAL A 21 -9.291 2.584 7.137 1.00 43.55 H new ATOM 0 HG11 VAL A 21 -11.319 2.304 5.722 1.00 72.12 H new ATOM 0 HG12 VAL A 21 -10.844 0.788 6.524 1.00 72.12 H new ATOM 0 HG13 VAL A 21 -12.219 1.731 7.146 1.00 72.12 H new ATOM 0 HG21 VAL A 21 -10.867 4.493 6.767 1.00 53.13 H new ATOM 0 HG22 VAL A 21 -11.722 4.056 8.265 1.00 53.13 H new ATOM 0 HG23 VAL A 21 -10.033 4.611 8.335 1.00 53.13 H new ATOM 337 N VAL A 22 -8.434 0.121 8.685 1.00 75.24 N ATOM 338 CA VAL A 22 -7.920 -1.253 8.524 1.00 50.24 C ATOM 339 C VAL A 22 -7.949 -2.001 9.872 1.00 73.42 C ATOM 340 O VAL A 22 -8.415 -3.144 9.934 1.00 72.13 O ATOM 341 CB VAL A 22 -6.463 -1.265 7.938 1.00 33.13 C ATOM 342 CG1 VAL A 22 -5.920 -2.708 7.782 1.00 32.23 C ATOM 343 CG2 VAL A 22 -6.407 -0.511 6.596 1.00 51.02 C ATOM 0 H VAL A 22 -7.708 0.837 8.660 1.00 75.24 H new ATOM 0 HA VAL A 22 -8.572 -1.763 7.814 1.00 50.24 H new ATOM 0 HB VAL A 22 -5.819 -0.749 8.650 1.00 33.13 H new ATOM 0 HG11 VAL A 22 -4.910 -2.674 7.374 1.00 32.23 H new ATOM 0 HG12 VAL A 22 -5.902 -3.197 8.756 1.00 32.23 H new ATOM 0 HG13 VAL A 22 -6.566 -3.269 7.106 1.00 32.23 H new ATOM 0 HG21 VAL A 22 -5.388 -0.532 6.209 1.00 51.02 H new ATOM 0 HG22 VAL A 22 -7.077 -0.990 5.882 1.00 51.02 H new ATOM 0 HG23 VAL A 22 -6.716 0.523 6.747 1.00 51.02 H new ATOM 353 N LEU A 23 -7.456 -1.322 10.933 1.00 55.52 N ATOM 354 CA LEU A 23 -7.409 -1.878 12.305 1.00 65.14 C ATOM 355 C LEU A 23 -8.802 -2.344 12.782 1.00 52.20 C ATOM 356 O LEU A 23 -8.981 -3.509 13.157 1.00 30.42 O ATOM 357 CB LEU A 23 -6.853 -0.800 13.283 1.00 2.23 C ATOM 358 CG LEU A 23 -5.341 -0.441 13.153 1.00 74.44 C ATOM 359 CD1 LEU A 23 -5.001 0.840 13.948 1.00 24.40 C ATOM 360 CD2 LEU A 23 -4.453 -1.623 13.603 1.00 41.13 C ATOM 0 H LEU A 23 -7.081 -0.376 10.863 1.00 55.52 H new ATOM 0 HA LEU A 23 -6.753 -2.748 12.293 1.00 65.14 H new ATOM 0 HB2 LEU A 23 -7.431 0.113 13.145 1.00 2.23 H new ATOM 0 HB3 LEU A 23 -7.034 -1.141 14.302 1.00 2.23 H new ATOM 0 HG LEU A 23 -5.134 -0.244 12.101 1.00 74.44 H new ATOM 0 HD11 LEU A 23 -3.940 1.065 13.839 1.00 24.40 H new ATOM 0 HD12 LEU A 23 -5.590 1.673 13.565 1.00 24.40 H new ATOM 0 HD13 LEU A 23 -5.232 0.686 15.002 1.00 24.40 H new ATOM 0 HD21 LEU A 23 -3.403 -1.348 13.503 1.00 41.13 H new ATOM 0 HD22 LEU A 23 -4.668 -1.863 14.644 1.00 41.13 H new ATOM 0 HD23 LEU A 23 -4.661 -2.493 12.980 1.00 41.13 H new ATOM 372 N LYS A 24 -9.791 -1.435 12.696 1.00 64.33 N ATOM 373 CA LYS A 24 -11.158 -1.669 13.218 1.00 31.11 C ATOM 374 C LYS A 24 -11.911 -2.695 12.362 1.00 31.14 C ATOM 375 O LYS A 24 -12.793 -3.403 12.868 1.00 34.25 O ATOM 376 CB LYS A 24 -11.944 -0.332 13.301 1.00 53.41 C ATOM 377 CG LYS A 24 -12.327 0.306 11.939 1.00 5.43 C ATOM 378 CD LYS A 24 -12.700 1.805 12.054 1.00 75.01 C ATOM 379 CE LYS A 24 -13.878 2.073 13.005 1.00 42.23 C ATOM 380 NZ LYS A 24 -14.176 3.527 13.121 1.00 43.13 N ATOM 0 H LYS A 24 -9.669 -0.519 12.265 1.00 64.33 H new ATOM 0 HA LYS A 24 -11.071 -2.080 14.224 1.00 31.11 H new ATOM 0 HB2 LYS A 24 -12.857 -0.503 13.871 1.00 53.41 H new ATOM 0 HB3 LYS A 24 -11.346 0.386 13.863 1.00 53.41 H new ATOM 0 HG2 LYS A 24 -11.493 0.197 11.246 1.00 5.43 H new ATOM 0 HG3 LYS A 24 -13.168 -0.240 11.513 1.00 5.43 H new ATOM 0 HD2 LYS A 24 -11.830 2.362 12.401 1.00 75.01 H new ATOM 0 HD3 LYS A 24 -12.949 2.186 11.064 1.00 75.01 H new ATOM 0 HE2 LYS A 24 -14.763 1.548 12.644 1.00 42.23 H new ATOM 0 HE3 LYS A 24 -13.648 1.669 13.991 1.00 42.23 H new ATOM 0 HZ1 LYS A 24 -14.976 3.667 13.771 1.00 43.13 H new ATOM 0 HZ2 LYS A 24 -13.340 4.024 13.489 1.00 43.13 H new ATOM 0 HZ3 LYS A 24 -14.420 3.907 12.184 1.00 43.13 H new ATOM 394 N SER A 25 -11.545 -2.775 11.070 1.00 4.30 N ATOM 395 CA SER A 25 -12.132 -3.731 10.120 1.00 13.24 C ATOM 396 C SER A 25 -11.711 -5.170 10.478 1.00 72.14 C ATOM 397 O SER A 25 -12.573 -6.021 10.724 1.00 74.32 O ATOM 398 CB SER A 25 -11.706 -3.373 8.676 1.00 44.04 C ATOM 399 OG SER A 25 -12.190 -4.307 7.726 1.00 41.30 O ATOM 0 H SER A 25 -10.831 -2.175 10.656 1.00 4.30 H new ATOM 0 HA SER A 25 -13.219 -3.672 10.183 1.00 13.24 H new ATOM 0 HB2 SER A 25 -12.076 -2.379 8.426 1.00 44.04 H new ATOM 0 HB3 SER A 25 -10.618 -3.331 8.620 1.00 44.04 H new ATOM 0 HG SER A 25 -11.899 -4.041 6.829 1.00 41.30 H new ATOM 405 N ASP A 26 -10.382 -5.413 10.525 1.00 63.12 N ATOM 406 CA ASP A 26 -9.824 -6.754 10.789 1.00 15.22 C ATOM 407 C ASP A 26 -8.323 -6.672 11.192 1.00 0.33 C ATOM 408 O ASP A 26 -7.504 -6.165 10.416 1.00 71.12 O ATOM 409 CB ASP A 26 -9.996 -7.670 9.548 1.00 31.42 C ATOM 410 CG ASP A 26 -9.474 -9.097 9.781 1.00 74.43 C ATOM 411 OD1 ASP A 26 -10.011 -9.795 10.667 1.00 42.11 O ATOM 412 OD2 ASP A 26 -8.536 -9.528 9.084 1.00 62.12 O ATOM 0 H ASP A 26 -9.675 -4.692 10.382 1.00 63.12 H new ATOM 0 HA ASP A 26 -10.376 -7.185 11.624 1.00 15.22 H new ATOM 0 HB2 ASP A 26 -11.051 -7.714 9.279 1.00 31.42 H new ATOM 0 HB3 ASP A 26 -9.469 -7.229 8.702 1.00 31.42 H new ATOM 417 N PRO A 27 -7.945 -7.180 12.417 1.00 1.44 N ATOM 418 CA PRO A 27 -6.548 -7.121 12.932 1.00 23.31 C ATOM 419 C PRO A 27 -5.569 -8.155 12.329 1.00 30.04 C ATOM 420 O PRO A 27 -4.371 -8.094 12.640 1.00 12.42 O ATOM 421 CB PRO A 27 -6.735 -7.365 14.445 1.00 35.14 C ATOM 422 CG PRO A 27 -7.947 -8.244 14.539 1.00 32.05 C ATOM 423 CD PRO A 27 -8.868 -7.789 13.426 1.00 42.34 C ATOM 0 HA PRO A 27 -6.082 -6.173 12.664 1.00 23.31 H new ATOM 0 HB2 PRO A 27 -5.860 -7.848 14.880 1.00 35.14 H new ATOM 0 HB3 PRO A 27 -6.882 -6.428 14.983 1.00 35.14 H new ATOM 0 HG2 PRO A 27 -7.680 -9.294 14.422 1.00 32.05 H new ATOM 0 HG3 PRO A 27 -8.429 -8.145 15.512 1.00 32.05 H new ATOM 0 HD2 PRO A 27 -9.426 -8.624 13.003 1.00 42.34 H new ATOM 0 HD3 PRO A 27 -9.600 -7.066 13.785 1.00 42.34 H new ATOM 431 N ASN A 28 -6.059 -9.108 11.501 1.00 40.13 N ATOM 432 CA ASN A 28 -5.163 -10.079 10.817 1.00 51.53 C ATOM 433 C ASN A 28 -4.282 -9.348 9.799 1.00 21.50 C ATOM 434 O ASN A 28 -3.093 -9.649 9.652 1.00 34.13 O ATOM 435 CB ASN A 28 -5.942 -11.202 10.088 1.00 54.23 C ATOM 436 CG ASN A 28 -6.666 -12.164 11.024 1.00 32.24 C ATOM 437 OD1 ASN A 28 -6.073 -13.115 11.535 1.00 0.21 O ATOM 438 ND2 ASN A 28 -7.958 -11.968 11.208 1.00 3.21 N ATOM 0 H ASN A 28 -7.050 -9.227 11.291 1.00 40.13 H new ATOM 0 HA ASN A 28 -4.554 -10.544 11.593 1.00 51.53 H new ATOM 0 HB2 ASN A 28 -6.670 -10.748 9.416 1.00 54.23 H new ATOM 0 HB3 ASN A 28 -5.247 -11.769 9.468 1.00 54.23 H new ATOM 0 HD21 ASN A 28 -8.494 -12.614 11.787 1.00 3.21 H new ATOM 0 HD22 ASN A 28 -8.420 -11.171 10.771 1.00 3.21 H new ATOM 445 N VAL A 29 -4.905 -8.387 9.112 1.00 42.30 N ATOM 446 CA VAL A 29 -4.253 -7.572 8.092 1.00 3.33 C ATOM 447 C VAL A 29 -3.251 -6.613 8.771 1.00 1.10 C ATOM 448 O VAL A 29 -3.664 -5.687 9.480 1.00 44.43 O ATOM 449 CB VAL A 29 -5.318 -6.767 7.265 1.00 22.14 C ATOM 450 CG1 VAL A 29 -4.678 -6.088 6.036 1.00 22.42 C ATOM 451 CG2 VAL A 29 -6.501 -7.680 6.853 1.00 52.14 C ATOM 0 H VAL A 29 -5.888 -8.153 9.252 1.00 42.30 H new ATOM 0 HA VAL A 29 -3.715 -8.221 7.401 1.00 3.33 H new ATOM 0 HB VAL A 29 -5.712 -5.977 7.905 1.00 22.14 H new ATOM 0 HG11 VAL A 29 -5.442 -5.539 5.485 1.00 22.42 H new ATOM 0 HG12 VAL A 29 -3.901 -5.398 6.365 1.00 22.42 H new ATOM 0 HG13 VAL A 29 -4.239 -6.847 5.389 1.00 22.42 H new ATOM 0 HG21 VAL A 29 -7.226 -7.101 6.281 1.00 52.14 H new ATOM 0 HG22 VAL A 29 -6.130 -8.502 6.241 1.00 52.14 H new ATOM 0 HG23 VAL A 29 -6.980 -8.080 7.747 1.00 52.14 H new ATOM 461 N LYS A 30 -1.944 -6.881 8.581 1.00 74.24 N ATOM 462 CA LYS A 30 -0.867 -6.161 9.284 1.00 65.24 C ATOM 463 C LYS A 30 -0.792 -4.688 8.847 1.00 53.03 C ATOM 464 O LYS A 30 -0.578 -4.390 7.674 1.00 2.12 O ATOM 465 CB LYS A 30 0.499 -6.855 9.052 1.00 21.32 C ATOM 466 CG LYS A 30 1.706 -6.161 9.742 1.00 51.24 C ATOM 467 CD LYS A 30 1.526 -6.060 11.276 1.00 24.22 C ATOM 468 CE LYS A 30 2.597 -5.209 11.959 1.00 22.22 C ATOM 469 NZ LYS A 30 2.335 -5.061 13.413 1.00 3.45 N ATOM 0 H LYS A 30 -1.608 -7.599 7.939 1.00 74.24 H new ATOM 0 HA LYS A 30 -1.100 -6.186 10.348 1.00 65.24 H new ATOM 0 HB2 LYS A 30 0.435 -7.882 9.410 1.00 21.32 H new ATOM 0 HB3 LYS A 30 0.689 -6.903 7.980 1.00 21.32 H new ATOM 0 HG2 LYS A 30 2.617 -6.717 9.521 1.00 51.24 H new ATOM 0 HG3 LYS A 30 1.834 -5.161 9.327 1.00 51.24 H new ATOM 0 HD2 LYS A 30 0.545 -5.638 11.492 1.00 24.22 H new ATOM 0 HD3 LYS A 30 1.542 -7.063 11.703 1.00 24.22 H new ATOM 0 HE2 LYS A 30 3.575 -5.666 11.810 1.00 22.22 H new ATOM 0 HE3 LYS A 30 2.631 -4.224 11.493 1.00 22.22 H new ATOM 0 HZ1 LYS A 30 3.081 -4.478 13.843 1.00 3.45 H new ATOM 0 HZ2 LYS A 30 1.413 -4.602 13.555 1.00 3.45 H new ATOM 0 HZ3 LYS A 30 2.327 -5.999 13.862 1.00 3.45 H new ATOM 483 N THR A 31 -0.966 -3.783 9.815 1.00 73.34 N ATOM 484 CA THR A 31 -0.837 -2.342 9.603 1.00 64.43 C ATOM 485 C THR A 31 0.577 -1.868 9.981 1.00 72.43 C ATOM 486 O THR A 31 1.003 -2.009 11.138 1.00 23.10 O ATOM 487 CB THR A 31 -1.885 -1.573 10.458 1.00 32.04 C ATOM 488 OG1 THR A 31 -1.740 -1.928 11.843 1.00 12.14 O ATOM 489 CG2 THR A 31 -3.321 -1.860 10.009 1.00 23.34 C ATOM 0 H THR A 31 -1.202 -4.034 10.775 1.00 73.34 H new ATOM 0 HA THR A 31 -1.014 -2.136 8.547 1.00 64.43 H new ATOM 0 HB THR A 31 -1.698 -0.508 10.319 1.00 32.04 H new ATOM 0 HG1 THR A 31 -0.795 -2.099 12.040 1.00 12.14 H new ATOM 0 HG21 THR A 31 -4.017 -1.301 10.635 1.00 23.34 H new ATOM 0 HG22 THR A 31 -3.445 -1.557 8.969 1.00 23.34 H new ATOM 0 HG23 THR A 31 -3.525 -2.927 10.103 1.00 23.34 H new ATOM 497 N VAL A 32 1.312 -1.341 8.993 1.00 11.11 N ATOM 498 CA VAL A 32 2.608 -0.675 9.211 1.00 34.34 C ATOM 499 C VAL A 32 2.548 0.705 8.547 1.00 11.01 C ATOM 500 O VAL A 32 2.452 0.796 7.319 1.00 44.34 O ATOM 501 CB VAL A 32 3.809 -1.503 8.608 1.00 32.34 C ATOM 502 CG1 VAL A 32 5.173 -0.814 8.863 1.00 63.32 C ATOM 503 CG2 VAL A 32 3.814 -2.955 9.134 1.00 35.34 C ATOM 0 H VAL A 32 1.025 -1.363 8.014 1.00 11.11 H new ATOM 0 HA VAL A 32 2.784 -0.590 10.283 1.00 34.34 H new ATOM 0 HB VAL A 32 3.660 -1.538 7.529 1.00 32.34 H new ATOM 0 HG11 VAL A 32 5.972 -1.417 8.432 1.00 63.32 H new ATOM 0 HG12 VAL A 32 5.174 0.173 8.401 1.00 63.32 H new ATOM 0 HG13 VAL A 32 5.334 -0.712 9.936 1.00 63.32 H new ATOM 0 HG21 VAL A 32 4.654 -3.497 8.699 1.00 35.34 H new ATOM 0 HG22 VAL A 32 3.910 -2.948 10.220 1.00 35.34 H new ATOM 0 HG23 VAL A 32 2.882 -3.446 8.855 1.00 35.34 H new ATOM 513 N ARG A 33 2.586 1.778 9.354 1.00 4.35 N ATOM 514 CA ARG A 33 2.651 3.154 8.839 1.00 61.24 C ATOM 515 C ARG A 33 4.001 3.767 9.239 1.00 73.12 C ATOM 516 O ARG A 33 4.255 4.030 10.418 1.00 44.45 O ATOM 517 CB ARG A 33 1.409 3.998 9.302 1.00 64.15 C ATOM 518 CG ARG A 33 1.215 4.221 10.831 1.00 42.42 C ATOM 519 CD ARG A 33 1.709 5.603 11.321 1.00 62.22 C ATOM 520 NE ARG A 33 1.558 5.739 12.774 1.00 30.11 N ATOM 521 CZ ARG A 33 2.144 6.677 13.539 1.00 21.21 C ATOM 522 NH1 ARG A 33 2.950 7.599 13.009 1.00 32.14 N ATOM 523 NH2 ARG A 33 1.925 6.672 14.841 1.00 15.44 N ATOM 0 H ARG A 33 2.573 1.717 10.372 1.00 4.35 H new ATOM 0 HA ARG A 33 2.597 3.153 7.750 1.00 61.24 H new ATOM 0 HB2 ARG A 33 1.472 4.976 8.826 1.00 64.15 H new ATOM 0 HB3 ARG A 33 0.512 3.513 8.917 1.00 64.15 H new ATOM 0 HG2 ARG A 33 0.158 4.115 11.074 1.00 42.42 H new ATOM 0 HG3 ARG A 33 1.747 3.440 11.374 1.00 42.42 H new ATOM 0 HD2 ARG A 33 2.756 5.735 11.048 1.00 62.22 H new ATOM 0 HD3 ARG A 33 1.147 6.391 10.820 1.00 62.22 H new ATOM 0 HE ARG A 33 0.956 5.063 13.245 1.00 30.11 H new ATOM 0 HH11 ARG A 33 3.132 7.601 12.005 1.00 32.14 H new ATOM 0 HH12 ARG A 33 3.384 8.302 13.608 1.00 32.14 H new ATOM 0 HH21 ARG A 33 1.318 5.963 15.253 1.00 15.44 H new ATOM 0 HH22 ARG A 33 2.362 7.377 15.434 1.00 15.44 H new ATOM 537 N THR A 34 4.899 3.880 8.242 1.00 62.31 N ATOM 538 CA THR A 34 6.237 4.461 8.390 1.00 1.23 C ATOM 539 C THR A 34 6.985 4.380 7.053 1.00 45.05 C ATOM 540 O THR A 34 6.887 3.371 6.331 1.00 24.00 O ATOM 541 CB THR A 34 7.118 3.754 9.501 1.00 44.13 C ATOM 542 OG1 THR A 34 8.374 4.440 9.666 1.00 3.43 O ATOM 543 CG2 THR A 34 7.386 2.266 9.199 1.00 72.53 C ATOM 0 H THR A 34 4.705 3.561 7.293 1.00 62.31 H new ATOM 0 HA THR A 34 6.086 5.494 8.703 1.00 1.23 H new ATOM 0 HB THR A 34 6.540 3.804 10.424 1.00 44.13 H new ATOM 0 HG1 THR A 34 8.904 3.991 10.357 1.00 3.43 H new ATOM 0 HG21 THR A 34 7.994 1.837 9.995 1.00 72.53 H new ATOM 0 HG22 THR A 34 6.438 1.731 9.137 1.00 72.53 H new ATOM 0 HG23 THR A 34 7.915 2.177 8.250 1.00 72.53 H new ATOM 551 N ASP A 35 7.706 5.453 6.709 1.00 43.23 N ATOM 552 CA ASP A 35 8.769 5.386 5.706 1.00 43.42 C ATOM 553 C ASP A 35 10.064 5.011 6.440 1.00 12.44 C ATOM 554 O ASP A 35 10.795 5.873 6.943 1.00 12.51 O ATOM 555 CB ASP A 35 8.929 6.713 4.924 1.00 44.01 C ATOM 556 CG ASP A 35 10.134 6.681 3.946 