USER MOD reduce.3.24.130724 H: found=0, std=0, add=1099, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1093 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 66 LYS NZ :NH3+ 163:sc= 1.98 (180deg=0.892) USER MOD Set 1.2: A 101 TYR OH : rot 4:sc= 0.358 USER MOD Set 1.3: A 114 ASN : amide:sc= -0.0385 K(o=2.3,f=-1.1!) USER MOD Single : A 1 GLY N :NH3+ -151:sc= 0.0672 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 3:sc= 1.17 USER MOD Single : A 10 TYR OH : rot 180:sc= 0.313 USER MOD Single : A 13 SER OG : rot 89:sc= 0.174 USER MOD Single : A 15 MET CE :methyl -163:sc= -2.88 (180deg=-5.49!) USER MOD Single : A 20 THR OG1 : rot -68:sc= 0.41 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 CYS SG : rot 65:sc= -0.117 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 81:sc= 1.32 USER MOD Single : A 43 HIS : no HD1:sc= -0.52 X(o=-0.52,f=-0.24) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot -47:sc= 0.363 USER MOD Single : A 56 LYS NZ :NH3+ 174:sc= 0.198 (180deg=0.188) USER MOD Single : A 60 ASN : amide:sc= 0.277 X(o=0.28,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 159:sc= -0.0574 (180deg=-0.733) USER MOD Single : A 62 SER OG : rot 180:sc= -0.0161 USER MOD Single : A 67 GLN : amide:sc= -0.374 K(o=-0.37,f=-1.5!) USER MOD Single : A 68 LYS NZ :NH3+ -168:sc= 2.06 (180deg=1.62) USER MOD Single : A 74 LYS NZ :NH3+ -164:sc= 1.24 (180deg=0.925) USER MOD Single : A 75 TYR OH : rot 120:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.0674) USER MOD Single : A 80 SER OG : rot -70:sc= -0.152 USER MOD Single : A 82 SER OG : rot 82:sc= 1.4 USER MOD Single : A 88 MET CE :methyl 163:sc= -2.1 (180deg=-2.5) USER MOD Single : A 89 GLN : amide:sc= -0.0796 K(o=-0.08,f=-1.1) USER MOD Single : A 91 ASN : amide:sc= -0.682 X(o=-0.68,f=-0.19) USER MOD Single : A 92 SER OG : rot -82:sc= 1.86 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 102 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0826) USER MOD Single : A 104 HIS : no HD1:sc= -0.0456 X(o=-0.046,f=0) USER MOD Single : A 109 LYS NZ :NH3+ -161:sc= 1.33 (180deg=1.11) USER MOD Single : A 115 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.607) USER MOD Single : A 120 THR OG1 : rot 89:sc= 1.24 USER MOD Single : A 122 HIS : no HD1:sc= -0.127 X(o=-0.13,f=-0.044) USER MOD Single : A 124 THR OG1 : rot -93:sc= 0.462 USER MOD Single : A 126 SER OG : rot 83:sc= 0.352 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -0.0385 K(o=-0.039,f=-1.5) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot -37:sc= 0.516 USER MOD Single : A 139 SER OG : rot 180:sc= 0.016 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 30.202 10.970 -8.583 1.00 0.00 N ATOM 2 CA GLY A 1 30.706 11.938 -7.597 1.00 0.00 C ATOM 3 C GLY A 1 29.895 11.824 -6.319 1.00 0.00 C ATOM 4 O GLY A 1 29.465 10.724 -5.981 1.00 0.00 O ATOM 0 H1 GLY A 1 30.977 10.682 -9.215 1.00 0.00 H new ATOM 0 H2 GLY A 1 29.829 10.134 -8.089 1.00 0.00 H new ATOM 0 H3 GLY A 1 29.443 11.408 -9.143 1.00 0.00 H new ATOM 0 HA2 GLY A 1 31.759 11.749 -7.390 1.00 0.00 H new ATOM 0 HA3 GLY A 1 30.636 12.950 -7.996 1.00 0.00 H new ATOM 8 N SER A 2 29.677 12.932 -5.602 1.00 0.00 N ATOM 9 CA SER A 2 28.579 12.995 -4.642 1.00 0.00 C ATOM 10 C SER A 2 27.289 13.009 -5.467 1.00 0.00 C ATOM 11 O SER A 2 27.260 13.654 -6.521 1.00 0.00 O ATOM 12 CB SER A 2 28.706 14.260 -3.775 1.00 0.00 C ATOM 13 OG SER A 2 27.978 14.155 -2.565 1.00 0.00 O ATOM 0 H SER A 2 30.238 13.782 -5.668 1.00 0.00 H new ATOM 0 HA SER A 2 28.587 12.145 -3.959 1.00 0.00 H new ATOM 0 HB2 SER A 2 29.757 14.440 -3.550 1.00 0.00 H new ATOM 0 HB3 SER A 2 28.348 15.122 -4.338 1.00 0.00 H new ATOM 0 HG SER A 2 28.088 14.978 -2.045 1.00 0.00 H new ATOM 19 N SER A 3 26.244 12.337 -4.994 1.00 0.00 N ATOM 20 CA SER A 3 24.925 12.360 -5.616 1.00 0.00 C ATOM 21 C SER A 3 23.792 12.319 -4.589 1.00 0.00 C ATOM 22 O SER A 3 22.669 12.697 -4.928 1.00 0.00 O ATOM 23 CB SER A 3 24.787 11.195 -6.607 1.00 0.00 C ATOM 24 OG SER A 3 24.635 11.655 -7.943 1.00 0.00 O ATOM 0 H SER A 3 26.290 11.754 -4.158 1.00 0.00 H new ATOM 0 HA SER A 3 24.838 13.306 -6.150 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.667 10.555 -6.541 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.927 10.584 -6.333 1.00 0.00 H new ATOM 0 HG SER A 3 24.552 10.887 -8.546 1.00 0.00 H new ATOM 30 N GLY A 4 24.034 11.877 -3.355 1.00 0.00 N ATOM 31 CA GLY A 4 22.968 11.607 -2.410 1.00 0.00 C ATOM 32 C GLY A 4 23.530 11.391 -1.017 1.00 0.00 C ATOM 33 O GLY A 4 24.045 10.311 -0.721 1.00 0.00 O ATOM 0 H GLY A 4 24.970 11.699 -2.991 1.00 0.00 H new ATOM 0 HA2 GLY A 4 22.265 12.440 -2.399 1.00 0.00 H new ATOM 0 HA3 GLY A 4 22.411 10.724 -2.724 1.00 0.00 H new ATOM 37 N SER A 5 23.445 12.396 -0.147 1.00 0.00 N ATOM 38 CA SER A 5 23.846 12.256 1.252 1.00 0.00 C ATOM 39 C SER A 5 22.779 12.808 2.203 1.00 0.00 C ATOM 40 O SER A 5 23.110 13.331 3.271 1.00 0.00 O ATOM 41 CB SER A 5 25.259 12.826 1.458 1.00 0.00 C ATOM 42 OG SER A 5 26.086 11.898 2.145 1.00 0.00 O ATOM 0 H SER A 5 23.099 13.324 -0.390 1.00 0.00 H new ATOM 0 HA SER A 5 23.912 11.199 1.510 1.00 0.00 H new ATOM 0 HB2 SER A 5 25.702 13.068 0.492 1.00 0.00 H new ATOM 0 HB3 SER A 5 25.201 13.756 2.024 1.00 0.00 H new ATOM 0 HG SER A 5 26.980 12.282 2.263 1.00 0.00 H new ATOM 48 N SER A 6 21.504 12.728 1.836 1.00 0.00 N ATOM 49 CA SER A 6 20.401 12.922 2.763 1.00 0.00 C ATOM 50 C SER A 6 19.309 11.902 2.457 1.00 0.00 C