USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 759 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 150 LYS NZ :NH3+ 151:sc= -0.0805 (180deg=-0.576) USER MOD Set 1.2: A 176 SER OG : rot 180:sc= -0.0827 USER MOD Set 2.1: A 144 THR OG1 : rot 150:sc= -1.51 USER MOD Set 2.2: A 146 HIS : no HD1:sc= -1.15 K(o=-2.7,f=-6!) USER MOD Single : A 88 LYS NZ :NH3+ -155:sc= -0.199 (180deg=-0.819) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 HIS : no HD1:sc= -0.587 X(o=-0.59,f=-0.8) USER MOD Single : A 97 THR OG1 : rot 81:sc= 0.406 USER MOD Single : A 100 LYS NZ :NH3+ -136:sc= -0.692 (180deg=-3.29!) USER MOD Single : A 102 TYR OH : rot 30:sc= -0.0204 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.0282 K(o=-0.028,f=-0.55) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.381 USER MOD Single : A 125 ASN : amide:sc= -0.324 X(o=-0.32,f=-0.33) USER MOD Single : A 134 SER OG : rot 150:sc= -0.346 USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc=-0.00675 X(o=-0.0068,f=-0.03) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 ASN :FLIP amide:sc= -2.47 F(o=-3.1,f=-2.5) USER MOD Single : A 165 ASN : amide:sc= -0.661 X(o=-0.66,f=-0.67) USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 178 ASN : amide:sc= -0.746 X(o=-0.75,f=-0.74) USER MOD Single : A 179 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 87 1.329 0.000 0.000 1.00 30.33 N ATOM 2 CA GLU A 87 2.093 -0.001 -1.242 1.00 3.20 C ATOM 3 C GLU A 87 2.116 -1.394 -1.865 1.00 2.04 C ATOM 4 O GLU A 87 3.181 -1.970 -2.087 1.00 23.41 O ATOM 5 CB GLU A 87 3.523 0.480 -0.989 1.00 73.34 C ATOM 6 CG GLU A 87 3.599 1.886 -0.418 1.00 75.23 C ATOM 7 CD GLU A 87 3.357 1.922 1.079 1.00 0.10 C ATOM 8 OE1 GLU A 87 3.985 1.118 1.800 1.00 11.21 O ATOM 9 OE2 GLU A 87 2.540 2.752 1.528 1.00 71.01 O1- ATOM 0 HA GLU A 87 1.606 0.682 -1.938 1.00 3.20 H new ATOM 0 HB2 GLU A 87 4.013 -0.209 -0.302 1.00 73.34 H new ATOM 0 HB3 GLU A 87 4.080 0.446 -1.925 1.00 73.34 H new ATOM 0 HG2 GLU A 87 4.580 2.309 -0.634 1.00 75.23 H new ATOM 0 HG3 GLU A 87 2.863 2.517 -0.916 1.00 75.23 H new ATOM 16 N LYS A 88 0.933 -1.931 -2.145 1.00 40.53 N ATOM 17 CA LYS A 88 0.815 -3.255 -2.743 1.00 63.05 C ATOM 18 C LYS A 88 0.837 -3.169 -4.266 1.00 52.21 C ATOM 19 O LYS A 88 1.547 -3.924 -4.929 1.00 53.22 O ATOM 20 CB LYS A 88 -0.475 -3.934 -2.278 1.00 43.40 C ATOM 21 CG LYS A 88 -0.313 -4.739 -1.001 1.00 73.43 C ATOM 22 CD LYS A 88 -1.394 -5.798 -0.868 1.00 72.30 C ATOM 23 CE LYS A 88 -0.977 -6.905 0.088 1.00 5.41 C ATOM 24 NZ LYS A 88 0.247 -7.611 -0.382 1.00 62.21 N1+ ATOM 0 H LYS A 88 0.042 -1.468 -1.967 1.00 40.53 H new ATOM 0 HA LYS A 88 1.669 -3.850 -2.419 1.00 63.05 H new ATOM 0 HB2 LYS A 88 -1.240 -3.174 -2.123 1.00 43.40 H new ATOM 0 HB3 LYS A 88 -0.835 -4.592 -3.069 1.00 43.40 H new ATOM 0 HG2 LYS A 88 0.667 -5.216 -0.992 1.00 73.43 H new ATOM 0 HG3 LYS A 88 -0.350 -4.070 -0.141 1.00 73.43 H new ATOM 0 HD2 LYS A 88 -2.315 -5.336 -0.512 1.00 72.30 H new ATOM 0 HD3 LYS A 88 -1.609 -6.224 -1.848 1.00 72.30 H new ATOM 0 HE2 LYS A 88 -0.796 -6.482 1.076 1.00 5.41 H new ATOM 0 HE3 LYS A 88 -1.792 -7.621 0.192 1.00 5.41 H new ATOM 0 HZ1 LYS A 88 0.266 -8.573 0.013 1.00 62.21 H new ATOM 0 HZ2 LYS A 88 0.240 -7.664 -1.421 1.00 62.21 H new ATOM 0 HZ3 LYS A 88 1.090 -7.090 -0.067 1.00 62.21 H new ATOM 38 N ALA A 89 0.055 -2.243 -4.812 1.00 2.12 N ATOM 39 CA ALA A 89 -0.012 -2.057 -6.256 1.00 32.13 C ATOM 40 C ALA A 89 1.274 -1.435 -6.790 1.00 63.45 C ATOM 41 O ALA A 89 1.667 -1.679 -7.932 1.00 5.31 O ATOM 42 CB ALA A 89 -1.209 -1.191 -6.621 1.00 44.04 C ATOM 0 H ALA A 89 -0.540 -1.611 -4.277 1.00 2.12 H new ATOM 0 HA ALA A 89 -0.130 -3.037 -6.718 1.00 32.13 H new ATOM 0 HB1 ALA A 89 -1.247 -1.060 -7.702 1.00 44.04 H new ATOM 0 HB2 ALA A 89 -2.125 -1.675 -6.282 1.00 44.04 H new ATOM 0 HB3 ALA A 89 -1.113 -0.217 -6.141 1.00 44.04 H new ATOM 48 N LYS A 90 1.927 -0.631 -5.958 1.00 51.00 N ATOM 49 CA LYS A 90 3.170 0.026 -6.346 1.00 61.25 C ATOM 50 C LYS A 90 4.226 -1.000 -6.743 1.00 14.35 C ATOM 51 O LYS A 90 5.128 -0.705 -7.527 1.00 71.13 O ATOM 52 CB LYS A 90 3.691 0.893 -5.198 1.00 41.44 C ATOM 53 CG LYS A 90 3.047 2.267 -5.132 1.00 65.43 C ATOM 54 CD LYS A 90 3.538 3.167 -6.253 1.00 32.40 C ATOM 55 CE LYS A 90 3.404 4.637 -5.887 1.00 73.34 C ATOM 56 NZ LYS A 90 4.231 5.506 -6.770 1.00 11.23 N1+ ATOM 0 H LYS A 90 1.616 -0.418 -5.010 1.00 51.00 H new ATOM 0 HA LYS A 90 2.964 0.661 -7.208 1.00 61.25 H new ATOM 0 HB2 LYS A 90 3.518 0.374 -4.255 1.00 41.44 H new ATOM 0 HB3 LYS A 90 4.769 1.011 -5.304 1.00 41.44 H new ATOM 0 HG2 LYS A 90 1.964 2.165 -5.194 1.00 65.43 H new ATOM 0 HG3 LYS A 90 3.269 2.728 -4.170 1.00 65.43 H new ATOM 0 HD2 LYS A 90 4.581 2.939 -6.473 1.00 32.40 H new ATOM 0 HD3 LYS A 90 2.969 2.963 -7.160 1.00 32.40 H new ATOM 0 HE2 LYS A 90 2.358 4.936 -5.960 1.00 73.34 H new ATOM 0 HE3 LYS A 90 3.705 4.782 -4.850 1.00 73.34 H new ATOM 0 HZ1 LYS A 90 4.112 6.500 -6.488 1.00 11.23 H new ATOM 0 HZ2 LYS A 90 5.232 5.238 -6.682 1.00 11.23 H new ATOM 0 HZ3 LYS A 90 3.927 5.387 -7.757 1.00 11.23 H new ATOM 70 N ARG A 91 4.107 -2.206 -6.197 1.00 52.32 N ATOM 71 CA ARG A 91 5.052 -3.276 -6.495 1.00 73.43 C ATOM 72 C ARG A 91 4.962 -3.689 -7.962 1.00 12.01 C ATOM 73 O ARG A 91 5.926 -4.196 -8.535 1.00 55.01 O ATOM 74 CB ARG A 91 4.787 -4.485 -5.597 1.00 55.15 C ATOM 75 CG ARG A 91 5.686 -4.544 -4.373 1.00 43.31 C ATOM 76 CD ARG A 91 5.697 -5.934 -3.756 1.00 24.02 C ATOM 77 NE ARG A 91 6.006 -5.896 -2.329 1.00 52.32 N ATOM 78 CZ ARG A 91 5.113 -5.601 -1.391 1.00 52.22 C ATOM 79 NH1 ARG A 91 3.862 -5.319 -1.727 1.00 64.04 N1+ ATOM 80 NH2 ARG A 91 5.471 -5.588 -0.113 1.00 70.21 N ATOM 0 H ARG A 91 3.366 -2.467 -5.546 1.00 52.32 H new ATOM 0 HA ARG A 91 6.057 -2.902 -6.302 1.00 73.43 H new ATOM 0 HB2 ARG A 91 3.747 -4.465 -5.272 1.00 55.15 H new ATOM 0 HB3 ARG A 91 4.921 -5.396 -6.180 1.00 55.15 H new ATOM 0 HG2 ARG A 91 6.701 -4.260 -4.652 1.00 43.31 H new ATOM 0 HG3 ARG A 91 5.344 -3.819 -3.634 1.00 43.31 H new ATOM 0 HD2 ARG A 91 4.725 -6.404 -3.904 1.00 24.02 H new ATOM 0 HD3 ARG A 91 6.432 -6.553 -4.270 1.00 24.02 H new ATOM 0 HE ARG A 91 6.960 -6.108 -2.037 1.00 52.32 H new ATOM 0 HH11 ARG A 91 3.583 -5.328 -2.708 1.00 64.04 H new ATOM 0 HH12 ARG A 91 3.178 -5.093 -1.004 1.00 64.04 H new ATOM 0 HH21 ARG A 91 6.433 -5.805 0.150 1.00 70.21 H new ATOM 0 HH22 ARG A 91 4.785 -5.361 0.607 1.00 70.21 H new ATOM 94 N HIS A 92 3.797 -3.468 -8.562 1.00 20.10 N ATOM 95 CA HIS A 92 3.580 -3.817 -9.962 1.00 61.12 C ATOM 96 C HIS A 92 4.676 -3.227 -10.845 1.00 44.23 C ATOM 97 O HIS A 92 5.250 -3.921 -11.684 1.00 34.04 O ATOM 98 CB HIS A 92 2.212 -3.319 -10.428 1.00 61.10 C ATOM 99 CG HIS A 92 1.066 -3.934 -9.684 1.00 44.40 C ATOM 100 ND1 HIS A 92 -0.244 -3.542 -9.863 1.00 73.45 N ATOM 101 CD2 HIS A 92 1.039 -4.920 -8.757 1.00 35.45 C ATOM 102 CE1 HIS A 92 -1.027 -4.260 -9.076 1.00 42.11 C ATOM 103 NE2 HIS A 92 -0.273 -5.103 -8.395 1.00 11.35 N ATOM 0 H HIS A 92 2.989 -3.049 -8.101 1.00 20.10 H new ATOM 0 HA HIS A 92 3.612 -4.903 -10.049 1.00 61.12 H new ATOM 0 HB2 HIS A 92 2.170 -2.236 -10.313 1.00 61.10 H new ATOM 0 HB3 HIS A 92 2.100 -3.531 -11.491 1.00 61.10 H new ATOM 0 HD2 HIS A 92 1.891 -5.462 -8.373 1.00 35.45 H new ATOM 0 HE1 HIS A 92 -2.101 -4.172 -9.003 1.00 42.11 H new ATOM 0 HE2 HIS A 92 -0.610 -5.780 -7.711 1.00 11.35 H new ATOM 111 N GLU A 93 4.961 -1.944 -10.649 1.00 62.03 N ATOM 112 CA GLU A 93 5.987 -1.262 -11.429 1.00 22.40 C ATOM 113 C GLU A 93 7.379 -1.573 -10.887 1.00 33.12 C ATOM 114 O GLU A 93 8.366 -1.528 -11.620 1.00 63.31 O ATOM 115 CB GLU A 93 5.749 0.249 -11.416 1.00 71.43 C ATOM 116 CG GLU A 93 4.345 0.648 -11.840 1.00 15.43 C ATOM 117 CD GLU A 93 4.170 2.151 -11.938 1.00 43.51 C ATOM 118 OE1 GLU A 93 5.109 2.884 -11.562 1.00 60.32 O1- ATOM 119 OE2 GLU A 93 3.094 2.594 -12.390 1.00 11.33 O ATOM 0 H GLU A 93 4.496 -1.356 -9.957 1.00 62.03 H new ATOM 0 HA GLU A 93 5.926 -1.623 -12.456 1.00 22.40 H new ATOM 0 HB2 GLU A 93 5.938 0.629 -10.412 1.00 71.43 H new ATOM 0 HB3 GLU A 93 6.470 0.728 -12.079 1.00 71.43 H new ATOM 0 HG2 GLU A 93 4.119 0.196 -12.806 1.00 15.43 H new ATOM 0 HG3 GLU A 93 3.626 0.248 -11.125 1.00 15.43 H new ATOM 126 N ALA A 94 7.449 -1.889 -9.598 1.00 71.42 N ATOM 127 CA ALA A 94 8.718 -2.209 -8.957 1.00 50.12 C ATOM 128 C ALA A 94 9.242 -3.563 -9.423 1.00 2.41 C ATOM 129 O ALA A 94 10.436 -3.845 -9.321 1.00 44.00 O ATOM 130 CB ALA A 94 8.564 -2.193 -7.444 1.00 70.33 C ATOM 0 H ALA A 94 6.641 -1.930 -8.977 1.00 71.42 H new ATOM 0 HA ALA A 94 9.444 -1.449 -9.245 1.00 50.12 H new ATOM 0 HB1 ALA A 94 9.520 -2.434 -6.978 1.00 70.33 H new ATOM 0 HB2 ALA A 94 8.242 -1.203 -7.121 1.00 70.33 H new ATOM 0 HB3 ALA A 94 7.819 -2.931 -7.146 1.00 70.33 H new ATOM 136 N TRP A 95 8.343 -4.395 -9.935 1.00 33.54 N ATOM 137 CA TRP A 95 8.716 -5.721 -10.416 1.00 2.43 C ATOM 138 C TRP A 95 9.777 -5.626 -11.506 1.00 64.44 C ATOM 139 O TRP A 95 10.517 -6.579 -11.749 1.00 61.23 O ATOM 140 CB TRP A 95 7.485 -6.458 -10.948 1.00 2.15 C ATOM 141 CG TRP A 95 6.561 -6.928 -9.865 1.00 41.24 C ATOM 142 CD1 TRP A 95 6.823 -6.974 -8.526 1.00 14.00 C ATOM 143 CD2 TRP A 95 5.227 -7.421 -10.032 1.00 42.31 C ATOM 144 NE1 TRP A 95 5.733 -7.465 -7.850 1.00 71.33 N ATOM 145 CE2 TRP A 95 4.740 -7.746 -8.751 1.00 74.32 C ATOM 146 CE3 TRP A 95 4.396 -7.617 -11.138 1.00 42.51 C ATOM 147 CZ2 TRP A 95 3.461 -8.257 -8.549 1.00 53.54 C ATOM 148 CZ3 TRP A 95 3.126 -8.124 -10.936 1.00 13.11 C ATOM 149 CH2 TRP A 95 2.668 -8.439 -9.650 1.00 33.31 C ATOM 0 H TRP A 95 7.351 -4.176 -10.028 1.00 33.54 H new ATOM 0 HA TRP A 95 9.132 -6.280 -9.578 1.00 2.43 H new ATOM 0 HB2 TRP A 95 6.938 -5.798 -11.622 1.00 2.15 H new ATOM 0 HB3 TRP A 95 7.810 -7.316 -11.536 1.00 2.15 H new ATOM 0 HD1 TRP A 95 7.751 -6.669 -8.066 1.00 14.00 H new ATOM 0 HE1 TRP A 95 5.673 -7.599 -6.841 1.00 71.33 H new ATOM 0 HE3 TRP A 95 4.740 -7.377 -12.133 1.00 42.51 H new ATOM 0 HZ2 TRP A 95 3.107 -8.501 -7.558 1.00 53.54 H new ATOM 0 HZ3 TRP A 95 2.476 -8.280 -11.784 1.00 13.11 H new ATOM 0 HH2 TRP A 95 1.670 -8.833 -9.525 1.00 33.31 H new ATOM 160 N ILE A 96 9.845 -4.471 -12.160 1.00 55.12 N ATOM 161 CA ILE A 96 10.818 -4.252 -13.224 1.00 34.21 C ATOM 162 C ILE A 96 12.235 -4.538 -12.740 1.00 70.15 C ATOM 163 O ILE A 96 13.114 -4.888 -13.528 1.00 2.25 O ATOM 164 CB ILE A 96 10.751 -2.810 -13.760 1.00 32.45 C ATOM 165 CG1 ILE A 96 9.346 -2.500 -14.279 1.00 12.32 C ATOM 166 CG2 ILE A 96 11.785 -2.604 -14.857 1.00 51.44 C ATOM 167 CD1 ILE A 96 9.120 -1.033 -14.573 1.00 41.21 C ATOM 0 H ILE A 96 9.238 -3.673 -11.972 1.00 55.12 H new ATOM 0 HA ILE A 96 10.566 -4.942 -14.029 1.00 34.21 H new ATOM 0 HB ILE A 96 10.975 -2.124 -12.943 1.00 32.45 H new ATOM 0 HG12 ILE A 96 9.168 -3.076 -15.187 1.00 12.32 H new ATOM 0 HG13 ILE A 96 8.614 -2.832 -13.542 1.00 12.32 H new ATOM 0 HG21 ILE A 96 11.725 -1.580 -15.226 1.00 51.44 H new ATOM 0 HG22 ILE A 96 12.782 -2.788 -14.456 1.00 51.44 H new ATOM 0 HG23 ILE A 96 11.590 -3.296 -15.676 1.00 51.44 H new ATOM 0 HD11 ILE A 96 8.103 -0.887 -14.937 1.00 