1.00 15.35 C ATOM 557 OD1 ASP A 35 10.027 6.058 2.868 1.00 64.23 O ATOM 558 OD2 ASP A 35 11.198 7.262 4.268 1.00 2.52 O ATOM 0 H ASP A 35 7.570 6.380 7.113 1.00 43.23 H new ATOM 0 HA ASP A 35 8.518 4.636 4.956 1.00 43.42 H new ATOM 0 HB2 ASP A 35 8.016 6.914 4.364 1.00 44.01 H new ATOM 0 HB3 ASP A 35 9.058 7.534 5.629 1.00 44.01 H new ATOM 563 N ASP A 36 10.266 3.708 6.598 1.00 42.31 N ATOM 564 CA ASP A 36 11.509 3.149 7.156 1.00 44.04 C ATOM 565 C ASP A 36 12.207 2.292 6.085 1.00 72.54 C ATOM 566 O ASP A 36 13.359 1.885 6.261 1.00 44.54 O ATOM 567 CB ASP A 36 11.204 2.321 8.432 1.00 24.10 C ATOM 568 CG ASP A 36 12.479 1.986 9.229 1.00 35.31 C ATOM 569 OD1 ASP A 36 12.940 2.839 10.008 1.00 3.51 O ATOM 570 OD2 ASP A 36 13.052 0.892 9.047 1.00 40.01 O ATOM 0 H ASP A 36 9.576 3.001 6.345 1.00 42.31 H new ATOM 0 HA ASP A 36 12.178 3.960 7.444 1.00 44.04 H new ATOM 0 HB2 ASP A 36 10.516 2.878 9.068 1.00 24.10 H new ATOM 0 HB3 ASP A 36 10.700 1.396 8.151 1.00 24.10 H new ATOM 575 N LYS A 37 11.479 2.063 4.957 1.00 70.22 N ATOM 576 CA LYS A 37 11.943 1.320 3.766 1.00 44.34 C ATOM 577 C LYS A 37 12.186 -0.168 4.098 1.00 63.20 C ATOM 578 O LYS A 37 11.339 -1.015 3.824 1.00 42.43 O ATOM 579 CB LYS A 37 13.221 1.953 3.127 1.00 32.34 C ATOM 580 CG LYS A 37 13.223 3.492 3.010 1.00 11.41 C ATOM 581 CD LYS A 37 14.528 4.024 2.368 1.00 32.23 C ATOM 582 CE LYS A 37 14.661 5.542 2.491 1.00 53.35 C ATOM 583 NZ LYS A 37 15.900 6.052 1.843 1.00 73.42 N ATOM 0 H LYS A 37 10.523 2.404 4.855 1.00 70.22 H new ATOM 0 HA LYS A 37 11.144 1.388 3.027 1.00 44.34 H new ATOM 0 HB2 LYS A 37 14.086 1.651 3.717 1.00 32.34 H new ATOM 0 HB3 LYS A 37 13.352 1.532 2.130 1.00 32.34 H new ATOM 0 HG2 LYS A 37 12.369 3.811 2.413 1.00 11.41 H new ATOM 0 HG3 LYS A 37 13.101 3.931 4.000 1.00 11.41 H new ATOM 0 HD2 LYS A 37 15.385 3.547 2.844 1.00 32.23 H new ATOM 0 HD3 LYS A 37 14.552 3.744 1.315 1.00 32.23 H new ATOM 0 HE2 LYS A 37 13.793 6.019 2.037 1.00 53.35 H new ATOM 0 HE3 LYS A 37 14.663 5.821 3.545 1.00 53.35 H new ATOM 0 HZ1 LYS A 37 15.948 7.085 1.951 1.00 73.42 H new ATOM 0 HZ2 LYS A 37 16.731 5.618 2.293 1.00 73.42 H new ATOM 0 HZ3 LYS A 37 15.888 5.810 0.832 1.00 73.42 H new ATOM 597 N GLU A 38 13.339 -0.441 4.742 1.00 43.14 N ATOM 598 CA GLU A 38 13.832 -1.795 5.050 1.00 11.03 C ATOM 599 C GLU A 38 12.877 -2.578 5.986 1.00 74.24 C ATOM 600 O GLU A 38 12.736 -3.800 5.843 1.00 73.42 O ATOM 601 CB GLU A 38 15.248 -1.684 5.674 1.00 64.43 C ATOM 602 CG GLU A 38 15.299 -0.877 6.986 1.00 14.24 C ATOM 603 CD GLU A 38 16.689 -0.840 7.633 1.00 71.43 C ATOM 604 OE1 GLU A 38 17.022 -1.769 8.396 1.00 14.11 O ATOM 605 OE2 GLU A 38 17.448 0.119 7.388 1.00 14.11 O ATOM 0 H GLU A 38 13.967 0.293 5.069 1.00 43.14 H new ATOM 0 HA GLU A 38 13.876 -2.361 4.120 1.00 11.03 H new ATOM 0 HB2 GLU A 38 15.629 -2.688 5.863 1.00 64.43 H new ATOM 0 HB3 GLU A 38 15.917 -1.220 4.949 1.00 64.43 H new ATOM 0 HG2 GLU A 38 14.973 0.144 6.787 1.00 14.24 H new ATOM 0 HG3 GLU A 38 14.590 -1.306 7.694 1.00 14.24 H new ATOM 612 N LYS A 39 12.222 -1.853 6.926 1.00 54.51 N ATOM 613 CA LYS A 39 11.208 -2.427 7.834 1.00 34.23 C ATOM 614 C LYS A 39 10.033 -3.016 7.040 1.00 3.50 C ATOM 615 O LYS A 39 9.502 -4.055 7.394 1.00 75.54 O ATOM 616 CB LYS A 39 10.698 -1.356 8.826 1.00 70.42 C ATOM 617 CG LYS A 39 9.538 -1.811 9.739 1.00 3.34 C ATOM 618 CD LYS A 39 9.095 -0.729 10.740 1.00 25.31 C ATOM 619 CE LYS A 39 7.860 -1.153 11.553 1.00 32.52 C ATOM 620 NZ LYS A 39 8.115 -2.354 12.396 1.00 41.41 N ATOM 0 H LYS A 39 12.384 -0.857 7.073 1.00 54.51 H new ATOM 0 HA LYS A 39 11.679 -3.231 8.399 1.00 34.23 H new ATOM 0 HB2 LYS A 39 11.531 -1.038 9.453 1.00 70.42 H new ATOM 0 HB3 LYS A 39 10.374 -0.483 8.260 1.00 70.42 H new ATOM 0 HG2 LYS A 39 8.687 -2.095 9.120 1.00 3.34 H new ATOM 0 HG3 LYS A 39 9.844 -2.702 10.288 1.00 3.34 H new ATOM 0 HD2 LYS A 39 9.917 -0.509 11.421 1.00 25.31 H new ATOM 0 HD3 LYS A 39 8.873 0.192 10.201 1.00 25.31 H new ATOM 0 HE2 LYS A 39 7.547 -0.326 12.190 1.00 32.52 H new ATOM 0 HE3 LYS A 39 7.035 -1.360 10.872 1.00 32.52 H new ATOM 0 HZ1 LYS A 39 7.268 -2.568 12.961 1.00 41.41 H new ATOM 0 HZ2 LYS A 39 8.338 -3.166 11.785 1.00 41.41 H new ATOM 0 HZ3 LYS A 39 8.917 -2.168 13.031 1.00 41.41 H new ATOM 634 N VAL A 40 9.659 -2.348 5.948 1.00 0.53 N ATOM 635 CA VAL A 40 8.527 -2.771 5.118 1.00 44.44 C ATOM 636 C VAL A 40 8.797 -4.157 4.481 1.00 35.31 C ATOM 637 O VAL A 40 7.896 -4.990 4.409 1.00 21.20 O ATOM 638 CB VAL A 40 8.200 -1.698 4.021 1.00 71.34 C ATOM 639 CG1 VAL A 40 6.970 -2.113 3.206 1.00 54.32 C ATOM 640 CG2 VAL A 40 8.005 -0.292 4.656 1.00 63.42 C ATOM 0 H VAL A 40 10.127 -1.505 5.615 1.00 0.53 H new ATOM 0 HA VAL A 40 7.653 -2.863 5.763 1.00 44.44 H new ATOM 0 HB VAL A 40 9.050 -1.638 3.341 1.00 71.34 H new ATOM 0 HG11 VAL A 40 6.761 -1.355 2.451 1.00 54.32 H new ATOM 0 HG12 VAL A 40 7.163 -3.068 2.717 1.00 54.32 H new ATOM 0 HG13 VAL A 40 6.110 -2.211 3.869 1.00 54.32 H new ATOM 0 HG21 VAL A 40 7.780 0.433 3.874 1.00 63.42 H new ATOM 0 HG22 VAL A 40 7.180 -0.326 5.368 1.00 63.42 H new ATOM 0 HG23 VAL A 40 8.918 0.004 5.172 1.00 63.42 H new ATOM 650 N LYS A 41 10.070 -4.406 4.097 1.00 73.12 N ATOM 651 CA LYS A 41 10.495 -5.669 3.443 1.00 73.11 C ATOM 652 C LYS A 41 10.319 -6.877 4.383 1.00 73.32 C ATOM 653 O LYS A 41 9.778 -7.911 3.971 1.00 73.01 O ATOM 654 CB LYS A 41 11.974 -5.599 2.949 1.00 53.13 C ATOM 655 CG LYS A 41 12.207 -4.797 1.648 1.00 71.33 C ATOM 656 CD LYS A 41 11.876 -3.300 1.772 1.00 22.11 C ATOM 657 CE LYS A 41 12.279 -2.508 0.528 1.00 71.32 C ATOM 658 NZ LYS A 41 13.729 -2.653 0.225 1.00 53.02 N ATOM 0 H LYS A 41 10.831 -3.740 4.231 1.00 73.12 H new ATOM 0 HA LYS A 41 9.849 -5.801 2.575 1.00 73.11 H new ATOM 0 HB2 LYS A 41 12.582 -5.159 3.740 1.00 53.13 H new ATOM 0 HB3 LYS A 41 12.336 -6.616 2.797 1.00 53.13 H new ATOM 0 HG2 LYS A 41 13.249 -4.905 1.348 1.00 71.33 H new ATOM 0 HG3 LYS A 41 11.600 -5.229 0.853 1.00 71.33 H new ATOM 0 HD2 LYS A 41 10.806 -3.180 1.945 1.00 22.11 H new ATOM 0 HD3 LYS A 41 12.387 -2.889 2.642 1.00 22.11 H new ATOM 0 HE2 LYS A 41 11.694 -2.850 -0.326 1.00 71.32 H new ATOM 0 HE3 LYS A 41 12.042 -1.454 0.676 1.00 71.32 H new ATOM 0 HZ1 LYS A 41 14.009 -1.941 -0.479 1.00 53.02 H new ATOM 0 HZ2 LYS A 41 14.281 -2.515 1.096 1.00 53.02 H new ATOM 0 HZ3 LYS A 41 13.911 -3.604 -0.154 1.00 53.02 H new ATOM 672 N GLU A 42 10.771 -6.724 5.650 1.00 34.23 N ATOM 673 CA GLU A 42 10.686 -7.809 6.649 1.00 10.22 C ATOM 674 C GLU A 42 9.213 -8.137 6.956 1.00 45.54 C ATOM 675 O GLU A 42 8.879 -9.275 7.233 1.00 72.31 O ATOM 676 CB GLU A 42 11.463 -7.473 7.961 1.00 0.04 C ATOM 677 CG GLU A 42 10.827 -6.376 8.836 1.00 4.32 C ATOM 678 CD GLU A 42 11.578 -6.092 10.142 1.00 60.34 C ATOM 679 OE1 GLU A 42 11.411 -6.863 11.110 1.00 44.12 O ATOM 680 OE2 GLU A 42 12.328 -5.096 10.215 1.00 11.10 O ATOM 0 H GLU A 42 11.195 -5.865 6.000 1.00 34.23 H new ATOM 0 HA GLU A 42 11.165 -8.687 6.216 1.00 10.22 H new ATOM 0 HB2 GLU A 42 11.553 -8.383 8.555 1.00 0.04 H new ATOM 0 HB3 GLU A 42 12.474 -7.164 7.697 1.00 0.04 H new ATOM 0 HG2 GLU A 42 10.769 -5.454 8.257 1.00 4.32 H new ATOM 0 HG3 GLU A 42 9.804 -6.667 9.075 1.00 4.32 H new ATOM 687 N GLU A 43 8.345 -7.124 6.881 1.00 12.51 N ATOM 688 CA GLU A 43 6.910 -7.279 7.152 1.00 1.54 C ATOM 689 C GLU A 43 6.179 -8.012 5.991 1.00 52.12 C ATOM 690 O GLU A 43 5.177 -8.704 6.226 1.00 5.03 O ATOM 691 CB GLU A 43 6.291 -5.889 7.422 1.00 40.04 C ATOM 692 CG GLU A 43 6.885 -5.126 8.629 1.00 41.20 C ATOM 693 CD GLU A 43 6.662 -5.819 9.983 1.00 40.10 C ATOM 694 OE1 GLU A 43 5.529 -5.776 10.490 1.00 10.00 O ATOM 695 OE2 GLU A 43 7.609 -6.411 10.542 1.00 61.43 O ATOM 0 H GLU A 43 8.616 -6.173 6.631 1.00 12.51 H new ATOM 0 HA GLU A 43 6.785 -7.903 8.037 1.00 1.54 H new ATOM 0 HB2 GLU A 43 6.413 -5.275 6.529 1.00 40.04 H new ATOM 0 HB3 GLU A 43 5.220 -6.011 7.581 1.00 40.04 H new ATOM 0 HG2 GLU A 43 7.956 -4.996 8.472 1.00 41.20 H new ATOM 0 HG3 GLU A 43 6.445 -4.129 8.667 1.00 41.20 H new ATOM 702 N ILE A 44 6.698 -7.859 4.750 1.00 32.41 N ATOM 703 CA ILE A 44 6.137 -8.505 3.533 1.00 24.31 C ATOM 704 C ILE A 44 6.295 -10.045 3.595 1.00 32.04 C ATOM 705 O ILE A 44 5.321 -10.788 3.391 1.00 30.23 O ATOM 706 CB ILE A 44 6.828 -7.945 2.226 1.00 53.42 C ATOM 707 CG1 ILE A 44 6.463 -6.443 1.984 1.00 60.23 C ATOM 708 CG2 ILE A 44 6.491 -8.791 0.974 1.00 61.34 C ATOM 709 CD1 ILE A 44 7.247 -5.773 0.859 1.00 30.32 C ATOM 0 H ILE A 44 7.519 -7.284 4.561 1.00 32.41 H new ATOM 0 HA ILE A 44 5.074 -8.267 3.497 1.00 24.31 H new ATOM 0 HB ILE A 44 7.903 -8.017 2.391 1.00 53.42 H new ATOM 0 HG12 ILE A 44 5.399 -6.373 1.760 1.00 60.23 H new ATOM 0 HG13 ILE A 44 6.631 -5.888 2.907 1.00 60.23 H new ATOM 0 HG21 ILE A 44 6.989 -8.366 0.103 1.00 61.34 H new ATOM 0 HG22 ILE A 44 6.833 -9.815 1.124 1.00 61.34 H new ATOM 0 HG23 ILE A 44 5.413 -8.789 0.813 1.00 61.34 H new ATOM 0 HD11 ILE A 44 6.929 -4.735 0.762 1.00 30.32 H new ATOM 0 HD12 ILE A 44 8.312 -5.807 1.088 1.00 30.32 H new ATOM 0 HD13 ILE A 44 7.060 -6.298 -0.078 1.00 30.32 H new ATOM 721 N GLU A 45 7.531 -10.502 3.888 1.00 13.34 N ATOM 722 CA GLU A 45 7.860 -11.944 3.968 1.00 0.34 C ATOM 723 C GLU A 45 7.050 -12.639 5.094 1.00 62.10 C ATOM 724 O GLU A 45 6.682 -13.809 4.969 1.00 42.33 O ATOM 725 CB GLU A 45 9.392 -12.147 4.168 1.00 45.40 C ATOM 726 CG GLU A 45 9.953 -11.510 5.451 1.00 34.25 C ATOM 727 CD GLU A 45 11.470 -11.685 5.640 1.00 14.51 C ATOM 728 OE1 GLU A 45 12.247 -10.827 5.165 1.00 30.30 O ATOM 729 OE2 GLU A 45 11.895 -12.668 6.283 1.00 61.24 O ATOM 0 H GLU A 45 8.324 -9.889 4.075 1.00 13.34 H new ATOM 0 HA GLU A 45 7.578 -12.410 3.024 1.00 0.34 H new ATOM 0 HB2 GLU A 45 9.606 -13.216 4.183 1.00 45.40 H new ATOM 0 HB3 GLU A 45 9.917 -11.729 3.309 1.00 45.40 H new ATOM 0 HG2 GLU A 45 9.721 -10.445 5.444 1.00 34.25 H new ATOM 0 HG3 GLU A 45 9.440 -11.942 6.310 1.00 34.25 H new ATOM 736 N LYS A 46 6.754 -11.880 6.171 1.00 73.32 N ATOM 737 CA LYS A 46 5.929 -12.360 7.296 1.00 24.15 C ATOM 738 C LYS A 46 4.463 -12.516 6.874 1.00 71.41 C ATOM 739 O LYS A 46 3.802 -13.475 7.271 1.00 42.03 O ATOM 740 CB LYS A 46 6.029 -11.382 8.486 1.00 64.42 C ATOM 741 CG LYS A 46 7.443 -11.266 9.074 1.00 15.20 C ATOM 742 CD LYS A 46 7.589 -10.100 10.079 1.00 13.02 C ATOM 743 CE LYS A 46 9.049 -9.876 10.494 1.00 62.23 C ATOM 744 NZ LYS A 46 9.212 -8.679 11.345 1.00 5.11 N ATOM 0 H LYS A 46 7.080 -10.920 6.283 1.00 73.32 H new ATOM 0 HA LYS A 46 6.307 -13.336 7.600 1.00 24.15 H new ATOM 0 HB2 LYS A 46 5.698 -10.395 8.162 1.00 64.42 H new ATOM 0 HB3 LYS A 46 5.345 -11.707 9.270 1.00 64.42 H new ATOM 0 HG2 LYS A 46 7.701 -12.201 9.572 1.00 15.20 H new ATOM 0 HG3 LYS A 46 8.157 -11.129 8.262 1.00 15.20 H new ATOM 0 HD2 LYS A 46 7.195 -9.187 9.634 1.00 13.02 H new ATOM 0 HD3 LYS A 46 6.988 -10.308 10.965 1.00 13.02 H new ATOM 0 HE2 LYS A 46 9.411 -10.753 11.031 1.00 62.23 H new ATOM 0 HE3 LYS A 46 9.666 -9.772 9.602 1.00 62.23 H new ATOM 0 HZ1 LYS A 46 10.163 -8.281 11.206 1.00 5.11 H new ATOM 0 HZ2 LYS A 46 8.498 -7.969 11.086 1.00 5.11 H new ATOM 0 HZ3 LYS A 46 9.091 -8.944 12.343 1.00 5.11 H new ATOM 758 N ALA A 47 3.981 -11.568 6.055 1.00 32.41 N ATOM 759 CA ALA A 47 2.576 -11.508 5.618 1.00 72.01 C ATOM 760 C ALA A 47 2.163 -12.760 4.836 1.00 11.12 C ATOM 761 O ALA A 47 1.161 -13.411 5.174 1.00 43.32 O ATOM 762 CB ALA A 47 2.333 -10.238 4.794 1.00 23.23 C ATOM 0 H ALA A 47 4.558 -10.817 5.675 1.00 32.41 H new ATOM 0 HA ALA A 47 1.951 -11.473 6.510 1.00 72.01 H new ATOM 0 HB1 ALA A 47 1.291 -10.204 4.476 1.00 23.23 H new ATOM 0 HB2 ALA A 47 2.555 -9.361 5.402 1.00 23.23 H new ATOM 0 HB3 ALA A 47 2.980 -10.244 3.917 1.00 23.23 H new ATOM 768 N ARG A 48 2.975 -13.111 3.826 1.00 72.22 N ATOM 769 CA ARG A 48 2.644 -14.186 2.885 1.00 34.01 C ATOM 770 C ARG A 48 2.662 -15.571 3.554 1.00 35.44 C ATOM 771 O ARG A 48 1.748 -16.374 3.320 1.00 45.13 O ATOM 772 CB ARG A 48 3.570 -14.148 1.651 1.00 70.12 C ATOM 773 CG ARG A 48 5.077 -14.373 1.907 1.00 42.25 C ATOM 774 CD ARG A 48 5.881 -14.391 0.594 1.00 22.20 C ATOM 775 NE ARG A 48 7.292 -14.747 0.794 1.00 22.32 N ATOM 776 CZ ARG A 48 7.856 -15.921 0.463 1.00 74.31 C ATOM 777 NH1 ARG A 48 7.136 -16.896 -0.089 1.00 43.11 N ATOM 778 NH2 ARG A 48 9.148 -16.094 0.674 1.00 11.05 N ATOM 0 H ARG A 48 3.871 -12.660 3.642 1.00 72.22 H new ATOM 0 HA ARG A 48 1.622 -14.012 2.547 1.00 34.01 H new ATOM 0 HB2 ARG A 48 3.228 -14.905 0.946 1.00 70.12 H new ATOM 0 HB3 ARG A 48 3.448 -13.180 1.164 1.00 70.12 H new ATOM 0 HG2 ARG A 48 5.458 -13.584 2.556 1.00 42.25 H new ATOM 0 HG3 ARG A 48 5.220 -15.316 2.434 1.00 42.25 H new ATOM 0 HD2 ARG A 48 5.426 -15.102 -0.095 1.00 22.20 H