ATOM 51 O SER A 6 19.081 11.553 1.294 1.00 0.00 O ATOM 52 CB SER A 6 19.869 14.356 2.660 1.00 0.00 C ATOM 53 OG SER A 6 20.904 15.307 2.882 1.00 0.00 O ATOM 0 H SER A 6 21.208 12.525 0.881 1.00 0.00 H new ATOM 0 HA SER A 6 20.745 12.771 3.786 1.00 0.00 H new ATOM 0 HB2 SER A 6 19.432 14.514 1.674 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.073 14.504 3.389 1.00 0.00 H new ATOM 0 HG SER A 6 20.537 16.213 2.809 1.00 0.00 H new ATOM 59 N GLY A 7 18.616 11.448 3.496 1.00 0.00 N ATOM 60 CA GLY A 7 17.477 10.558 3.381 1.00 0.00 C ATOM 61 C GLY A 7 16.233 11.158 4.014 1.00 0.00 C ATOM 62 O GLY A 7 15.132 10.727 3.689 1.00 0.00 O ATOM 0 H GLY A 7 18.839 11.697 4.460 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.285 10.346 2.329 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.708 9.607 3.861 1.00 0.00 H new ATOM 66 N GLU A 8 16.369 12.162 4.879 1.00 0.00 N ATOM 67 CA GLU A 8 15.232 12.903 5.394 1.00 0.00 C ATOM 68 C GLU A 8 14.612 13.686 4.231 1.00 0.00 C ATOM 69 O GLU A 8 15.301 14.469 3.572 1.00 0.00 O ATOM 70 CB GLU A 8 15.730 13.840 6.501 1.00 0.00 C ATOM 71 CG GLU A 8 14.582 14.505 7.266 1.00 0.00 C ATOM 72 CD GLU A 8 13.785 13.518 8.121 1.00 0.00 C ATOM 73 OE1 GLU A 8 14.402 12.734 8.885 1.00 0.00 O ATOM 74 OE2 GLU A 8 12.539 13.560 8.089 1.00 0.00 O ATOM 0 H GLU A 8 17.269 12.479 5.238 1.00 0.00 H new ATOM 0 HA GLU A 8 14.473 12.244 5.816 1.00 0.00 H new ATOM 0 HB2 GLU A 8 16.349 13.276 7.199 1.00 0.00 H new ATOM 0 HB3 GLU A 8 16.365 14.610 6.063 1.00 0.00 H new ATOM 0 HG2 GLU A 8 14.985 15.289 7.907 1.00 0.00 H new ATOM 0 HG3 GLU A 8 13.910 14.987 6.556 1.00 0.00 H new ATOM 81 N SER A 9 13.328 13.476 3.943 1.00 0.00 N ATOM 82 CA SER A 9 12.519 14.317 3.066 1.00 0.00 C ATOM 83 C SER A 9 11.042 14.133 3.433 1.00 0.00 C ATOM 84 O SER A 9 10.682 13.185 4.136 1.00 0.00 O ATOM 85 CB SER A 9 12.794 13.973 1.588 1.00 0.00 C ATOM 86 OG SER A 9 14.090 14.436 1.238 1.00 0.00 O ATOM 0 H SER A 9 12.806 12.689 4.328 1.00 0.00 H new ATOM 0 HA SER A 9 12.783 15.366 3.201 1.00 0.00 H new ATOM 0 HB2 SER A 9 12.724 12.896 1.433 1.00 0.00 H new ATOM 0 HB3 SER A 9 12.043 14.436 0.948 1.00 0.00 H new ATOM 0 HG SER A 9 14.523 14.823 2.027 1.00 0.00 H new ATOM 92 N TYR A 10 10.195 15.033 2.934 1.00 0.00 N ATOM 93 CA TYR A 10 8.746 15.031 3.092 1.00 0.00 C ATOM 94 C TYR A 10 8.076 14.752 1.747 1.00 0.00 C ATOM 95 O TYR A 10 7.087 14.027 1.698 1.00 0.00 O ATOM 96 CB TYR A 10 8.294 16.397 3.633 1.00 0.00 C ATOM 97 CG TYR A 10 6.819 16.690 3.418 1.00 0.00 C ATOM 98 CD1 TYR A 10 6.397 17.321 2.229 1.00 0.00 C ATOM 99 CD2 TYR A 10 5.866 16.292 4.373 1.00 0.00 C ATOM 100 CE1 TYR A 10 5.035 17.563 1.999 1.00 0.00 C ATOM 101 CE2 TYR A 10 4.497 16.517 4.141 1.00 0.00 C ATOM 102 CZ TYR A 10 4.075 17.151 2.949 1.00 0.00 C ATOM 103 OH TYR A 10 2.756 17.360 2.698 1.00 0.00 O ATOM 0 H TYR A 10 10.522 15.824 2.379 1.00 0.00 H new ATOM 0 HA TYR A 10 8.457 14.250 3.795 1.00 0.00 H new ATOM 0 HB2 TYR A 10 8.511 16.443 4.700 1.00 0.00 H new ATOM 0 HB3 TYR A 10 8.883 17.179 3.153 1.00 0.00 H new ATOM 0 HD1 TYR A 10 7.127 17.620 1.491 1.00 0.00 H new ATOM 0 HD2 TYR A 10 6.186 15.813 5.286 1.00 0.00 H new ATOM 0 HE1 TYR A 10 4.720 18.064 1.096 1.00 0.00 H new ATOM 0 HE2 TYR A 10 3.767 16.205 4.874 1.00 0.00 H new ATOM 0 HH TYR A 10 2.223 17.020 3.446 1.00 0.00 H new ATOM 113 N TRP A 11 8.603 15.296 0.640 1.00 0.00 N ATOM 114 CA TRP A 11 7.977 15.201 -0.684 1.00 0.00 C ATOM 115 C TRP A 11 7.707 13.756 -1.102 1.00 0.00 C ATOM 116 O TRP A 11 6.740 13.465 -1.801 1.00 0.00 O ATOM 117 CB TRP A 11 8.848 15.910 -1.719 1.00 0.00 C ATOM 118 CG TRP A 11 8.083 16.483 -2.869 1.00 0.00 C ATOM 119 CD1 TRP A 11 7.621 17.750 -2.928 1.00 0.00 C ATOM 120 CD2 TRP A 11 7.650 15.845 -4.108 1.00 0.00 C ATOM 121 NE1 TRP A 11 6.965 17.950 -4.124 1.00 0.00 N ATOM 122 CE2 TRP A 11 6.967 16.813 -4.900 1.00 0.00 C ATOM 123 CE3 TRP A 11 7.760 14.545 -4.643 1.00 0.00 C ATOM 124 CZ2 TRP A 11 6.454 16.517 -6.171 1.00 0.00 C ATOM 125 CZ3 TRP A 11 7.226 14.226 -5.906 1.00 0.00 C ATOM 126 CH2 TRP A 11 6.575 15.209 -6.671 1.00 0.00 C ATOM 0 H TRP A 11 9.480 15.817 0.640 1.00 0.00 H new ATOM 0 HA TRP A 11 7.007 15.694 -0.626 1.00 0.00 H new ATOM 0 HB2 TRP A 11 9.399 16.712 -1.227 1.00 0.00 H new ATOM 0 HB3 TRP A 11 9.586 15.205 -2.102 1.00 0.00 H new ATOM 0 HD1 TRP A 11 7.746 18.494 -2.155 1.00 0.00 H new ATOM 0 HE1 TRP A 11 6.532 18.831 -4.400 1.00 0.00 H new ATOM 0 HE3 TRP A 11 8.264 13.779 -4.073 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 5.972 17.284 -6.758 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 7.317 13.220 -6.289 1.00 0.00 H new ATOM 0 HH2 TRP A 11 6.169 14.960 -7.640 1.00 0.00 H new ATOM 137 N ARG A 12 8.523 12.829 -0.607 1.00 0.00 N ATOM 138 CA ARG A 12 8.380 11.396 -0.788 1.00 0.00 C ATOM 139 C ARG A 12 6.984 10.893 -0.372 1.00 0.00 C ATOM 140 O ARG A 12 6.477 9.940 -0.965 1.00 0.00 O ATOM 141 CB ARG A 12 9.550 10.758 -0.026 1.00 0.00 C ATOM 142 CG ARG A 12 10.029 9.423 -0.604 1.00 0.00 C ATOM 143 CD ARG A 12 11.549 9.272 -0.529 1.00 0.00 C ATOM 144 NE ARG A 12 12.302 10.087 -1.504 1.00 0.00 N ATOM 145 CZ ARG A 12 13.641 10.175 -1.558 1.00 0.00 C ATOM 146 NH1 ARG A 12 14.372 9.858 -0.493 1.00 0.00 N ATOM 147 NH2 ARG A 12 14.253 10.561 -2.673 1.00 0.00 N ATOM 0 H ARG A 12 9.338 13.073 -0.044 1.00 0.00 H new ATOM 0 HA ARG A 12 8.433 11.107 -1.838 1.00 0.00 H new ATOM 0 HB2 ARG A 12 10.386 11.457 -0.017 1.00 0.00 H new ATOM 