41.21 H new ATOM 0 HD12 ILE A 96 9.266 -0.453 -13.662 1.00 41.21 H new ATOM 0 HD13 ILE A 96 9.828 -0.701 -15.332 1.00 41.21 H new ATOM 179 N THR A 97 12.452 -4.388 -11.437 1.00 51.42 N ATOM 180 CA THR A 97 13.762 -4.631 -10.847 1.00 31.44 C ATOM 181 C THR A 97 14.023 -6.124 -10.682 1.00 41.10 C ATOM 182 O THR A 97 15.171 -6.570 -10.705 1.00 50.20 O ATOM 183 CB THR A 97 13.896 -3.943 -9.475 1.00 14.40 C ATOM 184 OG1 THR A 97 13.190 -2.698 -9.480 1.00 50.05 O ATOM 185 CG2 THR A 97 15.358 -3.702 -9.132 1.00 60.33 C ATOM 0 H THR A 97 11.736 -4.099 -10.770 1.00 51.42 H new ATOM 0 HA THR A 97 14.499 -4.210 -11.530 1.00 31.44 H new ATOM 0 HB THR A 97 13.465 -4.600 -8.720 1.00 14.40 H new ATOM 0 HG1 THR A 97 12.235 -2.863 -9.337 1.00 50.05 H new ATOM 0 HG21 THR A 97 15.428 -3.215 -8.159 1.00 60.33 H new ATOM 0 HG22 THR A 97 15.886 -4.655 -9.100 1.00 60.33 H new ATOM 0 HG23 THR A 97 15.809 -3.063 -9.891 1.00 60.33 H new ATOM 193 N LEU A 98 12.952 -6.892 -10.517 1.00 70.21 N ATOM 194 CA LEU A 98 13.065 -8.337 -10.349 1.00 75.55 C ATOM 195 C LEU A 98 13.641 -8.987 -11.602 1.00 22.22 C ATOM 196 O LEU A 98 14.276 -10.038 -11.531 1.00 13.11 O ATOM 197 CB LEU A 98 11.697 -8.942 -10.029 1.00 74.34 C ATOM 198 CG LEU A 98 10.890 -8.237 -8.937 1.00 35.43 C ATOM 199 CD1 LEU A 98 9.463 -8.761 -8.907 1.00 20.42 C ATOM 200 CD2 LEU A 98 11.556 -8.419 -7.581 1.00 61.11 C ATOM 0 H LEU A 98 11.995 -6.539 -10.496 1.00 70.21 H new ATOM 0 HA LEU A 98 13.743 -8.529 -9.518 1.00 75.55 H new ATOM 0 HB2 LEU A 98 11.103 -8.951 -10.943 1.00 74.34 H new ATOM 0 HB3 LEU A 98 11.842 -9.981 -9.733 1.00 74.34 H new ATOM 0 HG LEU A 98 10.859 -7.171 -9.164 1.00 35.43 H new ATOM 0 HD11 LEU A 98 8.904 -8.248 -8.124 1.00 20.42 H new ATOM 0 HD12 LEU A 98 8.988 -8.579 -9.871 1.00 20.42 H new ATOM 0 HD13 LEU A 98 9.473 -9.832 -8.704 1.00 20.42 H new ATOM 0 HD21 LEU A 98 10.969 -7.911 -6.816 1.00 61.11 H new ATOM 0 HD22 LEU A 98 11.617 -9.481 -7.345 1.00 61.11 H new ATOM 0 HD23 LEU A 98 12.560 -7.995 -7.609 1.00 61.11 H new ATOM 212 N GLU A 99 13.416 -8.353 -12.749 1.00 4.44 N ATOM 213 CA GLU A 99 13.914 -8.870 -14.018 1.00 1.33 C ATOM 214 C GLU A 99 15.407 -9.173 -13.934 1.00 35.40 C ATOM 215 O GLU A 99 15.855 -10.258 -14.305 1.00 24.30 O ATOM 216 CB GLU A 99 13.648 -7.867 -15.142 1.00 15.35 C ATOM 217 CG GLU A 99 13.139 -8.508 -16.422 1.00 32.50 C ATOM 218 CD GLU A 99 13.419 -7.662 -17.650 1.00 23.42 C ATOM 219 OE1 GLU A 99 13.256 -6.427 -17.570 1.00 23.50 O1- ATOM 220 OE2 GLU A 99 13.802 -8.237 -18.690 1.00 0.21 O ATOM 0 H GLU A 99 12.892 -7.481 -12.825 1.00 4.44 H new ATOM 0 HA GLU A 99 13.385 -9.798 -14.236 1.00 1.33 H new ATOM 0 HB2 GLU A 99 12.919 -7.134 -14.798 1.00 15.35 H new ATOM 0 HB3 GLU A 99 14.568 -7.324 -15.358 1.00 15.35 H new ATOM 0 HG2 GLU A 99 13.605 -9.485 -16.545 1.00 32.50 H new ATOM 0 HG3 GLU A 99 12.065 -8.676 -16.338 1.00 32.50 H new ATOM 227 N LYS A 100 16.174 -8.205 -13.443 1.00 11.05 N ATOM 228 CA LYS A 100 17.617 -8.365 -13.308 1.00 40.42 C ATOM 229 C LYS A 100 17.951 -9.477 -12.319 1.00 54.22 C ATOM 230 O LYS A 100 19.021 -10.080 -12.387 1.00 73.30 O ATOM 231 CB LYS A 100 18.256 -7.052 -12.852 1.00 73.52 C ATOM 232 CG LYS A 100 18.598 -6.112 -13.995 1.00 14.42 C ATOM 233 CD LYS A 100 17.459 -5.148 -14.283 1.00 74.54 C ATOM 234 CE LYS A 100 17.575 -3.882 -13.449 1.00 0.53 C ATOM 235 NZ LYS A 100 16.969 -4.049 -12.100 1.00 11.21 N1+ ATOM 0 H LYS A 100 15.820 -7.301 -13.132 1.00 11.05 H new ATOM 0 HA LYS A 100 18.020 -8.638 -14.283 1.00 40.42 H new ATOM 0 HB2 LYS A 100 17.576 -6.545 -12.167 1.00 73.52 H new ATOM 0 HB3 LYS A 100 19.164 -7.275 -12.292 1.00 73.52 H new ATOM 0 HG2 LYS A 100 19.498 -5.550 -13.748 1.00 14.42 H new ATOM 0 HG3 LYS A 100 18.820 -6.692 -14.891 1.00 14.42 H new ATOM 0 HD2 LYS A 100 17.460 -4.889 -15.342 1.00 74.54 H new ATOM 0 HD3 LYS A 100 16.507 -5.636 -14.075 1.00 74.54 H new ATOM 0 HE2 LYS A 100 18.626 -3.611 -13.344 1.00 0.53 H new ATOM 0 HE3 LYS A 100 17.084 -3.059 -13.968 1.00 0.53 H new ATOM 0 HZ1 LYS A 100 16.402 -3.209 -11.868 1.00 11.21 H new ATOM 0 HZ2 LYS A 100 16.358 -4.891 -12.095 1.00 11.21 H new ATOM 0 HZ3 LYS A 100 17.723 -4.164 -11.393 1.00 11.21 H new ATOM 249 N ALA A 101 17.027 -9.742 -11.401 1.00 55.34 N ATOM 250 CA ALA A 101 17.222 -10.783 -10.399 1.00 52.53 C ATOM 251 C ALA A 101 17.131 -12.171 -11.025 1.00 52.15 C ATOM 252 O ALA A 101 18.049 -12.982 -10.897 1.00 73.43 O ATOM 253 CB ALA A 101 16.201 -10.639 -9.281 1.00 21.20 C ATOM 0 H ALA A 101 16.136 -9.250 -11.331 1.00 55.34 H new ATOM 0 HA ALA A 101 18.221 -10.666 -9.980 1.00 52.53 H new ATOM 0 HB1 ALA A 101 16.359 -11.423 -8.541 1.00 21.20 H new ATOM 0 HB2 ALA A 101 16.315 -9.664 -8.807 1.00 21.20 H new ATOM 0 HB3 ALA A 101 15.196 -10.726 -9.693 1.00 21.20 H new ATOM 259 N TYR A 102 16.020 -12.438 -11.702 1.00 21.11 N ATOM 260 CA TYR A 102 15.808 -13.729 -12.345 1.00 31.20 C ATOM 261 C TYR A 102 16.924 -14.031 -13.341 1.00 54.12 C ATOM 262 O TYR A 102 17.219 -15.192 -13.624 1.00 14.45 O ATOM 263 CB TYR A 102 14.454 -13.751 -13.057 1.00 13.11 C ATOM 264 CG TYR A 102 13.307 -13.284 -12.191 1.00 64.12 C ATOM 265 CD1 TYR A 102 12.962 -13.967 -11.032 1.00 62.33 C ATOM 266 CD2 TYR A 102 12.568 -12.158 -12.532 1.00 0.35 C ATOM 267 CE1 TYR A 102 11.913 -13.544 -10.238 1.00 42.33 C ATOM 268 CE2 TYR A 102 11.519 -11.726 -11.743 1.00 40.03 C ATOM 269 CZ TYR A 102 11.195 -12.423 -10.598 1.00 31.20 C ATOM 270 OH TYR A 102 10.151 -11.997 -9.809 1.00 20.33 O ATOM 0 H TYR A 102 15.252 -11.777 -11.820 1.00 21.11 H new ATOM 0 HA TYR A 102 15.817 -14.498 -11.572 1.00 31.20 H new ATOM 0 HB2 TYR A 102 14.509 -13.120 -13.944 1.00 13.11 H new ATOM 0 HB3 TYR A 102 14.250 -14.765 -13.400 1.00 13.11 H new ATOM 0 HD1 TYR A 102 13.523 -14.844 -10.746 1.00 62.33 H new ATOM 0 HD2 TYR A 102 12.818 -11.611 -13.429 1.00 0.35 H new ATOM 0 HE1 TYR A 102 11.657 -14.088 -9.341 1.00 42.33 H new ATOM 0 HE2 TYR A 102 10.956 -10.847 -12.021 1.00 40.03 H new ATOM 0 HH TYR A 102 10.326 -12.240 -8.876 1.00 20.33 H new ATOM 280 N GLU A 103 17.540 -12.978 -13.867 1.00 1.02 N ATOM 281 CA GLU A 103 18.624 -13.130 -14.831 1.00 60.41 C ATOM 282 C GLU A 103 19.705 -14.062 -14.291 1.00 12.44 C ATOM 283 O GLU A 103 20.247 -14.891 -15.023 1.00 10.12 O ATOM 284 CB GLU A 103 19.232 -11.767 -15.168 1.00 65.01 C ATOM 285 CG GLU A 103 19.338 -11.500 -16.660 1.00 0.13 C ATOM 286 CD GLU A 103 20.480 -10.565 -17.006 1.00 52.23 C ATOM 287 OE1 GLU A 103 21.580 -10.737 -16.440 1.00 20.11 O1- ATOM 288 OE2 GLU A 103 20.274 -9.661 -17.842 1.00 62.03 O ATOM 0 H GLU A 103 17.308 -12.011 -13.642 1.00 1.02 H new ATOM 0 HA GLU A 103 18.210 -13.569 -15.739 1.00 60.41 H new ATOM 0 HB2 GLU A 103 18.626 -10.985 -14.710 1.00 65.01 H new ATOM 0 HB3 GLU A 103 20.225 -11.702 -14.724 1.00 65.01 H new ATOM 0 HG2 GLU A 103 19.475 -12.445 -17.185 1.00 0.13 H new ATOM 0 HG3 GLU A 103 18.401 -11.071 -17.016 1.00 0.13 H new ATOM 295 N ASP A 104 20.014 -13.919 -13.007 1.00 24.32 N ATOM 296 CA ASP A 104 21.030 -14.747 -12.368 1.00 22.21 C ATOM 297 C ASP A 104 20.388 -15.902 -11.605 1.00 53.01 C ATOM 298 O ASP A 104 20.999 -16.480 -10.707 1.00 74.24 O ATOM 299 CB ASP A 104 21.883 -13.904 -11.419 1.00 44.00 C ATOM 300 CG ASP A 104 23.290 -14.448 -11.268 1.00 42.43 C ATOM 301 OD1 ASP A 104 23.975 -14.616 -12.298 1.00 63.21 O1- ATOM 302 OD2 ASP A 104 23.706 -14.707 -10.119 1.00 73.33 O ATOM 0 H ASP A 104 19.575 -13.237 -12.388 1.00 24.32 H new ATOM 0 HA ASP A 104 21.670 -15.161 -13.148 1.00 22.21 H new ATOM 0 HB2 ASP A 104 21.930 -12.880 -11.790 1.00 44.00 H new ATOM 0 HB3 ASP A 104 21.404 -13.867 -10.441 1.00 44.00 H new ATOM 307 N ALA A 105 19.153 -16.231 -11.969 1.00 63.33 N ATOM 308 CA ALA A 105 18.430 -17.317 -11.320 1.00 75.23 C ATOM 309 C ALA A 105 18.229 -17.033 -9.836 1.00 40.43 C ATOM 310 O ALA A 105 18.630 -17.825 -8.984 1.00 42.15 O ATOM 311 CB ALA A 105 19.169 -18.633 -11.513 1.00 34.51 C ATOM 0 H ALA A 105 18.633 -15.761 -12.710 1.00 63.33 H new ATOM 0 HA ALA A 105 17.447 -17.394 -11.784 1.00 75.23 H new ATOM 0 HB1 ALA A 105 18.617 -19.435 -11.023 1.00 34.51 H new ATOM 0 HB2 ALA A 105 19.255 -18.849 -12.578 1.00 34.51 H new ATOM 0 HB3 ALA A 105 20.165 -18.558 -11.077 1.00 34.51 H new ATOM 317 N GLU A 106 17.608 -15.897 -9.534 1.00 74.03 N ATOM 318 CA GLU A 106 17.356 -15.509 -8.151 1.00 75.25 C ATOM 319 C GLU A 106 16.398 -16.487 -7.477 1.00 23.20 C ATOM 320 O GLU A 106 15.463 -16.989 -8.101 1.00 54.54 O ATOM 321 CB GLU A 106 16.782 -14.092 -8.092 1.00 21.20 C ATOM 322 CG GLU A 106 16.335 -13.674 -6.701 1.00 43.42 C ATOM 323 CD GLU A 106 17.491 -13.570 -5.724 1.00 0.21 C ATOM 324 OE1 GLU A 106 18.193 -14.584 -5.525 1.00 14.12 O1- ATOM 325 OE2 GLU A 106 17.692 -12.475 -5.159 1.00 44.33 O ATOM 0 H GLU A 106 17.270 -15.230 -10.228 1.00 74.03 H new ATOM 0 HA GLU A 106 18.305 -15.531 -7.616 1.00 75.25 H new ATOM 0 HB2 GLU A 106 17.535 -13.389 -8.449 1.00 21.20 H new ATOM 0 HB3 GLU A 106 15.934 -14.024 -8.773 1.00 21.20 H new ATOM 0 HG2 GLU A 106 15.827 -12.712 -6.761 1.00 43.42 H new ATOM 0 HG3 GLU A 106 15.609 -14.395 -6.324 1.00 43.42 H new ATOM 332 N THR A 107 16.638 -16.754 -6.196 1.00 4.24 N ATOM 333 CA THR A 107 15.799 -17.672 -5.437 1.00 44.41 C ATOM 334 C THR A 107 14.599 -16.950 -4.834 1.00 60.01 C ATOM 335 O THR A 107 14.702 -15.797 -4.415 1.00 43.33 O ATOM 336 CB THR A 107 16.593 -18.355 -4.308 1.00 43.42 C ATOM 337 OG1 THR A 107 15.774 -19.330 -3.653 1.00 2.32 O ATOM 338 CG2 THR A 107 17.081 -17.332 -3.294 1.00 72.55 C ATOM 0 H THR A 107 17.407 -16.347 -5.663 1.00 4.24 H new ATOM 0 HA THR A 107 15.449 -18.431 -6.136 1.00 44.41 H new ATOM 0 HB THR A 107 17.459 -18.847 -4.750 1.00 43.42 H new ATOM 0 HG1 THR A 107 16.287 -19.761 -2.938 1.00 2.32 H new ATOM 0 HG21 THR A 107 17.639 -17.838 -2.506 1.00 72.55 H new ATOM 0 HG22 THR A 107 17.728 -16.608 -3.790 1.00 72.55 H new ATOM 0 HG23 THR A 107 16.226 -16.815 -2.858 1.00 72.55 H new ATOM 346 N VAL A 108 13.461 -17.636 -4.793 1.00 20.54 N ATOM 347 CA VAL A 108 12.242 -17.060 -4.239 1.00 41.44 C ATOM 348 C VAL A 108 11.706 -17.907 -3.090 1.00 71.21 C ATOM 349 O VAL A 108 12.292 -18.930 -2.732 1.00 42.35 O ATOM 350 CB VAL A 108 11.147 -16.922 -5.314 1.00 65.54 C ATOM 351 CG1 VAL A 108 11.552 -15.894 -6.360 1.00 22.45 C ATOM 352 CG2 VAL A 108 10.864 -18.270 -5.961 1.00 1.14 C ATOM 0 H VAL A 108 13.358 -18.591 -5.137 1.00 20.54 H new ATOM 0 HA VAL A 108 12.502 -16.069 -3.866 1.00 41.44 H new ATOM 0 HB VAL A 108 10.232 -16.575 -4.834 1.00 65.54 H new ATOM 0 HG11 VAL A 108 10.766 -15.810 -7.111 1.00 22.45 H new ATOM 0 HG12 VAL A 108 11.701 -14.926 -5.881 1.00 22.45 H new ATOM 0 HG13 VAL A 108 12.480 -16.208 -6.839 1.00 22.45 H new ATOM 0 HG21 VAL A 108 10.088 -18.155 -6.718 1.00 1.14 H new ATOM 0 HG22 VAL A 108 11.774 -18.647 -6.428 1.00 1.14 H new ATOM 0 HG23 VAL A 108 10.527 -18.975 -5.201 1.00 1.14 H new ATOM 362 N THR A 109 10.588 -17.476 -2.514 1.00 0.35 N ATOM 363 CA THR A 109 9.973 -18.194 -1.405 1.00 72.43 C ATOM 364 C THR A 109 8.506 -17.812 -1.249 1.00 62.13 C ATOM 365 O THR A 109 8.178 -16.649 -1.018 1.00 