new ATOM 0 HD3 ARG A 48 5.822 -13.409 0.124 1.00 22.20 H new ATOM 0 HE ARG A 48 7.895 -14.043 1.220 1.00 22.32 H new ATOM 0 HH11 ARG A 48 6.141 -16.758 -0.266 1.00 43.11 H new ATOM 0 HH12 ARG A 48 7.579 -17.781 -0.334 1.00 43.11 H new ATOM 0 HH21 ARG A 48 9.703 -15.342 1.083 1.00 11.05 H new ATOM 0 HH22 ARG A 48 9.591 -16.979 0.428 1.00 11.05 H new ATOM 792 N LYS A 49 3.678 -15.842 4.410 1.00 34.13 N ATOM 793 CA LYS A 49 3.795 -17.145 5.097 1.00 23.21 C ATOM 794 C LYS A 49 2.664 -17.326 6.122 1.00 44.43 C ATOM 795 O LYS A 49 2.227 -18.446 6.390 1.00 35.32 O ATOM 796 CB LYS A 49 5.218 -17.346 5.737 1.00 13.42 C ATOM 797 CG LYS A 49 5.696 -16.350 6.838 1.00 12.04 C ATOM 798 CD LYS A 49 5.009 -16.539 8.220 1.00 75.13 C ATOM 799 CE LYS A 49 5.711 -15.803 9.363 1.00 35.33 C ATOM 800 NZ LYS A 49 6.988 -16.466 9.756 1.00 53.33 N ATOM 0 H LYS A 49 4.420 -15.180 4.637 1.00 34.13 H new ATOM 0 HA LYS A 49 3.685 -17.929 4.347 1.00 23.21 H new ATOM 0 HB2 LYS A 49 5.249 -18.349 6.163 1.00 13.42 H new ATOM 0 HB3 LYS A 49 5.949 -17.320 4.929 1.00 13.42 H new ATOM 0 HG2 LYS A 49 6.773 -16.457 6.964 1.00 12.04 H new ATOM 0 HG3 LYS A 49 5.515 -15.332 6.493 1.00 12.04 H new ATOM 0 HD2 LYS A 49 3.978 -16.190 8.154 1.00 75.13 H new ATOM 0 HD3 LYS A 49 4.971 -17.603 8.454 1.00 75.13 H new ATOM 0 HE2 LYS A 49 5.914 -14.775 9.061 1.00 35.33 H new ATOM 0 HE3 LYS A 49 5.047 -15.756 10.226 1.00 35.33 H new ATOM 0 HZ1 LYS A 49 7.422 -15.944 10.544 1.00 53.33 H new ATOM 0 HZ2 LYS A 49 6.795 -17.444 10.053 1.00 53.33 H new ATOM 0 HZ3 LYS A 49 7.639 -16.473 8.945 1.00 53.33 H new ATOM 814 N GLN A 50 2.195 -16.196 6.679 1.00 54.25 N ATOM 815 CA GLN A 50 1.179 -16.171 7.737 1.00 2.35 C ATOM 816 C GLN A 50 -0.239 -16.270 7.133 1.00 32.23 C ATOM 817 O GLN A 50 -1.201 -16.559 7.850 1.00 1.40 O ATOM 818 CB GLN A 50 1.362 -14.878 8.579 1.00 51.45 C ATOM 819 CG GLN A 50 0.626 -14.862 9.929 1.00 34.14 C ATOM 820 CD GLN A 50 1.045 -16.008 10.853 1.00 70.55 C ATOM 821 OE1 GLN A 50 1.998 -15.890 11.626 1.00 72.23 O ATOM 822 NE2 GLN A 50 0.327 -17.120 10.789 1.00 2.21 N ATOM 0 H GLN A 50 2.516 -15.268 6.403 1.00 54.25 H new ATOM 0 HA GLN A 50 1.303 -17.033 8.392 1.00 2.35 H new ATOM 0 HB2 GLN A 50 2.426 -14.732 8.763 1.00 51.45 H new ATOM 0 HB3 GLN A 50 1.021 -14.028 7.988 1.00 51.45 H new ATOM 0 HG2 GLN A 50 0.816 -13.912 10.429 1.00 34.14 H new ATOM 0 HG3 GLN A 50 -0.448 -14.920 9.752 1.00 34.14 H new ATOM 0 HE21 GLN A 50 -0.456 -17.185 10.138 1.00 2.21 H new ATOM 0 HE22 GLN A 50 0.557 -17.911 11.391 1.00 2.21 H new ATOM 831 N GLY A 51 -0.336 -16.042 5.804 1.00 22.32 N ATOM 832 CA GLY A 51 -1.596 -16.153 5.069 1.00 22.30 C ATOM 833 C GLY A 51 -2.534 -14.983 5.331 1.00 23.44 C ATOM 834 O GLY A 51 -3.758 -15.149 5.347 1.00 63.32 O ATOM 0 H GLY A 51 0.459 -15.778 5.222 1.00 22.32 H new ATOM 0 HA2 GLY A 51 -1.385 -16.212 4.001 1.00 22.30 H new ATOM 0 HA3 GLY A 51 -2.094 -17.082 5.348 1.00 22.30 H new ATOM 838 N ARG A 52 -1.953 -13.794 5.544 1.00 61.43 N ATOM 839 CA ARG A 52 -2.708 -12.551 5.775 1.00 74.31 C ATOM 840 C ARG A 52 -2.077 -11.398 4.976 1.00 74.50 C ATOM 841 O ARG A 52 -0.854 -11.365 4.814 1.00 72.21 O ATOM 842 CB ARG A 52 -2.823 -12.235 7.312 1.00 55.25 C ATOM 843 CG ARG A 52 -1.523 -12.373 8.156 1.00 63.15 C ATOM 844 CD ARG A 52 -0.557 -11.167 8.074 1.00 14.31 C ATOM 845 NE ARG A 52 0.620 -11.353 8.953 1.00 62.14 N ATOM 846 CZ ARG A 52 1.728 -10.591 8.948 1.00 65.32 C ATOM 847 NH1 ARG A 52 1.862 -9.567 8.111 1.00 25.41 N ATOM 848 NH2 ARG A 52 2.724 -10.872 9.773 1.00 24.32 N ATOM 0 H ARG A 52 -0.941 -13.665 5.561 1.00 61.43 H new ATOM 0 HA ARG A 52 -3.729 -12.679 5.414 1.00 74.31 H new ATOM 0 HB2 ARG A 52 -3.193 -11.216 7.422 1.00 55.25 H new ATOM 0 HB3 ARG A 52 -3.577 -12.896 7.739 1.00 55.25 H new ATOM 0 HG2 ARG A 52 -1.800 -12.527 9.199 1.00 63.15 H new ATOM 0 HG3 ARG A 52 -0.991 -13.268 7.832 1.00 63.15 H new ATOM 0 HD2 ARG A 52 -0.226 -11.034 7.044 1.00 14.31 H new ATOM 0 HD3 ARG A 52 -1.085 -10.257 8.359 1.00 14.31 H new ATOM 0 HE ARG A 52 0.588 -12.125 9.619 1.00 62.14 H new ATOM 0 HH11 ARG A 52 1.115 -9.345 7.453 1.00 25.41 H new ATOM 0 HH12 ARG A 52 2.712 -9.004 8.126 1.00 25.41 H new ATOM 0 HH21 ARG A 52 2.650 -11.665 10.410 1.00 24.32 H new ATOM 0 HH22 ARG A 52 3.566 -10.296 9.771 1.00 24.32 H new ATOM 862 N PRO A 53 -2.901 -10.442 4.438 1.00 5.12 N ATOM 863 CA PRO A 53 -2.374 -9.303 3.663 1.00 12.40 C ATOM 864 C PRO A 53 -1.761 -8.231 4.581 1.00 74.13 C ATOM 865 O PRO A 53 -1.754 -8.372 5.818 1.00 61.02 O ATOM 866 CB PRO A 53 -3.620 -8.790 2.902 1.00 24.42 C ATOM 867 CG PRO A 53 -4.777 -9.120 3.803 1.00 72.42 C ATOM 868 CD PRO A 53 -4.390 -10.390 4.547 1.00 74.42 C ATOM 0 HA PRO A 53 -1.560 -9.576 2.991 1.00 12.40 H new ATOM 0 HB2 PRO A 53 -3.557 -7.718 2.715 1.00 24.42 H new ATOM 0 HB3 PRO A 53 -3.721 -9.278 1.932 1.00 24.42 H new ATOM 0 HG2 PRO A 53 -4.972 -8.305 4.500 1.00 72.42 H new ATOM 0 HG3 PRO A 53 -5.689 -9.270 3.225 1.00 72.42 H new ATOM 0 HD2 PRO A 53 -4.712 -10.355 5.588 1.00 74.42 H new ATOM 0 HD3 PRO A 53 -4.853 -11.270 4.100 1.00 74.42 H new ATOM 876 N ILE A 54 -1.263 -7.153 3.976 1.00 45.25 N ATOM 877 CA ILE A 54 -0.530 -6.116 4.701 1.00 31.21 C ATOM 878 C ILE A 54 -0.742 -4.746 4.038 1.00 53.15 C ATOM 879 O ILE A 54 -0.713 -4.629 2.806 1.00 24.52 O ATOM 880 CB ILE A 54 0.996 -6.493 4.791 1.00 73.33 C ATOM 881 CG1 ILE A 54 1.800 -5.423 5.578 1.00 32.32 C ATOM 882 CG2 ILE A 54 1.609 -6.754 3.392 1.00 13.25 C ATOM 883 CD1 ILE A 54 3.256 -5.763 5.775 1.00 64.31 C ATOM 0 H ILE A 54 -1.355 -6.975 2.976 1.00 45.25 H new ATOM 0 HA ILE A 54 -0.916 -6.049 5.718 1.00 31.21 H new ATOM 0 HB ILE A 54 1.065 -7.427 5.348 1.00 73.33 H new ATOM 0 HG12 ILE A 54 1.729 -4.471 5.051 1.00 32.32 H new ATOM 0 HG13 ILE A 54 1.336 -5.282 6.554 1.00 32.32 H new ATOM 0 HG21 ILE A 54 2.663 -7.011 3.499 1.00 13.25 H new ATOM 0 HG22 ILE A 54 1.081 -7.578 2.912 1.00 13.25 H new ATOM 0 HG23 ILE A 54 1.514 -5.857 2.780 1.00 13.25 H new ATOM 0 HD11 ILE A 54 3.744 -4.964 6.333 1.00 64.31 H new ATOM 0 HD12 ILE A 54 3.340 -6.697 6.330 1.00 64.31 H new ATOM 0 HD13 ILE A 54 3.738 -5.874 4.804 1.00 64.31 H new ATOM 895 N VAL A 55 -0.999 -3.725 4.874 1.00 15.20 N ATOM 896 CA VAL A 55 -1.258 -2.354 4.431 1.00 5.33 C ATOM 897 C VAL A 55 -0.111 -1.441 4.895 1.00 55.31 C ATOM 898 O VAL A 55 0.128 -1.305 6.104 1.00 71.01 O ATOM 899 CB VAL A 55 -2.630 -1.812 4.985 1.00 62.34 C ATOM 900 CG1 VAL A 55 -3.068 -0.552 4.224 1.00 52.42 C ATOM 901 CG2 VAL A 55 -3.733 -2.885 4.923 1.00 20.14 C ATOM 0 H VAL A 55 -1.032 -3.835 5.887 1.00 15.20 H new ATOM 0 HA VAL A 55 -1.317 -2.355 3.343 1.00 5.33 H new ATOM 0 HB VAL A 55 -2.476 -1.552 6.032 1.00 62.34 H new ATOM 0 HG11 VAL A 55 -4.017 -0.197 4.624 1.00 52.42 H new ATOM 0 HG12 VAL A 55 -2.312 0.224 4.340 1.00 52.42 H new ATOM 0 HG13 VAL A 55 -3.186 -0.788 3.166 1.00 52.42 H new ATOM 0 HG21 VAL A 55 -4.664 -2.473 5.314 1.00 20.14 H new ATOM 0 HG22 VAL A 55 -3.880 -3.196 3.889 1.00 20.14 H new ATOM 0 HG23 VAL A 55 -3.437 -3.746 5.523 1.00 20.14 H new ATOM 911 N ILE A 56 0.606 -0.839 3.931 1.00 31.21 N ATOM 912 CA ILE A 56 1.779 0.016 4.202 1.00 62.45 C ATOM 913 C ILE A 56 1.450 1.476 3.865 1.00 73.51 C ATOM 914 O ILE A 56 1.115 1.787 2.720 1.00 61.05 O ATOM 915 CB ILE A 56 3.015 -0.455 3.357 1.00 51.31 C ATOM 916 CG1 ILE A 56 3.351 -1.950 3.647 1.00 64.44 C ATOM 917 CG2 ILE A 56 4.252 0.449 3.599 1.00 33.12 C ATOM 918 CD1 ILE A 56 3.781 -2.237 5.073 1.00 43.44 C ATOM 0 H ILE A 56 0.389 -0.931 2.938 1.00 31.21 H new ATOM 0 HA ILE A 56 2.028 -0.066 5.260 1.00 62.45 H new ATOM 0 HB ILE A 56 2.745 -0.364 2.305 1.00 51.31 H new ATOM 0 HG12 ILE A 56 2.475 -2.557 3.417 1.00 64.44 H new ATOM 0 HG13 ILE A 56 4.145 -2.268 2.971 1.00 64.44 H new ATOM 0 HG21 ILE A 56 5.087 0.091 2.997 1.00 33.12 H new ATOM 0 HG22 ILE A 56 4.014 1.475 3.317 1.00 33.12 H new ATOM 0 HG23 ILE A 56 4.525 0.417 4.654 1.00 33.12 H new ATOM 0 HD11 ILE A 56 3.994 -3.300 5.182 1.00 43.44 H new ATOM 0 HD12 ILE A 56 4.677 -1.662 5.306 1.00 43.44 H new ATOM 0 HD13 ILE A 56 2.981 -1.955 5.758 1.00 43.44 H new ATOM 930 N PHE A 57 1.559 2.364 4.863 1.00 22.51 N ATOM 931 CA PHE A 57 1.244 3.790 4.699 1.00 71.21 C ATOM 932 C PHE A 57 2.534 4.613 4.517 1.00 33.40 C ATOM 933 O PHE A 57 3.344 4.744 5.444 1.00 14.22 O ATOM 934 CB PHE A 57 0.423 4.299 5.901 1.00 13.44 C ATOM 935 CG PHE A 57 -0.923 3.597 6.064 1.00 71.34 C ATOM 936 CD1 PHE A 57 -1.033 2.376 6.741 1.00 24.33 C ATOM 937 CD2 PHE A 57 -2.075 4.142 5.514 1.00 65.13 C ATOM 938 CE1 PHE A 57 -2.253 1.748 6.855 1.00 70.20 C ATOM 939 CE2 PHE A 57 -3.285 3.507 5.628 1.00 73.13 C ATOM 940 CZ PHE A 57 -3.374 2.315 6.291 1.00 11.12 C ATOM 0 H PHE A 57 1.867 2.115 5.803 1.00 22.51 H new ATOM 0 HA PHE A 57 0.640 3.914 3.800 1.00 71.21 H new ATOM 0 HB2 PHE A 57 1.006 4.164 6.812 1.00 13.44 H new ATOM 0 HB3 PHE A 57 0.253 5.370 5.787 1.00 13.44 H new ATOM 0 HD1 PHE A 57 -0.154 1.924 7.177 1.00 24.33 H new ATOM 0 HD2 PHE A 57 -2.017 5.083 4.987 1.00 65.13 H new ATOM 0 HE1 PHE A 57 -2.331 0.811 7.387 1.00 70.20 H new ATOM 0 HE2 PHE A 57 -4.169 3.949 5.193 1.00 73.13 H new ATOM 0 HZ PHE A 57 -4.328 1.815 6.373 1.00 11.12 H new ATOM 950 N ILE A 58 2.714 5.122 3.288 1.00 63.12 N ATOM 951 CA ILE A 58 3.857 5.960 2.874 1.00 4.22 C ATOM 952 C ILE A 58 3.319 7.339 2.433 1.00 11.21 C ATOM 953 O ILE A 58 2.225 7.422 1.881 1.00 11.03 O ATOM 954 CB ILE A 58 4.635 5.276 1.680 1.00 32.33 C ATOM 955 CG1 ILE A 58 5.123 3.843 2.064 1.00 23.13 C ATOM 956 CG2 ILE A 58 5.818 6.139 1.188 1.00 25.03 C ATOM 957 CD1 ILE A 58 6.175 3.787 3.166 1.00 64.31 C ATOM 0 H ILE A 58 2.050 4.959 2.531 1.00 63.12 H new ATOM 0 HA ILE A 58 4.548 6.078 3.708 1.00 4.22 H new ATOM 0 HB ILE A 58 3.927 5.187 0.856 1.00 32.33 H new ATOM 0 HG12 ILE A 58 4.260 3.255 2.378 1.00 23.13 H new ATOM 0 HG13 ILE A 58 5.528 3.364 1.173 1.00 23.13 H new ATOM 0 HG21 ILE A 58 6.323 5.630 0.367 1.00 25.03 H new ATOM 0 HG22 ILE A 58 5.446 7.103 0.842 1.00 25.03 H new ATOM 0 HG23 ILE A 58 6.521 6.294 2.007 1.00 25.03 H new ATOM 0 HD11 ILE A 58 6.446 2.749 3.358 1.00 64.31 H new ATOM 0 HD12 ILE A 58 7.060 4.341 2.853 1.00 64.31 H new ATOM 0 HD13 ILE A 58 5.772 4.231 4.076 1.00 64.31 H new ATOM 969 N ARG A 59 4.068 8.420 2.696 1.00 25.30 N ATOM 970 CA ARG A 59 3.676 9.783 2.260 1.00 3.01 C ATOM 971 C ARG A 59 4.139 10.009 0.800 1.00 55.02 C ATOM 972 O ARG A 59 5.109 9.387 0.364 1.00 23.31 O ATOM 973 CB ARG A 59 4.281 10.826 3.225 1.00 64.23 C ATOM 974 CG ARG A 59 3.595 12.208 3.222 1.00 72.13 C ATOM 975 CD ARG A 59 4.333 13.215 4.123 1.00 11.54 C ATOM 976 NE ARG A 59 4.518 12.706 5.502 1.00 21.43 N ATOM 977 CZ ARG A 59 5.601 12.912 6.276 1.00 11.10 C ATOM 978 NH1 ARG A 59 6.638 13.611 5.841 1.00 42.51 N ATOM 979 NH2 ARG A 59 5.633 12.419 7.500 1.00 25.52 N ATOM 0 H ARG A 59 4.950 8.384 3.208 1.00 25.30 H new ATOM 0 HA ARG A 59 2.592 9.893 2.288 1.00 3.01 H new ATOM 0 HB2 ARG A 59 4.244 10.423 4.237 1.00 64.23 H new ATOM 0 HB3 ARG A 59 5.333 10.961 2.974 1.00 64.23 H new ATOM 0 HG2 ARG A 59 3.557 12.592 2.203 1.00 72.13 H new ATOM 0 HG3 ARG A 59 2.565 12.103 3.562 1.00 72.13 H new ATOM 0 HD2 ARG A 59 5.306 13.442 3.688 1.00 11.54 H new ATOM 0 HD3 ARG A 59 3.772 14.149 4.155 1.00 11.54 H new ATOM 0 HE ARG A 59 3.760 12.152 5.900 1.00 21.43 H new ATOM 0 HH11 ARG A 59 6.628 14.007 4.901 1.00 42.51 H new ATOM 0 HH12 ARG A 59 7.447 13.753 6.446 1.00 42.51 H new ATOM 0 HH21 ARG A 59 4.840 11.885 7.856 1.00 25.52 H new ATOM 0 HH22 ARG A 59 6.451 12.572 8.090 1.00 25.52 H new ATOM 993 N GLY A 60 3.444 10.905 0.066 1.00 60.12 N ATOM 994 CA GLY A 60 3.625 11.069 -1.391 1.00 63.44 C ATOM 995 C GLY A 60 5.033 11.456 -1.835 1.00 74.44 C ATOM 996 O GLY A 60 5.456 11.097 -2.940 1.00 31.33 O ATOM 0 H GLY A 60 2.745 11.532 0.465 1.00 60.12 H new ATOM 0 HA2 GLY A 60 3.351 10.135 -1.882 1.00 63.44 H new ATOM 0 HA3 GLY A 60 2.929 11.830 -1.743 1.00 63.44 H new ATOM 1000 N ALA A 61 5.765 12.185 -0.977 1.00 31.12 N ATOM 1001 CA ALA A 61 7.150 12.606 -1.267 1.00 52.50 C ATOM 1002 C ALA A 61 8.103 11.410 -1.142 1.00 32.53 C ATOM 1003 O ALA A 61 9.057 11.264 -1.911 1.00 60.12 O ATOM 1004 CB ALA A 61 7.563 13.743 -0.325 1.00 15.02 C ATOM 0 H ALA A 61 5.419 12.498 -0.070 1.00 31.12 H new ATOM 0 HA ALA A 61 7.205 12.977 -2.291 1.00 52.50 H new ATOM 0 HB1 ALA A 61 8.586 14.046 -0.547 1.00 15.02 H new ATOM 0 HB2 ALA A 61 6.894 14.592 -0.465 1.00 15.02 H new ATOM 0 HB3 ALA A 61 7.502 13.400 0.708 1.00 15.02 H new ATOM 1010 N TYR A 62 7.802 10.564 -0.151 1.00 21.20 N ATOM 1011 CA TYR A 62 8.530 9.322 0.134 1.00 42.05 C ATOM 1012 C TYR A 62 8.214 8.231 -0.901 1.00 64.25 C ATOM 1013 O TYR A 62 9.000 7.300 -1.049 1.00 12.25 O ATOM 1014 