0 HB3 ARG A 12 9.252 10.605 1.011 1.00 0.00 H new ATOM 0 HG2 ARG A 12 9.557 8.604 -0.061 1.00 0.00 H new ATOM 0 HG3 ARG A 12 9.709 9.343 -1.643 1.00 0.00 H new ATOM 0 HD2 ARG A 12 11.877 9.538 0.476 1.00 0.00 H new ATOM 0 HD3 ARG A 12 11.804 8.223 -0.680 1.00 0.00 H new ATOM 0 HE ARG A 12 11.765 10.622 -2.187 1.00 0.00 H new ATOM 0 HH11 ARG A 12 13.916 9.548 0.365 1.00 0.00 H new ATOM 0 HH12 ARG A 12 15.389 9.925 -0.534 1.00 0.00 H new ATOM 0 HH21 ARG A 12 13.705 10.795 -3.501 1.00 0.00 H new ATOM 0 HH22 ARG A 12 15.271 10.624 -2.701 1.00 0.00 H new ATOM 161 N SER A 13 6.328 11.550 0.593 1.00 0.00 N ATOM 162 CA SER A 13 4.978 11.251 1.049 1.00 0.00 C ATOM 163 C SER A 13 3.957 11.580 -0.034 1.00 0.00 C ATOM 164 O SER A 13 2.965 10.866 -0.205 1.00 0.00 O ATOM 165 CB SER A 13 4.707 12.078 2.315 1.00 0.00 C ATOM 166 OG SER A 13 3.469 11.724 2.887 1.00 0.00 O ATOM 0 H SER A 13 6.746 12.335 1.093 1.00 0.00 H new ATOM 0 HA SER A 13 4.888 10.187 1.270 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.506 11.917 3.038 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.709 13.140 2.069 1.00 0.00 H new ATOM 0 HG SER A 13 3.600 10.986 3.519 1.00 0.00 H new ATOM 172 N ARG A 14 4.185 12.674 -0.766 1.00 0.00 N ATOM 173 CA ARG A 14 3.269 13.181 -1.777 1.00 0.00 C ATOM 174 C ARG A 14 3.111 12.199 -2.924 1.00 0.00 C ATOM 175 O ARG A 14 2.078 12.220 -3.588 1.00 0.00 O ATOM 176 CB ARG A 14 3.770 14.524 -2.334 1.00 0.00 C ATOM 177 CG ARG A 14 4.081 15.601 -1.281 1.00 0.00 C ATOM 178 CD ARG A 14 2.858 15.977 -0.448 1.00 0.00 C ATOM 179 NE ARG A 14 1.849 16.683 -1.257 1.00 0.00 N ATOM 180 CZ ARG A 14 0.897 17.521 -0.834 1.00 0.00 C ATOM 181 NH1 ARG A 14 0.817 17.890 0.442 1.00 0.00 N ATOM 182 NH2 ARG A 14 0.017 17.964 -1.725 1.00 0.00 N ATOM 0 H ARG A 14 5.029 13.239 -0.666 1.00 0.00 H new ATOM 0 HA ARG A 14 2.301 13.320 -1.296 1.00 0.00 H new ATOM 0 HB2 ARG A 14 4.671 14.342 -2.919 1.00 0.00 H new ATOM 0 HB3 ARG A 14 3.019 14.917 -3.019 1.00 0.00 H new ATOM 0 HG2 ARG A 14 4.870 15.241 -0.620 1.00 0.00 H new ATOM 0 HG3 ARG A 14 4.464 16.491 -1.779 1.00 0.00 H new ATOM 0 HD2 ARG A 14 2.417 15.077 -0.020 1.00 0.00 H new ATOM 0 HD3 ARG A 14 3.165 16.609 0.385 1.00 0.00 H new ATOM 0 HE ARG A 14 1.881 16.512 -2.262 1.00 0.00 H new ATOM 0 HH11 ARG A 14 1.490 17.532 1.119 1.00 0.00 H new ATOM 0 HH12 ARG A 14 0.082 18.531 0.743 1.00 0.00 H new ATOM 0 HH21 ARG A 14 0.081 17.664 -2.698 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -0.722 18.605 -1.436 1.00 0.00 H new ATOM 196 N MET A 15 4.105 11.343 -3.172 1.00 0.00 N ATOM 197 CA MET A 15 3.989 10.346 -4.227 1.00 0.00 C ATOM 198 C MET A 15 2.888 9.356 -3.853 1.00 0.00 C ATOM 199 O MET A 15 2.008 9.087 -4.668 1.00 0.00 O ATOM 200 CB MET A 15 5.314 9.620 -4.467 1.00 0.00 C ATOM 201 CG MET A 15 6.498 10.567 -4.714 1.00 0.00 C ATOM 202 SD MET A 15 7.557 10.159 -6.124 1.00 0.00 S ATOM 203 CE MET A 15 7.768 8.375 -5.905 1.00 0.00 C ATOM 0 H MET A 15 4.987 11.323 -2.661 1.00 0.00 H new ATOM 0 HA MET A 15 3.731 10.849 -5.159 1.00 0.00 H new ATOM 0 HB2 MET A 15 5.536 8.992 -3.604 1.00 0.00 H new ATOM 0 HB3 MET A 15 5.205 8.957 -5.325 1.00 0.00 H new ATOM 0 HG2 MET A 15 6.108 11.575 -4.857 1.00 0.00 H new ATOM 0 HG3 MET A 15 7.115 10.588 -3.815 1.00 0.00 H new ATOM 0 HE1 MET A 15 8.617 8.034 -6.497 1.00 0.00 H new ATOM 0 HE2 MET A 15 7.948 8.156 -4.852 1.00 0.00 H new ATOM 0 HE3 MET A 15 6.866 7.859 -6.234 1.00 0.00 H new ATOM 213 N ILE A 16 2.928 8.850 -2.613 1.00 0.00 N ATOM 214 CA ILE A 16 1.911 7.959 -2.075 1.00 0.00 C ATOM 215 C ILE A 16 0.573 8.694 -2.086 1.00 0.00 C ATOM 216 O ILE A 16 -0.409 8.189 -2.625 1.00 0.00 O ATOM 217 CB ILE A 16 2.273 7.482 -0.642 1.00 0.00 C ATOM 218 CG1 ILE A 16 3.699 6.898 -0.480 1.00 0.00 C ATOM 219 CG2 ILE A 16 1.222 6.461 -0.156 1.00 0.00 C ATOM 220 CD1 ILE A 16 4.109 5.911 -1.566 1.00 0.00 C ATOM 0 H ILE A 16 3.679 9.055 -1.954 1.00 0.00 H new ATOM 0 HA ILE A 16 1.848 7.065 -2.695 1.00 0.00 H new ATOM 0 HB ILE A 16 2.265 8.380 -0.024 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.414 7.720 -0.466 1.00 0.00 H new ATOM 0 HG13 ILE A 16 3.766 6.401 0.488 1.00 0.00 H new ATOM 0 HG21 ILE A 16 1.477 6.127 0.850 1.00 0.00 H new ATOM 0 HG22 ILE A 16 0.238 6.930 -0.144 1.00 0.00 H new ATOM 0 HG23 ILE A 16 1.208 5.605 -0.830 1.00 0.00 H new ATOM 0 HD11 ILE A 16 5.121 5.555 -1.371 1.00 0.00 H new ATOM 0 HD12 ILE A 16 3.421 5.066 -1.568 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.079 6.405 -2.537 1.00 0.00 H new ATOM 232 N ASP A 17 0.535 9.876 -1.471 1.00 0.00 N ATOM 233 CA ASP A 17 -0.702 10.602 -1.199 1.00 0.00 C ATOM 234 C ASP A 17 -1.472 10.888 -2.483 1.00 0.00 C ATOM 235 O ASP A 17 -2.697 10.774 -2.537 1.00 0.00 O ATOM 236 CB ASP A 17 -0.375 11.914 -0.492 1.00 0.00 C ATOM 237 CG ASP A 17 -1.637 12.517 0.102 1.00 0.00 C ATOM 238 OD1 ASP A 17 -1.957 12.188 1.263 1.00 0.00 O ATOM 239 OD2 ASP A 17 -2.290 13.342 -0.568 1.00 0.00 O ATOM 0 H ASP A 17 1.372 10.360 -1.145 1.00 0.00 H new ATOM 0 HA ASP A 17 -1.330 9.981 -0.561 1.00 0.00 H new ATOM 0 HB2 ASP A 17 0.359 11.739 0.295 1.00 0.00 H new ATOM 0 HB3 ASP A 17 0.074 12.614 -1.197 1.00 0.00 H new ATOM 244 N ALA A 18 -0.739 11.227 -3.543 1.00 0.00 N ATOM 245 CA ALA A 18 -1.292 11.524 -4.845 1.00 0.00 C ATOM 246 C ALA A 18 -2.105 10.357 -5.412 1.00 0.00 C ATOM 247 O ALA A 18 -3.118 10.594 -6.075 1.00 0.00 O ATOM 248 CB ALA A 18 -0.142 11.867 -5.789 1.00 0.00 C ATOM 0 H ALA A 18 