25.51 O ATOM 366 CB THR A 109 10.708 -17.916 -0.080 1.00 21.55 C ATOM 367 OG1 THR A 109 10.007 -18.531 1.007 1.00 40.31 O ATOM 368 CG2 THR A 109 10.827 -16.420 0.169 1.00 24.53 C ATOM 0 H THR A 109 10.090 -16.632 -2.798 1.00 0.35 H new ATOM 0 HA THR A 109 10.046 -19.257 -1.637 1.00 72.43 H new ATOM 0 HB THR A 109 11.711 -18.338 -0.151 1.00 21.55 H new ATOM 0 HG1 THR A 109 10.481 -18.351 1.846 1.00 40.31 H new ATOM 0 HG21 THR A 109 11.349 -16.248 1.110 1.00 24.53 H new ATOM 0 HG22 THR A 109 11.386 -15.959 -0.646 1.00 24.53 H new ATOM 0 HG23 THR A 109 9.831 -15.979 0.221 1.00 24.53 H new ATOM 376 N GLY A 110 7.625 -18.800 -1.377 1.00 43.33 N ATOM 377 CA GLY A 110 6.202 -18.546 -1.246 1.00 13.05 C ATOM 378 C GLY A 110 5.414 -19.806 -0.946 1.00 3.55 C ATOM 379 O GLY A 110 5.959 -20.910 -0.975 1.00 41.25 O ATOM 0 H GLY A 110 7.871 -19.771 -1.569 1.00 43.33 H new ATOM 0 HA2 GLY A 110 6.037 -17.820 -0.450 1.00 13.05 H new ATOM 0 HA3 GLY A 110 5.829 -18.099 -2.168 1.00 13.05 H new ATOM 383 N VAL A 111 4.127 -19.642 -0.656 1.00 54.30 N ATOM 384 CA VAL A 111 3.263 -20.775 -0.348 1.00 20.01 C ATOM 385 C VAL A 111 2.161 -20.925 -1.391 1.00 45.43 C ATOM 386 O VAL A 111 1.659 -19.935 -1.924 1.00 13.55 O ATOM 387 CB VAL A 111 2.620 -20.629 1.044 1.00 12.42 C ATOM 388 CG1 VAL A 111 1.655 -19.455 1.066 1.00 14.12 C ATOM 389 CG2 VAL A 111 1.915 -21.917 1.442 1.00 40.44 C ATOM 0 H VAL A 111 3.660 -18.736 -0.628 1.00 54.30 H new ATOM 0 HA VAL A 111 3.893 -21.665 -0.358 1.00 20.01 H new ATOM 0 HB VAL A 111 3.408 -20.433 1.771 1.00 12.42 H new ATOM 0 HG11 VAL A 111 1.211 -19.368 2.057 1.00 14.12 H new ATOM 0 HG12 VAL A 111 2.193 -18.537 0.827 1.00 14.12 H new ATOM 0 HG13 VAL A 111 0.868 -19.617 0.329 1.00 14.12 H new ATOM 0 HG21 VAL A 111 1.466 -21.796 2.428 1.00 40.44 H new ATOM 0 HG22 VAL A 111 1.136 -22.145 0.714 1.00 40.44 H new ATOM 0 HG23 VAL A 111 2.637 -22.733 1.469 1.00 40.44 H new ATOM 399 N ILE A 112 1.789 -22.168 -1.677 1.00 15.31 N ATOM 400 CA ILE A 112 0.745 -22.446 -2.656 1.00 63.34 C ATOM 401 C ILE A 112 -0.611 -21.948 -2.169 1.00 32.02 C ATOM 402 O ILE A 112 -1.123 -22.407 -1.149 1.00 22.02 O ATOM 403 CB ILE A 112 0.647 -23.953 -2.960 1.00 73.40 C ATOM 404 CG1 ILE A 112 1.960 -24.461 -3.560 1.00 51.40 C ATOM 405 CG2 ILE A 112 -0.514 -24.228 -3.905 1.00 51.04 C ATOM 406 CD1 ILE A 112 2.424 -25.775 -2.972 1.00 44.52 C ATOM 0 H ILE A 112 2.195 -22.998 -1.245 1.00 15.31 H new ATOM 0 HA ILE A 112 1.018 -21.916 -3.569 1.00 63.34 H new ATOM 0 HB ILE A 112 0.465 -24.486 -2.027 1.00 73.40 H new ATOM 0 HG12 ILE A 112 1.837 -24.577 -4.637 1.00 51.40 H new ATOM 0 HG13 ILE A 112 2.735 -23.710 -3.407 1.00 51.40 H new ATOM 0 HG21 ILE A 112 -0.570 -25.297 -4.111 1.00 51.04 H new ATOM 0 HG22 ILE A 112 -1.445 -23.897 -3.444 1.00 51.04 H new ATOM 0 HG23 ILE A 112 -0.359 -23.687 -4.838 1.00 51.04 H new ATOM 0 HD11 ILE A 112 3.360 -26.074 -3.444 1.00 44.52 H new ATOM 0 HD12 ILE A 112 2.579 -25.659 -1.899 1.00 44.52 H new ATOM 0 HD13 ILE A 112 1.668 -26.540 -3.148 1.00 44.52 H new ATOM 418 N ASN A 113 -1.190 -21.007 -2.908 1.00 70.02 N ATOM 419 CA ASN A 113 -2.488 -20.447 -2.552 1.00 33.21 C ATOM 420 C ASN A 113 -3.607 -21.123 -3.340 1.00 62.31 C ATOM 421 O ASN A 113 -4.653 -21.459 -2.788 1.00 53.33 O ATOM 422 CB ASN A 113 -2.505 -18.939 -2.813 1.00 33.10 C ATOM 423 CG ASN A 113 -1.875 -18.150 -1.682 1.00 43.33 C ATOM 424 OD1 ASN A 113 -0.805 -18.503 -1.185 1.00 34.24 O ATOM 425 ND2 ASN A 113 -2.537 -17.075 -1.270 1.00 44.13 N ATOM 0 H ASN A 113 -0.781 -20.617 -3.757 1.00 70.02 H new ATOM 0 HA ASN A 113 -2.655 -20.628 -1.490 1.00 33.21 H new ATOM 0 HB2 ASN A 113 -1.973 -18.727 -3.740 1.00 33.10 H new ATOM 0 HB3 ASN A 113 -3.534 -18.609 -2.954 1.00 33.10 H new ATOM 0 HD21 ASN A 113 -2.162 -16.504 -0.512 1.00 44.13 H new ATOM 0 HD22 ASN A 113 -3.421 -16.820 -1.711 1.00 44.13 H new ATOM 432 N GLY A 114 -3.376 -21.319 -4.635 1.00 13.12 N ATOM 433 CA GLY A 114 -4.372 -21.954 -5.478 1.00 74.52 C ATOM 434 C GLY A 114 -3.849 -23.209 -6.148 1.00 51.31 C ATOM 435 O GLY A 114 -2.662 -23.309 -6.457 1.00 72.15 O ATOM 0 H GLY A 114 -2.517 -21.049 -5.115 1.00 13.12 H new ATOM 0 HA2 GLY A 114 -5.246 -22.204 -4.877 1.00 74.52 H new ATOM 0 HA3 GLY A 114 -4.701 -21.249 -6.241 1.00 74.52 H new ATOM 439 N LYS A 115 -4.737 -24.172 -6.372 1.00 74.23 N ATOM 440 CA LYS A 115 -4.360 -25.428 -7.009 1.00 34.25 C ATOM 441 C LYS A 115 -5.213 -25.689 -8.246 1.00 42.21 C ATOM 442 O LYS A 115 -6.442 -25.691 -8.175 1.00 24.11 O ATOM 443 CB LYS A 115 -4.506 -26.589 -6.022 1.00 22.32 C ATOM 444 CG LYS A 115 -5.914 -26.748 -5.475 1.00 35.33 C ATOM 445 CD LYS A 115 -5.954 -27.732 -4.318 1.00 22.31 C ATOM 446 CE LYS A 115 -7.304 -27.713 -3.617 1.00 75.20 C ATOM 447 NZ LYS A 115 -7.191 -28.106 -2.185 1.00 11.23 N1+ ATOM 0 H LYS A 115 -5.724 -24.106 -6.121 1.00 74.23 H new ATOM 0 HA LYS A 115 -3.318 -25.350 -7.318 1.00 34.25 H new ATOM 0 HB2 LYS A 115 -4.210 -27.514 -6.516 1.00 22.32 H new ATOM 0 HB3 LYS A 115 -3.817 -26.437 -5.191 1.00 22.32 H new ATOM 0 HG2 LYS A 115 -6.288 -25.779 -5.143 1.00 35.33 H new ATOM 0 HG3 LYS A 115 -6.577 -27.091 -6.269 1.00 35.33 H new ATOM 0 HD2 LYS A 115 -5.748 -28.737 -4.686 1.00 22.31 H new ATOM 0 HD3 LYS A 115 -5.168 -27.487 -3.603 1.00 22.31 H new ATOM 0 HE2 LYS A 115 -7.735 -26.714 -3.687 1.00 75.20 H new ATOM 0 HE3 LYS A 115 -7.988 -28.392 -4.127 1.00 75.20 H new ATOM 0 HZ1 LYS A 115 -8.132 -28.081 -1.743 1.00 11.23 H new ATOM 0 HZ2 LYS A 115 -6.803 -29.069 -2.119 1.00 11.23 H new ATOM 0 HZ3 LYS A 115 -6.559 -27.443 -1.692 1.00 11.23 H new ATOM 461 N VAL A 116 -4.554 -25.909 -9.379 1.00 23.14 N ATOM 462 CA VAL A 116 -5.252 -26.174 -10.631 1.00 34.23 C ATOM 463 C VAL A 116 -4.987 -27.593 -11.119 1.00 0.13 C ATOM 464 O VAL A 116 -4.219 -28.338 -10.510 1.00 22.41 O ATOM 465 CB VAL A 116 -4.833 -25.178 -11.729 1.00 11.42 C ATOM 466 CG1 VAL A 116 -5.296 -23.772 -11.380 1.00 22.33 C ATOM 467 CG2 VAL A 116 -3.326 -25.216 -11.934 1.00 71.40 C ATOM 0 H VAL A 116 -3.537 -25.909 -9.455 1.00 23.14 H new ATOM 0 HA VAL A 116 -6.317 -26.056 -10.430 1.00 34.23 H new ATOM 0 HB VAL A 116 -5.312 -25.471 -12.663 1.00 11.42 H new ATOM 0 HG11 VAL A 116 -4.991 -23.083 -12.167 1.00 22.33 H new ATOM 0 HG12 VAL A 116 -6.382 -23.759 -11.287 1.00 22.33 H new ATOM 0 HG13 VAL A 116 -4.847 -23.465 -10.435 1.00 22.33 H new ATOM 0 HG21 VAL A 116 -3.047 -24.507 -12.713 1.00 71.40 H new ATOM 0 HG22 VAL A 116 -2.825 -24.949 -11.003 1.00 71.40 H new ATOM 0 HG23 VAL A 116 -3.025 -26.220 -12.233 1.00 71.40 H new ATOM 477 N LYS A 117 -5.627 -27.963 -12.224 1.00 32.33 N ATOM 478 CA LYS A 117 -5.460 -29.293 -12.797 1.00 42.33 C ATOM 479 C LYS A 117 -4.014 -29.522 -13.227 1.00 14.34 C ATOM 480 O LYS A 117 -3.622 -29.161 -14.336 1.00 60.05 O ATOM 481 CB LYS A 117 -6.395 -29.475 -13.995 1.00 61.43 C ATOM 482 CG LYS A 117 -7.868 -29.456 -13.625 1.00 62.31 C ATOM 483 CD LYS A 117 -8.752 -29.434 -14.861 1.00 13.11 C ATOM 484 CE LYS A 117 -10.093 -28.774 -14.574 1.00 34.15 C ATOM 485 NZ LYS A 117 -10.006 -27.289 -14.643 1.00 72.03 N1+ ATOM 0 H LYS A 117 -6.267 -27.359 -12.741 1.00 32.33 H new ATOM 0 HA LYS A 117 -5.713 -30.026 -12.032 1.00 42.33 H new ATOM 0 HB2 LYS A 117 -6.201 -28.685 -14.720 1.00 61.43 H new ATOM 0 HB3 LYS A 117 -6.164 -30.421 -14.485 1.00 61.43 H new ATOM 0 HG2 LYS A 117 -8.104 -30.333 -13.023 1.00 62.31 H new ATOM 0 HG3 LYS A 117 -8.079 -28.581 -13.010 1.00 62.31 H new ATOM 0 HD2 LYS A 117 -8.245 -28.897 -15.663 1.00 13.11 H new ATOM 0 HD3 LYS A 117 -8.914 -30.453 -15.212 1.00 13.11 H new ATOM 0 HE2 LYS A 117 -10.833 -29.128 -15.292 1.00 34.15 H new ATOM 0 HE3 LYS A 117 -10.440 -29.072 -13.585 1.00 34.15 H new ATOM 0 HZ1 LYS A 117 -10.939 -26.877 -14.442 1.00 72.03 H new ATOM 0 HZ2 LYS A 117 -9.318 -26.949 -13.941 1.00 72.03 H new ATOM 0 HZ3 LYS A 117 -9.699 -27.003 -15.595 1.00 72.03 H new ATOM 499 N GLY A 118 -3.227 -30.127 -12.342 1.00 2.22 N ATOM 500 CA GLY A 118 -1.835 -30.395 -12.650 1.00 23.52 C ATOM 501 C GLY A 118 -0.919 -29.264 -12.227 1.00 73.33 C ATOM 502 O GLY A 118 0.210 -29.497 -11.796 1.00 53.41 O ATOM 0 H GLY A 118 -3.529 -30.436 -11.418 1.00 2.22 H new ATOM 0 HA2 GLY A 118 -1.526 -31.314 -12.152 1.00 23.52 H new ATOM 0 HA3 GLY A 118 -1.729 -30.563 -13.722 1.00 23.52 H new ATOM 506 N GLY A 119 -1.405 -28.032 -12.352 1.00 73.01 N ATOM 507 CA GLY A 119 -0.609 -26.879 -11.976 1.00 40.10 C ATOM 508 C GLY A 119 -0.810 -26.482 -10.527 1.00 3.33 C ATOM 509 O GLY A 119 -1.663 -27.039 -9.836 1.00 23.40 O ATOM 0 H GLY A 119 -2.336 -27.813 -12.707 1.00 73.01 H new ATOM 0 HA2 GLY A 119 0.445 -27.098 -12.146 1.00 40.10 H new ATOM 0 HA3 GLY A 119 -0.868 -26.038 -12.619 1.00 40.10 H new ATOM 513 N PHE A 120 -0.022 -25.517 -10.065 1.00 21.13 N ATOM 514 CA PHE A 120 -0.116 -25.047 -8.688 1.00 73.13 C ATOM 515 C PHE A 120 0.325 -23.591 -8.578 1.00 33.45 C ATOM 516 O PHE A 120 1.468 -23.250 -8.883 1.00 42.12 O ATOM 517 CB PHE A 120 0.741 -25.921 -7.769 1.00 45.15 C ATOM 518 CG PHE A 120 0.022 -27.136 -7.255 1.00 10.53 C ATOM 519 CD1 PHE A 120 -1.024 -27.009 -6.356 1.00 40.45 C ATOM 520 CD2 PHE A 120 0.393 -28.404 -7.671 1.00 41.15 C ATOM 521 CE1 PHE A 120 -1.688 -28.125 -5.882 1.00 33.12 C ATOM 522 CE2 PHE A 120 -0.267 -29.524 -7.201 1.00 24.30 C ATOM 523 CZ PHE A 120 -1.308 -29.384 -6.304 1.00 54.21 C ATOM 0 H PHE A 120 0.689 -25.045 -10.624 1.00 21.13 H new ATOM 0 HA PHE A 120 -1.159 -25.117 -8.378 1.00 73.13 H new ATOM 0 HB2 PHE A 120 1.632 -26.238 -8.310 1.00 45.15 H new ATOM 0 HB3 PHE A 120 1.078 -25.323 -6.922 1.00 45.15 H new ATOM 0 HD1 PHE A 120 -1.324 -26.027 -6.022 1.00 40.45 H new ATOM 0 HD2 PHE A 120 1.208 -28.519 -8.371 1.00 41.15 H new ATOM 0 HE1 PHE A 120 -2.503 -28.013 -5.182 1.00 33.12 H new ATOM 0 HE2 PHE A 120 0.031 -30.507 -7.535 1.00 24.30 H new ATOM 0 HZ PHE A 120 -1.824 -30.257 -5.933 1.00 54.21 H new ATOM 533 N THR A 121 -0.592 -22.733 -8.141 1.00 3.13 N ATOM 534 CA THR A 121 -0.300 -21.312 -7.992 1.00 4.13 C ATOM 535 C THR A 121 0.346 -21.022 -6.643 1.00 21.42 C ATOM 536 O THR A 121 -0.092 -21.531 -5.611 1.00 71.30 O ATOM 537 CB THR A 121 -1.576 -20.460 -8.132 1.00 11.34 C ATOM 538 OG1 THR A 121 -2.731 -21.305 -8.146 1.00 20.12 O ATOM 539 CG2 THR A 121 -1.534 -19.629 -9.406 1.00 43.11 C ATOM 0 H THR A 121 -1.543 -22.997 -7.884 1.00 3.13 H new ATOM 0 HA THR A 121 0.395 -21.046 -8.788 1.00 4.13 H new ATOM 0 HB THR A 121 -1.631 -19.785 -7.278 1.00 11.34 H new ATOM 0 HG1 THR A 121 -3.538 -20.755 -8.234 1.00 20.12 H new ATOM 0 HG21 THR A 121 -2.445 -19.036 -9.484 1.00 43.11 H new ATOM 0 HG22 THR A 121 -0.670 -18.965 -9.379 1.00 43.11 H new ATOM 0 HG23 THR A 121 -1.457 -20.290 -10.269 1.00 43.11 H new ATOM 547 N VAL A 122 1.390 -20.199 -6.657 1.00 12.32 N ATOM 548 CA VAL A 122 2.096 -19.840 -5.433 1.00 62.52 C ATOM 549 C VAL A 122 2.381 -18.343 -5.383 1.00 11.44 C ATOM 550 O VAL A 122 2.766 -17.741 -6.385 1.00 22.11 O ATOM 551 CB VAL A 122 3.425 -20.608 -5.305 1.00 61.21 C ATOM 552 CG1 VAL A 122 4.032 -20.399 -3.926 1.00 4.33 C ATOM 553 CG2 VAL A 122 3.212 -22.089 -5.583 1.00 4.41 C ATOM 0 H VAL A 122 