CB TYR A 62 8.203 8.805 1.547 1.00 33.01 C ATOM 1015 CG TYR A 62 8.606 9.732 2.692 1.00 35.04 C ATOM 1016 CD1 TYR A 62 9.907 10.221 2.804 1.00 0.45 C ATOM 1017 CD2 TYR A 62 7.698 10.085 3.682 1.00 24.20 C ATOM 1018 CE1 TYR A 62 10.275 11.037 3.856 1.00 40.15 C ATOM 1019 CE2 TYR A 62 8.061 10.893 4.732 1.00 45.31 C ATOM 1020 CZ TYR A 62 9.346 11.368 4.820 1.00 25.00 C ATOM 1021 OH TYR A 62 9.703 12.180 5.873 1.00 52.44 O ATOM 0 H TYR A 62 7.026 10.728 0.491 1.00 21.20 H new ATOM 0 HA TYR A 62 9.593 9.554 0.076 1.00 42.05 H new ATOM 0 HB2 TYR A 62 7.130 8.623 1.610 1.00 33.01 H new ATOM 0 HB3 TYR A 62 8.698 7.844 1.688 1.00 33.01 H new ATOM 0 HD1 TYR A 62 10.639 9.957 2.055 1.00 0.45 H new ATOM 0 HD2 TYR A 62 6.685 9.716 3.625 1.00 24.20 H new ATOM 0 HE1 TYR A 62 11.285 11.414 3.923 1.00 40.15 H new ATOM 0 HE2 TYR A 62 7.336 11.155 5.488 1.00 45.31 H new ATOM 0 HH TYR A 62 8.929 12.314 6.459 1.00 52.44 H new ATOM 1031 N GLU A 63 7.017 8.328 -1.552 1.00 64.22 N ATOM 1032 CA GLU A 63 6.434 7.261 -2.415 1.00 51.10 C ATOM 1033 C GLU A 63 7.426 6.707 -3.454 1.00 43.14 C ATOM 1034 O GLU A 63 7.282 5.568 -3.882 1.00 12.00 O ATOM 1035 CB GLU A 63 5.146 7.751 -3.143 1.00 65.32 C ATOM 1036 CG GLU A 63 4.441 6.648 -3.985 1.00 23.40 C ATOM 1037 CD GLU A 63 3.208 7.088 -4.794 1.00 1.01 C ATOM 1038 OE1 GLU A 63 3.258 8.143 -5.467 1.00 4.33 O ATOM 1039 OE2 GLU A 63 2.195 6.347 -4.802 1.00 55.24 O ATOM 0 H GLU A 63 6.427 9.157 -1.490 1.00 64.22 H new ATOM 0 HA GLU A 63 6.181 6.449 -1.733 1.00 51.10 H new ATOM 0 HB2 GLU A 63 4.444 8.133 -2.402 1.00 65.32 H new ATOM 0 HB3 GLU A 63 5.404 8.584 -3.797 1.00 65.32 H new ATOM 0 HG2 GLU A 63 5.171 6.227 -4.677 1.00 23.40 H new ATOM 0 HG3 GLU A 63 4.140 5.845 -3.312 1.00 23.40 H new ATOM 1046 N GLU A 64 8.417 7.506 -3.865 1.00 1.02 N ATOM 1047 CA GLU A 64 9.447 7.075 -4.834 1.00 31.24 C ATOM 1048 C GLU A 64 10.191 5.769 -4.370 1.00 52.53 C ATOM 1049 O GLU A 64 10.687 5.000 -5.209 1.00 33.53 O ATOM 1050 CB GLU A 64 10.394 8.268 -5.163 1.00 45.43 C ATOM 1051 CG GLU A 64 11.387 8.710 -4.054 1.00 42.11 C ATOM 1052 CD GLU A 64 12.722 7.936 -4.073 1.00 0.32 C ATOM 1053 OE1 GLU A 64 13.438 8.001 -5.097 1.00 4.14 O ATOM 1054 OE2 GLU A 64 13.049 7.246 -3.087 1.00 11.41 O ATOM 0 H GLU A 64 8.533 8.466 -3.541 1.00 1.02 H new ATOM 0 HA GLU A 64 8.962 6.789 -5.767 1.00 31.24 H new ATOM 0 HB2 GLU A 64 10.972 8.007 -6.050 1.00 45.43 H new ATOM 0 HB3 GLU A 64 9.777 9.127 -5.426 1.00 45.43 H new ATOM 0 HG2 GLU A 64 11.593 9.775 -4.166 1.00 42.11 H new ATOM 0 HG3 GLU A 64 10.914 8.577 -3.081 1.00 42.11 H new ATOM 1061 N VAL A 65 10.255 5.546 -3.034 1.00 21.50 N ATOM 1062 CA VAL A 65 10.784 4.298 -2.414 1.00 24.21 C ATOM 1063 C VAL A 65 9.887 3.073 -2.708 1.00 64.45 C ATOM 1064 O VAL A 65 10.390 1.951 -2.844 1.00 22.14 O ATOM 1065 CB VAL A 65 10.925 4.441 -0.845 1.00 0.54 C ATOM 1066 CG1 VAL A 65 11.536 3.169 -0.210 1.00 21.13 C ATOM 1067 CG2 VAL A 65 11.750 5.684 -0.470 1.00 5.11 C ATOM 0 H VAL A 65 9.939 6.231 -2.348 1.00 21.50 H new ATOM 0 HA VAL A 65 11.765 4.141 -2.862 1.00 24.21 H new ATOM 0 HB VAL A 65 9.920 4.566 -0.442 1.00 0.54 H new ATOM 0 HG11 VAL A 65 11.618 3.304 0.869 1.00 21.13 H new ATOM 0 HG12 VAL A 65 10.895 2.313 -0.421 1.00 21.13 H new ATOM 0 HG13 VAL A 65 12.526 2.993 -0.630 1.00 21.13 H new ATOM 0 HG21 VAL A 65 11.829 5.755 0.615 1.00 5.11 H new ATOM 0 HG22 VAL A 65 12.747 5.603 -0.902 1.00 5.11 H new ATOM 0 HG23 VAL A 65 11.259 6.577 -0.857 1.00 5.11 H new ATOM 1077 N VAL A 66 8.563 3.309 -2.785 1.00 30.20 N ATOM 1078 CA VAL A 66 7.538 2.247 -2.879 1.00 65.44 C ATOM 1079 C VAL A 66 7.813 1.251 -4.026 1.00 1.35 C ATOM 1080 O VAL A 66 7.582 0.080 -3.830 1.00 34.24 O ATOM 1081 CB VAL A 66 6.079 2.854 -2.999 1.00 75.30 C ATOM 1082 CG1 VAL A 66 5.004 1.784 -3.306 1.00 31.30 C ATOM 1083 CG2 VAL A 66 5.711 3.625 -1.712 1.00 53.32 C ATOM 0 H VAL A 66 8.170 4.250 -2.784 1.00 30.20 H new ATOM 0 HA VAL A 66 7.599 1.685 -1.947 1.00 65.44 H new ATOM 0 HB VAL A 66 6.094 3.540 -3.846 1.00 75.30 H new ATOM 0 HG11 VAL A 66 4.026 2.260 -3.376 1.00 31.30 H new ATOM 0 HG12 VAL A 66 5.238 1.294 -4.251 1.00 31.30 H new ATOM 0 HG13 VAL A 66 4.990 1.043 -2.507 1.00 31.30 H new ATOM 0 HG21 VAL A 66 4.706 4.036 -1.809 1.00 53.32 H new ATOM 0 HG22 VAL A 66 5.745 2.947 -0.859 1.00 53.32 H new ATOM 0 HG23 VAL A 66 6.422 4.437 -1.558 1.00 53.32 H new ATOM 1093 N ARG A 67 8.366 1.698 -5.181 1.00 12.25 N ATOM 1094 CA ARG A 67 8.634 0.787 -6.339 1.00 64.13 C ATOM 1095 C ARG A 67 9.683 -0.296 -5.967 1.00 2.14 C ATOM 1096 O ARG A 67 9.631 -1.425 -6.459 1.00 23.33 O ATOM 1097 CB ARG A 67 9.120 1.573 -7.587 1.00 1.13 C ATOM 1098 CG ARG A 67 8.983 0.812 -8.930 1.00 3.40 C ATOM 1099 CD ARG A 67 9.712 1.515 -10.087 1.00 1.04 C ATOM 1100 NE ARG A 67 11.173 1.496 -9.879 1.00 32.02 N ATOM 1101 CZ ARG A 67 12.100 1.124 -10.784 1.00 13.53 C ATOM 1102 NH1 ARG A 67 11.758 0.729 -12.006 1.00 42.34 N ATOM 1103 NH2 ARG A 67 13.379 1.114 -10.438 1.00 12.31 N ATOM 0 H ARG A 67 8.634 2.669 -5.342 1.00 12.25 H new ATOM 0 HA ARG A 67 7.690 0.300 -6.583 1.00 64.13 H new ATOM 0 HB2 ARG A 67 8.557 2.504 -7.654 1.00 1.13 H new ATOM 0 HB3 ARG A 67 10.166 1.843 -7.444 1.00 1.13 H new ATOM 0 HG2 ARG A 67 9.381 -0.196 -8.814 1.00 3.40 H new ATOM 0 HG3 ARG A 67 7.927 0.711 -9.179 1.00 3.40 H new ATOM 0 HD2 ARG A 67 9.468 1.022 -11.028 1.00 1.04 H new ATOM 0 HD3 ARG A 67 9.366 2.545 -10.168 1.00 1.04 H new ATOM 0 HE ARG A 67 11.513 1.792 -8.964 1.00 32.02 H new ATOM 0 HH11 ARG A 67 10.775 0.703 -12.277 1.00 42.34 H new ATOM 0 HH12 ARG A 67 12.479 0.452 -12.673 1.00 42.34 H new ATOM 0 HH21 ARG A 67 13.654 1.386 -9.494 1.00 12.31 H new ATOM 0 HH22 ARG A 67 14.088 0.834 -11.115 1.00 12.31 H new ATOM 1117 N ASP A 68 10.629 0.090 -5.092 1.00 35.23 N ATOM 1118 CA ASP A 68 11.673 -0.803 -4.547 1.00 45.44 C ATOM 1119 C ASP A 68 11.045 -1.827 -3.576 1.00 24.04 C ATOM 1120 O ASP A 68 11.343 -3.027 -3.635 1.00 55.44 O ATOM 1121 CB ASP A 68 12.757 0.062 -3.845 1.00 50.32 C ATOM 1122 CG ASP A 68 13.863 -0.756 -3.161 1.00 24.41 C ATOM 1123 OD1 ASP A 68 14.625 -1.443 -3.865 1.00 72.33 O ATOM 1124 OD2 ASP A 68 13.984 -0.698 -1.923 1.00 72.25 O ATOM 0 H ASP A 68 10.692 1.044 -4.737 1.00 35.23 H new ATOM 0 HA ASP A 68 12.144 -1.367 -5.353 1.00 45.44 H new ATOM 0 HB2 ASP A 68 13.212 0.724 -4.582 1.00 50.32 H new ATOM 0 HB3 ASP A 68 12.275 0.696 -3.101 1.00 50.32 H new ATOM 1129 N ILE A 69 10.150 -1.317 -2.710 1.00 63.23 N ATOM 1130 CA ILE A 69 9.310 -2.124 -1.797 1.00 53.32 C ATOM 1131 C ILE A 69 8.447 -3.134 -2.593 1.00 42.40 C ATOM 1132 O ILE A 69 8.320 -4.309 -2.213 1.00 71.54 O ATOM 1133 CB ILE A 69 8.383 -1.168 -0.948 1.00 54.32 C ATOM 1134 CG1 ILE A 69 9.235 -0.271 0.020 1.00 63.03 C ATOM 1135 CG2 ILE A 69 7.284 -1.949 -0.196 1.00 40.01 C ATOM 1136 CD1 ILE A 69 8.443 0.776 0.794 1.00 62.01 C ATOM 0 H ILE A 69 9.985 -0.314 -2.621 1.00 63.23 H new ATOM 0 HA ILE A 69 9.961 -2.686 -1.128 1.00 53.32 H new ATOM 0 HB ILE A 69 7.870 -0.504 -1.643 1.00 54.32 H new ATOM 0 HG12 ILE A 69 9.747 -0.917 0.733 1.00 63.03 H new ATOM 0 HG13 ILE A 69 10.005 0.235 -0.562 1.00 63.03 H new ATOM 0 HG21 ILE A 69 6.669 -1.253 0.375 1.00 40.01 H new ATOM 0 HG22 ILE A 69 6.659 -2.480 -0.914 1.00 40.01 H new ATOM 0 HG23 ILE A 69 7.747 -2.666 0.482 1.00 40.01 H new ATOM 0 HD11 ILE A 69 9.119 1.344 1.434 1.00 62.01 H new ATOM 0 HD12 ILE A 69 7.952 1.452 0.094 1.00 62.01 H new ATOM 0 HD13 ILE A 69 7.691 0.282 1.409 1.00 62.01 H new ATOM 1148 N VAL A 70 7.904 -2.642 -3.718 1.00 21.01 N ATOM 1149 CA VAL A 70 7.021 -3.390 -4.604 1.00 22.44 C ATOM 1150 C VAL A 70 7.789 -4.543 -5.244 1.00 55.24 C ATOM 1151 O VAL A 70 7.283 -5.663 -5.271 1.00 75.15 O ATOM 1152 CB VAL A 70 6.415 -2.461 -5.729 1.00 25.04 C ATOM 1153 CG1 VAL A 70 5.809 -3.283 -6.875 1.00 33.32 C ATOM 1154 CG2 VAL A 70 5.362 -1.483 -5.155 1.00 44.31 C ATOM 0 H VAL A 70 8.076 -1.689 -4.038 1.00 21.01 H new ATOM 0 HA VAL A 70 6.197 -3.783 -4.009 1.00 22.44 H new ATOM 0 HB VAL A 70 7.241 -1.874 -6.131 1.00 25.04 H new ATOM 0 HG11 VAL A 70 5.402 -2.610 -7.630 1.00 33.32 H new ATOM 0 HG12 VAL A 70 6.582 -3.907 -7.324 1.00 33.32 H new ATOM 0 HG13 VAL A 70 5.012 -3.917 -6.486 1.00 33.32 H new ATOM 0 HG21 VAL A 70 4.968 -0.861 -5.958 1.00 44.31 H new ATOM 0 HG22 VAL A 70 4.548 -2.049 -4.702 1.00 44.31 H new ATOM 0 HG23 VAL A 70 5.827 -0.849 -4.400 1.00 44.31 H new ATOM 1164 N GLU A 71 9.012 -4.241 -5.746 1.00 21.12 N ATOM 1165 CA GLU A 71 9.844 -5.223 -6.449 1.00 50.20 C ATOM 1166 C GLU A 71 10.141 -6.409 -5.535 1.00 63.23 C ATOM 1167 O GLU A 71 10.024 -7.546 -5.975 1.00 1.34 O ATOM 1168 CB GLU A 71 11.162 -4.603 -6.979 1.00 35.34 C ATOM 1169 CG GLU A 71 12.060 -5.617 -7.734 1.00 53.03 C ATOM 1170 CD GLU A 71 13.414 -5.046 -8.164 1.00 52.34 C ATOM 1171 OE1 GLU A 71 13.497 -4.457 -9.254 1.00 53.34 O ATOM 1172 OE2 GLU A 71 14.400 -5.180 -7.412 1.00 50.21 O ATOM 0 H GLU A 71 9.437 -3.317 -5.671 1.00 21.12 H new ATOM 0 HA GLU A 71 9.281 -5.568 -7.316 1.00 50.20 H new ATOM 0 HB2 GLU A 71 10.923 -3.774 -7.646 1.00 35.34 H new ATOM 0 HB3 GLU A 71 11.722 -4.187 -6.141 1.00 35.34 H new ATOM 0 HG2 GLU A 71 12.229 -6.484 -7.095 1.00 53.03 H new ATOM 0 HG3 GLU A 71 11.529 -5.971 -8.618 1.00 53.03 H new ATOM 1179 N TYR A 72 10.485 -6.123 -4.256 1.00 21.33 N ATOM 1180 CA TYR A 72 10.710 -7.165 -3.237 1.00 42.01 C ATOM 1181 C TYR A 72 9.487 -8.097 -3.166 1.00 22.23 C ATOM 1182 O TYR A 72 9.617 -9.304 -3.366 1.00 23.12 O ATOM 1183 CB TYR A 72 10.997 -6.527 -1.843 1.00 24.21 C ATOM 1184 CG TYR A 72 11.180 -7.552 -0.695 1.00 52.02 C ATOM 1185 CD1 TYR A 72 10.080 -8.038 0.019 1.00 54.41 C ATOM 1186 CD2 TYR A 72 12.441 -8.040 -0.342 1.00 12.53 C ATOM 1187 CE1 TYR A 72 10.222 -8.965 1.024 1.00 54.24 C ATOM 1188 CE2 TYR A 72 12.590 -8.971 0.671 1.00 41.41 C ATOM 1189 CZ TYR A 72 11.477 -9.431 1.349 1.00 12.24 C ATOM 1190 OH TYR A 72 11.616 -10.359 2.353 1.00 14.51 O ATOM 0 H TYR A 72 10.612 -5.172 -3.909 1.00 21.33 H new ATOM 0 HA TYR A 72 11.585 -7.750 -3.522 1.00 42.01 H new ATOM 0 HB2 TYR A 72 11.897 -5.916 -1.915 1.00 24.21 H new ATOM 0 HB3 TYR A 72 10.176 -5.857 -1.588 1.00 24.21 H new ATOM 0 HD1 TYR A 72 9.093 -7.675 -0.226 1.00 54.41 H new ATOM 0 HD2 TYR A 72 13.314 -7.684 -0.869 1.00 12.53 H new ATOM 0 HE1 TYR A 72 9.354 -9.326 1.556 1.00 54.24 H new ATOM 0 HE2 TYR A 72 13.572 -9.337 0.931 1.00 41.41 H new ATOM 0 HH TYR A 72 11.886 -9.908 3.180 1.00 14.51 H new ATOM 1200 N ALA A 73 8.308 -7.499 -2.917 1.00 53.22 N ATOM 1201 CA ALA A 73 7.041 -8.233 -2.767 1.00 3.24 C ATOM 1202 C ALA A 73 6.678 -9.014 -4.050 1.00 33.20 C ATOM 1203 O ALA A 73 6.155 -10.123 -3.979 1.00 55.45 O ATOM 1204 CB ALA A 73 5.922 -7.259 -2.395 1.00 21.41 C ATOM 0 H ALA A 73 8.208 -6.489 -2.814 1.00 53.22 H new ATOM 0 HA ALA A 73 7.164 -8.964 -1.968 1.00 3.24 H new ATOM 0 HB1 ALA A 73 4.985 -7.806 -2.285 1.00 21.41 H new ATOM 0 HB2 ALA A 73 6.167 -6.765 -1.455 1.00 21.41 H new ATOM 0 HB3 ALA A 73 5.815 -6.511 -3.180 1.00 21.41 H new ATOM 1210 N GLN A 74 7.027 -8.433 -5.205 1.00 2.13 N ATOM 1211 CA GLN A 74 6.734 -9.000 -6.527 1.00 74.44 C ATOM 1212 C GLN A 74 7.614 -10.245 -6.768 1.00 73.45 C ATOM 1213 O GLN A 74 7.158 -11.234 -7.355 1.00 73.35 O ATOM 1214 CB GLN A 74 6.959 -7.904 -7.610 1.00 41.33 C ATOM 1215 CG GLN A 74 6.460 -8.271 -9.018 1.00 4.20 C ATOM 1216 CD GLN A 74 6.729 -7.184 -10.066 1.00 22.42 C ATOM 1217 OE1 GLN A 74 7.780 -7.174 -10.706 1.00 20.31 O ATOM 1218 NE2 GLN A 74 5.778 -6.279 -10.270 1.00 62.33 N ATOM 0 H GLN A 74 7.527 -7.545 -5.248 1.00 2.13 H new ATOM 0 HA GLN A 74 5.694 -9.322 -6.583 1.00 74.44 H new ATOM 0 HB2 GLN A 74 6.459 -6.990 -7.290 1.00 41.33 H new ATOM 0 HB3 GLN A 74 8.025 -7.682 -7.665 1.00 41.33 H new ATOM 0 HG2 GLN A 74 6.940 -9.197 -9.335 1.00 4.20 H new ATOM 0 HG3 GLN A 74 5.388 -8.466 -8.976 1.00 4.20 H new ATOM 0 HE21 GLN A 74 4.917 -6.312 -9.724 1.00 62.33 H new ATOM 0 HE22 GLN A 74 5.909 -5.551 -10.972 1.00 62.33 H new ATOM 1227 N LYS A 75 8.867 -10.198 -6.256 1.00 4.20 N ATOM 1228 CA LYS A 75 9.810 -11.336 -6.318 1.00 35.10 C ATOM 1229 C LYS A 75 9.440 -12.406 -5.268 1.00 1.11 C ATOM 1230 O LYS A 75 9.760 -13.587 -5.442 1.00 53.35 O ATOM 1231 CB LYS A 75 11.285 -10.882 -6.114 1.00 15.31 C ATOM 1232 CG LYS A 75 11.809 -9.808 -7.098 1.00 3.22 C ATOM 1233 CD LYS A 75 11.527 -10.130 -8.584 1.00 32.24 C ATOM 1234 CE LYS A 75 12.104 -9.068 -9.537 1.00 50.14 C ATOM 1235 NZ LYS A 75 13.590 -9.025 -9.500 1.00 11.22 N ATOM 0 H LYS A 75 9.249 -9.374 -5.791 1.00 4.20 H new ATOM 0 HA LYS A 75 9.728 -11.767 -7.316 1.00 35.10 H new ATOM 0 HB2 LYS A 75 11.388 -10.497 -5.099 1.00 15.31 H new ATOM 0 HB3 LYS A 75 11.928 -11.759 -6.189 1.00 15.31 H new ATOM 0 HG2 