0.278 11.302 -3.510 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.977 12.366 -4.746 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -0.539 12.095 -6.778 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.397 12.734 -5.406 1.00 0.00 H new ATOM 0 HB3 ALA A 18 0.538 11.018 -5.857 1.00 0.00 H new ATOM 254 N VAL A 19 -1.670 9.114 -5.187 1.00 0.00 N ATOM 255 CA VAL A 19 -2.347 7.926 -5.705 1.00 0.00 C ATOM 256 C VAL A 19 -3.351 7.353 -4.705 1.00 0.00 C ATOM 257 O VAL A 19 -4.140 6.479 -5.073 1.00 0.00 O ATOM 258 CB VAL A 19 -1.331 6.881 -6.204 1.00 0.00 C ATOM 259 CG1 VAL A 19 -0.524 7.461 -7.368 1.00 0.00 C ATOM 260 CG2 VAL A 19 -0.352 6.367 -5.143 1.00 0.00 C ATOM 0 H VAL A 19 -0.836 8.905 -4.639 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.936 8.230 -6.570 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.932 6.024 -6.508 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.194 6.719 -7.718 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -1.199 7.726 -8.182 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.009 8.351 -7.034 1.00 0.00 H new ATOM 0 HG21 VAL A 19 0.321 5.637 -5.592 1.00 0.00 H new ATOM 0 HG22 VAL A 19 0.228 7.201 -4.749 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.908 5.897 -4.332 1.00 0.00 H new ATOM 270 N THR A 20 -3.395 7.871 -3.476 1.00 0.00 N ATOM 271 CA THR A 20 -4.349 7.492 -2.441 1.00 0.00 C ATOM 272 C THR A 20 -5.321 8.641 -2.140 1.00 0.00 C ATOM 273 O THR A 20 -5.858 8.740 -1.040 1.00 0.00 O ATOM 274 CB THR A 20 -3.604 6.910 -1.228 1.00 0.00 C ATOM 275 OG1 THR A 20 -2.689 7.826 -0.668 1.00 0.00 O ATOM 276 CG2 THR A 20 -2.815 5.648 -1.608 1.00 0.00 C ATOM 0 H THR A 20 -2.742 8.591 -3.167 1.00 0.00 H new ATOM 0 HA THR A 20 -4.995 6.687 -2.792 1.00 0.00 H new ATOM 0 HB THR A 20 -4.378 6.674 -0.498 1.00 0.00 H new ATOM 0 HG1 THR A 20 -1.947 7.971 -1.292 1.00 0.00 H new ATOM 0 HG21 THR A 20 -2.300 5.262 -0.728 1.00 0.00 H new ATOM 0 HG22 THR A 20 -3.501 4.891 -1.988 1.00 0.00 H new ATOM 0 HG23 THR A 20 -2.083 5.894 -2.378 1.00 0.00 H new ATOM 284 N SER A 21 -5.533 9.514 -3.127 1.00 0.00 N ATOM 285 CA SER A 21 -6.438 10.648 -3.077 1.00 0.00 C ATOM 286 C SER A 21 -7.877 10.127 -3.014 1.00 0.00 C ATOM 287 O SER A 21 -8.224 9.198 -3.744 1.00 0.00 O ATOM 288 CB SER A 21 -6.150 11.484 -4.328 1.00 0.00 C ATOM 289 OG SER A 21 -7.097 12.508 -4.531 1.00 0.00 O ATOM 0 H SER A 21 -5.052 9.440 -4.023 1.00 0.00 H new ATOM 0 HA SER A 21 -6.299 11.274 -2.196 1.00 0.00 H new ATOM 0 HB2 SER A 21 -5.157 11.925 -4.244 1.00 0.00 H new ATOM 0 HB3 SER A 21 -6.135 10.831 -5.200 1.00 0.00 H new ATOM 0 HG SER A 21 -6.866 13.011 -5.340 1.00 0.00 H new ATOM 295 N ASP A 22 -8.703 10.691 -2.134 1.00 0.00 N ATOM 296 CA ASP A 22 -10.079 10.275 -1.878 1.00 0.00 C ATOM 297 C ASP A 22 -10.986 10.549 -3.088 1.00 0.00 C ATOM 298 O ASP A 22 -11.515 11.654 -3.238 1.00 0.00 O ATOM 299 CB ASP A 22 -10.618 10.937 -0.599 1.00 0.00 C ATOM 300 CG ASP A 22 -10.706 12.453 -0.569 1.00 0.00 C ATOM 301 OD1 ASP A 22 -9.688 13.122 -0.852 1.00 0.00 O ATOM 302 OD2 ASP A 22 -11.760 12.983 -0.140 1.00 0.00 O ATOM 0 H ASP A 22 -8.419 11.483 -1.557 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.081 9.197 -1.720 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -11.616 10.540 -0.411 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.988 10.622 0.232 1.00 0.00 H new ATOM 307 N GLU A 23 -11.164 9.560 -3.967 1.00 0.00 N ATOM 308 CA GLU A 23 -11.998 9.578 -5.167 1.00 0.00 C ATOM 309 C GLU A 23 -12.333 8.137 -5.541 1.00 0.00 C ATOM 310 O GLU A 23 -11.425 7.301 -5.604 1.00 0.00 O ATOM 311 CB GLU A 23 -11.231 10.157 -6.361 1.00 0.00 C ATOM 312 CG GLU A 23 -11.270 11.683 -6.455 1.00 0.00 C ATOM 313 CD GLU A 23 -10.878 12.111 -7.872 1.00 0.00 C ATOM 314 OE1 GLU A 23 -11.686 11.923 -8.816 1.00 0.00 O ATOM 315 OE2 GLU A 23 -9.717 12.534 -8.079 1.00 0.00 O ATOM 0 H GLU A 23 -10.695 8.662 -3.849 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.882 10.179 -4.956 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -10.191 9.835 -6.301 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -11.642 9.738 -7.279 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -12.268 12.049 -6.215 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -10.587 12.122 -5.728 1.00 0.00 H new ATOM 322 N ASP A 24 -13.597 7.841 -5.854 1.00 0.00 N ATOM 323 CA ASP A 24 -14.008 6.549 -6.420 1.00 0.00 C ATOM 324 C ASP A 24 -13.215 6.229 -7.693 1.00 0.00 C ATOM 325 O ASP A 24 -12.928 5.063 -7.985 1.00 0.00 O ATOM 326 CB ASP A 24 -15.505 6.574 -6.746 1.00 0.00 C ATOM 327 CG ASP A 24 -15.939 5.302 -7.483 1.00 0.00 C ATOM 328 OD1 ASP A 24 -15.958 4.207 -6.878 1.00 0.00 O ATOM 329 OD2 ASP A 24 -16.215 5.394 -8.704 1.00 0.00 O ATOM 0 H ASP A 24 -14.370 8.493 -5.722 1.00 0.00 H new ATOM 0 HA ASP A 24 -13.805 5.775 -5.679 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -16.078 6.675 -5.824 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -15.731 7.446 -7.359 1.00 0.00 H new ATOM 334 N LYS A 25 -12.807 7.260 -8.430 1.00 0.00 N ATOM 335 CA LYS A 25 -11.926 7.173 -9.582 1.00 0.00 C ATOM 336 C LYS A 25 -10.497 6.813 -9.159 1.00 0.00 C ATOM 337 O LYS A 25 -9.769 7.618 -8.568 1.00 0.00 O ATOM 338 CB LYS A 25 -12.010 8.502 -10.343 1.00 0.00 C ATOM 339 CG LYS A 25 -12.666 8.311 -11.713 1.00 0.00 C ATOM 340 CD LYS A 25 -11.755 7.650 -12.749 1.00 0.00 C ATOM 341 CE LYS A 25 -10.544 8.527 -13.072 1.00 0.00 C ATOM 342 NZ LYS A 25 -9.936 8.154 -14.360 1.00 0.00 N ATOM 0 H LYS A 25 -13.096 8.217 -8.228 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.241 6.369 -10.248 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -12.582 9.223 -9.760 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.010 8.916 -10.470 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -13.564 7.705 -11.594 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.985 9.282 -12.091 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.416 6.684 -12.374 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -12.320 7.457 -13.661 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.849 9.573 -13.102 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.803 8.433 -12.