1.765 -19.769 -7.502 1.00 12.32 H new ATOM 0 HA VAL A 122 1.446 -20.112 -4.601 1.00 62.52 H new ATOM 0 HB VAL A 122 4.123 -20.218 -6.046 1.00 61.21 H new ATOM 0 HG11 VAL A 122 4.970 -20.949 -3.854 1.00 4.33 H new ATOM 0 HG12 VAL A 122 4.221 -19.337 -3.769 1.00 4.33 H new ATOM 0 HG13 VAL A 122 3.340 -20.761 -3.165 1.00 4.33 H new ATOM 0 HG21 VAL A 122 4.161 -22.617 -5.488 1.00 4.41 H new ATOM 0 HG22 VAL A 122 2.498 -22.495 -4.866 1.00 4.41 H new ATOM 0 HG23 VAL A 122 2.825 -22.217 -6.594 1.00 4.41 H new ATOM 563 N GLU A 123 2.191 -17.748 -4.209 1.00 1.41 N ATOM 564 CA GLU A 123 2.427 -16.321 -4.029 1.00 24.31 C ATOM 565 C GLU A 123 3.877 -16.055 -3.634 1.00 24.33 C ATOM 566 O GLU A 123 4.316 -16.436 -2.548 1.00 63.43 O ATOM 567 CB GLU A 123 1.485 -15.756 -2.964 1.00 10.44 C ATOM 568 CG GLU A 123 1.687 -14.273 -2.698 1.00 13.44 C ATOM 569 CD GLU A 123 0.784 -13.750 -1.598 1.00 44.22 C ATOM 570 OE1 GLU A 123 0.793 -14.335 -0.495 1.00 5.32 O ATOM 571 OE2 GLU A 123 0.068 -12.756 -1.841 1.00 14.32 O1- ATOM 0 H GLU A 123 1.874 -18.232 -3.369 1.00 1.41 H new ATOM 0 HA GLU A 123 2.230 -15.824 -4.979 1.00 24.31 H new ATOM 0 HB2 GLU A 123 0.454 -15.923 -3.277 1.00 10.44 H new ATOM 0 HB3 GLU A 123 1.629 -16.306 -2.034 1.00 10.44 H new ATOM 0 HG2 GLU A 123 2.727 -14.095 -2.425 1.00 13.44 H new ATOM 0 HG3 GLU A 123 1.498 -13.714 -3.615 1.00 13.44 H new ATOM 578 N LEU A 124 4.616 -15.401 -4.523 1.00 13.23 N ATOM 579 CA LEU A 124 6.017 -15.084 -4.269 1.00 3.34 C ATOM 580 C LEU A 124 6.254 -13.578 -4.329 1.00 14.51 C ATOM 581 O LEU A 124 6.442 -13.013 -5.405 1.00 51.32 O ATOM 582 CB LEU A 124 6.913 -15.794 -5.284 1.00 74.20 C ATOM 583 CG LEU A 124 6.671 -17.294 -5.460 1.00 25.45 C ATOM 584 CD1 LEU A 124 7.203 -17.767 -6.803 1.00 35.05 C ATOM 585 CD2 LEU A 124 7.316 -18.075 -4.324 1.00 14.43 C ATOM 0 H LEU A 124 4.268 -15.080 -5.427 1.00 13.23 H new ATOM 0 HA LEU A 124 6.267 -15.433 -3.267 1.00 3.34 H new ATOM 0 HB2 LEU A 124 6.786 -15.310 -6.252 1.00 74.20 H new ATOM 0 HB3 LEU A 124 7.952 -15.646 -4.988 1.00 74.20 H new ATOM 0 HG LEU A 124 5.596 -17.474 -5.435 1.00 25.45 H new ATOM 0 HD11 LEU A 124 7.022 -18.836 -6.910 1.00 35.05 H new ATOM 0 HD12 LEU A 124 6.695 -17.231 -7.605 1.00 35.05 H new ATOM 0 HD13 LEU A 124 8.274 -17.573 -6.859 1.00 35.05 H new ATOM 0 HD21 LEU A 124 7.134 -19.140 -4.465 1.00 14.43 H new ATOM 0 HD22 LEU A 124 8.390 -17.888 -4.318 1.00 14.43 H new ATOM 0 HD23 LEU A 124 6.887 -17.757 -3.374 1.00 14.43 H new ATOM 597 N ASN A 125 6.246 -12.936 -3.166 1.00 42.42 N ATOM 598 CA ASN A 125 6.462 -11.496 -3.087 1.00 23.03 C ATOM 599 C ASN A 125 5.352 -10.738 -3.810 1.00 71.21 C ATOM 600 O ASN A 125 5.549 -9.611 -4.262 1.00 12.11 O ATOM 601 CB ASN A 125 7.821 -11.129 -3.687 1.00 41.54 C ATOM 602 CG ASN A 125 8.876 -12.184 -3.417 1.00 2.20 C ATOM 603 OD1 ASN A 125 9.099 -12.575 -2.272 1.00 61.54 O ATOM 604 ND2 ASN A 125 9.531 -12.650 -4.474 1.00 75.40 N ATOM 0 H ASN A 125 6.092 -13.390 -2.265 1.00 42.42 H new ATOM 0 HA ASN A 125 6.447 -11.209 -2.036 1.00 23.03 H new ATOM 0 HB2 ASN A 125 7.715 -10.992 -4.763 1.00 41.54 H new ATOM 0 HB3 ASN A 125 8.151 -10.175 -3.275 1.00 41.54 H new ATOM 0 HD21 ASN A 125 10.252 -13.361 -4.354 1.00 75.40 H new ATOM 0 HD22 ASN A 125 9.313 -12.297 -5.406 1.00 75.40 H new ATOM 611 N GLY A 126 4.185 -11.367 -3.914 1.00 44.14 N ATOM 612 CA GLY A 126 3.061 -10.737 -4.583 1.00 71.51 C ATOM 613 C GLY A 126 2.821 -11.302 -5.969 1.00 14.11 C ATOM 614 O GLY A 126 1.713 -11.212 -6.499 1.00 40.40 O ATOM 0 H GLY A 126 3.998 -12.300 -3.548 1.00 44.14 H new ATOM 0 HA2 GLY A 126 2.163 -10.869 -3.980 1.00 71.51 H new ATOM 0 HA3 GLY A 126 3.241 -9.665 -4.657 1.00 71.51 H new ATOM 618 N ILE A 127 3.861 -11.884 -6.557 1.00 22.22 N ATOM 619 CA ILE A 127 3.757 -12.464 -7.890 1.00 73.32 C ATOM 620 C ILE A 127 3.180 -13.875 -7.832 1.00 14.32 C ATOM 621 O ILE A 127 3.338 -14.580 -6.836 1.00 64.31 O ATOM 622 CB ILE A 127 5.127 -12.511 -8.592 1.00 24.54 C ATOM 623 CG1 ILE A 127 5.845 -11.167 -8.447 1.00 35.23 C ATOM 624 CG2 ILE A 127 4.958 -12.871 -10.061 1.00 3.54 C ATOM 625 CD1 ILE A 127 7.228 -11.152 -9.057 1.00 1.33 C ATOM 0 H ILE A 127 4.784 -11.966 -6.132 1.00 22.22 H new ATOM 0 HA ILE A 127 3.086 -11.822 -8.462 1.00 73.32 H new ATOM 0 HB ILE A 127 5.736 -13.281 -8.117 1.00 24.54 H new ATOM 0 HG12 ILE A 127 5.242 -10.390 -8.916 1.00 35.23 H new ATOM 0 HG13 ILE A 127 5.921 -10.917 -7.389 1.00 35.23 H new ATOM 0 HG21 ILE A 127 5.935 -12.900 -10.543 1.00 3.54 H new ATOM 0 HG22 ILE A 127 4.483 -13.849 -10.144 1.00 3.54 H new ATOM 0 HG23 ILE A 127 4.334 -12.122 -10.550 1.00 3.54 H new ATOM 0 HD11 ILE A 127 7.677 -10.169 -8.917 1.00 1.33 H new ATOM 0 HD12 ILE A 127 7.848 -11.906 -8.572 1.00 1.33 H new ATOM 0 HD13 ILE A 127 7.158 -11.370 -10.123 1.00 1.33 H new ATOM 637 N ARG A 128 2.512 -14.280 -8.908 1.00 34.50 N ATOM 638 CA ARG A 128 1.912 -15.606 -8.980 1.00 4.34 C ATOM 639 C ARG A 128 2.798 -16.561 -9.774 1.00 60.24 C ATOM 640 O ARG A 128 3.144 -16.291 -10.924 1.00 55.21 O ATOM 641 CB ARG A 128 0.525 -15.528 -9.621 1.00 35.11 C ATOM 642 CG ARG A 128 -0.595 -15.292 -8.621 1.00 21.23 C ATOM 643 CD ARG A 128 -0.845 -13.808 -8.403 1.00 73.51 C ATOM 644 NE ARG A 128 -1.370 -13.159 -9.601 1.00 62.14 N ATOM 645 CZ ARG A 128 -1.703 -11.875 -9.655 1.00 54.34 C ATOM 646 NH1 ARG A 128 -1.565 -11.105 -8.585 1.00 63.40 N1+ ATOM 647 NH2 ARG A 128 -2.174 -11.357 -10.783 1.00 13.12 N ATOM 0 H ARG A 128 2.373 -13.708 -9.741 1.00 34.50 H new ATOM 0 HA ARG A 128 1.814 -15.988 -7.964 1.00 4.34 H new ATOM 0 HB2 ARG A 128 0.519 -14.724 -10.357 1.00 35.11 H new ATOM 0 HB3 ARG A 128 0.330 -16.455 -10.160 1.00 35.11 H new ATOM 0 HG2 ARG A 128 -1.509 -15.767 -8.978 1.00 21.23 H new ATOM 0 HG3 ARG A 128 -0.341 -15.762 -7.671 1.00 21.23 H new ATOM 0 HD2 ARG A 128 -1.549 -13.676 -7.581 1.00 73.51 H new ATOM 0 HD3 ARG A 128 0.085 -13.324 -8.107 1.00 73.51 H new ATOM 0 HE ARG A 128 -1.487 -13.723 -10.443 1.00 62.14 H new ATOM 0 HH11 ARG A 128 -1.202 -11.499 -7.717 1.00 63.40 H new ATOM 0 HH12 ARG A 128 -1.822 -10.119 -8.630 1.00 63.40 H new ATOM 0 HH21 ARG A 128 -2.280 -11.946 -11.609 1.00 13.12 H new ATOM 0 HH22 ARG A 128 -2.430 -10.370 -10.823 1.00 13.12 H new ATOM 661 N ALA A 129 3.161 -17.679 -9.153 1.00 23.11 N ATOM 662 CA ALA A 129 4.005 -18.674 -9.802 1.00 52.14 C ATOM 663 C ALA A 129 3.176 -19.848 -10.313 1.00 51.23 C ATOM 664 O ALA A 129 1.982 -19.949 -10.027 1.00 40.33 O ATOM 665 CB ALA A 129 5.079 -19.162 -8.842 1.00 63.52 C ATOM 0 H ALA A 129 2.883 -17.918 -8.201 1.00 23.11 H new ATOM 0 HA ALA A 129 4.486 -18.203 -10.659 1.00 52.14 H new ATOM 0 HB1 ALA A 129 5.702 -19.905 -9.340 1.00 63.52 H new ATOM 0 HB2 ALA A 129 5.697 -18.320 -8.530 1.00 63.52 H new ATOM 0 HB3 ALA A 129 4.608 -19.611 -7.967 1.00 63.52 H new ATOM 671 N PHE A 130 3.815 -20.733 -11.070 1.00 51.13 N ATOM 672 CA PHE A 130 3.136 -21.899 -11.622 1.00 11.43 C ATOM 673 C PHE A 130 4.056 -23.116 -11.620 1.00 70.34 C ATOM 674 O PHE A 130 5.102 -23.120 -12.271 1.00 70.32 O ATOM 675 CB PHE A 130 2.657 -21.611 -13.046 1.00 33.32 C ATOM 676 CG PHE A 130 1.396 -22.339 -13.414 1.00 74.44 C ATOM 677 CD1 PHE A 130 1.439 -23.659 -13.830 1.00 63.42 C ATOM 678 CD2 PHE A 130 0.167 -21.702 -13.343 1.00 15.20 C ATOM 679 CE1 PHE A 130 0.280 -24.333 -14.169 1.00 15.24 C ATOM 680 CE2 PHE A 130 -0.995 -22.370 -13.680 1.00 51.42 C ATOM 681 CZ PHE A 130 -0.938 -23.687 -14.095 1.00 35.35 C ATOM 0 H PHE A 130 4.803 -20.665 -11.315 1.00 51.13 H new ATOM 0 HA PHE A 130 2.273 -22.116 -10.993 1.00 11.43 H new ATOM 0 HB2 PHE A 130 2.493 -20.539 -13.156 1.00 33.32 H new ATOM 0 HB3 PHE A 130 3.444 -21.887 -13.748 1.00 33.32 H new ATOM 0 HD1 PHE A 130 2.389 -24.168 -13.890 1.00 63.42 H new ATOM 0 HD2 PHE A 130 0.117 -20.672 -13.021 1.00 15.20 H new ATOM 0 HE1 PHE A 130 0.328 -25.363 -14.491 1.00 15.24 H new ATOM 0 HE2 PHE A 130 -1.947 -21.863 -13.619 1.00 51.42 H new ATOM 0 HZ PHE A 130 -1.845 -24.210 -14.361 1.00 35.35 H new ATOM 691 N LEU A 131 3.661 -24.148 -10.883 1.00 42.32 N ATOM 692 CA LEU A 131 4.449 -25.373 -10.794 1.00 71.54 C ATOM 693 C LEU A 131 3.880 -26.454 -11.707 1.00 33.11 C ATOM 694 O LEU A 131 2.686 -26.754 -11.687 1.00 13.54 O ATOM 695 CB LEU A 131 4.486 -25.876 -9.350 1.00 3.45 C ATOM 696 CG LEU A 131 5.622 -25.336 -8.480 1.00 1.01 C ATOM 697 CD1 LEU A 131 5.367 -23.883 -8.110 1.00 72.14 C ATOM 698 CD2 LEU A 131 5.785 -26.187 -7.229 1.00 1.05 C ATOM 0 H LEU A 131 2.799 -24.161 -10.338 1.00 42.32 H new ATOM 0 HA LEU A 131 5.464 -25.147 -11.119 1.00 71.54 H new ATOM 0 HB2 LEU A 131 3.539 -25.623 -8.874 1.00 3.45 H new ATOM 0 HB3 LEU A 131 4.554 -26.964 -9.367 1.00 3.45 H new ATOM 0 HG LEU A 131 6.548 -25.386 -9.052 1.00 1.01 H new ATOM 0 HD11 LEU A 131 6.186 -23.516 -7.491 1.00 72.14 H new ATOM 0 HD12 LEU A 131 5.301 -23.283 -9.017 1.00 72.14 H new ATOM 0 HD13 LEU A 131 4.431 -23.807 -7.556 1.00 72.14 H new ATOM 0 HD21 LEU A 131 6.598 -25.789 -6.621 1.00 1.05 H new ATOM 0 HD22 LEU A 131 4.859 -26.169 -6.654 1.00 1.05 H new ATOM 0 HD23 LEU A 131 6.015 -27.213 -7.515 1.00 1.05 H new ATOM 710 N PRO A 132 4.754 -27.056 -12.527 1.00 44.13 N ATOM 711 CA PRO A 132 4.363 -28.116 -13.461 1.00 23.41 C ATOM 712 C PRO A 132 3.991 -29.411 -12.746 1.00 0.41 C ATOM 713 O PRO A 132 4.713 -29.873 -11.864 1.00 50.35 O ATOM 714 CB PRO A 132 5.617 -28.318 -14.315 1.00 2.04 C ATOM 715 CG PRO A 132 6.742 -27.867 -13.449 1.00 70.40 C ATOM 716 CD PRO A 132 6.193 -26.750 -12.605 1.00 11.23 C ATOM 0 HA PRO A 132 3.478 -27.845 -14.037 1.00 23.41 H new ATOM 0 HB2 PRO A 132 5.735 -29.362 -14.605 1.00 2.04 H new ATOM 0 HB3 PRO A 132 5.567 -27.735 -15.235 1.00 2.04 H new ATOM 0 HG2 PRO A 132 7.107 -28.684 -12.826 1.00 70.40 H new ATOM 0 HG3 PRO A 132 7.584 -27.524 -14.050 1.00 70.40 H new ATOM 0 HD2 PRO A 132 6.653 -26.729 -11.617 1.00 11.23 H new ATOM 0 HD3 PRO A 132 6.373 -25.776 -13.061 1.00 11.23 H new ATOM 724 N GLY A 133 2.860 -29.992 -13.133 1.00 51.13 N ATOM 725 CA GLY A 133 2.413 -31.228 -12.519 1.00 72.20 C ATOM 726 C GLY A 133 3.210 -32.429 -12.987 1.00 24.31 C ATOM 727 O GLY A 133 3.099 -33.516 -12.419 1.00 62.54 O ATOM 0 H GLY A 133 2.245 -29.629 -13.861 1.00 51.13 H new ATOM 0 HA2 GLY A 133 2.494 -31.142 -11.435 1.00 72.20 H new ATOM 0 HA3 GLY A 133 1.359 -31.384 -12.748 1.00 72.20 H new ATOM 731 N SER A 134 4.014 -32.235 -14.027 1.00 13.24 N ATOM 732 CA SER A 134 4.829 -33.313 -14.575 1.00 0.03 C ATOM 733 C SER A 134 5.620 -34.011 -13.473 1.00 14.21 C ATOM 734 O SER A 134 5.853 -35.219 -13.529 1.00 33.45 O ATOM 735 CB SER A 134 5.785 -32.769 -15.638 1.00 71.14 C ATOM 736 OG SER A 134 6.725 -33.754 -16.031 1.00 54.54 O ATOM 0 H SER A 134 4.119 -31.341 -14.507 1.00 13.24 H new ATOM 0 HA SER A 134 4.161 -34.041 -15.036 1.00 0.03 H new ATOM 0 HB2 SER A 134 5.217 -32.437 -16.507 1.00 71.14 H new ATOM 0 HB3 SER A 134 6.309 -31.897 -15.248 1.00 71.14 H new ATOM 0 HG SER A 134 6.984 -33.605 -16.964 1.00 54.54 H new ATOM 742 N LEU A 135 6.030 -33.241 -12.471 1.00 22.34 N ATOM 743 CA LEU A 135 6.796 -33.783 -11.353 1.00 71.02 C ATOM 744 C LEU A 135 6.101 -33.494 -10.026 1.00 43.52 C ATOM 745 O LEU A 135 6.751 -33.184 -9.028 1.00 62.30 O ATOM 746 CB LEU A 135 8.207 -33.194 -11.343 1.00 1.33 C ATOM 747 CG LEU A 135 9.197 -33.803 -12.336 1.00 35.31 C ATOM 748 CD1 LEU A 135 10.544 -33.104 -12.245 1.00 35.24 C ATOM 749 CD2 LEU A 135 9.351 -35.297 -12.087 1.00 24.21 C ATOM 0 H LEU A 135 5.845 -32.240 -12.409 1.00 22.34 H new ATOM 0 HA LEU A 135 6.862 -34.864 -11.479 1.00 71.02 H new ATOM 0 HB2 LEU A 135 8.134 -32.125 -11.543 1.00 1.33 H new ATOM 0 HB3 LEU A 135 8.617 -33.303 -10.339 1.00 1.33 H new ATOM 0 HG LEU A 135 8.805 -33.661 -13.343 1.00 35.31 H new ATOM 0 HD11 LEU A 135 11.235 -33.551 -12.959 1.00 35.24 H new ATOM 0 HD12 LEU A 135 10.421 -32.045 -12.474 1.00 35.24 H new ATOM 0 HD13 LEU A 135 10.943 -33.213 -11.237 1.00 35.24 H new ATOM 0 HD21 LEU A 135 10.059 -35.714 -12.803 1.00 24.21 H new ATOM 0 HD22 LEU A 135 9.719 -35.461 -11.074 1.00 24.21 H new ATOM 0 HD23 LEU A 135 8.385 -35.787 -12.205 1.00 24.21 H new ATOM 761 N VAL A 136 4.776 -33.600 -10.022 1.00 10.15 N ATOM 762 CA VAL A 136 3.993 -33.353 -8.817 1.00 65.54 C ATOM 763 C VAL A 136 3.145 -34.567 -8.455 1.00 40.25 C ATOM 764 O VAL A 136 3.278 -35.127 -7.366 1.00 34.33 O ATOM 765 CB VAL A 136 3.073 -32.130 -8.987 1.00 44.33 C ATOM 766 CG1 VAL A 136 2.204 -31.941 -7.753 1.00 72.44 C ATOM 767 CG2 VAL A 136 3.894 -30.881 -9.268 1.00 24.52 C ATOM 0 H VAL A 136 4.222 -33.855 -10.840 1.00 10.15 H new ATOM 0 HA VAL A 136 4.702 -33.156 -8.013 1.00 65.54 H new ATOM 0 HB VAL A 136 2.418 -32.305 -9.840 1.00 44.33 H new ATOM 0 HG11 VAL A 136 1.560 -31.072 -7.891 1.00 72.44 H new ATOM 0 HG12 VAL A 136 1.589 -32.828 -7.602 1.00 72.44 H new ATOM 0 HG13 VAL A 136 2.839 -31.787 -6.881 1.00 72.44 H new ATOM 0 HG21 VAL A 136 3.228 -30.026 -9.385 1.00 24.52 H new ATOM 0 HG22 VAL A 136 4.575 -30.699 -8.437 1.00 24.52 H new ATOM 0 HG23 VAL A 136 4.468 -31.022 -10.184 1.00 24.52 H new ATOM 777 N ASP A 137 2.275 -34.970 -9.374 1.00 63.00 N ATOM 778 CA ASP A 137 1.405 -36.119 -9.152 1.00 72.00 C ATOM 779 C ASP A 137 1.715 -37.234 -10.146 1.00 1.41 C ATOM 780 O ASP A 137 1.566 -37.061 -11.356 1.00 33.31 O ATOM 781 CB ASP A 137 -0.063 -35.706 -9.271 1.00 42.44 C ATOM 782 CG ASP A 137 -0.994 -36.666 -8.558 1.00 44.32 C ATOM 783 OD1 ASP A 137 -1.084 -36.593 -7.314 1.00 15.05 O ATOM 784 OD2 ASP A 137 -1.634 -37.491 -9.243 1.00 53.44 O1- ATOM 0 H ASP A 137 2.153 -34.518 -10.280 1.00 63.00 H new ATOM 0 HA ASP A 137 1.588 -36.493 -8.145 1.00 72.00 H new ATOM 0 HB2 ASP A 137 -0.191 -34.706 -8.857 1.00 42.44 H new ATOM 0 HB3 ASP A 137 -0.338 -35.653 -10.324 1.00 42.44 H new ATOM 789 N VAL A 138 2.147 -38.380 -9.628 1.00 53.41 N ATOM 790 CA VAL A 138 2.477 -39.523 -10.469 1.00 15.53 C ATOM 791 C VAL A 138 2.799 -40.752 -9.625 1.00 1.43 C ATOM 792 O VAL A 138 3.683 -40.716 -8.770 1.00 34.11 O ATOM 793 CB VAL A 138 3.675 -39.217 -11.387 1.00 13.01 C ATOM 794 CG1 VAL A 138 4.879 -38.780 -10.567 1.00 11.43 C ATOM 795 CG2 VAL A 138 4.014 -40.429 -12.242 1.00 50.50 C ATOM 0 H VAL A 138 2.276 -38.541 -8.629 1.00 53.41 H new ATOM 0 HA VAL A 138 1.600 -39.727 -11.084 1.00 15.53 H new ATOM 0 HB VAL A 138 3.401 -38.397 -12.051 1.00 13.01 H new ATOM 0 HG11 VAL A 138 5.715 -38.568 -11.233 1.00 11.43 H new ATOM 0 HG12 VAL A 138 4.628 -37.882 -10.003 1.00 11.43 H new ATOM 0 HG13 VAL A 138 5.158 -39.576 -9.877 1.00 11.43 H new ATOM 0 HG21 VAL A 138 4.863 -40.195 -12.885 1.00 50.50 H new ATOM 0 HG22 VAL A 138 4.268 -41.270 -11.597 1.00 50.50 H new ATOM 0 HG23 VAL A 138 3.154 -40.692 -12.858 1.00 50.50 H new ATOM 805 N ARG A 139 2.075 -41.839 -9.873 1.00 35.25 N ATOM 806 CA ARG A 139 2.283 -43.079 -9.135 1.00 31.31 C ATOM 807 C ARG A 139 2.218 -42.834 -7.630 1.00 33.22 C ATOM 808 O ARG A 139 3.229 -42.861 -6.929 1.00 64.02 O ATOM 809 CB ARG A 139 3.632 -43.697 -9.505 1.00 30.13 C ATOM 810 CG ARG A 139 3.550 -44.703 -10.642 1.00 20.12 C ATOM 811 CD ARG A 139 4.901 -44.895 -11.314 1.00 14.14 C ATOM 812 NE ARG A 139 5.257 -46.306 -11.433 1.00 54.24 N ATOM 813 CZ ARG A 139 5.721 -47.035 -10.424 1.00 72.02 C ATOM 814 NH1 ARG A 139 5.884 -46.488 -9.227 1.00 5.33 N1+ ATOM 815 NH2 ARG A 139 6.023 -48.313 -10.612 1.00 4.43 N ATOM 0 H ARG A 139 1.340 -41.886 -10.579 1.00 35.25 H new ATOM 0 HA ARG A 139 1.487 -43.772 -9.407 1.00 31.31 H new ATOM 0 HB2 ARG A 139 4.322 -42.901 -9.785 1.00 30.13 H new ATOM 0 HB3 ARG A 139 4.050 -44.188 -8.626 1.00 30.13 H new ATOM 0 HG2 ARG A 139 3.194 -45.659 -10.258 1.00 20.12 H new ATOM 0 HG3 ARG A 139 2.821 -44.363 -11.378 1.00 20.12 H new ATOM 0 HD2 ARG A 139 4.881 -44.441 -12.305 1.00 14.14 H new ATOM 0 HD3 ARG A 139 5.668 -44.375 -10.741 1.00 14.14 H new ATOM 0 HE ARG A 139 5.143 -46.757 -12.341 1.00 54.24 H new ATOM 0 HH11 ARG A 139 5.653 -45.506 -9.079 1.00 5.33 H new ATOM 0 HH12 ARG A 139 6.240 -47.050 -8.454 1.00 5.33 H new ATOM 0 HH21 ARG A 139 5.899 -48.736 -11.532 1.00 4.43 H new ATOM 0 HH22 ARG A 139 6.379 -48.872 -9.837 1.00 4.43 H new ATOM 829 N PRO A 140 1.001 -42.589 -7.122 1.00 72.14 N ATOM 830 CA PRO A 140 0.776 -42.334 -5.696 1.00 14.50 C ATOM 831 C PRO A 140 0.988 -43.581 -4.844 1.00 3.15 C ATOM 832 O PRO A 140 0.488 -44.658 -5.167 1.00 52.42 O ATOM 833 CB PRO A 140 -0.689 -41.892 -5.642 1.00 25.24 C ATOM 834 CG PRO A 140 -1.316 -42.513 -6.842 1.00 34.04 C ATOM 835 CD PRO A 140 -0.248 -42.541 -7.900 1.00 45.02 C ATOM 0 HA PRO A 140 1.473 -41.596 -5.298 1.00 14.50 H new ATOM 0 HB2 PRO A 140 -1.171 -42.229 -4.724 1.00 25.24 H new ATOM 0 HB3 PRO A 140 -0.776 -40.806 -5.667 1.00 25.24 H new ATOM 0 HG2 PRO A 140 -1.672 -43.519 -6.620 1.00 34.04 H new ATOM 0 HG3 PRO A 140 -2.179 -41.936 -7.174 1.00 34.04 H new ATOM 0 HD2 PRO A 140 -0.350 -43.409 -8.551 1.00 45.02 H new ATOM 0 HD3 PRO A 140 -0.291 -41.658 -8.538 1.00 45.02 H new ATOM 843 N VAL A 141 1.733 -43.427 -3.753 1.00 14.24 N ATOM 844 CA VAL A 141 2.010 -44.540 -2.854 1.00 40.14 C ATOM 845 C VAL A 141 1.624 -44.196 -1.419 1.00 51.04 C ATOM 846 O VAL A 141 1.118 -45.043 -0.682 1.00 50.42 O ATOM 847 CB VAL A 141 3.498 -44.936 -2.893 1.00 61.41 C ATOM 848 CG1 VAL A 141 4.378 -43.737 -2.575 1.00 4.11 C ATOM 849 CG2 VAL A 141 3.770 -46.079 -1.926 1.00 2.25 C ATOM 0 H VAL A 141 2.155 -42.542 -3.471 1.00 14.24 H new ATOM 0 HA VAL A 141 1.409 -45.382 -3.197 1.00 40.14 H new ATOM 0 HB VAL A 141 3.740 -45.277 -3.900 1.00 61.41 H new ATOM 0 HG11 VAL A 141 5.426 -44.036 -2.607 1.00 4.11 H new ATOM 0 HG12 VAL A 141 4.202 -42.951 -3.310 1.00 4.11 H new ATOM 0 HG13 VAL A 141 4.138 -43.363 -1.580 1.00 4.11 H new ATOM 0 HG21 VAL A 141 4.826 -46.346 -1.966 1.00 2.25 H new ATOM 0 HG22 VAL A 141 3.513 -45.768 -0.913 1.00 2.25 H new ATOM 0 HG23 VAL A 141 3.166 -46.943 -2.205 1.00 2.25 H new ATOM 859 N ARG A 142 1.866 -42.949 -1.030 1.00 71.04 N ATOM 860 CA ARG A 142 1.545 -42.493 0.317 1.00 53.24 C ATOM 861 C ARG A 142 0.686 -41.232 0.274 1.00 4.13 C ATOM 862 O ARG A 142 0.308 -40.763 -0.800 1.00 5.33 O ATOM 863 CB ARG A 142 2.827 -42.223 1.107 1.00 34.10 C ATOM 864 CG ARG A 142 3.670 -41.097 0.533 1.00 34.45 C ATOM 865 CD ARG A 142 5.015 -40.993 1.236 1.00 41.42 C ATOM 866 NE ARG A 142 5.731 -42.266 1.236 1.00 32.52 N ATOM 867 CZ ARG A 142 6.777 -42.520 2.015 1.00 43.31 C ATOM 868 NH1 ARG A 142 7.225 -41.594 2.852 1.00 73.12 N1+ ATOM 869 NH2 ARG A 142 7.376 -43.702 1.958 1.00 14.02 N ATOM 0 H ARG A 142 2.283 -42.236 -1.628 1.00 71.04 H new ATOM 0 HA ARG A 142 0.979 -43.281 0.815 1.00 53.24 H new ATOM 0 HB2 ARG A 142 2.565 -41.981 2.137 1.00 34.10 H new ATOM 0 HB3 ARG A 142 3.424 -43.134 1.136 1.00 34.10 H new ATOM 0 HG2 ARG A 142 3.827 -41.266 -0.532 1.00 34.45 H new ATOM 0 HG3 ARG A 142 3.133 -40.153 0.631 1.00 34.45 H new ATOM 0 HD2 ARG A 142 5.624 -40.234 0.744 1.00 41.42 H new ATOM 0 HD3 ARG A 142 4.863 -40.662 2.263 1.00 41.42 H new ATOM 0 HE ARG A 142 5.411 -43.000 0.604 1.00 32.52 H new ATOM 0 HH11 ARG A 142 6.766 -40.684 2.899 1.00 73.12 H new ATOM 0 HH12 ARG A 142 8.028 -41.792 3.449 1.00 73.12 H new ATOM 0 HH21 ARG A 142 7.034 -44.417 1.316 1.00 14.02 H new ATOM 0 HH22 ARG A 142 8.179 -43.896 2.556 1.00 14.02 H new ATOM 883 N ASP A 143 0.383 -40.689 1.447 1.00 41.32 N ATOM 884 CA ASP A 143 -0.431 -39.482 1.544 1.00 33.40 C ATOM 885 C ASP A 143 0.130 -38.377 0.655 1.00 60.23 C ATOM 886 O ASP A 143 1.331 -38.103 0.669 1.00 42.31 O ATOM 887 CB ASP A 143 -0.499 -39.003 2.995 1.00 30.13 C ATOM 888 CG ASP A 143 -1.418 -39.858 3.845 1.00 23.42 C ATOM 889 OD1 ASP A 143 -1.571 -41.057 3.532 1.00 65.31 O ATOM 890 OD2 ASP A 143 -1.983 -39.328 4.824 1.00 1.43 O1- ATOM 0 H ASP A 143 0.688 -41.065 2.345 1.00 41.32 H new ATOM 0 HA ASP A 143 -1.438 -39.722 1.202 1.00 33.40 H new ATOM 0 HB2 ASP A 143 0.503 -39.013 3.425 1.00 30.13 H new ATOM 0 HB3 ASP A 143 -0.845 -37.970 3.017 1.00 30.13 H new ATOM 895 N THR A 144 -0.747 -37.744 -0.118 1.00 33.51 N ATOM 896 CA THR A 144 -0.339 -36.670 -1.015 1.00 12.22 C ATOM 897 C THR A 144 -1.111 -35.388 -0.724 1.00 32.31 C ATOM 898 O THR A 144 -1.549 -34.693 -1.642 1.00 31.31 O ATOM 899 CB THR A 144 -0.550 -37.059 -2.490 1.00 3.12 C ATOM 900 OG1 THR A 144 -0.067 -36.018 -3.346 1.00 2.12 O ATOM 901 CG2 THR A 144 -2.022 -37.316 -2.777 1.00 34.45 C ATOM 0 H THR A 144 -1.744 -37.957 -0.141 1.00 33.51 H new ATOM 0 HA THR A 144 0.723 -36.499 -0.841 1.00 12.22 H new ATOM 0 HB THR A 144 0.007 -37.976 -2.684 1.00 3.12 H new ATOM 0 HG1 THR A 144 0.246 -36.407 -4.189 1.00 2.12 H new ATOM 0 HG21 THR A 144 -2.146 -37.589 -3.825 1.00 34.45 H new ATOM 0 HG22 THR A 144 -2.379 -38.129 -2.145 1.00 34.45 H new ATOM 0 HG23 THR A 144 -2.597 -36.414 -2.567 1.00 34.45 H new ATOM 909 N LEU A 145 -1.274 -35.079 0.558 1.00 25.21 N ATOM 910 CA LEU A 145 -1.994 -33.879 0.970 1.00 41.45 C ATOM 911 C LEU A 145 -1.063 -32.671 1.002 1.00 44.04 C ATOM 912 O LEU A 145 -1.514 -31.530 1.118 1.00 41.05 O ATOM 913 CB LEU A 145 -2.626 -34.087 2.347 1.00 72.14 C ATOM 914 CG LEU A 145 -4.035 -34.681 2.357 1.00 12.03 C ATOM 915 CD1 LEU A 145 -5.011 -33.751 1.654 1.00 10.12 C ATOM 916 CD2 LEU A 145 -4.039 -36.055 1.702 1.00 72.53 C ATOM 0 H LEU A 145 -0.917 -35.643 1.330 1.00 25.21 H new ATOM 0 HA LEU A 145 -2.782 -33.689 0.241 1.00 41.45 H new ATOM 0 HB2 LEU A 145 -1.974 -34.739 2.929 1.00 72.14 H new ATOM 0 HB3 LEU A 145 -2.655 -33.126 2.860 1.00 72.14 H new ATOM 0 HG LEU A 145 -4.354 -34.793 3.393 1.00 12.03 H new ATOM 0 HD11 LEU A 145 -6.008 -34.190 1.671 1.00 10.12 H new ATOM 0 HD12 LEU A 145 -5.029 -32.789 2.166 1.00 10.12 H new ATOM 0 HD13 LEU A 145 -4.696 -33.606 0.621 1.00 10.12 H new ATOM 0 HD21 LEU A 145 -5.050 -36.463 1.718 1.00 72.53 H new ATOM 0 HD22 LEU A 145 -3.699 -35.967 0.670 1.00 72.53 H new ATOM 0 HD23 LEU A 145 -3.371 -36.720 2.248 1.00 72.53 H new ATOM 928 N HIS A 146 0.236 -32.928 0.897 1.00 33.21 N ATOM 929 CA HIS A 146 1.231 -31.861 0.911 1.00 1.43 C ATOM 930 C HIS A 146 1.201 -31.073 -0.395 1.00 63.11 C ATOM 931 O HIS A 146 1.856 -30.038 -0.523 1.00 22.21 O ATOM 932 CB HIS A 146 2.627 -32.439 1.139 1.00 72.35 C ATOM 933 CG HIS A 146 2.951 -33.595 0.243 1.00 0.24 C ATOM 934 ND1 HIS A 146 2.324 -33.808 -0.967 1.00 1.44 N