LYS A 75 11.353 -8.849 -6.851 1.00 3.22 H new ATOM 0 HG3 LYS A 75 12.884 -9.695 -6.958 1.00 3.22 H new ATOM 0 HD2 LYS A 75 11.953 -11.103 -8.829 1.00 32.24 H new ATOM 0 HD3 LYS A 75 10.451 -10.205 -8.738 1.00 32.24 H new ATOM 0 HE2 LYS A 75 11.774 -9.278 -10.554 1.00 50.14 H new ATOM 0 HE3 LYS A 75 11.707 -8.089 -9.269 1.00 50.14 H new ATOM 0 HZ1 LYS A 75 13.937 -8.382 -10.240 1.00 11.22 H new ATOM 0 HZ2 LYS A 75 13.904 -8.684 -8.569 1.00 11.22 H new ATOM 0 HZ3 LYS A 75 13.969 -9.979 -9.665 1.00 11.22 H new ATOM 1249 N GLU A 76 8.755 -11.978 -4.177 1.00 21.22 N ATOM 1250 CA GLU A 76 8.206 -12.888 -3.133 1.00 11.24 C ATOM 1251 C GLU A 76 6.992 -13.688 -3.661 1.00 32.30 C ATOM 1252 O GLU A 76 6.439 -14.527 -2.939 1.00 10.13 O ATOM 1253 CB GLU A 76 7.797 -12.075 -1.863 1.00 21.31 C ATOM 1254 CG GLU A 76 8.964 -11.440 -1.086 1.00 41.00 C ATOM 1255 CD GLU A 76 9.930 -12.463 -0.459 1.00 62.34 C ATOM 1256 OE1 GLU A 76 9.612 -13.010 0.616 1.00 73.54 O ATOM 1257 OE2 GLU A 76 11.009 -12.718 -1.032 1.00 41.34 O ATOM 0 H GLU A 76 8.566 -10.992 -3.994 1.00 21.22 H new ATOM 0 HA GLU A 76 8.990 -13.598 -2.868 1.00 11.24 H new ATOM 0 HB2 GLU A 76 7.109 -11.285 -2.163 1.00 21.31 H new ATOM 0 HB3 GLU A 76 7.250 -12.735 -1.190 1.00 21.31 H new ATOM 0 HG2 GLU A 76 9.525 -10.791 -1.759 1.00 41.00 H new ATOM 0 HG3 GLU A 76 8.559 -10.807 -0.297 1.00 41.00 H new ATOM 1264 N GLY A 77 6.585 -13.411 -4.921 1.00 1.34 N ATOM 1265 CA GLY A 77 5.462 -14.087 -5.559 1.00 71.31 C ATOM 1266 C GLY A 77 4.136 -13.518 -5.101 1.00 22.25 C ATOM 1267 O GLY A 77 3.139 -14.246 -5.005 1.00 61.25 O ATOM 0 H GLY A 77 7.034 -12.712 -5.513 1.00 1.34 H new ATOM 0 HA2 GLY A 77 5.546 -13.990 -6.641 1.00 71.31 H new ATOM 0 HA3 GLY A 77 5.500 -15.152 -5.330 1.00 71.31 H new ATOM 1271 N LEU A 78 4.139 -12.209 -4.785 1.00 61.32 N ATOM 1272 CA LEU A 78 2.962 -11.487 -4.289 1.00 55.51 C ATOM 1273 C LEU A 78 2.543 -10.416 -5.300 1.00 4.24 C ATOM 1274 O LEU A 78 3.389 -9.680 -5.826 1.00 11.50 O ATOM 1275 CB LEU A 78 3.270 -10.829 -2.912 1.00 52.13 C ATOM 1276 CG LEU A 78 3.764 -11.799 -1.794 1.00 4.11 C ATOM 1277 CD1 LEU A 78 4.045 -11.052 -0.476 1.00 64.53 C ATOM 1278 CD2 LEU A 78 2.753 -12.949 -1.595 1.00 15.43 C ATOM 0 H LEU A 78 4.969 -11.622 -4.869 1.00 61.32 H new ATOM 0 HA LEU A 78 2.144 -12.196 -4.161 1.00 55.51 H new ATOM 0 HB2 LEU A 78 4.027 -10.058 -3.059 1.00 52.13 H new ATOM 0 HB3 LEU A 78 2.369 -10.327 -2.560 1.00 52.13 H new ATOM 0 HG LEU A 78 4.711 -12.233 -2.115 1.00 4.11 H new ATOM 0 HD11 LEU A 78 4.387 -11.761 0.278 1.00 64.53 H new ATOM 0 HD12 LEU A 78 4.815 -10.299 -0.642 1.00 64.53 H new ATOM 0 HD13 LEU A 78 3.132 -10.567 -0.131 1.00 64.53 H new ATOM 0 HD21 LEU A 78 3.112 -13.617 -0.812 1.00 15.43 H new ATOM 0 HD22 LEU A 78 1.786 -12.537 -1.306 1.00 15.43 H new ATOM 0 HD23 LEU A 78 2.647 -13.505 -2.526 1.00 15.43 H new ATOM 1290 N ARG A 79 1.236 -10.360 -5.584 1.00 45.15 N ATOM 1291 CA ARG A 79 0.636 -9.289 -6.381 1.00 63.44 C ATOM 1292 C ARG A 79 0.649 -8.018 -5.519 1.00 71.21 C ATOM 1293 O ARG A 79 0.216 -8.049 -4.363 1.00 74.24 O ATOM 1294 CB ARG A 79 -0.804 -9.715 -6.801 1.00 44.43 C ATOM 1295 CG ARG A 79 -1.558 -8.792 -7.808 1.00 51.52 C ATOM 1296 CD ARG A 79 -2.107 -7.488 -7.176 1.00 21.11 C ATOM 1297 NE ARG A 79 -3.118 -6.832 -8.011 1.00 30.03 N ATOM 1298 CZ ARG A 79 -4.387 -7.244 -8.132 1.00 12.11 C ATOM 1299 NH1 ARG A 79 -4.813 -8.314 -7.489 1.00 52.35 N ATOM 1300 NH2 ARG A 79 -5.240 -6.577 -8.887 1.00 41.22 N ATOM 0 H ARG A 79 0.565 -11.059 -5.266 1.00 45.15 H new ATOM 0 HA ARG A 79 1.190 -9.094 -7.299 1.00 63.44 H new ATOM 0 HB2 ARG A 79 -0.747 -10.713 -7.236 1.00 44.43 H new ATOM 0 HB3 ARG A 79 -1.409 -9.794 -5.898 1.00 44.43 H new ATOM 0 HG2 ARG A 79 -0.883 -8.532 -8.623 1.00 51.52 H new ATOM 0 HG3 ARG A 79 -2.387 -9.349 -8.245 1.00 51.52 H new ATOM 0 HD2 ARG A 79 -2.540 -7.716 -6.202 1.00 21.11 H new ATOM 0 HD3 ARG A 79 -1.281 -6.798 -7.004 1.00 21.11 H new ATOM 0 HE ARG A 79 -2.836 -6.005 -8.536 1.00 30.03 H new ATOM 0 HH11 ARG A 79 -4.174 -8.838 -6.891 1.00 52.35 H new ATOM 0 HH12 ARG A 79 -5.782 -8.617 -7.589 1.00 52.35 H new ATOM 0 HH21 ARG A 79 -4.935 -5.740 -9.384 1.00 41.22 H new ATOM 0 HH22 ARG A 79 -6.204 -6.898 -8.973 1.00 41.22 H new ATOM 1314 N VAL A 80 1.150 -6.905 -6.068 1.00 41.52 N ATOM 1315 CA VAL A 80 1.245 -5.643 -5.331 1.00 65.30 C ATOM 1316 C VAL A 80 0.245 -4.650 -5.927 1.00 33.30 C ATOM 1317 O VAL A 80 0.115 -4.541 -7.152 1.00 61.02 O ATOM 1318 CB VAL A 80 2.692 -5.039 -5.343 1.00 53.12 C ATOM 1319 CG1 VAL A 80 2.795 -3.871 -4.333 1.00 50.32 C ATOM 1320 CG2 VAL A 80 3.754 -6.123 -5.052 1.00 14.23 C ATOM 0 H VAL A 80 1.497 -6.855 -7.026 1.00 41.52 H new ATOM 0 HA VAL A 80 1.008 -5.843 -4.286 1.00 65.30 H new ATOM 0 HB VAL A 80 2.891 -4.649 -6.341 1.00 53.12 H new ATOM 0 HG11 VAL A 80 3.805 -3.461 -4.352 1.00 50.32 H new ATOM 0 HG12 VAL A 80 2.082 -3.092 -4.604 1.00 50.32 H new ATOM 0 HG13 VAL A 80 2.570 -4.236 -3.331 1.00 50.32 H new ATOM 0 HG21 VAL A 80 4.747 -5.673 -5.067 1.00 14.23 H new ATOM 0 HG22 VAL A 80 3.569 -6.560 -4.071 1.00 14.23 H new ATOM 0 HG23 VAL A 80 3.697 -6.902 -5.813 1.00 14.23 H new ATOM 1330 N LEU A 81 -0.459 -3.949 -5.045 1.00 70.22 N ATOM 1331 CA LEU A 81 -1.537 -3.041 -5.391 1.00 43.22 C ATOM 1332 C LEU A 81 -1.370 -1.773 -4.567 1.00 61.33 C ATOM 1333 O LEU A 81 -1.584 -1.796 -3.360 1.00 24.25 O ATOM 1334 CB LEU A 81 -2.875 -3.757 -5.082 1.00 13.54 C ATOM 1335 CG LEU A 81 -4.189 -2.986 -5.389 1.00 71.42 C ATOM 1336 CD1 LEU A 81 -4.186 -2.451 -6.816 1.00 50.32 C ATOM 1337 CD2 LEU A 81 -5.412 -3.893 -5.140 1.00 22.05 C ATOM 0 H LEU A 81 -0.287 -4.001 -4.041 1.00 70.22 H new ATOM 0 HA LEU A 81 -1.525 -2.767 -6.446 1.00 43.22 H new ATOM 0 HB2 LEU A 81 -2.894 -4.691 -5.643 1.00 13.54 H new ATOM 0 HB3 LEU A 81 -2.879 -4.021 -4.024 1.00 13.54 H new ATOM 0 HG LEU A 81 -4.253 -2.131 -4.716 1.00 71.42 H new ATOM 0 HD11 LEU A 81 -5.116 -1.916 -7.006 1.00 50.32 H new ATOM 0 HD12 LEU A 81 -3.343 -1.773 -6.948 1.00 50.32 H new ATOM 0 HD13 LEU A 81 -4.096 -3.282 -7.516 1.00 50.32 H new ATOM 0 HD21 LEU A 81 -6.326 -3.340 -5.359 1.00 22.05 H new ATOM 0 HD22 LEU A 81 -5.354 -4.768 -5.787 1.00 22.05 H new ATOM 0 HD23 LEU A 81 -5.422 -4.212 -4.098 1.00 22.05 H new ATOM 1349 N VAL A 82 -0.969 -0.663 -5.195 1.00 65.21 N ATOM 1350 CA VAL A 82 -0.743 0.590 -4.466 1.00 2.23 C ATOM 1351 C VAL A 82 -2.010 1.459 -4.550 1.00 52.31 C ATOM 1352 O VAL A 82 -2.460 1.831 -5.639 1.00 51.02 O ATOM 1353 CB VAL A 82 0.557 1.348 -4.957 1.00 43.03 C ATOM 1354 CG1 VAL A 82 1.794 0.421 -4.867 1.00 5.13 C ATOM 1355 CG2 VAL A 82 0.424 1.912 -6.381 1.00 73.11 C ATOM 0 H VAL A 82 -0.795 -0.606 -6.198 1.00 65.21 H new ATOM 0 HA VAL A 82 -0.553 0.359 -3.418 1.00 2.23 H new ATOM 0 HB VAL A 82 0.687 2.199 -4.289 1.00 43.03 H new ATOM 0 HG11 VAL A 82 2.678 0.960 -5.209 1.00 5.13 H new ATOM 0 HG12 VAL A 82 1.938 0.106 -3.834 1.00 5.13 H new ATOM 0 HG13 VAL A 82 1.638 -0.456 -5.495 1.00 5.13 H new ATOM 0 HG21 VAL A 82 1.348 2.420 -6.659 1.00 73.11 H new ATOM 0 HG22 VAL A 82 0.234 1.097 -7.079 1.00 73.11 H new ATOM 0 HG23 VAL A 82 -0.404 2.620 -6.416 1.00 73.11 H new ATOM 1365 N ILE A 83 -2.629 1.725 -3.398 1.00 11.44 N ATOM 1366 CA ILE A 83 -3.838 2.545 -3.303 1.00 71.20 C ATOM 1367 C ILE A 83 -3.383 3.956 -2.936 1.00 72.02 C ATOM 1368 O ILE A 83 -3.024 4.215 -1.790 1.00 54.53 O ATOM 1369 CB ILE A 83 -4.816 1.982 -2.211 1.00 30.42 C ATOM 1370 CG1 ILE A 83 -5.142 0.482 -2.495 1.00 34.40 C ATOM 1371 CG2 ILE A 83 -6.111 2.831 -2.106 1.00 64.03 C ATOM 1372 CD1 ILE A 83 -5.875 -0.223 -1.369 1.00 72.51 C ATOM 0 H ILE A 83 -2.302 1.374 -2.498 1.00 11.44 H new ATOM 0 HA ILE A 83 -4.382 2.539 -4.248 1.00 71.20 H new ATOM 0 HB ILE A 83 -4.315 2.048 -1.245 1.00 30.42 H new ATOM 0 HG12 ILE A 83 -5.745 0.419 -3.401 1.00 34.40 H new ATOM 0 HG13 ILE A 83 -4.211 -0.048 -2.694 1.00 34.40 H new ATOM 0 HG21 ILE A 83 -6.762 2.409 -1.340 1.00 64.03 H new ATOM 0 HG22 ILE A 83 -5.853 3.856 -1.839 1.00 64.03 H new ATOM 0 HG23 ILE A 83 -6.629 2.825 -3.065 1.00 64.03 H new ATOM 0 HD11 ILE A 83 -6.062 -1.260 -1.649 1.00 72.51 H new ATOM 0 HD12 ILE A 83 -5.266 -0.195 -0.465 1.00 72.51 H new ATOM 0 HD13 ILE A 83 -6.824 0.279 -1.182 1.00 72.51 H new ATOM 1384 N LYS A 84 -3.405 4.875 -3.892 1.00 61.31 N ATOM 1385 CA LYS A 84 -2.680 6.144 -3.777 1.00 70.33 C ATOM 1386 C LYS A 84 -3.553 7.330 -4.208 1.00 35.02 C ATOM 1387 O LYS A 84 -4.226 7.292 -5.246 1.00 11.43 O ATOM 1388 CB LYS A 84 -1.327 6.034 -4.558 1.00 43.04 C ATOM 1389 CG LYS A 84 -1.422 5.421 -5.993 1.00 61.31 C ATOM 1390 CD LYS A 84 -1.531 6.465 -7.134 1.00 62.03 C ATOM 1391 CE LYS A 84 -0.180 7.098 -7.524 1.00 55.03 C ATOM 1392 NZ LYS A 84 0.481 7.818 -6.400 1.00 45.34 N ATOM 0 H LYS A 84 -3.921 4.768 -4.766 1.00 61.31 H new ATOM 0 HA LYS A 84 -2.437 6.342 -2.733 1.00 70.33 H new ATOM 0 HB2 LYS A 84 -0.892 7.030 -4.636 1.00 43.04 H new ATOM 0 HB3 LYS A 84 -0.637 5.430 -3.969 1.00 43.04 H new ATOM 0 HG2 LYS A 84 -0.543 4.801 -6.168 1.00 61.31 H new ATOM 0 HG3 LYS A 84 -2.290 4.763 -6.036 1.00 61.31 H new ATOM 0 HD2 LYS A 84 -1.965 5.987 -8.012 1.00 62.03 H new ATOM 0 HD3 LYS A 84 -2.218 7.254 -6.828 1.00 62.03 H new ATOM 0 HE2 LYS A 84 0.487 6.317 -7.888 1.00 55.03 H new ATOM 0 HE3 LYS A 84 -0.337 7.793 -8.349 1.00 55.03 H new ATOM 0 HZ1 LYS A 84 1.249 8.412 -6.772 1.00 45.34 H new ATOM 0 HZ2 LYS A 84 -0.216 8.417 -5.914 1.00 45.34 H new ATOM 0 HZ3 LYS A 84 0.873 7.128 -5.728 1.00 45.34 H new ATOM 1406 N VAL A 85 -3.561 8.362 -3.360 1.00 33.24 N ATOM 1407 CA VAL A 85 -4.367 9.568 -3.530 1.00 2.32 C ATOM 1408 C VAL A 85 -3.597 10.572 -4.409 1.00 50.45 C ATOM 1409 O VAL A 85 -2.449 10.915 -4.093 1.00 61.23 O ATOM 1410 CB VAL A 85 -4.709 10.187 -2.119 1.00 74.04 C ATOM 1411 CG1 VAL A 85 -5.568 11.455 -2.235 1.00 2.23 C ATOM 1412 CG2 VAL A 85 -5.402 9.150 -1.199 1.00 34.33 C ATOM 0 H VAL A 85 -2.991 8.380 -2.514 1.00 33.24 H new ATOM 0 HA VAL A 85 -5.307 9.323 -4.025 1.00 2.32 H new ATOM 0 HB VAL A 85 -3.759 10.471 -1.667 1.00 74.04 H new ATOM 0 HG11 VAL A 85 -5.778 11.845 -1.239 1.00 2.23 H new ATOM 0 HG12 VAL A 85 -5.031 12.207 -2.813 1.00 2.23 H new ATOM 0 HG13 VAL A 85 -6.506 11.214 -2.735 1.00 2.23 H new ATOM 0 HG21 VAL A 85 -5.624 9.609 -0.236 1.00 34.33 H new ATOM 0 HG22 VAL A 85 -6.329 8.814 -1.663 1.00 34.33 H new ATOM 0 HG23 VAL A 85 -4.741 8.296 -1.051 1.00 34.33 H new ATOM 1422 N ALA A 86 -4.232 11.022 -5.514 1.00 42.22 N ATOM 1423 CA ALA A 86 -3.592 11.859 -6.541 1.00 22.21 C ATOM 1424 C ALA A 86 -3.252 13.262 -6.001 1.00 70.31 C ATOM 1425 O ALA A 86 -2.075 13.544 -5.744 1.00 15.31 O ATOM 1426 CB ALA A 86 -4.474 11.924 -7.798 1.00 52.20 C ATOM 0 H ALA A 86 -5.209 10.811 -5.715 1.00 42.22 H new ATOM 0 HA ALA A 86 -2.644 11.398 -6.818 1.00 22.21 H new ATOM 0 HB1 ALA A 86 -3.990 12.546 -8.551 1.00 52.20 H new ATOM 0 HB2 ALA A 86 -4.616 10.919 -8.195 1.00 52.20 H new ATOM 0 HB3 ALA A 86 -5.443 12.353 -7.541 1.00 52.20 H new ATOM 1432 N GLN A 87 -4.299 14.104 -5.791 1.00 35.32 N ATOM 1433 CA GLN A 87 -4.190 15.518 -5.338 1.00 44.32 C ATOM 1434 C GLN A 87 -3.299 16.360 -6.285 1.00 61.15 C ATOM 1435 O GLN A 87 -3.801 17.151 -7.089 1.00 23.55 O ATOM 1436 CB GLN A 87 -3.688 15.624 -3.863 1.00 2.42 C ATOM 1437 CG GLN A 87 -4.487 14.812 -2.828 1.00 61.33 C ATOM 1438 CD GLN A 87 -5.923 15.299 -2.590 1.00 20.45 C ATOM 1439 OE1 GLN A 87 -6.574 15.872 -3.463 1.00 4.55 O ATOM 1440 NE2 GLN A 87 -6.448 15.042 -1.410 1.00 61.21 N ATOM 0 H GLN A 87 -5.265 13.812 -5.935 1.00 35.32 H new ATOM 0 HA GLN A 87 -5.198 15.932 -5.373 1.00 44.32 H new ATOM 0 HB2 GLN A 87 -2.648 15.300 -3.828 1.00 2.42 H new ATOM 0 HB3 GLN A 87 -3.705 16.673 -3.567 1.00 2.42 H new ATOM 0 HG2 GLN A 87 -4.521 13.772 -3.152 1.00 61.33 H new ATOM 0 HG3 GLN A 87 -3.950 14.833 -1.879 1.00 61.33 H new ATOM 0 HE21 GLN A 87 -5.894 14.566 -0.698 1.00 61.21 H new ATOM 0 HE22 GLN A 87 -7.409 15.319 -1.208 1.00 61.21 H new ATOM 1449 N ASP A 88 -1.973 16.170 -6.157 1.00 72.15 N ATOM 1450 CA ASP A 88 -0.948 16.757 -7.033 1.00 42.34 C ATOM 1451 C ASP A 88 -1.196 16.383 -8.504 1.00 64.14 C ATOM 1452 O ASP A 88 -1.260 17.263 -9.372 1.00 51.22 O ATOM 1453 CB ASP A 88 0.444 16.258 -6.564 1.00 25.33 C ATOM 1454 CG ASP A 88 1.590 16.647 -7.512 1.00 60.20 C ATOM 1455 OD1 ASP A 88 2.157 17.746 -7.370 1.00 75.45 O ATOM 1456 OD2 ASP A 88 1.927 15.843 -8.399 1.00 20.40 O ATOM 0 H ASP A 88 -1.576 15.587 -5.420 1.00 72.15 H new ATOM 0 HA ASP A 88 -0.992 17.844 -6.967 1.00 42.34 H new ATOM 0 HB2 ASP A 88 0.651 16.662 -5.573 1.00 25.33 H new ATOM 0 HB3 ASP A 88 0.417 15.173 -6.466 1.00 25.33 H new ATOM 1461 N GLN A 89 -1.328 15.059 -8.739 1.00 54.00 N ATOM 1462 CA GLN A 89 -1.578 