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.118 8.768 -14.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.624 7.163 -14.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.636 8.268 -15.120 1.00 0.00 H new ATOM 356 N VAL A 26 -10.110 5.586 -9.482 1.00 0.00 N ATOM 357 CA VAL A 26 -8.787 5.010 -9.244 1.00 0.00 C ATOM 358 C VAL A 26 -7.695 5.785 -10.005 1.00 0.00 C ATOM 359 O VAL A 26 -7.970 6.376 -11.056 1.00 0.00 O ATOM 360 CB VAL A 26 -8.807 3.514 -9.636 1.00 0.00 C ATOM 361 CG1 VAL A 26 -9.654 2.697 -8.646 1.00 0.00 C ATOM 362 CG2 VAL A 26 -9.352 3.265 -11.057 1.00 0.00 C ATOM 0 H VAL A 26 -10.741 4.929 -9.941 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.544 5.092 -8.185 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.766 3.193 -9.608 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.652 1.649 -8.944 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.234 2.790 -7.644 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -10.677 3.072 -8.647 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.339 2.196 -11.269 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -10.375 3.636 -11.125 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.728 3.787 -11.783 1.00 0.00 H new ATOM 372 N ALA A 27 -6.462 5.783 -9.485 1.00 0.00 N ATOM 373 CA ALA A 27 -5.283 6.323 -10.158 1.00 0.00 C ATOM 374 C ALA A 27 -4.736 5.306 -11.177 1.00 0.00 C ATOM 375 O ALA A 27 -4.937 4.097 -11.001 1.00 0.00 O ATOM 376 CB ALA A 27 -4.203 6.638 -9.113 1.00 0.00 C ATOM 0 H ALA A 27 -6.255 5.396 -8.564 1.00 0.00 H new ATOM 0 HA ALA A 27 -5.561 7.234 -10.688 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -3.321 7.041 -9.611 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -4.586 7.371 -8.403 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -3.934 5.725 -8.582 1.00 0.00 H new ATOM 382 N PRO A 28 -3.996 5.762 -12.202 1.00 0.00 N ATOM 383 CA PRO A 28 -3.361 4.882 -13.175 1.00 0.00 C ATOM 384 C PRO A 28 -2.104 4.229 -12.602 1.00 0.00 C ATOM 385 O PRO A 28 -1.465 4.761 -11.691 1.00 0.00 O ATOM 386 CB PRO A 28 -2.963 5.781 -14.343 1.00 0.00 C ATOM 387 CG PRO A 28 -2.703 7.117 -13.652 1.00 0.00 C ATOM 388 CD PRO A 28 -3.690 7.154 -12.501 1.00 0.00 C ATOM 0 HA PRO A 28 -4.040 4.080 -13.466 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -2.077 5.410 -14.858 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -3.756 5.856 -15.087 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.675 7.185 -13.295 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -2.859 7.953 -14.334 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -3.262 7.656 -11.634 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -4.591 7.703 -12.775 1.00 0.00 H new ATOM 396 N VAL A 29 -1.679 3.128 -13.226 1.00 0.00 N ATOM 397 CA VAL A 29 -0.494 2.386 -12.813 1.00 0.00 C ATOM 398 C VAL A 29 0.778 3.221 -12.931 1.00 0.00 C ATOM 399 O VAL A 29 1.645 3.088 -12.069 1.00 0.00 O ATOM 400 CB VAL A 29 -0.365 1.062 -13.589 1.00 0.00 C ATOM 401 CG1 VAL A 29 0.773 0.206 -13.012 1.00 0.00 C ATOM 402 CG2 VAL A 29 -1.675 0.270 -13.505 1.00 0.00 C ATOM 0 H VAL A 29 -2.152 2.727 -14.036 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.621 2.146 -11.757 1.00 0.00 H new ATOM 0 HB VAL A 29 -0.145 1.300 -14.630 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.848 -0.725 -13.573 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.713 0.752 -13.087 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.566 -0.017 -11.965 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.572 -0.664 -14.057 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.902 0.051 -12.462 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.484 0.859 -13.936 1.00 0.00 H new ATOM 412 N TYR A 30 0.890 4.105 -13.930 1.00 0.00 N ATOM 413 CA TYR A 30 2.125 4.858 -14.107 1.00 0.00 C ATOM 414 C TYR A 30 2.423 5.745 -12.900 1.00 0.00 C ATOM 415 O TYR A 30 3.591 5.975 -12.602 1.00 0.00 O ATOM 416 CB TYR A 30 2.155 5.654 -15.418 1.00 0.00 C ATOM 417 CG TYR A 30 1.185 6.815 -15.491 1.00 0.00 C ATOM 418 CD1 TYR A 30 1.504 8.062 -14.909 1.00 0.00 C ATOM 419 CD2 TYR A 30 -0.041 6.649 -16.153 1.00 0.00 C ATOM 420 CE1 TYR A 30 0.583 9.125 -14.961 1.00 0.00 C ATOM 421 CE2 TYR A 30 -0.950 7.710 -16.227 1.00 0.00 C ATOM 422 CZ TYR A 30 -0.657 8.946 -15.615 1.00 0.00 C ATOM 423 OH TYR A 30 -1.615 9.911 -15.611 1.00 0.00 O ATOM 0 H TYR A 30 0.157 4.309 -14.610 1.00 0.00 H new ATOM 0 HA TYR A 30 2.925 4.121 -14.179 1.00 0.00 H new ATOM 0 HB2 TYR A 30 3.165 6.035 -15.570 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.944 4.973 -16.243 1.00 0.00 H new ATOM 0 HD1 TYR A 30 2.458 8.200 -14.422 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -0.284 5.699 -16.607 1.00 0.00 H new ATOM 0 HE1 TYR A 30 0.823 10.073 -14.503 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -1.882 7.581 -16.757 1.00 0.00 H new ATOM 0 HH TYR A 30 -2.395 9.599 -16.116 1.00 0.00 H new ATOM 433 N LYS A 31 1.417 6.219 -12.161 1.00 0.00 N ATOM 434 CA LYS A 31 1.706 6.975 -10.949 1.00 0.00 C ATOM 435 C LYS A 31 2.226 6.070 -9.829 1.00 0.00 C ATOM 436 O LYS A 31 2.885 6.589 -8.934 1.00 0.00 O ATOM 437 CB LYS A 31 0.483 7.772 -10.489 1.00 0.00 C ATOM 438 CG LYS A 31 0.091 8.920 -11.430 1.00 0.00 C ATOM 439 CD LYS A 31 -0.938 9.828 -10.749 1.00 0.00 C ATOM 440 CE LYS A 31 -1.138 11.118 -11.544 1.00 0.00 C ATOM 441 NZ LYS A 31 -2.182 11.956 -10.924 1.00 0.00 N ATOM 0 H LYS A 31 0.427 6.097 -12.374 1.00 0.00 H new ATOM 0 HA LYS A 31 2.498 7.684 -11.190 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -0.364 7.093 -10.390 1.00 0.00 H new ATOM 0 HB3 LYS A 31 0.681 8.181 -9.498 1.00 0.00 H new ATOM 0 HG2 LYS A 31 0.975 9.497 -11.700 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -0.322 8.518 -12.355 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -1.888 9.302 -10.657 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.606 10.067 -9.739 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -0.200 11.672 -11.590 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -1.418 10.879 -12.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -2.303 12.827 -11.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -3.080 11.432 -10.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -1.900 12.200 -9.953 1.00 0.00 H new ATOM 455 N LEU A 32 1.918 4.763 -9.837 1.00 0.00 N ATOM 456 CA LEU A 32 2.281 3.804 -8.798 1.00 0.00 C ATOM 457 C LEU A 32 3.723 3.318 -8.993 1.00 0.00 C ATOM 458 O LEU A 32 4.464 3.176 -8.022 1.00 0.00 O ATOM 459 CB LEU A 32 1.332 2.581 -8.819 1.00 0.00 C ATOM 460 CG LEU A 32 -0.185 2.841 -8.913 1.00 0.00 C ATOM 461 CD1 LEU A 32 -0.955 1.519 -8.995 1.00 0.00 C ATOM 462 CD2 LEU A 32 -0.751 3.635 -7.736 1.00 0.00 C ATOM 0 H LEU A 32 1.390 4.336 -10.598 1.00 0.00 H new ATOM 0 HA LEU A 32 2.193 4.311 -7.837 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.616 1.953 -9.664 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.516 2.001 -7.915 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.314 3.436 -9.817 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.024 1.724 -9.061 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.636 0.967 -9.879 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.754 0.925 -8.104 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.823 3.777 -7.875 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.574 3.088 -6.810 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.260 4.607 -7.683 1.00 0.00 H new ATOM 474 N GLU A 33 4.130 3.032 -10.234 1.00 0.00 N ATOM 475 CA GLU A 33 5.435 2.423 -10.531 1.00 0.00 C ATOM 476 C GLU A 33 6.621 3.310 -10.144 1.00 0.00 C ATOM 477 O GLU A 33 7.709 2.814 -9.863 1.00 0.00 O ATOM 478 CB GLU A 33 5.549 2.057 -12.010 1.00 0.00 C ATOM 479 CG GLU A 33 5.369 3.259 -12.946 1.00 0.00 C ATOM 480 CD GLU A 33 6.497 3.473 -13.941 1.00 0.00 C ATOM 481 OE1 GLU A 33 6.751 2.523 -14.712 1.00 0.00 O ATOM 482 OE2 GLU A 33 7.032 4.613 -13.982 1.00 0.00 O ATOM 0 H GLU A 33 3.565 3.216 -11.063 1.00 0.00 H new ATOM 0 HA GLU A 33 5.480 1.523 -9.918 1.00 0.00 H new ATOM 0 HB2 GLU A 33 6.525 1.606 -12.192 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.800 1.303 -12.250 1.00 0.00 H new ATOM 0 HG2 GLU A 33 4.437 3.134 -13.497 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.263 4.159 -12.341 1.00 0.00 H new ATOM 489 N GLU A 34 6.394 4.617 -10.119 1.00 0.00 N ATOM 490 CA GLU A 34 7.390 5.623 -9.777 1.00 0.00 C ATOM 491 C GLU A 34 7.840 5.460 -8.319 1.00 0.00 C ATOM 492 O GLU A 34 9.016 5.619 -8.000 1.00 0.00 O ATOM 493 CB GLU A 34 6.764 6.991 -10.079 1.00 0.00 C ATOM 494 CG GLU A 34 7.432 8.175 -9.378 1.00 0.00 C ATOM 495 CD GLU A 34 7.061 9.501 -10.040 1.00 0.00 C ATOM 496 OE1 GLU A 34 5.859 9.701 -10.332 1.00 0.00 O ATOM 497 OE2 GLU A 34 7.938 10.370 -10.229 1.00 0.00 O ATOM 0 H GLU A 34 5.483 5.018 -10.343 1.00 0.00 H new ATOM 0 HA GLU A 34 8.300 5.515 -10.368 1.00 0.00 H new ATOM 0 HB2 GLU A 34 6.797 7.159 -11.155 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.713 6.964 -9.793 1.00 0.00 H new ATOM 0 HG2 GLU A 34 7.133 8.194 -8.330 1.00 0.00 H new ATOM 0 HG3 GLU A 34 8.514 8.048 -9.398 1.00 0.00 H new ATOM 504 N ILE A 35 6.917 5.104 -7.426 1.00 0.00 N ATOM 505 CA ILE A 35 7.232 4.815 -6.029 1.00 0.00 C ATOM 506 C ILE A 35 8.154 3.595 -5.991 1.00 0.00 C ATOM 507 O ILE A 35 9.131 3.566 -5.242 1.00 0.00 O ATOM 508 CB ILE A 35 5.930 4.592 -5.222 1.00 0.00 C ATOM 509 CG1 ILE A 35 5.073 5.871 -5.095 1.00 0.00 C ATOM 510 CG2 ILE A 35 6.248 4.102 -3.798 1.00 0.00 C ATOM 511 CD1 ILE A 35 4.334 6.343 -6.345 1.00 0.00 C ATOM 0 H ILE A 35 5.927 5.008 -7.653 1.00 0.00 H new ATOM 0 HA ILE A 35 7.746 5.657 -5.565 1.00 0.00 H new ATOM 0 HB ILE A 35 5.366 3.844 -5.778 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.336 5.707 -4.309 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.722 6.680 -4.760 1.00 0.00 H new ATOM 0 HG21 ILE A 35 5.319 3.952 -3.249 1.00 0.00 H new ATOM 0 HG22 ILE A 35 6.794 3.160 -3.851 1.00 0.00 H new ATOM 0 HG23 ILE A 35 6.857 4.846 -3.285 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.773 7.249 -6.116 1.00 0.00 H new ATOM 0 HD12 ILE A 35 5.054 6.553 -7.136 