ATOM 935 CD2 HIS A 146 3.842 -34.604 0.386 1.00 32.41 C ATOM 936 CE1 HIS A 146 2.815 -34.898 -1.529 1.00 40.02 C ATOM 937 NE2 HIS A 146 3.738 -35.400 -0.728 1.00 53.34 N ATOM 0 H HIS A 146 0.625 -33.866 0.801 1.00 33.21 H new ATOM 0 HA HIS A 146 0.989 -31.183 1.730 1.00 1.43 H new ATOM 0 HB2 HIS A 146 3.366 -31.653 0.985 1.00 72.35 H new ATOM 0 HB3 HIS A 146 2.713 -32.759 2.177 1.00 72.35 H new ATOM 0 HD2 HIS A 146 4.510 -34.755 1.221 1.00 32.41 H new ATOM 0 HE1 HIS A 146 2.513 -35.309 -2.481 1.00 40.02 H new ATOM 0 HE2 HIS A 146 4.285 -36.242 -0.908 1.00 53.34 H new ATOM 945 N LEU A 147 0.437 -31.570 -1.362 1.00 3.03 N ATOM 946 CA LEU A 147 0.322 -30.913 -2.660 1.00 14.44 C ATOM 947 C LEU A 147 -0.220 -29.495 -2.506 1.00 54.12 C ATOM 948 O LEU A 147 0.115 -28.605 -3.287 1.00 62.14 O ATOM 949 CB LEU A 147 -0.588 -31.722 -3.584 1.00 15.31 C ATOM 950 CG LEU A 147 -0.083 -33.111 -3.976 1.00 63.33 C ATOM 951 CD1 LEU A 147 -1.032 -33.763 -4.970 1.00 5.30 C ATOM 952 CD2 LEU A 147 1.321 -33.024 -4.555 1.00 24.23 C ATOM 0 H LEU A 147 -0.112 -32.425 -1.272 1.00 3.03 H new ATOM 0 HA LEU A 147 1.317 -30.856 -3.101 1.00 14.44 H new ATOM 0 HB2 LEU A 147 -1.558 -31.834 -3.099 1.00 15.31 H new ATOM 0 HB3 LEU A 147 -0.751 -31.146 -4.495 1.00 15.31 H new ATOM 0 HG LEU A 147 -0.047 -33.730 -3.080 1.00 63.33 H new ATOM 0 HD11 LEU A 147 -0.656 -34.751 -5.238 1.00 5.30 H new ATOM 0 HD12 LEU A 147 -2.020 -33.860 -4.520 1.00 5.30 H new ATOM 0 HD13 LEU A 147 -1.101 -33.146 -5.866 1.00 5.30 H new ATOM 0 HD21 LEU A 147 1.664 -34.022 -4.828 1.00 24.23 H new ATOM 0 HD22 LEU A 147 1.311 -32.389 -5.441 1.00 24.23 H new ATOM 0 HD23 LEU A 147 1.996 -32.599 -3.812 1.00 24.23 H new ATOM 964 N GLU A 148 -1.057 -29.294 -1.493 1.00 71.13 N ATOM 965 CA GLU A 148 -1.644 -27.984 -1.237 1.00 1.45 C ATOM 966 C GLU A 148 -1.333 -27.516 0.181 1.00 64.53 C ATOM 967 O GLU A 148 -1.451 -28.281 1.138 1.00 52.44 O ATOM 968 CB GLU A 148 -3.159 -28.029 -1.451 1.00 74.44 C ATOM 969 CG GLU A 148 -3.872 -29.019 -0.546 1.00 61.21 C ATOM 970 CD GLU A 148 -4.264 -28.414 0.788 1.00 71.04 C ATOM 971 OE1 GLU A 148 -4.735 -27.258 0.800 1.00 61.21 O1- ATOM 972 OE2 GLU A 148 -4.098 -29.097 1.820 1.00 15.42 O ATOM 0 H GLU A 148 -1.344 -30.021 -0.837 1.00 71.13 H new ATOM 0 HA GLU A 148 -1.206 -27.274 -1.939 1.00 1.45 H new ATOM 0 HB2 GLU A 148 -3.571 -27.034 -1.283 1.00 74.44 H new ATOM 0 HB3 GLU A 148 -3.363 -28.287 -2.490 1.00 74.44 H new ATOM 0 HG2 GLU A 148 -4.766 -29.388 -1.050 1.00 61.21 H new ATOM 0 HG3 GLU A 148 -3.225 -29.879 -0.374 1.00 61.21 H new ATOM 979 N GLY A 149 -0.935 -26.254 0.308 1.00 54.43 N ATOM 980 CA GLY A 149 -0.612 -25.706 1.613 1.00 25.32 C ATOM 981 C GLY A 149 0.861 -25.830 1.945 1.00 34.35 C ATOM 982 O GLY A 149 1.298 -25.430 3.025 1.00 65.23 O ATOM 0 H GLY A 149 -0.830 -25.601 -0.469 1.00 54.43 H new ATOM 0 HA2 GLY A 149 -0.901 -24.656 1.644 1.00 25.32 H new ATOM 0 HA3 GLY A 149 -1.198 -26.221 2.375 1.00 25.32 H new ATOM 986 N LYS A 150 1.631 -26.387 1.017 1.00 70.04 N ATOM 987 CA LYS A 150 3.065 -26.564 1.215 1.00 31.31 C ATOM 988 C LYS A 150 3.782 -25.218 1.231 1.00 54.12 C ATOM 989 O LYS A 150 3.619 -24.408 0.319 1.00 22.52 O ATOM 990 CB LYS A 150 3.647 -27.452 0.114 1.00 50.15 C ATOM 991 CG LYS A 150 5.158 -27.354 -0.011 1.00 10.22 C ATOM 992 CD LYS A 150 5.565 -26.454 -1.166 1.00 65.53 C ATOM 993 CE LYS A 150 6.370 -27.214 -2.208 1.00 15.14 C ATOM 994 NZ LYS A 150 5.647 -28.420 -2.697 1.00 42.30 N1+ ATOM 0 H LYS A 150 1.285 -26.724 0.119 1.00 70.04 H new ATOM 0 HA LYS A 150 3.216 -27.047 2.180 1.00 31.31 H new ATOM 0 HB2 LYS A 150 3.374 -28.488 0.312 1.00 50.15 H new ATOM 0 HB3 LYS A 150 3.193 -27.179 -0.839 1.00 50.15 H new ATOM 0 HG2 LYS A 150 5.576 -26.967 0.918 1.00 10.22 H new ATOM 0 HG3 LYS A 150 5.577 -28.349 -0.159 1.00 10.22 H new ATOM 0 HD2 LYS A 150 4.674 -26.031 -1.630 1.00 65.53 H new ATOM 0 HD3 LYS A 150 6.154 -25.619 -0.788 1.00 65.53 H new ATOM 0 HE2 LYS A 150 6.588 -26.556 -3.049 1.00 15.14 H new ATOM 0 HE3 LYS A 150 7.327 -27.513 -1.780 1.00 15.14 H new ATOM 0 HZ1 LYS A 150 5.935 -28.624 -3.675 1.00 42.30 H new ATOM 0 HZ2 LYS A 150 5.878 -29.233 -2.091 1.00 42.30 H new ATOM 0 HZ3 LYS A 150 4.622 -28.246 -2.667 1.00 42.30 H new ATOM 1008 N GLU A 151 4.576 -24.988 2.272 1.00 41.22 N ATOM 1009 CA GLU A 151 5.318 -23.740 2.404 1.00 55.31 C ATOM 1010 C GLU A 151 6.813 -23.971 2.199 1.00 33.43 C ATOM 1011 O GLU A 151 7.556 -24.191 3.156 1.00 74.30 O ATOM 1012 CB GLU A 151 5.072 -23.117 3.779 1.00 5.22 C ATOM 1013 CG GLU A 151 3.602 -22.890 4.090 1.00 51.44 C ATOM 1014 CD GLU A 151 3.323 -22.827 5.579 1.00 14.32 C ATOM 1015 OE1 GLU A 151 4.276 -22.586 6.351 1.00 24.15 O ATOM 1016 OE2 GLU A 151 2.154 -23.018 5.974 1.00 1.24 O1- ATOM 0 H GLU A 151 4.722 -25.649 3.035 1.00 41.22 H new ATOM 0 HA GLU A 151 4.964 -23.055 1.634 1.00 55.31 H new ATOM 0 HB2 GLU A 151 5.501 -23.764 4.544 1.00 5.22 H new ATOM 0 HB3 GLU A 151 5.598 -22.164 3.836 1.00 5.22 H new ATOM 0 HG2 GLU A 151 3.275 -21.961 3.623 1.00 51.44 H new ATOM 0 HG3 GLU A 151 3.013 -23.693 3.648 1.00 51.44 H new ATOM 1023 N LEU A 152 7.246 -23.920 0.944 1.00 4.40 N ATOM 1024 CA LEU A 152 8.652 -24.124 0.612 1.00 14.53 C ATOM 1025 C LEU A 152 9.105 -23.144 -0.465 1.00 1.52 C ATOM 1026 O LEU A 152 8.283 -22.497 -1.114 1.00 22.54 O ATOM 1027 CB LEU A 152 8.881 -25.561 0.138 1.00 72.43 C ATOM 1028 CG LEU A 152 9.774 -26.427 1.027 1.00 52.41 C ATOM 1029 CD1 LEU A 152 11.133 -25.770 1.219 1.00 52.35 C ATOM 1030 CD2 LEU A 152 9.107 -26.677 2.371 1.00 3.13 C ATOM 0 H LEU A 152 6.644 -23.739 0.140 1.00 4.40 H new ATOM 0 HA LEU A 152 9.242 -23.945 1.511 1.00 14.53 H new ATOM 0 HB2 LEU A 152 7.911 -26.050 0.045 1.00 72.43 H new ATOM 0 HB3 LEU A 152 9.319 -25.528 -0.860 1.00 72.43 H new ATOM 0 HG LEU A 152 9.923 -27.387 0.534 1.00 52.41 H new ATOM 0 HD11 LEU A 152 11.755 -26.400 1.854 1.00 52.35 H new ATOM 0 HD12 LEU A 152 11.616 -25.643 0.250 1.00 52.35 H new ATOM 0 HD13 LEU A 152 11.003 -24.796 1.690 1.00 52.35 H new ATOM 0 HD21 LEU A 152 9.757 -27.295 2.990 1.00 3.13 H new ATOM 0 HD22 LEU A 152 8.927 -25.725 2.871 1.00 3.13 H new ATOM 0 HD23 LEU A 152 8.158 -27.190 2.216 1.00 3.13 H new ATOM 1042 N GLU A 153 10.418 -23.040 -0.650 1.00 64.45 N ATOM 1043 CA GLU A 153 10.979 -22.139 -1.649 1.00 72.24 C ATOM 1044 C GLU A 153 10.950 -22.777 -3.035 1.00 52.22 C ATOM 1045 O GLU A 153 10.602 -23.949 -3.184 1.00 74.32 O ATOM 1046 CB GLU A 153 12.415 -21.762 -1.279 1.00 65.41 C ATOM 1047 CG GLU A 153 13.360 -22.950 -1.218 1.00 32.34 C ATOM 1048 CD GLU A 153 14.646 -22.636 -0.479 1.00 54.31 C ATOM 1049 OE1 GLU A 153 14.855 -21.456 -0.127 1.00 12.13 O1- ATOM 1050 OE2 GLU A 153 15.443 -23.570 -0.253 1.00 31.43 O ATOM 0 H GLU A 153 11.112 -23.568 -0.121 1.00 64.45 H new ATOM 0 HA GLU A 153 10.368 -21.237 -1.671 1.00 72.24 H new ATOM 0 HB2 GLU A 153 12.793 -21.045 -2.008 1.00 65.41 H new ATOM 0 HB3 GLU A 153 12.412 -21.261 -0.311 1.00 65.41 H new ATOM 0 HG2 GLU A 153 12.858 -23.784 -0.727 1.00 32.34 H new ATOM 0 HG3 GLU A 153 13.598 -23.273 -2.232 1.00 32.34 H new ATOM 1057 N PHE A 154 11.318 -21.998 -4.047 1.00 71.32 N ATOM 1058 CA PHE A 154 11.333 -22.486 -5.421 1.00 73.31 C ATOM 1059 C PHE A 154 12.632 -22.098 -6.121 1.00 21.25 C ATOM 1060 O PHE A 154 13.507 -21.468 -5.527 1.00 32.42 O ATOM 1061 CB PHE A 154 10.137 -21.929 -6.196 1.00 71.02 C ATOM 1062 CG PHE A 154 8.821 -22.154 -5.509 1.00 21.14 C ATOM 1063 CD1 PHE A 154 8.395 -21.303 -4.502 1.00 72.32 C ATOM 1064 CD2 PHE A 154 8.009 -23.218 -5.869 1.00 33.11 C ATOM 1065 CE1 PHE A 154 7.184 -21.507 -3.868 1.00 33.30 C ATOM 1066 CE2 PHE A 154 6.797 -23.426 -5.239 1.00 3.41 C ATOM 1067 CZ PHE A 154 6.384 -22.571 -4.237 1.00 31.11 C ATOM 0 H PHE A 154 11.610 -21.026 -3.941 1.00 71.32 H new ATOM 0 HA PHE A 154 11.265 -23.574 -5.395 1.00 73.31 H new ATOM 0 HB2 PHE A 154 10.280 -20.859 -6.349 1.00 71.02 H new ATOM 0 HB3 PHE A 154 10.106 -22.391 -7.183 1.00 71.02 H new ATOM 0 HD1 PHE A 154 9.017 -20.470 -4.209 1.00 72.32 H new ATOM 0 HD2 PHE A 154 8.327 -23.892 -6.651 1.00 33.11 H new ATOM 0 HE1 PHE A 154 6.864 -20.836 -3.085 1.00 33.30 H new ATOM 0 HE2 PHE A 154 6.173 -24.258 -5.531 1.00 3.41 H new ATOM 0 HZ PHE A 154 5.438 -22.734 -3.743 1.00 31.11 H new ATOM 1077 N LYS A 155 12.751 -22.481 -7.388 1.00 14.10 N ATOM 1078 CA LYS A 155 13.942 -22.174 -8.172 1.00 52.02 C ATOM 1079 C LYS A 155 13.565 -21.571 -9.521 1.00 34.24 C ATOM 1080 O LYS A 155 13.055 -22.264 -10.402 1.00 74.34 O ATOM 1081 CB LYS A 155 14.779 -23.438 -8.382 1.00 22.41 C ATOM 1082 CG LYS A 155 16.270 -23.170 -8.488 1.00 33.03 C ATOM 1083 CD LYS A 155 17.050 -24.449 -8.741 1.00 61.52 C ATOM 1084 CE LYS A 155 16.976 -24.867 -10.201 1.00 44.24 C ATOM 1085 NZ LYS A 155 17.238 -26.323 -10.375 1.00 21.03 N1+ ATOM 0 H LYS A 155 12.037 -23.005 -7.894 1.00 14.10 H new ATOM 0 HA LYS A 155 14.532 -21.443 -7.619 1.00 52.02 H new ATOM 0 HB2 LYS A 155 14.600 -24.124 -7.554 1.00 22.41 H new ATOM 0 HB3 LYS A 155 14.443 -23.939 -9.290 1.00 22.41 H new ATOM 0 HG2 LYS A 155 16.457 -22.463 -9.296 1.00 33.03 H new ATOM 0 HG3 LYS A 155 16.623 -22.703 -7.568 1.00 33.03 H new ATOM 0 HD2 LYS A 155 18.092 -24.304 -8.455 1.00 61.52 H new ATOM 0 HD3 LYS A 155 16.656 -25.247 -8.112 1.00 61.52 H new ATOM 0 HE2 LYS A 155 15.990 -24.625 -10.598 1.00 44.24 H new ATOM 0 HE3 LYS A 155 17.702 -24.296 -10.780 1.00 44.24 H new ATOM 0 HZ1 LYS A 155 17.178 -26.568 -11.384 1.00 21.03 H new ATOM 0 HZ2 LYS A 155 18.189 -26.550 -10.019 1.00 21.03 H new ATOM 0 HZ3 LYS A 155 16.530 -26.869 -9.844 1.00 21.03 H new ATOM 1099 N VAL A 156 13.820 -20.276 -9.677 1.00 14.23 N ATOM 1100 CA VAL A 156 13.510 -19.580 -10.920 1.00 74.32 C ATOM 1101 C VAL A 156 14.442 -20.019 -12.044 1.00 51.23 C ATOM 1102 O VAL A 156 15.664 -19.976 -11.902 1.00 60.42 O ATOM 1103 CB VAL A 156 13.613 -18.053 -10.750 1.00 20.45 C ATOM 1104 CG1 VAL A 156 13.107 -17.340 -11.995 1.00 14.03 C ATOM 1105 CG2 VAL A 156 12.845 -17.601 -9.517 1.00 31.34 C ATOM 0 H VAL A 156 14.241 -19.688 -8.958 1.00 14.23 H new ATOM 0 HA VAL A 156 12.484 -19.841 -11.180 1.00 74.32 H new ATOM 0 HB VAL A 156 14.662 -17.791 -10.613 1.00 20.45 H new ATOM 0 HG11 VAL A 156 13.188 -16.262 -11.855 1.00 14.03 H new ATOM 0 HG12 VAL A 156 13.706 -17.640 -12.855 1.00 14.03 H new ATOM 0 HG13 VAL A 156 12.064 -17.606 -12.168 1.00 14.03 H new ATOM 0 HG21 VAL A 156 12.929 -16.519 -9.412 1.00 31.34 H new ATOM 0 HG22 VAL A 156 11.795 -17.875 -9.621 1.00 31.34 H new ATOM 0 HG23 VAL A 156 13.260 -18.084 -8.632 1.00 31.34 H new ATOM 1115 N ILE A 157 13.857 -20.442 -13.160 1.00 64.23 N ATOM 1116 CA ILE A 157 14.635 -20.887 -14.308 1.00 1.32 C ATOM 1117 C ILE A 157 14.355 -20.022 -15.532 1.00 51.51 C ATOM 1118 O ILE A 157 15.223 -19.831 -16.384 1.00 50.24 O ATOM 1119 CB ILE A 157 14.337 -22.358 -14.654 1.00 71.04 C ATOM 1120 CG1 ILE A 157 15.324 -22.868 -15.706 1.00 51.24 C ATOM 1121 CG2 ILE A 157 12.905 -22.506 -15.147 1.00 54.14 C ATOM 1122 CD1 ILE A 157 16.738 -23.011 -15.189 1.00 30.43 C ATOM 0 H ILE A 157 12.847 -20.486 -13.293 1.00 64.23 H new ATOM 0 HA