14.439 -10.059 1.00 12.11 C ATOM 1463 C GLN A 89 -0.320 14.444 -10.975 1.00 51.11 C ATOM 1464 O GLN A 89 0.073 13.387 -11.451 1.00 42.14 O ATOM 1465 CB GLN A 89 -2.805 15.052 -10.812 1.00 10.32 C ATOM 1466 CG GLN A 89 -4.148 14.959 -10.055 1.00 50.53 C ATOM 1467 CD GLN A 89 -5.332 15.498 -10.872 1.00 52.30 C ATOM 1468 OE1 GLN A 89 -6.005 14.756 -11.586 1.00 30.12 O ATOM 1469 NE2 GLN A 89 -5.586 16.792 -10.785 1.00 54.12 N ATOM 0 H GLN A 89 -1.261 14.370 -7.990 1.00 54.00 H new ATOM 0 HA GLN A 89 -1.824 13.402 -9.832 1.00 12.11 H new ATOM 0 HB2 GLN A 89 -2.596 16.101 -11.023 1.00 10.32 H new ATOM 0 HB3 GLN A 89 -2.911 14.549 -11.773 1.00 10.32 H new ATOM 0 HG2 GLN A 89 -4.339 13.919 -9.790 1.00 50.53 H new ATOM 0 HG3 GLN A 89 -4.073 15.517 -9.122 1.00 50.53 H new ATOM 0 HE21 GLN A 89 -5.012 17.385 -10.185 1.00 54.12 H new ATOM 0 HE22 GLN A 89 -6.356 17.198 -11.317 1.00 54.12 H new ATOM 1478 N GLU A 90 0.325 15.617 -11.168 1.00 1.35 N ATOM 1479 CA GLU A 90 1.327 15.839 -12.247 1.00 74.14 C ATOM 1480 C GLU A 90 2.692 15.155 -11.971 1.00 54.32 C ATOM 1481 O GLU A 90 3.139 14.316 -12.761 1.00 72.24 O ATOM 1482 CB GLU A 90 1.525 17.367 -12.423 1.00 44.02 C ATOM 1483 CG GLU A 90 2.611 17.775 -13.446 1.00 41.24 C ATOM 1484 CD GLU A 90 2.879 19.282 -13.443 1.00 63.14 C ATOM 1485 OE1 GLU A 90 3.582 19.761 -12.531 1.00 71.31 O ATOM 1486 OE2 GLU A 90 2.382 20.000 -14.335 1.00 10.11 O ATOM 0 H GLU A 90 0.169 16.438 -10.583 1.00 1.35 H new ATOM 0 HA GLU A 90 0.941 15.382 -13.158 1.00 74.14 H new ATOM 0 HB2 GLU A 90 0.576 17.808 -12.729 1.00 44.02 H new ATOM 0 HB3 GLU A 90 1.780 17.798 -11.455 1.00 44.02 H new ATOM 0 HG2 GLU A 90 3.536 17.244 -13.221 1.00 41.24 H new ATOM 0 HG3 GLU A 90 2.300 17.466 -14.444 1.00 41.24 H new ATOM 1493 N LEU A 91 3.332 15.502 -10.844 1.00 63.25 N ATOM 1494 CA LEU A 91 4.644 14.930 -10.444 1.00 12.33 C ATOM 1495 C LEU A 91 4.437 13.493 -9.948 1.00 42.33 C ATOM 1496 O LEU A 91 5.322 12.642 -10.048 1.00 33.42 O ATOM 1497 CB LEU A 91 5.306 15.794 -9.334 1.00 35.44 C ATOM 1498 CG LEU A 91 5.397 17.328 -9.603 1.00 5.21 C ATOM 1499 CD1 LEU A 91 6.116 18.052 -8.445 1.00 51.14 C ATOM 1500 CD2 LEU A 91 6.061 17.641 -10.961 1.00 73.15 C ATOM 0 H LEU A 91 2.963 16.184 -10.181 1.00 63.25 H new ATOM 0 HA LEU A 91 5.309 14.925 -11.307 1.00 12.33 H new ATOM 0 HB2 LEU A 91 4.751 15.643 -8.408 1.00 35.44 H new ATOM 0 HB3 LEU A 91 6.315 15.417 -9.166 1.00 35.44 H new ATOM 0 HG LEU A 91 4.377 17.707 -9.655 1.00 5.21 H new ATOM 0 HD11 LEU A 91 6.166 19.120 -8.658 1.00 51.14 H new ATOM 0 HD12 LEU A 91 5.565 17.892 -7.518 1.00 51.14 H new ATOM 0 HD13 LEU A 91 7.126 17.656 -8.339 1.00 51.14 H new ATOM 0 HD21 LEU A 91 6.103 18.721 -11.105 1.00 73.15 H new ATOM 0 HD22 LEU A 91 7.072 17.234 -10.974 1.00 73.15 H new ATOM 0 HD23 LEU A 91 5.478 17.190 -11.764 1.00 73.15 H new ATOM 1512 N LEU A 92 3.240 13.279 -9.393 1.00 21.11 N ATOM 1513 CA LEU A 92 2.742 11.980 -8.954 1.00 20.33 C ATOM 1514 C LEU A 92 2.608 11.005 -10.143 1.00 71.33 C ATOM 1515 O LEU A 92 2.904 9.820 -9.997 1.00 34.44 O ATOM 1516 CB LEU A 92 1.388 12.207 -8.228 1.00 24.44 C ATOM 1517 CG LEU A 92 0.576 10.929 -7.792 1.00 33.04 C ATOM 1518 CD1 LEU A 92 0.034 11.068 -6.354 1.00 1.44 C ATOM 1519 CD2 LEU A 92 -0.579 10.626 -8.788 1.00 54.23 C ATOM 0 H LEU A 92 2.572 14.033 -9.233 1.00 21.11 H new ATOM 0 HA LEU A 92 3.447 11.517 -8.264 1.00 20.33 H new ATOM 0 HB2 LEU A 92 1.580 12.805 -7.337 1.00 24.44 H new ATOM 0 HB3 LEU A 92 0.751 12.804 -8.881 1.00 24.44 H new ATOM 0 HG LEU A 92 1.267 10.086 -7.810 1.00 33.04 H new ATOM 0 HD11 LEU A 92 -0.521 10.169 -6.086 1.00 1.44 H new ATOM 0 HD12 LEU A 92 0.866 11.200 -5.663 1.00 1.44 H new ATOM 0 HD13 LEU A 92 -0.627 11.933 -6.296 1.00 1.44 H new ATOM 0 HD21 LEU A 92 -1.120 9.739 -8.459 1.00 54.23 H new ATOM 0 HD22 LEU A 92 -1.262 11.475 -8.823 1.00 54.23 H new ATOM 0 HD23 LEU A 92 -0.166 10.452 -9.782 1.00 54.23 H new ATOM 1531 N GLU A 93 2.180 11.539 -11.313 1.00 31.21 N ATOM 1532 CA GLU A 93 1.978 10.759 -12.558 1.00 50.31 C ATOM 1533 C GLU A 93 3.299 10.125 -13.023 1.00 14.22 C ATOM 1534 O GLU A 93 3.299 9.010 -13.554 1.00 64.12 O ATOM 1535 CB GLU A 93 1.363 11.685 -13.657 1.00 20.53 C ATOM 1536 CG GLU A 93 0.947 11.024 -15.004 1.00 20.22 C ATOM 1537 CD GLU A 93 2.125 10.758 -15.967 1.00 74.41 C ATOM 1538 OE1 GLU A 93 2.894 11.695 -16.248 1.00 64.24 O ATOM 1539 OE2 GLU A 93 2.271 9.629 -16.471 1.00 1.11 O ATOM 0 H GLU A 93 1.964 12.530 -11.420 1.00 31.21 H new ATOM 0 HA GLU A 93 1.282 9.943 -12.366 1.00 50.31 H new ATOM 0 HB2 GLU A 93 0.483 12.170 -13.234 1.00 20.53 H new ATOM 0 HB3 GLU A 93 2.085 12.471 -13.877 1.00 20.53 H new ATOM 0 HG2 GLU A 93 0.444 10.080 -14.793 1.00 20.22 H new ATOM 0 HG3 GLU A 93 0.222 11.667 -15.503 1.00 20.22 H new ATOM 1546 N ARG A 94 4.407 10.852 -12.801 1.00 52.32 N ATOM 1547 CA ARG A 94 5.764 10.420 -13.185 1.00 4.52 C ATOM 1548 C ARG A 94 6.104 9.032 -12.597 1.00 52.54 C ATOM 1549 O ARG A 94 6.561 8.132 -13.314 1.00 63.13 O ATOM 1550 CB ARG A 94 6.789 11.484 -12.720 1.00 11.04 C ATOM 1551 CG ARG A 94 8.258 11.165 -13.058 1.00 43.44 C ATOM 1552 CD ARG A 94 9.226 12.210 -12.491 1.00 14.03 C ATOM 1553 NE ARG A 94 9.148 12.312 -11.020 1.00 13.32 N ATOM 1554 CZ ARG A 94 9.636 13.328 -10.287 1.00 40.13 C ATOM 1555 NH1 ARG A 94 10.253 14.359 -10.867 1.00 41.43 N ATOM 1556 NH2 ARG A 94 9.501 13.301 -8.969 1.00 1.45 N ATOM 0 H ARG A 94 4.387 11.765 -12.346 1.00 52.32 H new ATOM 0 HA ARG A 94 5.808 10.326 -14.270 1.00 4.52 H new ATOM 0 HB2 ARG A 94 6.527 12.441 -13.172 1.00 11.04 H new ATOM 0 HB3 ARG A 94 6.699 11.606 -11.641 1.00 11.04 H new ATOM 0 HG2 ARG A 94 8.515 10.183 -12.662 1.00 43.44 H new ATOM 0 HG3 ARG A 94 8.376 11.113 -14.140 1.00 43.44 H new ATOM 0 HD2 ARG A 94 10.245 11.952 -12.781 1.00 14.03 H new ATOM 0 HD3 ARG A 94 9.005 13.182 -12.932 1.00 14.03 H new ATOM 0 HE ARG A 94 8.687 11.551 -10.520 1.00 13.32 H new ATOM 0 HH11 ARG A 94 10.360 14.384 -11.881 1.00 41.43 H new ATOM 0 HH12 ARG A 94 10.618 15.122 -10.296 1.00 41.43 H new ATOM 0 HH21 ARG A 94 9.031 12.515 -8.521 1.00 1.45 H new ATOM 0 HH22 ARG A 94 9.867 14.066 -8.403 1.00 1.45 H new ATOM 1570 N PHE A 95 5.858 8.887 -11.289 1.00 52.11 N ATOM 1571 CA PHE A 95 6.104 7.638 -10.555 1.00 13.41 C ATOM 1572 C PHE A 95 4.975 6.612 -10.807 1.00 63.42 C ATOM 1573 O PHE A 95 5.224 5.403 -10.895 1.00 64.41 O ATOM 1574 CB PHE A 95 6.251 7.946 -9.047 1.00 1.25 C ATOM 1575 CG PHE A 95 6.630 6.729 -8.219 1.00 61.01 C ATOM 1576 CD1 PHE A 95 7.912 6.190 -8.307 1.00 42.23 C ATOM 1577 CD2 PHE A 95 5.704 6.095 -7.394 1.00 11.04 C ATOM 1578 CE1 PHE A 95 8.255 5.071 -7.591 1.00 73.54 C ATOM 1579 CE2 PHE A 95 6.052 4.968 -6.683 1.00 12.41 C ATOM 1580 CZ PHE A 95 7.323 4.460 -6.780 1.00 74.24 C ATOM 0 H PHE A 95 5.481 9.635 -10.707 1.00 52.11 H new ATOM 0 HA PHE A 95 7.031 7.193 -10.916 1.00 13.41 H new ATOM 0 HB2 PHE A 95 7.009 8.718 -8.913 1.00 1.25 H new ATOM 0 HB3 PHE A 95 5.312 8.353 -8.673 1.00 1.25 H new ATOM 0 HD1 PHE A 95 8.645 6.659 -8.947 1.00 42.23 H new ATOM 0 HD2 PHE A 95 4.703 6.491 -7.311 1.00 11.04 H new ATOM 0 HE1 PHE A 95 9.255 4.669 -7.663 1.00 73.54 H new ATOM 0 HE2 PHE A 95 5.324 4.484 -6.049 1.00 12.41 H new ATOM 0 HZ PHE A 95 7.594 3.578 -6.219 1.00 74.24 H new ATOM 1590 N TYR A 96 3.738 7.129 -10.920 1.00 44.43 N ATOM 1591 CA TYR A 96 2.505 6.341 -11.145 1.00 21.54 C ATOM 1592 C TYR A 96 2.608 5.453 -12.408 1.00 63.03 C ATOM 1593 O TYR A 96 2.242 4.267 -12.372 1.00 55.12 O ATOM 1594 CB TYR A 96 1.300 7.333 -11.219 1.00 73.24 C ATOM 1595 CG TYR A 96 0.073 6.883 -12.030 1.00 23.14 C ATOM 1596 CD1 TYR A 96 -0.863 6.006 -11.496 1.00 75.32 C ATOM 1597 CD2 TYR A 96 -0.148 7.361 -13.332 1.00 74.13 C ATOM 1598 CE1 TYR A 96 -1.968 5.616 -12.227 1.00 40.24 C ATOM 1599 CE2 TYR A 96 -1.253 6.968 -14.061 1.00 53.52 C ATOM 1600 CZ TYR A 96 -2.163 6.097 -13.501 1.00 70.43 C ATOM 1601 OH TYR A 96 -3.268 5.698 -14.226 1.00 73.52 O ATOM 0 H TYR A 96 3.560 8.131 -10.856 1.00 44.43 H new ATOM 0 HA TYR A 96 2.356 5.650 -10.316 1.00 21.54 H new ATOM 0 HB2 TYR A 96 0.974 7.546 -10.201 1.00 73.24 H new ATOM 0 HB3 TYR A 96 1.659 8.271 -11.641 1.00 73.24 H new ATOM 0 HD1 TYR A 96 -0.725 5.624 -10.495 1.00 75.32 H new ATOM 0 HD2 TYR A 96 0.559 8.049 -13.771 1.00 74.13 H new ATOM 0 HE1 TYR A 96 -2.682 4.930 -11.796 1.00 40.24 H new ATOM 0 HE2 TYR A 96 -1.403 7.341 -15.063 1.00 53.52 H new ATOM 0 HH TYR A 96 -3.256 6.131 -15.105 1.00 73.52 H new ATOM 1611 N GLU A 97 3.099 6.054 -13.509 1.00 73.00 N ATOM 1612 CA GLU A 97 3.282 5.363 -14.793 1.00 0.21 C ATOM 1613 C GLU A 97 4.339 4.269 -14.657 1.00 53.14 C ATOM 1614 O GLU A 97 4.140 3.155 -15.138 1.00 62.33 O ATOM 1615 CB GLU A 97 3.693 6.363 -15.905 1.00 43.43 C ATOM 1616 CG GLU A 97 3.904 5.711 -17.291 1.00 12.03 C ATOM 1617 CD GLU A 97 4.251 6.718 -18.392 1.00 61.24 C ATOM 1618 OE1 GLU A 97 5.408 7.169 -18.452 1.00 40.24 O ATOM 1619 OE2 GLU A 97 3.374 7.054 -19.218 1.00 30.24 O ATOM 0 H GLU A 97 3.379 7.034 -13.529 1.00 73.00 H new ATOM 0 HA GLU A 97 2.332 4.908 -15.073 1.00 0.21 H new ATOM 0 HB2 GLU A 97 2.925 7.132 -15.990 1.00 43.43 H new ATOM 0 HB3 GLU A 97 4.614 6.864 -15.607 1.00 43.43 H new ATOM 0 HG2 GLU A 97 4.703 4.973 -17.219 1.00 12.03 H new ATOM 0 HG3 GLU A 97 2.999 5.174 -17.573 1.00 12.03 H new ATOM 1626 N GLN A 98 5.439 4.614 -13.963 1.00 63.11 N ATOM 1627 CA GLN A 98 6.599 3.731 -13.770 1.00 20.45 C ATOM 1628 C GLN A 98 6.194 2.426 -13.067 1.00 3.13 C ATOM 1629 O GLN A 98 6.684 1.364 -13.427 1.00 63.43 O ATOM 1630 CB GLN A 98 7.737 4.490 -12.995 1.00 53.33 C ATOM 1631 CG GLN A 98 9.053 4.642 -13.789 1.00 73.24 C ATOM 1632 CD GLN A 98 8.888 5.321 -15.160 1.00 61.24 C ATOM 1633 OE1 GLN A 98 8.021 6.175 -15.366 1.00 30.14 O ATOM 1634 NE2 GLN A 98 9.737 4.961 -16.107 1.00 44.13 N ATOM 0 H GLN A 98 5.546 5.525 -13.516 1.00 63.11 H new ATOM 0 HA GLN A 98 6.991 3.452 -14.748 1.00 20.45 H new ATOM 0 HB2 GLN A 98 7.375 5.481 -12.720 1.00 53.33 H new ATOM 0 HB3 GLN A 98 7.946 3.958 -12.067 1.00 53.33 H new ATOM 0 HG2 GLN A 98 9.759 5.220 -13.193 1.00 73.24 H new ATOM 0 HG3 GLN A 98 9.492 3.655 -13.935 1.00 73.24 H new ATOM 0 HE21 GLN A 98 10.446 4.253 -15.914 1.00 44.13 H new ATOM 0 HE22 GLN A 98 9.684 5.391 -17.030 1.00 44.13 H new ATOM 1643 N LEU A 99 5.267 2.530 -12.100 1.00 2.23 N ATOM 1644 CA LEU A 99 4.697 1.366 -11.394 1.00 3.42 C ATOM 1645 C LEU A 99 4.031 0.398 -12.389 1.00 75.13 C ATOM 1646 O LEU A 99 4.393 -0.776 -12.465 1.00 70.33 O ATOM 1647 CB LEU A 99 3.669 1.861 -10.346 1.00 73.13 C ATOM 1648 CG LEU A 99 4.270 2.615 -9.125 1.00 43.21 C ATOM 1649 CD1 LEU A 99 3.188 3.393 -8.356 1.00 4.24 C ATOM 1650 CD2 LEU A 99 5.012 1.631 -8.201 1.00 64.02 C ATOM 0 H LEU A 99 4.890 3.424 -11.784 1.00 2.23 H new ATOM 0 HA LEU A 99 5.497 0.825 -10.889 1.00 3.42 H new ATOM 0 HB2 LEU A 99 2.957 2.520 -10.844 1.00 73.13 H new ATOM 0 HB3 LEU A 99 3.107 1.002 -9.980 1.00 73.13 H new ATOM 0 HG LEU A 99 4.988 3.345 -9.497 1.00 43.21 H new ATOM 0 HD11 LEU A 99 3.642 3.908 -7.510 1.00 4.24 H new ATOM 0 HD12 LEU A 99 2.725 4.124 -9.019 1.00 4.24 H new ATOM 0 HD13 LEU A 99 2.429 2.699 -7.994 1.00 4.24 H new ATOM 0 HD21 LEU A 99 5.427 2.173 -7.351 1.00 64.02 H new ATOM 0 HD22 LEU A 99 4.316 0.873 -7.843 1.00 64.02 H new ATOM 0 HD23 LEU A 99 5.819 1.150 -8.754 1.00 64.02 H new ATOM 1662 N LYS A 100 3.118 0.938 -13.205 1.00 10.03 N ATOM 1663 CA LYS A 100 2.358 0.157 -14.198 1.00 63.23 C ATOM 1664 C LYS A 100 3.264 -0.365 -15.321 1.00 23.45 C ATOM 1665 O LYS A 100 2.996 -1.413 -15.916 1.00 64.24 O ATOM 1666 CB LYS A 100 1.214 1.021 -14.771 1.00 23.01 C ATOM 1667 CG LYS A 100 0.113 1.394 -13.729 1.00 30.33 C ATOM 1668 CD LYS A 100 -1.300 0.878 -14.120 1.00 34.14 C ATOM 1669 CE LYS A 100 -1.384 -0.655 -14.229 1.00 24.11 C ATOM 1670 NZ LYS A 100 -2.736 -1.116 -14.661 1.00 54.12 N ATOM 0 H LYS A 100 2.882 1.930 -13.198 1.00 10.03 H new ATOM 0 HA LYS A 100 1.934 -0.714 -13.699 1.00 63.23 H new ATOM 0 HB2 LYS A 100 1.636 1.938 -15.181 1.00 23.01 H new ATOM 0 HB3 LYS A 100 0.749 0.486 -15.599 1.00 23.01 H new ATOM 0 HG2 LYS A 100 0.387 0.983 -12.758 1.00 30.33 H new ATOM 0 HG3 LYS A 100 0.079 2.478 -13.618 1.00 30.33 H new ATOM 0 HD2 LYS A 100 -2.022 1.222 -13.379 1.00 34.14 H new ATOM 0 HD3 LYS A 100 -1.588 1.319 -15.074 1.00 34.14 H new ATOM 0 HE2 LYS A 100 -0.637 -1.008 -14.940 1.00 24.11 H new ATOM 0 HE3 LYS A 100 -1.141 -1.100 -13.264 1.00 24.11 H new ATOM 0 HZ1 LYS A 100 -2.746 -2.154 -14.721 1.00 54.12 H new ATOM 0 HZ2 LYS A 100 -3.447 -0.802 -13.970 1.00 54.12 H new ATOM 0 HZ3 LYS A 100 -2.958 -0.713 -15.594 1.00 54.12 H new ATOM 1684 N LYS A 101 4.344 0.374 -15.586 1.00 4.43 N ATOM 1685 CA LYS A 101 5.303 0.057 -16.649 1.00 1.21 C ATOM 1686 C LYS A 101 6.273 -1.048 -16.177 1.00 2.02 C ATOM 1687 O LYS A 101 6.815 -1.806 -16.987 1.00 13.31 O ATOM 1688 CB LYS A 101 6.035 1.358 -17.061 1.00 25.30 C ATOM 1689 CG LYS A 101 6.832 1.273 -18.373 1.00 23.44 C ATOM 1690 CD LYS A 101 7.383 2.653 -18.807 1.00 61.35 C ATOM 1691 CE LYS A 101 8.067 2.600 -20.174 1.00 50.00 C ATOM 1692 NZ LYS A 101 8.499 3.940 -20.644 1.00 35.44 N ATOM 0 H LYS A 101 4.580 1.218 -15.064 1.00 4.43 H new ATOM 0 HA LYS A 101 4.790 -0.334 -17.527 1.00 1.21 H new ATOM 0 HB2 LYS A 101 5.299 2.157 -17.153 1.00 25.30 H new ATOM 0 HB3 LYS A 101 6.716 1.643 -16.259 1.00 25.30 H new ATOM 0 HG2 LYS A 101 7.660 0.575 -18.250 1.00 23.44 H new ATOM 0 HG3 LYS A 101 6.193 0.874 -19.160 1.00 23.44 H new ATOM 0 HD2 LYS A 101 6.566 3.374 -18.839 1.00 61.35 H new ATOM 0 HD3 LYS A 101 8.093 3.009 -18.061 1.00 61.35 H new ATOM 0 HE2 LYS A 101 8.933 1.941 -20.118 1.00 50.00 H new ATOM 0 HE3 LYS A 101 7.383 2.166 -20.903 1.00 50.00 H new ATOM 0 HZ1 LYS A 101 8.957 3.851 -21.574 1.00 35.44 H new ATOM 0 HZ2 LYS A 101 7.671 4.564 -20.724 1.00 35.44 H new ATOM 0 HZ3 LYS A 101 9.173 4.346 -19.964 1.00 35.44 H new ATOM 1706 N ASP A 102 6.453 -1.143 -14.843 1.00 61.03 N ATOM 1707 CA ASP A 102 7.171 -2.259 -14.185 1.00 43.50 C ATOM 1708 C ASP A 102 6.263 -3.488 -13.987 1.00 12.12 C ATOM 1709 O ASP A 102 6.708 -4.503 -13.431 1.00 75.53 O ATOM 1710 CB ASP A 102 7.764 -1.797 -12.817 1.00 12.23 C ATOM 1711 CG ASP A 102 9.118 -1.091 -12.971 1.00 70.13 C ATOM 1712 OD1 ASP A 102 9.158 0.139 -13.157 1.00 43.25 O ATOM 1713 OD2 ASP A 102 10.156 -1.777 -12.928 1.00 25.22 O ATOM 0 H ASP A 102 6.103 -0.445 -14.187 1.00 61.03 H new ATOM 0 HA ASP A 102 7.987 -2.555 -14.844 1.00 43.50 H new ATOM 0 HB2 ASP A 102 7.060 -1.123 -12.329 1.00 12.23 H new ATOM 0 HB3 ASP A 102 7.881 -2.662 -12.165 1.00 12.23 H new ATOM 1718 N GLY A 103 4.998 -3.386 -14.431 1.00 23.25 N ATOM 1719 CA GLY A 103 4.051 -4.500 -14.373 1.00 33.24 C ATOM 1720 C GLY A 103 3.434 -4.664 -12.996 1.00 13.10 C ATOM 1721 O GLY A 103 3.340 -5.779 -12.473 1.00 40.22 O ATOM 0 H GLY A 103 4.611 -2.534 -14.836 1.00 23.25 H new ATOM 0 HA2 GLY A 103 3.260 -4.339 -15.106 1.00 33.24 H new ATOM 0 HA3 GLY A 103 4.561 -5.422 -14.652 1.00 33.24 H new ATOM 1725 N VAL A 104 3.042 -3.524 -12.400 1.00 21.53 N ATOM 1726 CA VAL A 104 2.448 -3.464 -11.052 1.00 50.40 C ATOM 1727 C VAL A 104 1.038 -2.865 -11.134 1.00 20.13 C ATOM 1728 O VAL A 104 0.777 -1.990 -11.973 1.00 3.53 O ATOM 1729 CB VAL A 104 3.334 -2.598 -10.082 1.00 10.40 C ATOM 1730 CG1 VAL A 104 2.799 -2.625 -8.630 1.00 53.33 C ATOM 1731 CG2 VAL A 104 4.810 -3.052 -10.143 1.00 4.24 C ATOM 0 H VAL A 104 3.129 -2.610 -12.844 1.00 21.53 H new ATOM 0 HA VAL A 104 2.395 -4.478 -10.656 1.00 50.40 H new ATOM 0 HB VAL A 104 3.278 -1.564 -10.421 1.00 10.40 H new ATOM 0 HG11 VAL A 104 3.440 -2.014 -7.995 1.00 53.33 H new ATOM 0 HG12 VAL A 104 1.784 -2.229 -8.609 1.00 53.33 H new ATOM 0 HG13 VAL A 104 2.795 -3.651 -8.263 1.00 53.33 H new ATOM 0 HG21 VAL A 104 5.407 -2.441 -9.465 1.00 4.24 H new ATOM 0 HG22 VAL A 104 4.881 -4.098 -9.846 1.00 4.24 H new ATOM 0 HG23 VAL A 104 5.184 -2.937 -11.160 1.00 4.24 H new ATOM 1741 N ASP A 105 0.143 -3.335 -10.256 1.00 64.14 N ATOM 1742 CA ASP A 105 -1.243 -2.873 -10.210 1.00 1.11 C ATOM 1743 C ASP A 105 -1.336 -1.616 -9.327 1.00 14.41 C ATOM 1744 O ASP A 105 -0.709 -1.553 -8.262 1.00 42.41 O ATOM 1745 CB ASP A 105 -2.156 -3.993 -9.652 1.00 12.13 C ATOM 1746 CG ASP A 105 -3.578 -3.957 -10.229 1.00 41.15 C ATOM 1747 OD1 ASP A 105 -4.296 -2.967 -10.026 1.00 24.31 O ATOM 1748 OD2 ASP A 105 -3.975 -4.929 -10.903 1.00 2.11 O ATOM 0 H ASP A 105 0.363 -4.046 -9.559 1.00 64.14 H new ATOM 0 HA ASP A 105 -1.576 -2.625 -11.218 1.00 1.11 H new ATOM 0 HB2 ASP A 105 -1.707 -4.962 -9.870 1.00 12.13 H new ATOM 0 HB3 ASP A 105 -2.209 -3.903 -8.567 1.00 12.13 H new ATOM 1753 N VAL A 106 -2.112 -0.618 -9.778 1.00 60.33 N ATOM 1754 CA VAL A 106 -2.293 0.652 -9.050 1.00 51.34 C ATOM 1755 C VAL A 106 -3.789 1.026 -9.036 1.00 41.30 C ATOM 1756 O VAL A 106 -4.523 0.730 -9.993 1.00 70.22 O ATOM 1757 CB VAL A 106 -1.439 1.845 -9.654 1.00 0.33 C ATOM 1758 CG1 VAL A 106 0.033 1.445 -9.916 1.00 24.23 C ATOM 1759 CG2 VAL A 106 -2.070 2.427 -10.928 1.00 74.40 C ATOM 0 H VAL A 106 -2.631 -0.666 -10.655 1.00 60.33 H new ATOM 0 HA VAL A 106 -1.930 0.495 -8.034 1.00 51.34 H new ATOM 0 HB VAL A 106 -1.442 2.624 -8.892 1.00 0.33 H new ATOM 0 HG11 VAL A 106 0.574 2.297 -10.329 1.00 24.23 H new ATOM 0 HG12 VAL A 106 0.499 1.139 -8.979 1.00 24.23 H new ATOM 0 HG13 VAL A 106 0.065 0.617 -10.624 1.00 24.23 H new ATOM 0 HG21 VAL A 106 -1.449 3.240 -11.303 1.00 74.40 H new ATOM 0 HG22 VAL A 106 -2.144 1.647 -11.686 1.00 74.40 H new ATOM 0 HG23 VAL A 106 -3.066 2.807 -10.700 1.00 74.40 H new ATOM 1769 N ARG A 107 -4.239 1.627 -7.932 1.00 11.05 N ATOM 1770 CA ARG A 107 -5.581 2.215 -7.812 1.00 54.24 C ATOM 1771 C ARG A 107 -5.457 3.677 -7.364 1.00 13.03 C ATOM 1772 O ARG A 107 -5.051 3.959 -6.233 1.00 13.20 O ATOM 1773 CB ARG A 107 -6.472 1.403 -6.828 1.00 70.03 C ATOM 1774 CG ARG A 107 -6.928 0.034 -7.378 1.00 13.45 C ATOM 1775 CD ARG A 107 -7.826 -0.729 -6.396 1.00 63.04 C ATOM 1776 NE ARG A 107 -8.236 -2.047 -6.925 1.00 4.34 N ATOM 1777 CZ ARG A 107 -9.488 -2.543 -6.897 1.00 34.35 C ATOM 1778 NH1 ARG A 107 -10.492 -1.845 -6.363 1.00 11.13 N ATOM 1779 NH2 ARG A 107 -9.728 -3.743 -7.411 1.00 31.53 N ATOM 0 H ARG A 107 -3.678 1.722 -7.085 1.00 11.05 H new ATOM 0 HA ARG A 107 -6.068 2.179 -8.787 1.00 54.24 H new ATOM 0 HB2 ARG A 107 -5.921 1.245 -5.901 1.00 70.03 H new ATOM 0 HB3 ARG A 107 -7.353 1.995 -6.579 1.00 70.03 H new ATOM 0 HG2 ARG A 107 -7.466 0.184 -8.314 1.00 13.45 H new ATOM 0 HG3 ARG A 107 -6.051 -0.571 -7.607 1.00 13.45 H new ATOM 0 HD2 ARG A 107 -7.297 -0.866 -5.453 1.00 63.04 H new ATOM 0 HD3 ARG A 107 -8.713 -0.134 -6.180 1.00 63.04 H new ATOM 0 HE ARG A 107 -7.511 -2.629 -7.346 1.00 4.34 H new ATOM 0 HH11 ARG A 107 -10.317 -0.921 -5.968 1.00 11.13 H new ATOM 0 HH12 ARG A 107 -11.434 -2.235 -6.350 1.00 11.13 H new ATOM 0 HH21 ARG A 107 -8.967 -4.283 -7.823 1.00 31.53 H new ATOM 0 HH22 ARG A 107 -10.673 -4.125 -7.394 1.00 31.53 H new ATOM 1793 N VAL A 108 -5.788 4.601 -8.276 1.00 13.42 N ATOM 1794 CA VAL A 108 -5.851 6.041 -7.975 1.00 51.14 C ATOM 1795 C VAL A 108 -7.238 6.360 -7.398 1.00 71.14 C ATOM 1796 O VAL A 108 -8.270 5.964 -7.953 1.00 74.02 O ATOM 1797 CB VAL A 108 -5.550 6.954 -9.229 1.00 22.35 C ATOM 1798 CG1 VAL A 108 -4.101 6.772 -9.708 1.00 21.23 C ATOM 1799 CG2 VAL A 108 -6.536 6.699 -10.391 1.00 73.12 C ATOM 0 H VAL A 108 -6.020 4.373 -9.243 1.00 13.42 H new ATOM 0 HA VAL A 108 -5.070 6.265 -7.249 1.00 51.14 H new ATOM 0 HB VAL A 108 -5.687 7.986 -8.905 1.00 22.35 H new ATOM 0 HG11 VAL A 108 -3.920 7.412 -10.572 1.00 21.23 H new ATOM 0 HG12 VAL A 108 -3.416 7.044 -8.905 1.00 21.23 H new ATOM 0 HG13 VAL A 108 -3.938 5.731 -9.987 1.00 21.23 H new ATOM 0 HG21 VAL A 108 -6.287 7.350 -11.229 1.00 73.12 H new ATOM 0 HG22 VAL A 108 -6.465 5.658 -10.707 1.00 73.12 H new ATOM 0 HG23 VAL A 108 -7.553 6.908 -10.058 1.00 73.12 H new ATOM 1809 N THR A 109 -7.246 7.024 -6.250 1.00 33.25 N ATOM 1810 CA THR A 109 -8.469 7.332 -5.509 1.00 1.41 C ATOM 1811 C THR A 109 -8.782 8.827 -5.611 1.00 23.43 C ATOM 1812 O THR A 109 -9.890 9.190 -6.036 1.00 41.43 O ATOM 1813 CB THR A 109 -8.309 6.868 -4.030 1.00 61.31 C ATOM 1814 OG1 THR A 109 -7.107 7.433 -3.470 1.00 32.23 O ATOM 1815 CG2 THR A 109 -8.244 5.328 -3.932 1.00 3.44 C ATOM 0 H THR A 109 -6.398 7.369 -5.800 1.00 33.25 H new ATOM 0 HA THR A 109 -9.313 6.794 -5.941 1.00 1.41 H new ATOM 0 HB THR A 109 -9.179 7.214 -3.471 1.00 61.31 H new ATOM 0 HG1 THR A 109 -6.662 6.764 -2.909 1.00 32.23 H new ATOM 0 HG21 THR A 109 -8.132 5.034 -2.888 1.00 3.44 H new ATOM 0 HG22 THR A 109 -9.162 4.899 -4.334 1.00 3.44 H new ATOM 0 HG23 THR A 109 -7.392 4.963 -4.505 1.00 3.44 H new ATOM 1823 N ASP A 110 -7.778 9.668 -5.238 1.00 3.12 N ATOM 1824 CA ASP A 110 -7.832 11.160 -5.312 1.00 12.11 C ATOM 1825 C ASP A 110 -8.795 11.743 -4.251 1.00 34.24 C ATOM 1826 O ASP A 110 -8.401 12.556 -3.403 1.00 1.42 O ATOM 1827 CB ASP A 110 -8.171 11.663 -6.746 1.00 60.31 C ATOM 1828 CG ASP A 110 -8.232 13.197 -6.850 1.00 50.00 C ATOM 1829 OD1 ASP A 110 -7.169 13.846 -6.775 1.00 60.11 O ATOM 1830 OD2 ASP A 110 -9.334 13.760 -7.021 1.00 12.50 O ATOM 0 H ASP A 110 -6.891 9.324 -4.870 1.00 3.12 H new ATOM 0 HA ASP A 110 -6.833 11.530 -5.081 1.00 12.11 H new ATOM 0 HB2 ASP A 110 -7.422 11.287 -7.443 1.00 60.31 H new ATOM 0 HB3 ASP A 110 -9.130 11.246 -7.054 1.00 60.31 H new ATOM 1835 N ASN A 111 -10.066 11.345 -4.345 1.00 72.10 N ATOM 1836 CA ASN A 111 -11.049 11.491 -3.271 1.00 32.23 C ATOM 1837 C ASN A 111 -10.626 10.608 -2.074 1.00 42.21 C ATOM 1838 O ASN A 111 -10.396 9.400 -2.242 1.00 11.31 O ATOM 1839 CB ASN A 111 -12.440 11.066 -3.803 1.00 44.53 C ATOM 1840 CG ASN A 111 -13.564 11.073 -2.758 1.00 71.52 C ATOM 1841 OD1 ASN A 111 -13.542 11.825 -1.783 1.00 60.23 O ATOM 1842 ND2 ASN A 111 -14.570 10.244 -2.977 1.00 1.51 N ATOM 0 H ASN A 111 -10.446 10.905 -5.183 1.00 72.10 H new ATOM 0 HA ASN A 111 -11.101 12.528 -2.938 1.00 32.23 H new ATOM 0 HB2 ASN A 111 -12.719 11.732 -4.619 1.00 44.53 H new ATOM 0 HB3 ASN A 111 -12.361 10.063 -4.223 1.00 44.53 H new ATOM 0 HD21 ASN A 111 -15.357 10.215 -2.329 1.00 1.51 H new ATOM 0 HD22 ASN A 111 -14.559 9.633 -3.794 1.00 1.51 H new ATOM 1849 N GLU A 112 -10.518 11.221 -0.885 1.00 22.40 N ATOM 1850 CA GLU A 112 -10.082 10.528 0.348 1.00 72.13 C ATOM 1851 C GLU A 112 -11.115 9.475 0.800 1.00 32.43 C ATOM 1852 O GLU A 112 -10.760 8.519 1.493 1.00 74.12 O ATOM 1853 CB GLU A 112 -9.781 11.569 1.466 1.00 31.00 C ATOM 1854 CG GLU A 112 -10.991 12.428 1.943 1.00 51.20 C ATOM 1855 CD GLU A 112 -11.810 11.802 3.096 1.00 72.22 C ATOM 1856 OE1 GLU A 112 -11.294 11.746 4.225 1.00 23.33 O ATOM 1857 OE2 GLU A 112 -12.971 11.390 2.886 1.00 25.32 O ATOM 0 H GLU A 112 -10.729 12.209 -0.746 1.00 22.40 H new ATOM 0 HA GLU A 112 -9.161 9.985 0.135 1.00 72.13 H new ATOM 0 HB2 GLU A 112 -9.374 11.040 2.328 1.00 31.00 H new ATOM 0 HB3 GLU A 112 -9.002 12.242 1.108 1.00 31.00 H new ATOM 0 HG2 GLU A 112 -10.624 13.403 2.263 1.00 51.20 H new ATOM 0 HG3 GLU A 112 -11.654 12.600 1.095 1.00 51.20 H new ATOM 1864 N ASP A 113 -12.393 9.675 0.397 1.00 70.43 N ATOM 1865 CA ASP A 113 -13.491 8.731 0.673 1.00 24.11 C ATOM 1866 C ASP A 113 -13.263 7.428 -0.084 1.00 25.11 C ATOM 1867 O ASP A 113 -13.466 6.348 0.474 1.00 33.20 O ATOM 1868 CB ASP A 113 -14.855 9.348 0.283 1.00 41.24 C ATOM 1869 CG ASP A 113 -16.049 8.430 0.606 1.00 73.14 C ATOM 1870 OD1 ASP A 113 -16.496 8.416 1.766 1.00 11.14 O ATOM 1871 OD2 ASP A 113 -16.540 7.712 -0.295 1.00 70.44 O ATOM 0 H ASP A 113 -12.687 10.498 -0.129 1.00 70.43 H new ATOM 0 HA ASP A 113 -13.506 8.520 1.742 1.00 24.11 H new ATOM 0 HB2 ASP A 113 -14.981 10.296 0.807 1.00 41.24 H new ATOM 0 HB3 ASP A 113 -14.854 9.571 -0.784 1.00 41.24 H new ATOM 1876 N GLU A 114 -12.840 7.553 -1.356 1.00 31.00 N ATOM 1877 CA GLU A 114 -12.494 6.403 -2.202 1.00 64.45 C ATOM 1878 C GLU A 114 -11.339 5.601 -1.589 1.00 42.32 C ATOM 1879 O GLU A 114 -11.368 4.377 -1.593 1.00 13.43 O ATOM 1880 CB GLU A 114 -12.130 6.863 -3.637 1.00 22.03 C ATOM 1881 CG GLU A 114 -13.322 7.315 -4.501 1.00 12.30 C ATOM 1882 CD GLU A 114 -14.346 6.190 -4.750 1.00 21.10 C ATOM 1883 OE1 GLU A 114 -14.007 5.216 -5.456 1.00 20.14 O ATOM 1884 OE2 GLU A 114 -15.476 6.257 -4.227 1.00 74.12 O ATOM 0 H GLU A 114 -12.730 8.454 -1.822 1.00 31.00 H new ATOM 0 HA GLU A 114 -13.369 5.755 -2.260 1.00 64.45 H new ATOM 0 HB2 GLU A 114 -11.418 7.686 -3.568 1.00 22.03 H new ATOM 0 HB3 GLU A 114 -11.622 6.044 -4.146 1.00 22.03 H new ATOM 0 HG2 GLU A 114 -13.821 8.152 -4.012 1.00 12.30 H new ATOM 0 HG3 GLU A 114 -12.952 7.680 -5.459 1.00 12.30 H new ATOM 1891 N ALA A 115 -10.346 6.313 -1.041 1.00 12.24 N ATOM 1892 CA ALA A 115 -9.168 5.703 -0.403 1.00 1.02 C ATOM 1893 C ALA A 115 -9.542 4.985 0.911 1.00 71.41 C ATOM 1894 O ALA A 115 -8.999 3.918 1.227 1.00 11.44 O ATOM 1895 CB ALA A 115 -8.116 6.788 -0.165 1.00 22.42 C ATOM 0 H ALA A 115 -10.335 7.333 -1.027 1.00 12.24 H new ATOM 0 HA ALA A 115 -8.758 4.942 -1.066 1.00 1.02 H new ATOM 0 HB1 ALA A 115 -7.239 6.347 0.308 1.00 22.42 H new ATOM 0 HB2 ALA A 115 -7.830 7.233 -1.118 1.00 22.42 H new ATOM 0 HB3 ALA A 115 -8.529 7.559 0.485 1.00 22.42 H new ATOM 1901 N LYS A 116 -10.490 5.587 1.644 1.00 45.23 N ATOM 1902 CA LYS A 116 -10.974 5.097 2.937 1.00 65.35 C ATOM 1903 C LYS A 116 -11.761 3.791 2.760 1.00 32.12 C ATOM 1904 O LYS A 116 -11.482 2.783 3.422 1.00 22.33 O ATOM 1905 