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.647 5.565 -6.677 1.00 0.00 H new ATOM 523 N CYS A 36 7.819 2.585 -6.795 1.00 0.00 N ATOM 524 CA CYS A 36 8.563 1.345 -6.889 1.00 0.00 C ATOM 525 C CYS A 36 9.973 1.582 -7.444 1.00 0.00 C ATOM 526 O CYS A 36 10.847 0.750 -7.194 1.00 0.00 O ATOM 527 CB CYS A 36 7.802 0.342 -7.775 1.00 0.00 C ATOM 528 SG CYS A 36 6.028 0.245 -7.368 1.00 0.00 S ATOM 0 H CYS A 36 7.005 2.615 -7.409 1.00 0.00 H new ATOM 0 HA CYS A 36 8.665 0.932 -5.885 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.915 0.629 -8.820 1.00 0.00 H new ATOM 0 HB3 CYS A 36 8.250 -0.646 -7.665 1.00 0.00 H new ATOM 0 HG CYS A 36 5.460 1.385 -7.628 1.00 0.00 H new ATOM 534 N ASP A 37 10.201 2.677 -8.181 1.00 0.00 N ATOM 535 CA ASP A 37 11.527 3.057 -8.650 1.00 0.00 C ATOM 536 C ASP A 37 12.340 3.612 -7.498 1.00 0.00 C ATOM 537 O ASP A 37 13.442 3.131 -7.227 1.00 0.00 O ATOM 538 CB ASP A 37 11.478 4.098 -9.778 1.00 0.00 C ATOM 539 CG ASP A 37 12.850 4.127 -10.471 1.00 0.00 C ATOM 540 OD1 ASP A 37 13.174 3.133 -11.159 1.00 0.00 O ATOM 541 OD2 ASP A 37 13.623 5.104 -10.308 1.00 0.00 O ATOM 0 H ASP A 37 9.464 3.322 -8.466 1.00 0.00 H new ATOM 0 HA ASP A 37 11.993 2.156 -9.050 1.00 0.00 H new ATOM 0 HB2 ASP A 37 10.697 3.845 -10.494 1.00 0.00 H new ATOM 0 HB3 ASP A 37 11.235 5.082 -9.376 1.00 0.00 H new ATOM 546 N LEU A 38 11.770 4.602 -6.796 1.00 0.00 N ATOM 547 CA LEU A 38 12.504 5.349 -5.794 1.00 0.00 C ATOM 548 C LEU A 38 13.094 4.418 -4.756 1.00 0.00 C ATOM 549 O LEU A 38 14.274 4.531 -4.441 1.00 0.00 O ATOM 550 CB LEU A 38 11.672 6.421 -5.109 1.00 0.00 C ATOM 551 CG LEU A 38 11.411 7.626 -6.019 1.00 0.00 C ATOM 552 CD1 LEU A 38 10.967 8.848 -5.213 1.00 0.00 C ATOM 553 CD2 LEU A 38 12.543 8.129 -6.918 1.00 0.00 C ATOM 0 H LEU A 38 10.800 4.896 -6.912 1.00 0.00 H new ATOM 0 HA LEU A 38 13.304 5.861 -6.330 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.720 5.993 -4.795 1.00 0.00 H new ATOM 0 HB3 LEU A 38 12.185 6.754 -4.207 1.00 0.00 H new ATOM 0 HG LEU A 38 10.649 7.206 -6.675 1.00 0.00 H new ATOM 0 HD11 LEU A 38 10.790 9.685 -5.889 1.00 0.00 H new ATOM 0 HD12 LEU A 38 10.048 8.615 -4.676 1.00 0.00 H new ATOM 0 HD13 LEU A 38 11.746 9.116 -4.500 1.00 0.00 H new ATOM 0 HD21 LEU A 38 12.195 8.985 -7.496 1.00 0.00 H new ATOM 0 HD22 LEU A 38 13.391 8.428 -6.302 1.00 0.00 H new ATOM 0 HD23 LEU A 38 12.850 7.333 -7.597 1.00 0.00 H new ATOM 565 N LEU A 39 12.274 3.509 -4.226 1.00 0.00 N ATOM 566 CA LEU A 39 12.661 2.570 -3.184 1.00 0.00 C ATOM 567 C LEU A 39 13.856 1.719 -3.599 1.00 0.00 C ATOM 568 O LEU A 39 14.751 1.508 -2.781 1.00 0.00 O ATOM 569 CB LEU A 39 11.479 1.659 -2.853 1.00 0.00 C ATOM 570 CG LEU A 39 10.358 2.364 -2.093 1.00 0.00 C ATOM 571 CD1 LEU A 39 8.975 1.787 -2.374 1.00 0.00 C ATOM 572 CD2 LEU A 39 10.648 2.214 -0.615 1.00 0.00 C ATOM 0 H LEU A 39 11.302 3.407 -4.519 1.00 0.00 H new ATOM 0 HA LEU A 39 12.951 3.148 -2.307 1.00 0.00 H new ATOM 0 HB2 LEU A 39 11.077 1.249 -3.779 1.00 0.00 H new ATOM 0 HB3 LEU A 39 11.835 0.817 -2.260 1.00 0.00 H new ATOM 0 HG LEU A 39 10.337 3.404 -2.419 1.00 0.00 H new ATOM 0 HD11 LEU A 39 8.228 2.336 -1.801 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.753 1.875 -3.438 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.954 0.736 -2.085 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.865 2.707 -0.039 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.677 1.156 -0.356 1.00 0.00 H new ATOM 0 HD23 LEU A 39 11.610 2.671 -0.385 1.00 0.00 H new ATOM 584 N ARG A 40 13.896 1.214 -4.838 1.00 0.00 N ATOM 585 CA ARG A 40 15.048 0.458 -5.325 1.00 0.00 C ATOM 586 C ARG A 40 16.270 1.368 -5.356 1.00 0.00 C ATOM 587 O ARG A 40 17.341 0.981 -4.888 1.00 0.00 O ATOM 588 CB ARG A 40 14.771 -0.126 -6.716 1.00 0.00 C ATOM 589 CG ARG A 40 13.706 -1.233 -6.686 1.00 0.00 C ATOM 590 CD ARG A 40 13.496 -1.850 -8.073 1.00 0.00 C ATOM 591 NE ARG A 40 14.656 -2.646 -8.502 1.00 0.00 N ATOM 592 CZ ARG A 40 14.770 -3.320 -9.649 1.00 0.00 C ATOM 593 NH1 ARG A 40 13.851 -3.226 -10.602 1.00 0.00 N ATOM 594 NH2 ARG A 40 15.823 -4.097 -9.838 1.00 0.00 N ATOM 0 H ARG A 40 13.143 1.317 -5.518 1.00 0.00 H new ATOM 0 HA ARG A 40 15.238 -0.376 -4.650 1.00 0.00 H new ATOM 0 HB2 ARG A 40 14.443 0.671 -7.383 1.00 0.00 H new ATOM 0 HB3 ARG A 40 15.696 -0.527 -7.129 1.00 0.00 H new ATOM 0 HG2 ARG A 40 14.007 -2.010 -5.983 1.00 0.00 H new ATOM 0 HG3 ARG A 40 12.764 -0.823 -6.323 1.00 0.00 H new ATOM 0 HD2 ARG A 40 12.608 -2.482 -8.058 1.00 0.00 H new ATOM 0 HD3 ARG A 40 13.311 -1.058 -8.798 1.00 0.00 H new ATOM 0 HE ARG A 40 15.449 -2.687 -7.862 1.00 0.00 H new ATOM 0 HH11 ARG A 40 13.035 -2.629 -10.467 1.00 0.00 H new ATOM 0 HH12 ARG A 40 13.961 -3.751 -11.470 1.00 0.00 H new ATOM 0 HH21 ARG A 40 16.535 -4.176 -9.112 1.00 0.00 H new ATOM 0 HH22 ARG A 40 15.923 -4.618 -10.709 1.00 0.00 H new ATOM 608 N SER A 41 16.101 2.592 -5.851 1.00 0.00 N ATOM 609 CA SER A 41 17.144 3.601 -5.924 1.00 0.00 C ATOM 610 C SER A 41 17.505 4.215 -4.560 1.00 0.00 C ATOM 611 O SER A 41 18.274 5.177 -4.529 1.00 0.00 O ATOM 612 CB SER A 41 16.700 4.677 -6.925 1.00 0.00 C ATOM 613 OG SER A 41 17.800 5.124 -7.699 1.00 0.00 O ATOM 0 H SER A 41 15.207 2.914 -6.222 1.00 0.00 H new ATOM 0 HA SER A 41 18.062 3.119 -6.262 1.00 0.00 H new ATOM 0 HB2 SER A 41 15.927 4.275 -7.580 1.00 0.00 H new ATOM 0 HB3 SER A 41 16.259 5.518 -6.391 1.00 0.00 H new ATOM 0 HG SER A 41 17.498 5.808 -8.332 1.00 0.00 H