ILE A 157 15.685 -20.792 -14.032 1.00 1.32 H new ATOM 0 HB ILE A 157 14.454 -22.959 -13.752 1.00 71.04 H new ATOM 0 HG12 ILE A 157 14.981 -23.835 -16.075 1.00 51.24 H new ATOM 0 HG13 ILE A 157 15.324 -22.184 -16.555 1.00 51.24 H new ATOM 0 HG21 ILE A 157 12.709 -23.551 -15.388 1.00 54.14 H new ATOM 0 HG22 ILE A 157 12.216 -22.178 -14.368 1.00 54.14 H new ATOM 0 HG23 ILE A 157 12.762 -21.895 -16.039 1.00 54.14 H new ATOM 0 HD11 ILE A 157 17.382 -23.377 -15.988 1.00 30.43 H new ATOM 0 HD12 ILE A 157 17.100 -22.042 -14.846 1.00 30.43 H new ATOM 0 HD13 ILE A 157 16.752 -23.718 -14.359 1.00 30.43 H new ATOM 1134 N LYS A 158 13.136 -19.499 -15.613 1.00 11.20 N ATOM 1135 CA LYS A 158 12.740 -18.650 -16.730 1.00 74.04 C ATOM 1136 C LYS A 158 11.371 -18.025 -16.480 1.00 3.31 C ATOM 1137 O LYS A 158 10.429 -18.708 -16.077 1.00 5.10 O ATOM 1138 CB LYS A 158 12.711 -19.461 -18.028 1.00 24.24 C ATOM 1139 CG LYS A 158 12.860 -18.612 -19.279 1.00 25.34 C ATOM 1140 CD LYS A 158 12.429 -19.371 -20.523 1.00 75.32 C ATOM 1141 CE LYS A 158 13.588 -20.144 -21.134 1.00 1.33 C ATOM 1142 NZ LYS A 158 13.212 -20.774 -22.429 1.00 35.23 N1+ ATOM 0 H LYS A 158 12.405 -19.649 -14.918 1.00 11.20 H new ATOM 0 HA LYS A 158 13.474 -17.850 -16.824 1.00 74.04 H new ATOM 0 HB2 LYS A 158 13.512 -20.200 -18.003 1.00 24.24 H new ATOM 0 HB3 LYS A 158 11.772 -20.011 -18.082 1.00 24.24 H new ATOM 0 HG2 LYS A 158 12.262 -17.707 -19.179 1.00 25.34 H new ATOM 0 HG3 LYS A 158 13.898 -18.298 -19.385 1.00 25.34 H new ATOM 0 HD2 LYS A 158 11.624 -20.061 -20.269 1.00 75.32 H new ATOM 0 HD3 LYS A 158 12.030 -18.671 -21.257 1.00 75.32 H new ATOM 0 HE2 LYS A 158 14.432 -19.472 -21.289 1.00 1.33 H new ATOM 0 HE3 LYS A 158 13.918 -20.915 -20.437 1.00 1.33 H new ATOM 0 HZ1 LYS A 158 14.028 -21.291 -22.813 1.00 35.23 H new ATOM 0 HZ2 LYS A 158 12.423 -21.435 -22.278 1.00 35.23 H new ATOM 0 HZ3 LYS A 158 12.921 -20.037 -23.102 1.00 35.23 H new ATOM 1156 N LEU A 159 11.268 -16.722 -16.722 1.00 22.41 N ATOM 1157 CA LEU A 159 10.014 -16.004 -16.524 1.00 43.12 C ATOM 1158 C LEU A 159 9.403 -15.597 -17.861 1.00 63.43 C ATOM 1159 O LEU A 159 10.119 -15.326 -18.825 1.00 65.04 O ATOM 1160 CB LEU A 159 10.244 -14.765 -15.657 1.00 4.42 C ATOM 1161 CG LEU A 159 11.280 -13.767 -16.174 1.00 11.11 C ATOM 1162 CD1 LEU A 159 10.928 -12.355 -15.733 1.00 0.52 C ATOM 1163 CD2 LEU A 159 12.673 -14.147 -15.692 1.00 43.35 C ATOM 0 H LEU A 159 12.038 -16.142 -17.055 1.00 22.41 H new ATOM 0 HA LEU A 159 9.318 -16.671 -16.015 1.00 43.12 H new ATOM 0 HB2 LEU A 159 9.293 -14.245 -15.543 1.00 4.42 H new ATOM 0 HB3 LEU A 159 10.549 -15.093 -14.663 1.00 4.42 H new ATOM 0 HG LEU A 159 11.273 -13.797 -17.264 1.00 11.11 H new ATOM 0 HD11 LEU A 159 11.677 -11.659 -16.110 1.00 0.52 H new ATOM 0 HD12 LEU A 159 9.949 -12.084 -16.128 1.00 0.52 H new ATOM 0 HD13 LEU A 159 10.906 -12.309 -14.644 1.00 0.52 H new ATOM 0 HD21 LEU A 159 13.398 -13.426 -16.069 1.00 43.35 H new ATOM 0 HD22 LEU A 159 12.694 -14.146 -14.602 1.00 43.35 H new ATOM 0 HD23 LEU A 159 12.926 -15.142 -16.059 1.00 43.35 H new ATOM 1175 N ASP A 160 8.076 -15.554 -17.910 1.00 63.41 N ATOM 1176 CA ASP A 160 7.368 -15.176 -19.128 1.00 74.52 C ATOM 1177 C ASP A 160 6.681 -13.824 -18.960 1.00 55.45 C ATOM 1178 O ASP A 160 5.524 -13.753 -18.546 1.00 12.23 O ATOM 1179 CB ASP A 160 6.337 -16.244 -19.496 1.00 1.44 C ATOM 1180 CG ASP A 160 6.946 -17.392 -20.276 1.00 35.14 C ATOM 1181 OD1 ASP A 160 7.989 -17.921 -19.838 1.00 20.24 O ATOM 1182 OD2 ASP A 160 6.379 -17.762 -21.326 1.00 74.23 O1- ATOM 0 H ASP A 160 7.469 -15.776 -17.121 1.00 63.41 H new ATOM 0 HA ASP A 160 8.098 -15.094 -19.933 1.00 74.52 H new ATOM 0 HB2 ASP A 160 5.878 -16.630 -18.586 1.00 1.44 H new ATOM 0 HB3 ASP A 160 5.542 -15.789 -20.086 1.00 1.44 H new ATOM 1187 N GLN A 161 7.402 -12.756 -19.283 1.00 71.33 N ATOM 1188 CA GLN A 161 6.861 -11.406 -19.165 1.00 43.43 C ATOM 1189 C GLN A 161 5.744 -11.178 -20.178 1.00 43.02 C ATOM 1190 O GLN A 161 4.888 -10.312 -19.990 1.00 33.42 O ATOM 1191 CB GLN A 161 7.969 -10.371 -19.368 1.00 3.00 C ATOM 1192 CG GLN A 161 8.966 -10.314 -18.222 1.00 42.43 C ATOM 1193 CD GLN A 161 8.418 -9.593 -17.007 1.00 42.32 C ATOM 1194 OE1 GLN A 161 7.804 -10.205 -16.132 1.00 31.54 O ATOM 1195 NE2 GLN A 161 8.637 -8.285 -16.945 1.00 21.10 N ATOM 0 H GLN A 161 8.361 -12.798 -19.628 1.00 71.33 H new ATOM 0 HA GLN A 161 6.447 -11.293 -18.163 1.00 43.43 H new ATOM 0 HB2 GLN A 161 8.502 -10.598 -20.291 1.00 3.00 H new ATOM 0 HB3 GLN A 161 7.517 -9.387 -19.495 1.00 3.00 H new ATOM 0 HG2 GLN A 161 9.249 -11.328 -17.941 1.00 42.43 H new ATOM 0 HG3 GLN A 161 9.873 -9.812 -18.559 1.00 42.43 H new ATOM 0 HE21 GLN A 161 9.151 -7.818 -17.692 1.00 21.10 H new ATOM 0 HE22 GLN A 161 8.292 -7.747 -16.150 1.00 21.10 H new ATOM 1204 N LYS A 162 5.757 -11.959 -21.252 1.00 74.31 N ATOM 1205 CA LYS A 162 4.744 -11.843 -22.295 1.00 0.03 C ATOM 1206 C LYS A 162 3.341 -11.896 -21.699 1.00 53.11 C ATOM 1207 O LYS A 162 2.465 -11.121 -22.082 1.00 52.53 O ATOM 1208 CB LYS A 162 4.915 -12.961 -23.326 1.00 22.24 C ATOM 1209 CG LYS A 162 5.829 -12.590 -24.481 1.00 53.23 C ATOM 1210 CD LYS A 162 7.276 -12.946 -24.183 1.00 14.41 C ATOM 1211 CE LYS A 162 8.011 -11.787 -23.527 1.00 61.10 C ATOM 1212 NZ LYS A 162 9.459 -11.782 -23.875 1.00 71.30 N1+ ATOM 0 H LYS A 162 6.458 -12.680 -21.424 1.00 74.31 H new ATOM 0 HA LYS A 162 4.874 -10.879 -22.788 1.00 0.03 H new ATOM 0 HB2 LYS A 162 5.314 -13.845 -22.828 1.00 22.24 H new ATOM 0 HB3 LYS A 162 3.936 -13.232 -23.721 1.00 22.24 H new ATOM 0 HG2 LYS A 162 5.504 -13.107 -25.384 1.00 53.23 H new ATOM 0 HG3 LYS A 162 5.750 -11.521 -24.680 1.00 53.23 H new ATOM 0 HD2 LYS A 162 7.310 -13.817 -23.529 1.00 14.41 H new ATOM 0 HD3 LYS A 162 7.782 -13.222 -25.108 1.00 14.41 H new ATOM 0 HE2 LYS A 162 7.559 -10.846 -23.840 1.00 61.10 H new ATOM 0 HE3 LYS A 162 7.898 -11.851 -22.445 1.00 61.10 H new ATOM 0 HZ1 LYS A 162 9.925 -10.978 -23.409 1.00 71.30 H new ATOM 0 HZ2 LYS A 162 9.896 -12.669 -23.554 1.00 71.30 H new ATOM 0 HZ3 LYS A 162 9.568 -11.696 -24.906 1.00 71.30 H new ATOM 1226 N ARG A 163 3.136 -12.814 -20.761 1.00 24.25 N ATOM 1227 CA ARG A 163 1.839 -12.967 -20.112 1.00 62.53 C ATOM 1228 C ARG A 163 1.828 -12.280 -18.750 1.00 54.45 C ATOM 1229 O ARG A 163 1.052 -12.643 -17.867 1.00 65.14 O ATOM 1230 CB ARG A 163 1.498 -14.449 -19.950 1.00 3.31 C ATOM 1231 CG ARG A 163 1.313 -15.180 -21.270 1.00 22.22 C ATOM 1232 CD ARG A 163 -0.013 -14.822 -21.924 1.00 13.20 C ATOM 1233 NE ARG A 163 -0.267 -15.622 -23.119 1.00 12.45 N ATOM 1234 CZ ARG A 163 -1.465 -15.747 -23.679 1.00 22.53 C ATOM 1235 NH1 ARG A 163 -2.513 -15.128 -23.154 1.00 24.04 N1+ ATOM 1236 NH2 ARG A 163 -1.616 -16.492 -24.766 1.00 20.22 N ATOM 0 H ARG A 163 3.851 -13.463 -20.433 1.00 24.25 H new ATOM 0 HA ARG A 163 1.087 -12.495 -20.744 1.00 62.53 H new ATOM 0 HB2 ARG A 163 2.292 -14.936 -19.383 1.00 3.31 H new ATOM 0 HB3 ARG A 163 0.584 -14.541 -19.363 1.00 3.31 H new ATOM 0 HG2 ARG A 163 2.132 -14.929 -21.944 1.00 22.22 H new ATOM 0 HG3 ARG A 163 1.358 -16.256 -21.101 1.00 22.22 H new ATOM 0 HD2 ARG A 163 -0.822 -14.971 -21.209 1.00 13.20 H new ATOM 0 HD3 ARG A 163 -0.013 -13.765 -22.189 1.00 13.20 H new ATOM 0 HE ARG A 163 0.519 -16.112 -23.547 1.00 12.45 H new ATOM 0 HH11 ARG A 163 -2.400 -14.554 -22.318 1.00 24.04 H new ATOM 0 HH12 ARG A 163 -3.432 -15.225 -23.586 1.00 24.04 H new ATOM 0 HH21 ARG A 163 -0.812 -16.970 -25.173 1.00 20.22 H new ATOM 0 HH22 ARG A 163 -2.536 -16.587 -25.195 1.00 20.22 H new ATOM 1250 N ASN A 164 2.695 -11.285 -18.587 1.00 34.44 N ATOM 1251 CA ASN A 164 2.785 -10.548 -17.332 1.00 31.41 C ATOM 1252 C ASN A 164 2.688 -11.492 -16.138 1.00 13.15 C ATOM 1253 O ASN A 164 2.068 -11.168 -15.126 1.00 31.11 O ATOM 1254 CB ASN A 164 1.679 -9.494 -17.255 1.00 35.43 C ATOM 1255 CG ASN A 164 0.296 -10.112 -17.171 1.00 23.04 C ATOM 1256 OD1 ASN A 164 -0.327 -10.326 -18.324 1.00 72.53 O flip ATOM 1257 ND2 ASN A 164 -0.204 -10.395 -16.083 1.00 42.42 N flip ATOM 0 H ASN A 164 3.345 -10.971 -19.308 1.00 34.44 H new ATOM 0 HA ASN A 164 3.754 -10.051 -17.301 1.00 31.41 H new ATOM 0 HB2 ASN A 164 1.844 -8.861 -16.383 1.00 35.43 H new ATOM 0 HB3 ASN A 164 1.733 -8.849 -18.132 1.00 35.43 H new ATOM 0 HD21 ASN A 164 0.312 -10.213 -15.222 1.00 42.42 H new ATOM 0 HD22 ASN A 164 -1.134 -10.812 -16.042 1.00 42.42 H new ATOM 1264 N ASN A 165 3.306 -12.662 -16.264 1.00 24.24 N ATOM 1265 CA ASN A 165 3.289 -13.655 -15.196 1.00 24.21 C ATOM 1266 C ASN A 165 4.627 -14.384 -15.110 1.00 75.13 C ATOM 1267 O ASN A 165 5.471 -14.261 -15.997 1.00 12.32 O ATOM 1268 CB ASN A 165 2.160 -14.662 -15.424 1.00 52.22 C ATOM 1269 CG ASN A 165 1.794 -15.416 -14.160 1.00 64.44 C ATOM 1270 OD1 ASN A 165 1.385 -14.819 -13.164 1.00 33.43 O ATOM 1271 ND2 ASN A 165 1.940 -16.735 -14.196 1.00 51.05 N ATOM 0 H ASN A 165 3.825 -12.946 -17.095 1.00 24.24 H new ATOM 0 HA ASN A 165 3.117 -13.135 -14.253 1.00 24.21 H new ATOM 0 HB2 ASN A 165 1.280 -14.139 -15.799 1.00 52.22 H new ATOM 0 HB3 ASN A 165 2.461 -15.373 -16.194 1.00 52.22 H new ATOM 0 HD21 ASN A 165 1.710 -17.296 -13.376 1.00 51.05 H new ATOM 0 HD22 ASN A 165 2.282 -17.187 -15.044 1.00 51.05 H new ATOM 1278 N VAL A 166 4.812 -15.144 -14.035 1.00 14.54 N ATOM 1279 CA VAL A 166 6.045 -15.895 -13.833 1.00 71.02 C ATOM 1280 C VAL A 166 5.753 -17.359 -13.526 1.00 3.03 C ATOM 1281 O VAL A 166 4.770 -17.681 -12.859 1.00 35.01 O ATOM 1282 CB VAL A 166 6.884 -15.299 -12.687 1.00 45.01 C ATOM 1283 CG1 VAL A 166 7.140 -13.819 -12.926 1.00 21.30 C ATOM 1284 CG2 VAL A 166 6.192 -15.519 -11.350 1.00 20.03 C ATOM 0 H VAL A 166 4.123 -15.256 -13.291 1.00 14.54 H new ATOM 0 HA VAL A 166 6.612 -15.828 -14.762 1.00 71.02 H new ATOM 0 HB VAL A 166 7.846 -15.810 -12.661 1.00 45.01 H new ATOM 0 HG11 VAL A 166 7.734 -13.415 -12.106 1.00 21.30 H new ATOM 0 HG12 VAL A 166 7.681 -13.690 -13.864 1.00 21.30 H new ATOM 0 HG13 VAL A 166 6.189 -13.289 -12.980 1.00 21.30 H new ATOM 0 HG21 VAL A 166 6.799 -15.092 -10.552 1.00 20.03 H new ATOM 0 HG22 VAL A 166 5.215 -15.035 -11.362 1.00 20.03 H new ATOM 0 HG23 VAL A 166 6.066 -16.588 -11.177 1.00 20.03 H new ATOM 1294 N VAL A 167 6.614 -18.245 -14.018 1.00 13.11 N ATOM 1295 CA VAL A 167 6.450 -19.676 -13.796 1.00 13.14 C ATOM 1296 C VAL A 167 7.613 -20.244 -12.990 1.00 22.44 C ATOM 1297 O VAL A 167 8.605 -19.557 -12.742 1.00 43.21 O ATOM 1298 CB VAL A 167 6.340 -20.442 -15.127 1.00 34.31 C ATOM 1299 CG1 VAL A 167 5.210 -19.879 -15.975 1.00 72.33 C ATOM 1300 CG2 VAL A 167 7.660 -20.392 -15.881 1.00 20.40 C ATOM 0 H VAL A 167 7.433 -17.996 -14.573 1.00 13.11 H new ATOM 0 HA VAL A 167 5.525 -19.805 -13.234 1.00 13.14 H new ATOM 0 HB VAL A 167 6.113 -21.485 -14.908 1.00 34.31 H new ATOM 0 HG11 VAL A 167 5.147 -20.433 -16.912 1.00 72.33 H new ATOM 0 HG12 VAL A 167 4.268 -19.973 -15.435 1.00 72.33 H new ATOM 0 HG13 VAL A 167 5.404 -18.828 -16.187 1.00 72.33 H new ATOM 0 HG21 VAL A 167 7.564 -20.938 -16.819 1.00 20.40 H new ATOM 0 HG22 VAL A 167 7.920 -19.354 -16.090 1.00 20.40 H new ATOM 0 HG23 VAL A 167 