CB LYS A 116 -11.869 6.202 3.535 1.00 30.13 C ATOM 1906 CG LYS A 116 -12.453 5.919 4.929 1.00 24.21 C ATOM 1907 CD LYS A 116 -13.571 6.916 5.284 1.00 32.32 C ATOM 1908 CE LYS A 116 -13.114 8.388 5.266 1.00 42.22 C ATOM 1909 NZ LYS A 116 -12.019 8.668 6.232 1.00 63.51 N ATOM 0 H LYS A 116 -10.950 6.447 1.345 1.00 45.23 H new ATOM 0 HA LYS A 116 -10.140 4.878 3.604 1.00 65.35 H new ATOM 0 HB2 LYS A 116 -11.288 7.123 3.587 1.00 30.13 H new ATOM 0 HB3 LYS A 116 -12.695 6.384 2.847 1.00 30.13 H new ATOM 0 HG2 LYS A 116 -12.846 4.903 4.961 1.00 24.21 H new ATOM 0 HG3 LYS A 116 -11.661 5.978 5.675 1.00 24.21 H new ATOM 0 HD2 LYS A 116 -14.394 6.791 4.581 1.00 32.32 H new ATOM 0 HD3 LYS A 116 -13.959 6.677 6.274 1.00 32.32 H new ATOM 0 HE2 LYS A 116 -12.780 8.647 4.261 1.00 42.22 H new ATOM 0 HE3 LYS A 116 -13.965 9.030 5.494 1.00 42.22 H new ATOM 0 HZ1 LYS A 116 -11.754 9.672 6.175 1.00 63.51 H new ATOM 0 HZ2 LYS A 116 -12.342 8.450 7.196 1.00 63.51 H new ATOM 0 HZ3 LYS A 116 -11.194 8.078 6.002 1.00 63.51 H new ATOM 1923 N LYS A 117 -12.732 3.832 1.833 1.00 54.33 N ATOM 1924 CA LYS A 117 -13.631 2.709 1.560 1.00 0.24 C ATOM 1925 C LYS A 117 -12.889 1.558 0.881 1.00 54.45 C ATOM 1926 O LYS A 117 -13.265 0.404 1.069 1.00 13.15 O ATOM 1927 CB LYS A 117 -14.841 3.147 0.698 1.00 1.33 C ATOM 1928 CG LYS A 117 -14.497 3.552 -0.752 1.00 14.04 C ATOM 1929 CD LYS A 117 -15.728 3.889 -1.627 1.00 13.11 C ATOM 1930 CE LYS A 117 -16.582 2.656 -1.996 1.00 42.33 C ATOM 1931 NZ LYS A 117 -17.354 2.094 -0.853 1.00 52.14 N ATOM 0 H LYS A 117 -12.913 4.651 1.252 1.00 54.33 H new ATOM 0 HA LYS A 117 -14.007 2.359 2.521 1.00 0.24 H new ATOM 0 HB2 LYS A 117 -15.562 2.330 0.670 1.00 1.33 H new ATOM 0 HB3 LYS A 117 -15.331 3.988 1.188 1.00 1.33 H new ATOM 0 HG2 LYS A 117 -13.835 4.417 -0.728 1.00 14.04 H new ATOM 0 HG3 LYS A 117 -13.943 2.740 -1.222 1.00 14.04 H new ATOM 0 HD2 LYS A 117 -16.353 4.608 -1.098 1.00 13.11 H new ATOM 0 HD3 LYS A 117 -15.390 4.374 -2.543 1.00 13.11 H new ATOM 0 HE2 LYS A 117 -17.276 2.931 -2.790 1.00 42.33 H new ATOM 0 HE3 LYS A 117 -15.929 1.881 -2.397 1.00 42.33 H new ATOM 0 HZ1 LYS A 117 -18.311 1.842 -1.171 1.00 52.14 H new ATOM 0 HZ2 LYS A 117 -16.874 1.244 -0.494 1.00 52.14 H new ATOM 0 HZ3 LYS A 117 -17.417 2.803 -0.095 1.00 52.14 H new ATOM 1945 N ARG A 118 -11.851 1.900 0.084 1.00 0.05 N ATOM 1946 CA ARG A 118 -11.086 0.928 -0.708 1.00 53.55 C ATOM 1947 C ARG A 118 -10.446 -0.120 0.202 1.00 43.05 C ATOM 1948 O ARG A 118 -10.441 -1.295 -0.122 1.00 61.51 O ATOM 1949 CB ARG A 118 -9.981 1.633 -1.548 1.00 4.02 C ATOM 1950 CG ARG A 118 -9.530 0.846 -2.803 1.00 23.25 C ATOM 1951 CD ARG A 118 -10.450 1.072 -4.020 1.00 24.53 C ATOM 1952 NE ARG A 118 -11.862 0.679 -3.806 1.00 44.13 N ATOM 1953 CZ ARG A 118 -12.936 1.438 -4.128 1.00 33.32 C ATOM 1954 NH1 ARG A 118 -12.786 2.647 -4.674 1.00 10.32 N ATOM 1955 NH2 ARG A 118 -14.155 0.962 -3.927 1.00 2.33 N ATOM 0 H ARG A 118 -11.525 2.861 -0.024 1.00 0.05 H new ATOM 0 HA ARG A 118 -11.781 0.437 -1.389 1.00 53.55 H new ATOM 0 HB2 ARG A 118 -10.348 2.611 -1.860 1.00 4.02 H new ATOM 0 HB3 ARG A 118 -9.113 1.806 -0.912 1.00 4.02 H new ATOM 0 HG2 ARG A 118 -8.513 1.140 -3.064 1.00 23.25 H new ATOM 0 HG3 ARG A 118 -9.503 -0.218 -2.568 1.00 23.25 H new ATOM 0 HD2 ARG A 118 -10.417 2.127 -4.293 1.00 24.53 H new ATOM 0 HD3 ARG A 118 -10.055 0.511 -4.867 1.00 24.53 H new ATOM 0 HE ARG A 118 -12.039 -0.233 -3.384 1.00 44.13 H new ATOM 0 HH11 ARG A 118 -11.851 3.012 -4.855 1.00 10.32 H new ATOM 0 HH12 ARG A 118 -13.606 3.205 -4.910 1.00 10.32 H new ATOM 0 HH21 ARG A 118 -14.280 0.030 -3.532 1.00 2.33 H new ATOM 0 HH22 ARG A 118 -14.969 1.527 -4.167 1.00 2.33 H new ATOM 1969 N LEU A 119 -9.931 0.338 1.351 1.00 54.20 N ATOM 1970 CA LEU A 119 -9.248 -0.523 2.318 1.00 31.15 C ATOM 1971 C LEU A 119 -10.206 -1.514 2.957 1.00 12.34 C ATOM 1972 O LEU A 119 -9.980 -2.714 2.879 1.00 33.42 O ATOM 1973 CB LEU A 119 -8.530 0.340 3.380 1.00 40.11 C ATOM 1974 CG LEU A 119 -7.281 1.078 2.838 1.00 73.43 C ATOM 1975 CD1 LEU A 119 -6.657 1.994 3.900 1.00 30.03 C ATOM 1976 CD2 LEU A 119 -6.263 0.049 2.300 1.00 33.35 C ATOM 0 H LEU A 119 -9.978 1.317 1.634 1.00 54.20 H new ATOM 0 HA LEU A 119 -8.498 -1.109 1.788 1.00 31.15 H new ATOM 0 HB2 LEU A 119 -9.232 1.074 3.775 1.00 40.11 H new ATOM 0 HB3 LEU A 119 -8.232 -0.297 4.213 1.00 40.11 H new ATOM 0 HG LEU A 119 -7.588 1.725 2.016 1.00 73.43 H new ATOM 0 HD11 LEU A 119 -5.783 2.494 3.481 1.00 30.03 H new ATOM 0 HD12 LEU A 119 -7.388 2.740 4.211 1.00 30.03 H new ATOM 0 HD13 LEU A 119 -6.356 1.399 4.762 1.00 30.03 H new ATOM 0 HD21 LEU A 119 -5.385 0.571 1.919 1.00 33.35 H new ATOM 0 HD22 LEU A 119 -5.965 -0.623 3.105 1.00 33.35 H new ATOM 0 HD23 LEU A 119 -6.719 -0.528 1.496 1.00 33.35 H new ATOM 1988 N LYS A 120 -11.306 -1.003 3.529 1.00 74.50 N ATOM 1989 CA LYS A 120 -12.329 -1.848 4.173 1.00 53.51 C ATOM 1990 C LYS A 120 -12.933 -2.840 3.148 1.00 23.02 C ATOM 1991 O LYS A 120 -13.232 -3.986 3.485 1.00 64.35 O ATOM 1992 CB LYS A 120 -13.427 -0.965 4.799 1.00 13.42 C ATOM 1993 CG LYS A 120 -14.506 -1.743 5.598 1.00 12.31 C ATOM 1994 CD LYS A 120 -15.622 -0.818 6.137 1.00 43.52 C ATOM 1995 CE LYS A 120 -15.109 0.214 7.155 1.00 63.44 C ATOM 1996 NZ LYS A 120 -16.172 1.177 7.543 1.00 62.45 N ATOM 0 H LYS A 120 -11.513 -0.005 3.560 1.00 74.50 H new ATOM 0 HA LYS A 120 -11.860 -2.428 4.968 1.00 53.51 H new ATOM 0 HB2 LYS A 120 -12.957 -0.239 5.462 1.00 13.42 H new ATOM 0 HB3 LYS A 120 -13.918 -0.401 4.005 1.00 13.42 H new ATOM 0 HG2 LYS A 120 -14.948 -2.506 4.958 1.00 12.31 H new ATOM 0 HG3 LYS A 120 -14.033 -2.261 6.432 1.00 12.31 H new ATOM 0 HD2 LYS A 120 -16.088 -0.295 5.302 1.00 43.52 H new ATOM 0 HD3 LYS A 120 -16.396 -1.427 6.604 1.00 43.52 H new ATOM 0 HE2 LYS A 120 -14.743 -0.301 8.043 1.00 63.44 H new ATOM 0 HE3 LYS A 120 -14.264 0.756 6.730 1.00 63.44 H new ATOM 0 HZ1 LYS A 120 -15.790 1.858 8.230 1.00 62.45 H new ATOM 0 HZ2 LYS A 120 -16.504 1.686 6.699 1.00 62.45 H new ATOM 0 HZ3 LYS A 120 -16.967 0.662 7.971 1.00 62.45 H new ATOM 2010 N GLU A 121 -13.051 -2.381 1.885 1.00 2.05 N ATOM 2011 CA GLU A 121 -13.590 -3.182 0.777 1.00 4.11 C ATOM 2012 C GLU A 121 -12.659 -4.342 0.438 1.00 70.35 C ATOM 2013 O GLU A 121 -13.059 -5.497 0.485 1.00 73.15 O ATOM 2014 CB GLU A 121 -13.792 -2.295 -0.473 1.00 2.23 C ATOM 2015 CG GLU A 121 -14.293 -3.050 -1.713 1.00 33.51 C ATOM 2016 CD GLU A 121 -14.403 -2.155 -2.944 1.00 12.53 C ATOM 2017 OE1 GLU A 121 -13.371 -1.922 -3.610 1.00 21.34 O ATOM 2018 OE2 GLU A 121 -15.513 -1.668 -3.251 1.00 61.03 O ATOM 0 H GLU A 121 -12.773 -1.440 1.608 1.00 2.05 H new ATOM 0 HA GLU A 121 -14.551 -3.589 1.091 1.00 4.11 H new ATOM 0 HB2 GLU A 121 -14.503 -1.505 -0.232 1.00 2.23 H new ATOM 0 HB3 GLU A 121 -12.847 -1.810 -0.716 1.00 2.23 H new ATOM 0 HG2 GLU A 121 -13.615 -3.876 -1.929 1.00 33.51 H new ATOM 0 HG3 GLU A 121 -15.268 -3.486 -1.498 1.00 33.51 H new ATOM 2025 N LEU A 122 -11.395 -4.009 0.151 1.00 62.30 N ATOM 2026 CA LEU A 122 -10.402 -4.975 -0.332 1.00 12.42 C ATOM 2027 C LEU A 122 -10.028 -5.969 0.777 1.00 15.22 C ATOM 2028 O LEU A 122 -9.654 -7.089 0.482 1.00 5.02 O ATOM 2029 CB LEU A 122 -9.159 -4.249 -0.914 1.00 54.15 C ATOM 2030 CG LEU A 122 -9.416 -3.364 -2.186 1.00 44.31 C ATOM 2031 CD1 LEU A 122 -8.105 -2.771 -2.735 1.00 75.22 C ATOM 2032 CD2 LEU A 122 -10.176 -4.131 -3.284 1.00 61.42 C ATOM 0 H LEU A 122 -11.032 -3.061 0.247 1.00 62.30 H new ATOM 0 HA LEU A 122 -10.844 -5.551 -1.146 1.00 12.42 H new ATOM 0 HB2 LEU A 122 -8.734 -3.617 -0.135 1.00 54.15 H new ATOM 0 HB3 LEU A 122 -8.407 -4.998 -1.162 1.00 54.15 H new ATOM 0 HG LEU A 122 -10.053 -2.538 -1.869 1.00 44.31 H new ATOM 0 HD11 LEU A 122 -8.320 -2.165 -3.615 1.00 75.22 H new ATOM 0 HD12 LEU A 122 -7.639 -2.149 -1.971 1.00 75.22 H new ATOM 0 HD13 LEU A 122 -7.427 -3.579 -3.009 1.00 75.22 H new ATOM 0 HD21 LEU A 122 -10.330 -3.478 -4.143 1.00 61.42 H new ATOM 0 HD22 LEU A 122 -9.595 -5.001 -3.589 1.00 61.42 H new ATOM 0 HD23 LEU A 122 -11.142 -4.457 -2.898 1.00 61.42 H new ATOM 2044 N LEU A 123 -10.148 -5.531 2.046 1.00 43.11 N ATOM 2045 CA LEU A 123 -9.972 -6.400 3.232 1.00 62.31 C ATOM 2046 C LEU A 123 -10.998 -7.561 3.239 1.00 31.12 C ATOM 2047 O LEU A 123 -10.665 -8.671 3.673 1.00 12.23 O ATOM 2048 CB LEU A 123 -10.067 -5.561 4.549 1.00 24.44 C ATOM 2049 CG LEU A 123 -8.709 -5.128 5.195 1.00 4.03 C ATOM 2050 CD1 LEU A 123 -7.763 -4.403 4.213 1.00 11.43 C ATOM 2051 CD2 LEU A 123 -8.966 -4.281 6.448 1.00 1.35 C ATOM 0 H LEU A 123 -10.370 -4.563 2.280 1.00 43.11 H new ATOM 0 HA LEU A 123 -8.977 -6.842 3.178 1.00 62.31 H new ATOM 0 HB2 LEU A 123 -10.649 -4.663 4.341 1.00 24.44 H new ATOM 0 HB3 LEU A 123 -10.626 -6.140 5.284 1.00 24.44 H new ATOM 0 HG LEU A 123 -8.190 -6.043 5.480 1.00 4.03 H new ATOM 0 HD11 LEU A 123 -6.842 -4.132 4.728 1.00 11.43 H new ATOM 0 HD12 LEU A 123 -7.531 -5.063 3.377 1.00 11.43 H new ATOM 0 HD13 LEU A 123 -8.248 -3.501 3.839 1.00 11.43 H new ATOM 0 HD21 LEU A 123 -8.014 -3.986 6.889 1.00 1.35 H new ATOM 0 HD22 LEU A 123 -9.532 -3.390 6.175 1.00 1.35 H new ATOM 0 HD23 LEU A 123 -9.535 -4.865 7.171 1.00 1.35 H new ATOM 2063 N GLU A 124 -12.237 -7.289 2.756 1.00 24.01 N ATOM 2064 CA GLU A 124 -13.288 -8.330 2.594 1.00 74.05 C ATOM 2065 C GLU A 124 -12.803 -9.399 1.598 1.00 63.32 C ATOM 2066 O GLU A 124 -12.834 -10.595 1.884 1.00 62.23 O ATOM 2067 CB GLU A 124 -14.620 -7.707 2.072 1.00 24.52 C ATOM 2068 CG GLU A 124 -15.182 -6.544 2.910 1.00 23.52 C ATOM 2069 CD GLU A 124 -16.421 -5.892 2.270 1.00 74.01 C ATOM 2070 OE1 GLU A 124 -16.263 -5.124 1.301 1.00 62.15 O ATOM 2071 OE2 GLU A 124 -17.560 -6.161 2.715 1.00 15.13 O ATOM 0 H GLU A 124 -12.534 -6.356 2.471 1.00 24.01 H new ATOM 0 HA GLU A 124 -13.475 -8.782 3.568 1.00 74.05 H new ATOM 0 HB2 GLU A 124 -14.461 -7.354 1.053 1.00 24.52 H new ATOM 0 HB3 GLU A 124 -15.373 -8.493 2.022 1.00 24.52 H new ATOM 0 HG2 GLU A 124 -15.442 -6.910 3.903 1.00 23.52 H new ATOM 0 HG3 GLU A 124 -14.407 -5.789 3.041 1.00 23.52 H new ATOM 2078 N LYS A 125 -12.290 -8.916 0.451 1.00 61.54 N ATOM 2079 CA LYS A 125 -11.799 -9.758 -0.663 1.00 23.43 C ATOM 2080 C LYS A 125 -10.410 -10.343 -0.352 1.00 41.12 C ATOM 2081 O LYS A 125 -9.948 -11.264 -1.044 1.00 15.45 O ATOM 2082 CB LYS A 125 -11.722 -8.925 -1.985 1.00 35.33 C ATOM 2083 CG LYS A 125 -13.076 -8.459 -2.592 1.00 33.31 C ATOM 2084 CD LYS A 125 -13.775 -7.365 -1.761 1.00 42.43 C ATOM 2085 CE LYS A 125 -15.158 -6.973 -2.288 1.00 71.34 C ATOM 2086 NZ LYS A 125 -15.884 -6.072 -1.348 1.00 41.42 N ATOM 0 H LYS A 125 -12.202 -7.917 0.267 1.00 61.54 H new ATOM 0 HA LYS A 125 -12.505 -10.579 -0.788 1.00 23.43 H new ATOM 0 HB2 LYS A 125 -11.111 -8.042 -1.797 1.00 35.33 H new ATOM 0 HB3 LYS A 125 -11.200 -9.521 -2.734 1.00 35.33 H new ATOM 0 HG2 LYS A 125 -12.904 -8.084 -3.601 1.00 33.31 H new ATOM 0 HG3 LYS A 125 -13.741 -9.318 -2.681 1.00 33.31 H new ATOM 0 HD2 LYS A 125 -13.874 -7.712 -0.732 1.00 42.43 H new ATOM 0 HD3 LYS A 125 -13.141 -6.479 -1.739 1.00 42.43 H new ATOM 0 HE2 LYS A 125 -15.050 -6.478 -3.253 1.00 71.34 H new ATOM 0 HE3 LYS A 125 -15.750 -7.873 -2.456 1.00 71.34 H new ATOM 0 HZ1 LYS A 125 -16.343 -5.308 -1.884 1.00 41.42 H new ATOM 0 HZ2 LYS A 125 -16.605 -6.616 -0.833 1.00 41.42 H new ATOM 0 HZ3 LYS A 125 -15.210 -5.662 -0.670 1.00 41.42 H new ATOM 2100 N VAL A 126 -9.763 -9.791 0.701 1.00 62.22 N ATOM 2101 CA VAL A 126 -8.368 -10.060 1.068 1.00 64.45 C ATOM 2102 C VAL A 126 -7.441 -9.655 -0.105 1.00 55.44 C ATOM 2103 O VAL A 126 -6.989 -10.490 -0.897 1.00 60.51 O ATOM 2104 CB VAL A 126 -8.146 -11.548 1.564 1.00 34.52 C ATOM 2105 CG1 VAL A 126 -6.697 -11.794 2.041 1.00 20.32 C ATOM 2106 CG2 VAL A 126 -9.149 -11.903 2.686 1.00 12.11 C ATOM 0 H VAL A 126 -10.216 -9.129 1.331 1.00 62.22 H new ATOM 0 HA VAL A 126 -8.105 -9.446 1.930 1.00 64.45 H new ATOM 0 HB VAL A 126 -8.323 -12.201 0.709 1.00 34.52 H new ATOM 0 HG11 VAL A 126 -6.593 -12.828 2.371 1.00 20.32 H new ATOM 0 HG12 VAL A 126 -6.006 -11.605 1.219 1.00 20.32 H new ATOM 0 HG13 VAL A 126 -6.468 -11.124 2.869 1.00 20.32 H new ATOM 0 HG21 VAL A 126 -8.981 -12.929 3.013 1.00 12.11 H new ATOM 0 HG22 VAL A 126 -9.008 -11.226 3.528 1.00 12.11 H new ATOM 0 HG23 VAL A 126 -10.167 -11.805 2.309 1.00 12.11 H new ATOM 2116 N GLY A 127 -7.255 -8.335 -0.248 1.00 73.30 N ATOM 2117 CA GLY A 127 -6.379 -7.759 -1.261 1.00 43.54 C ATOM 2118 C GLY A 127 -7.118 -7.110 -2.432 1.00 21.35 C ATOM 2119 O GLY A 127 -6.926 -5.917 -2.686 1.00 12.14 O ATOM 0 H GLY A 127 -7.713 -7.640 0.341 1.00 73.30 H new ATOM 0 HA2 GLY A 127 -5.740 -7.012 -0.790 1.00 43.54 H new ATOM 0 HA3 GLY A 127 -5.725 -8.541 -1.647 1.00 43.54 H new