8.443 -20.847 -15.274 1.00 20.40 H new ATOM 1310 N VAL A 168 7.486 -21.503 -12.584 1.00 51.55 N ATOM 1311 CA VAL A 168 8.527 -22.165 -11.807 1.00 64.01 C ATOM 1312 C VAL A 168 9.066 -23.388 -12.541 1.00 10.40 C ATOM 1313 O VAL A 168 8.361 -24.009 -13.336 1.00 41.54 O ATOM 1314 CB VAL A 168 8.006 -22.598 -10.424 1.00 22.31 C ATOM 1315 CG1 VAL A 168 9.156 -23.054 -9.539 1.00 30.42 C ATOM 1316 CG2 VAL A 168 7.234 -21.464 -9.767 1.00 74.30 C ATOM 0 H VAL A 168 6.672 -22.085 -12.780 1.00 51.55 H new ATOM 0 HA VAL A 168 9.331 -21.441 -11.673 1.00 64.01 H new ATOM 0 HB VAL A 168 7.327 -23.440 -10.558 1.00 22.31 H new ATOM 0 HG11 VAL A 168 8.769 -23.356 -8.566 1.00 30.42 H new ATOM 0 HG12 VAL A 168 9.662 -23.899 -10.006 1.00 30.42 H new ATOM 0 HG13 VAL A 168 9.863 -22.234 -9.410 1.00 30.42 H new ATOM 0 HG21 VAL A 168 6.873 -21.787 -8.791 1.00 74.30 H new ATOM 0 HG22 VAL A 168 7.889 -20.601 -9.644 1.00 74.30 H new ATOM 0 HG23 VAL A 168 6.386 -21.190 -10.395 1.00 74.30 H new ATOM 1326 N SER A 169 10.322 -23.729 -12.269 1.00 61.10 N ATOM 1327 CA SER A 169 10.958 -24.877 -12.905 1.00 42.35 C ATOM 1328 C SER A 169 10.356 -26.183 -12.396 1.00 41.01 C ATOM 1329 O SER A 169 9.823 -26.243 -11.288 1.00 55.21 O ATOM 1330 CB SER A 169 12.465 -24.861 -12.644 1.00 11.22 C ATOM 1331 OG SER A 169 13.131 -25.825 -13.442 1.00 62.55 O ATOM 0 H SER A 169 10.919 -23.226 -11.612 1.00 61.10 H new ATOM 0 HA SER A 169 10.782 -24.810 -13.979 1.00 42.35 H new ATOM 0 HB2 SER A 169 12.864 -23.869 -12.858 1.00 11.22 H new ATOM 0 HB3 SER A 169 12.657 -25.062 -11.590 1.00 11.22 H new ATOM 0 HG SER A 169 14.093 -25.794 -13.258 1.00 62.55 H new ATOM 1337 N ARG A 170 10.444 -27.226 -13.215 1.00 13.32 N ATOM 1338 CA ARG A 170 9.908 -28.532 -12.849 1.00 64.45 C ATOM 1339 C ARG A 170 10.903 -29.308 -11.992 1.00 32.44 C ATOM 1340 O ARG A 170 10.574 -29.757 -10.894 1.00 71.21 O ATOM 1341 CB ARG A 170 9.564 -29.335 -14.105 1.00 3.01 C ATOM 1342 CG ARG A 170 8.767 -30.598 -13.820 1.00 21.22 C ATOM 1343 CD ARG A 170 8.927 -31.620 -14.935 1.00 64.43 C ATOM 1344 NE ARG A 170 8.704 -31.032 -16.253 1.00 33.33 N ATOM 1345 CZ ARG A 170 8.969 -31.661 -17.393 1.00 12.34 C ATOM 1346 NH1 ARG A 170 9.464 -32.891 -17.375 1.00 3.35 N1+ ATOM 1347 NH2 ARG A 170 8.739 -31.059 -18.553 1.00 44.41 N ATOM 0 H ARG A 170 10.881 -27.192 -14.136 1.00 13.32 H new ATOM 0 HA ARG A 170 9.000 -28.374 -12.267 1.00 64.45 H new ATOM 0 HB2 ARG A 170 8.995 -28.702 -14.786 1.00 3.01 H new ATOM 0 HB3 ARG A 170 10.487 -29.606 -14.617 1.00 3.01 H new ATOM 0 HG2 ARG A 170 9.097 -31.033 -12.876 1.00 21.22 H new ATOM 0 HG3 ARG A 170 7.713 -30.346 -13.704 1.00 21.22 H new ATOM 0 HD2 ARG A 170 9.929 -32.048 -14.894 1.00 64.43 H new ATOM 0 HD3 ARG A 170 8.224 -32.439 -14.780 1.00 64.43 H new ATOM 0 HE ARG A 170 8.324 -30.087 -16.301 1.00 33.33 H new ATOM 0 HH11 ARG A 170 9.642 -33.356 -16.485 1.00 3.35 H new ATOM 0 HH12 ARG A 170 9.667 -33.372 -18.251 1.00 3.35 H new ATOM 0 HH21 ARG A 170 8.359 -30.113 -18.570 1.00 44.41 H new ATOM 0 HH22 ARG A 170 8.943 -31.542 -19.428 1.00 44.41 H new ATOM 1361 N ARG A 171 12.121 -29.463 -12.502 1.00 61.43 N ATOM 1362 CA ARG A 171 13.164 -30.186 -11.784 1.00 54.13 C ATOM 1363 C ARG A 171 13.414 -29.562 -10.415 1.00 41.13 C ATOM 1364 O ARG A 171 13.848 -30.239 -9.483 1.00 64.11 O ATOM 1365 CB ARG A 171 14.459 -30.196 -12.597 1.00 13.15 C ATOM 1366 CG ARG A 171 14.999 -28.807 -12.899 1.00 24.35 C ATOM 1367 CD ARG A 171 16.071 -28.848 -13.977 1.00 42.03 C ATOM 1368 NE ARG A 171 15.502 -28.739 -15.318 1.00 64.34 N ATOM 1369 CZ ARG A 171 16.232 -28.748 -16.428 1.00 51.24 C ATOM 1370 NH1 ARG A 171 17.551 -28.860 -16.358 1.00 23.41 N1+ ATOM 1371 NH2 ARG A 171 15.641 -28.645 -17.612 1.00 34.32 N ATOM 0 H ARG A 171 12.409 -29.098 -13.410 1.00 61.43 H new ATOM 0 HA ARG A 171 12.826 -31.212 -11.640 1.00 54.13 H new ATOM 0 HB2 ARG A 171 15.216 -30.760 -12.052 1.00 13.15 H new ATOM 0 HB3 ARG A 171 14.285 -30.721 -13.536 1.00 13.15 H new ATOM 0 HG2 ARG A 171 14.183 -28.160 -13.221 1.00 24.35 H new ATOM 0 HG3 ARG A 171 15.412 -28.371 -11.990 1.00 24.35 H new ATOM 0 HD2 ARG A 171 16.779 -28.035 -13.816 1.00 42.03 H new ATOM 0 HD3 ARG A 171 16.632 -29.779 -13.896 1.00 42.03 H new ATOM 0 HE ARG A 171 14.490 -28.651 -15.407 1.00 64.34 H new ATOM 0 HH11 ARG A 171 18.009 -28.940 -15.450 1.00 23.41 H new ATOM 0 HH12 ARG A 171 18.108 -28.867 -17.212 1.00 23.41 H new ATOM 0 HH21 ARG A 171 14.626 -28.559 -17.670 1.00 34.32 H new ATOM 0 HH22 ARG A 171 16.202 -28.652 -18.464 1.00 34.32 H new ATOM 1385 N ALA A 172 13.138 -28.267 -10.301 1.00 63.40 N ATOM 1386 CA ALA A 172 13.332 -27.552 -9.046 1.00 2.13 C ATOM 1387 C ALA A 172 12.480 -28.154 -7.934 1.00 45.02 C ATOM 1388 O ALA A 172 12.750 -27.948 -6.750 1.00 44.21 O ATOM 1389 CB ALA A 172 13.006 -26.077 -9.223 1.00 62.22 C ATOM 0 H ALA A 172 12.779 -27.692 -11.063 1.00 63.40 H new ATOM 0 HA ALA A 172 14.379 -27.649 -8.759 1.00 2.13 H new ATOM 0 HB1 ALA A 172 13.155 -25.555 -8.278 1.00 62.22 H new ATOM 0 HB2 ALA A 172 13.661 -25.648 -9.981 1.00 62.22 H new ATOM 0 HB3 ALA A 172 11.968 -25.969 -9.537 1.00 62.22 H new ATOM 1395 N VAL A 173 11.450 -28.899 -8.321 1.00 4.21 N ATOM 1396 CA VAL A 173 10.558 -29.531 -7.357 1.00 11.43 C ATOM 1397 C VAL A 173 11.343 -30.344 -6.333 1.00 14.32 C ATOM 1398 O VAL A 173 10.910 -30.508 -5.192 1.00 63.23 O ATOM 1399 CB VAL A 173 9.539 -30.452 -8.054 1.00 61.53 C ATOM 1400 CG1 VAL A 173 10.239 -31.648 -8.679 1.00 60.30 C ATOM 1401 CG2 VAL A 173 8.469 -30.903 -7.071 1.00 52.12 C ATOM 0 H VAL A 173 11.213 -29.080 -9.296 1.00 4.21 H new ATOM 0 HA VAL A 173 10.023 -28.729 -6.848 1.00 11.43 H new ATOM 0 HB VAL A 173 9.053 -29.889 -8.851 1.00 61.53 H new ATOM 0 HG11 VAL A 173 9.503 -32.287 -9.167 1.00 60.30 H new ATOM 0 HG12 VAL A 173 10.963 -31.301 -9.416 1.00 60.30 H new ATOM 0 HG13 VAL A 173 10.754 -32.215 -7.903 1.00 60.30 H new ATOM 0 HG21 VAL A 173 7.758 -31.553 -7.580 1.00 52.12 H new ATOM 0 HG22 VAL A 173 8.935 -31.448 -6.250 1.00 52.12 H new ATOM 0 HG23 VAL A 173 7.946 -30.031 -6.677 1.00 52.12 H new ATOM 1411 N ILE A 174 12.498 -30.851 -6.749 1.00 53.34 N ATOM 1412 CA ILE A 174 13.345 -31.646 -5.868 1.00 61.21 C ATOM 1413 C ILE A 174 13.596 -30.923 -4.549 1.00 61.34 C ATOM 1414 O ILE A 174 13.769 -31.555 -3.507 1.00 73.44 O ATOM 1415 CB ILE A 174 14.698 -31.970 -6.528 1.00 31.14 C ATOM 1416 CG1 ILE A 174 15.482 -30.684 -6.793 1.00 21.44 C ATOM 1417 CG2 ILE A 174 14.484 -32.743 -7.821 1.00 1.52 C ATOM 1418 CD1 ILE A 174 16.834 -30.921 -7.430 1.00 43.50 C ATOM 0 H ILE A 174 12.869 -30.726 -7.691 1.00 53.34 H new ATOM 0 HA ILE A 174 12.813 -32.577 -5.675 1.00 61.21 H new ATOM 0 HB ILE A 174 15.278 -32.592 -5.847 1.00 31.14 H new ATOM 0 HG12 ILE A 174 14.893 -30.036 -7.441 1.00 21.44 H new ATOM 0 HG13 ILE A 174 15.621 -30.152 -5.852 1.00 21.44 H new ATOM 0 HG21 ILE A 174 15.449 -32.965 -8.276 1.00 1.52 H new ATOM 0 HG22 ILE A 174 13.962 -33.675 -7.605 1.00 1.52 H new ATOM 0 HG23 ILE A 174 13.888 -32.144 -8.509 1.00 1.52 H new ATOM 0 HD11 ILE A 174 17.334 -29.965 -7.589 1.00 43.50 H new ATOM 0 HD12 ILE A 174 17.442 -31.543 -6.773 1.00 43.50 H new ATOM 0 HD13 ILE A 174 16.702 -31.425 -8.387 1.00 43.50 H new ATOM 1430 N GLU A 175 13.614 -29.595 -4.602 1.00 41.14 N ATOM 1431 CA GLU A 175 13.843 -28.786 -3.410 1.00 41.22 C ATOM 1432 C GLU A 175 12.530 -28.497 -2.688 1.00 41.13 C ATOM 1433 O GLU A 175 12.435 -28.641 -1.469 1.00 64.54 O ATOM 1434 CB GLU A 175 14.532 -27.472 -3.783 1.00 45.13 C ATOM 1435 CG GLU A 175 15.890 -27.662 -4.439 1.00 52.34 C ATOM 1436 CD GLU A 175 16.847 -28.463 -3.577 1.00 64.43 C ATOM 1437 OE1 GLU A 175 16.801 -28.308 -2.339 1.00 72.13 O ATOM 1438 OE2 GLU A 175 17.642 -29.243 -4.141 1.00 13.32 O1- ATOM 0 H GLU A 175 13.473 -29.057 -5.457 1.00 41.14 H new ATOM 0 HA GLU A 175 14.491 -29.350 -2.739 1.00 41.22 H new ATOM 0 HB2 GLU A 175 13.886 -26.912 -4.459 1.00 45.13 H new ATOM 0 HB3 GLU A 175 14.653 -26.867 -2.884 1.00 45.13 H new ATOM 0 HG2 GLU A 175 15.760 -28.167 -5.396 1.00 52.34 H new ATOM 0 HG3 GLU A 175 16.327 -26.686 -4.650 1.00 52.34 H new ATOM 1445 N SER A 176 11.520 -28.088 -3.449 1.00 33.30 N ATOM 1446 CA SER A 176 10.214 -27.774 -2.882 1.00 74.04 C ATOM 1447 C SER A 176 9.657 -28.966 -2.110 1.00 63.41 C ATOM 1448 O SER A 176 9.070 -28.806 -1.040 1.00 54.23 O ATOM 1449 CB SER A 176 9.239 -27.367 -3.988 1.00 15.31 C ATOM 1450 OG SER A 176 8.562 -28.497 -4.512 1.00 72.12 O ATOM 0 H SER A 176 11.581 -27.966 -4.460 1.00 33.30 H new ATOM 0 HA SER A 176 10.336 -26.940 -2.191 1.00 74.04 H new ATOM 0 HB2 SER A 176 8.514 -26.655 -3.594 1.00 15.31 H new ATOM 0 HB3 SER A 176 9.781 -26.861 -4.787 1.00 15.31 H new ATOM 0 HG SER A 176 7.944 -28.210 -5.216 1.00 72.12 H new ATOM 1456 N GLU A 177 9.844 -30.161 -2.662 1.00 54.35 N ATOM 1457 CA GLU A 177 9.359 -31.380 -2.025 1.00 44.40 C ATOM 1458 C GLU A 177 9.827 -31.460 -0.575 1.00 62.41 C ATOM 1459 O GLU A 177 9.035 -31.714 0.331 1.00 45.33 O ATOM 1460 CB GLU A 177 9.841 -32.611 -2.797 1.00 54.14 C ATOM 1461 CG GLU A 177 8.943 -32.987 -3.964 1.00 45.50 C ATOM 1462 CD GLU A 177 8.910 -34.482 -4.215 1.00 30.24 C ATOM 1463 OE1 GLU A 177 9.932 -35.151 -3.957 1.00 54.53 O1- ATOM 1464 OE2 GLU A 177 7.860 -34.983 -4.669 1.00 1.22 O ATOM 0 H GLU A 177 10.327 -30.311 -3.548 1.00 54.35 H new ATOM 0 HA GLU A 177 8.269 -31.356 -2.036 1.00 44.40 H new ATOM 0 HB2 GLU A 177 10.848 -32.424 -3.170 1.00 54.14 H new ATOM 0 HB3 GLU A 177 9.906 -33.457 -2.112 1.00 54.14 H new ATOM 0 HG2 GLU A 177 7.931 -32.633 -3.768 1.00 45.50 H new ATOM 0 HG3 GLU A 177 9.290 -32.479 -4.864 1.00 45.50 H new ATOM 1471 N ASN A 178 11.122 -31.243 -0.364 1.00 31.53 N ATOM 1472 CA ASN A 178 11.696 -31.291 0.975 1.00 54.34 C ATOM 1473 C ASN A 178 13.179 -30.933 0.944 1.00 61.14 C ATOM 1474 O ASN A 178 14.039 -31.811 0.862 1.00 23.32 O ATOM 1475 CB ASN A 178 11.509 -32.683 1.583 1.00 24.22 C ATOM 1476 CG ASN A 178 10.399 -32.718 2.616 1.00 53.15 C ATOM 1477 OD1 ASN A 178 9.443 -33.484 2.490 1.00 22.43 O ATOM 1478 ND2 ASN A 178 10.520 -31.886 3.643 1.00 41.11 N ATOM 0 H ASN A 178 11.793 -31.032 -1.103 1.00 31.53 H new ATOM 0 HA ASN A 178 11.176 -30.559 1.593 1.00 54.34 H new ATOM 0 HB2 ASN A 178 11.286 -33.396 0.789 1.00 24.22 H new ATOM 0 HB3 ASN A 178 12.443 -33.003 2.046 1.00 24.22 H new ATOM 0 HD21 ASN A 178 9.804 -31.864 4.369 1.00 41.11 H new ATOM 0 HD22 ASN A 178 11.330 -31.269 3.707 1.00 41.11 H new ATOM 1485 N SER A 179 13.471 -29.638 1.011 1.00 21.43 N ATOM 1486 CA SER A 179 14.850 -29.164 0.987 1.00 15.51 C ATOM 1487 C SER A 179 15.695 -29.898 2.023 1.00 64.24 C ATOM 1488 O SER A 179 16.875 -30.164 1.800 1.00 71.22 O ATOM 1489 CB SER A 179 14.897 -27.657 1.249 1.00 21.23 C ATOM 1490 OG SER A 179 14.978 -27.383 2.637 1.00 74.50 O ATOM 0 H SER A 179 12.772 -28.899 1.082 1.00 21.43 H new ATOM 0 HA SER A 179 15.261 -29.368 -0.002 1.00 15.51 H new ATOM 0 HB2 SER A 179 15.757 -27.223 0.739 1.00 21.23 H new ATOM 0 HB3 SER A 179 14.007 -27.184 0.833 1.00 21.23 H new ATOM 0 HG SER A 179 15.008 -26.414 2.778 1.00 74.50 H new TER 1496 SER A 179