new ATOM 619 N SER A 42 16.984 3.709 -3.438 1.00 0.00 N ATOM 620 CA SER A 42 17.105 4.328 -2.124 1.00 0.00 C ATOM 621 C SER A 42 17.791 3.419 -1.105 1.00 0.00 C ATOM 622 O SER A 42 17.918 2.208 -1.322 1.00 0.00 O ATOM 623 CB SER A 42 15.701 4.647 -1.630 1.00 0.00 C ATOM 624 OG SER A 42 15.153 5.751 -2.313 1.00 0.00 O ATOM 0 H SER A 42 16.455 2.837 -3.423 1.00 0.00 H new ATOM 0 HA SER A 42 17.720 5.223 -2.223 1.00 0.00 H new ATOM 0 HB2 SER A 42 15.059 3.777 -1.768 1.00 0.00 H new ATOM 0 HB3 SER A 42 15.729 4.856 -0.561 1.00 0.00 H new ATOM 0 HG SER A 42 14.798 5.457 -3.178 1.00 0.00 H new ATOM 630 N HIS A 43 18.189 4.007 0.028 1.00 0.00 N ATOM 631 CA HIS A 43 18.608 3.286 1.225 1.00 0.00 C ATOM 632 C HIS A 43 17.388 2.848 2.054 1.00 0.00 C ATOM 633 O HIS A 43 16.275 3.338 1.850 1.00 0.00 O ATOM 634 CB HIS A 43 19.590 4.159 2.018 1.00 0.00 C ATOM 635 CG HIS A 43 20.342 3.417 3.092 1.00 0.00 C ATOM 636 ND1 HIS A 43 20.288 3.683 4.437 1.00 0.00 N ATOM 637 CD2 HIS A 43 21.227 2.390 2.910 1.00 0.00 C ATOM 638 CE1 HIS A 43 21.100 2.822 5.066 1.00 0.00 C ATOM 639 NE2 HIS A 43 21.681 1.994 4.177 1.00 0.00 N ATOM 0 H HIS A 43 18.228 5.020 0.136 1.00 0.00 H new ATOM 0 HA HIS A 43 19.127 2.368 0.948 1.00 0.00 H new ATOM 0 HB2 HIS A 43 20.307 4.601 1.326 1.00 0.00 H new ATOM 0 HB3 HIS A 43 19.040 4.981 2.476 1.00 0.00 H new ATOM 0 HD2 HIS A 43 21.522 1.962 1.963 1.00 0.00 H new ATOM 0 HE1 HIS A 43 21.265 2.796 6.133 1.00 0.00 H new ATOM 0 HE2 HIS A 43 22.324 1.230 4.384 1.00 0.00 H new ATOM 647 N VAL A 44 17.591 1.952 3.025 1.00 0.00 N ATOM 648 CA VAL A 44 16.525 1.395 3.859 1.00 0.00 C ATOM 649 C VAL A 44 15.785 2.471 4.665 1.00 0.00 C ATOM 650 O VAL A 44 14.582 2.340 4.864 1.00 0.00 O ATOM 651 CB VAL A 44 17.083 0.255 4.738 1.00 0.00 C ATOM 652 CG1 VAL A 44 18.113 0.726 5.773 1.00 0.00 C ATOM 653 CG2 VAL A 44 15.973 -0.522 5.456 1.00 0.00 C ATOM 0 H VAL A 44 18.516 1.589 3.256 1.00 0.00 H new ATOM 0 HA VAL A 44 15.767 0.966 3.204 1.00 0.00 H new ATOM 0 HB VAL A 44 17.591 -0.405 4.035 1.00 0.00 H new ATOM 0 HG11 VAL A 44 18.461 -0.128 6.354 1.00 0.00 H new ATOM 0 HG12 VAL A 44 18.958 1.186 5.262 1.00 0.00 H new ATOM 0 HG13 VAL A 44 17.652 1.455 6.440 1.00 0.00 H new ATOM 0 HG21 VAL A 44 16.416 -1.313 6.061 1.00 0.00 H new ATOM 0 HG22 VAL A 44 15.412 0.156 6.099 1.00 0.00 H new ATOM 0 HG23 VAL A 44 15.302 -0.962 4.719 1.00 0.00 H new ATOM 663 N SER A 45 16.444 3.560 5.069 1.00 0.00 N ATOM 664 CA SER A 45 15.773 4.645 5.783 1.00 0.00 C ATOM 665 C SER A 45 14.627 5.232 4.944 1.00 0.00 C ATOM 666 O SER A 45 13.635 5.718 5.480 1.00 0.00 O ATOM 667 CB SER A 45 16.819 5.710 6.123 1.00 0.00 C ATOM 668 OG SER A 45 16.410 6.538 7.190 1.00 0.00 O ATOM 0 H SER A 45 17.440 3.712 4.913 1.00 0.00 H new ATOM 0 HA SER A 45 15.325 4.266 6.701 1.00 0.00 H new ATOM 0 HB2 SER A 45 17.759 5.223 6.383 1.00 0.00 H new ATOM 0 HB3 SER A 45 17.010 6.323 5.242 1.00 0.00 H new ATOM 0 HG SER A 45 17.107 7.202 7.375 1.00 0.00 H new ATOM 674 N ILE A 46 14.746 5.183 3.615 1.00 0.00 N ATOM 675 CA ILE A 46 13.731 5.702 2.718 1.00 0.00 C ATOM 676 C ILE A 46 12.598 4.694 2.576 1.00 0.00 C ATOM 677 O ILE A 46 11.441 5.099 2.463 1.00 0.00 O ATOM 678 CB ILE A 46 14.336 5.977 1.338 1.00 0.00 C ATOM 679 CG1 ILE A 46 15.745 6.606 1.337 1.00 0.00 C ATOM 680 CG2 ILE A 46 13.387 6.854 0.530 1.00 0.00 C ATOM 681 CD1 ILE A 46 15.883 7.877 2.161 1.00 0.00 C ATOM 0 H ILE A 46 15.553 4.780 3.138 1.00 0.00 H new ATOM 0 HA ILE A 46 13.343 6.632 3.134 1.00 0.00 H new ATOM 0 HB ILE A 46 14.464 4.994 0.885 1.00 0.00 H new ATOM 0 HG12 ILE A 46 16.455 5.869 1.712 1.00 0.00 H new ATOM 0 HG13 ILE A 46 16.027 6.826 0.307 1.00 0.00 H new ATOM 0 HG21 ILE A 46 13.819 7.049 -0.452 1.00 0.00 H new ATOM 0 HG22 ILE A 46 12.432 6.343 0.411 1.00 0.00 H new ATOM 0 HG23 ILE A 46 13.231 7.798 1.052 1.00 0.00 H new ATOM 0 HD11 ILE A 46 16.908 8.242 2.097 1.00 0.00 H new ATOM 0 HD12 ILE A 46 15.203 8.636 1.775 1.00 0.00 H new ATOM 0 HD13 ILE A 46 15.637 7.665 3.202 1.00 0.00 H new ATOM 693 N VAL A 47 12.919 3.392 2.568 1.00 0.00 N ATOM 694 CA VAL A 47 11.901 2.353 2.620 1.00 0.00 C ATOM 695 C VAL A 47 11.021 2.630 3.833 1.00 0.00 C ATOM 696 O VAL A 47 9.801 2.569 3.713 1.00 0.00 O ATOM 697 CB VAL A 47 12.500 0.936 2.732 1.00 0.00 C ATOM 698 CG1 VAL A 47 11.387 -0.099 2.919 1.00 0.00 C ATOM 699 CG2 VAL A 47 13.324 0.548 1.494 1.00 0.00 C ATOM 0 H VAL A 47 13.876 3.042 2.526 1.00 0.00 H new ATOM 0 HA VAL A 47 11.332 2.379 1.691 1.00 0.00 H new ATOM 0 HB VAL A 47 13.163 0.947 3.597 1.00 0.00 H new ATOM 0 HG11 VAL A 47 11.825 -1.094 2.996 1.00 0.00 H new ATOM 0 HG12 VAL A 47 10.831 0.125 3.830 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.712 -0.065 2.064 1.00 0.00 H new ATOM 0 HG21 VAL A 47 13.723 -0.458 1.623 1.00 0.00 H new ATOM 0 HG22 VAL A 47 12.687 0.575 0.610 1.00 0.00 H new ATOM 0 HG23 VAL A 47 14.147 1.252 1.369 1.00 0.00 H new ATOM 709 N LYS A 48 11.637 2.910 4.986 1.00 0.00 N ATOM 710 CA LYS A 48 10.905 3.123 6.218 1.00 0.00 C ATOM 711 C LYS A 48 9.948 4.296 6.083 1.00 0.00 C ATOM 712 O LYS A 48 8.789 4.140 6.457 1.00 0.00 O ATOM 713 CB LYS A 48 11.858 3.374 7.390 1.00 0.00 C ATOM 714 CG LYS A 48 12.647 2.139 7.841 1.00 0.00 C ATOM 715 CD LYS A 48 13.525 2.556 9.028 1.00 0.00 C ATOM 716 CE LYS A 48 14.033 1.359 9.830 1.00 0.00 C ATOM 717 NZ LYS A 48 14.689 1.816 11.069 1.00 0.00 N ATOM 0 H LYS A 48 12.649 2.993 5.082 1.00 0.00 H new ATOM 0 HA LYS A 48 10.333 2.217 6.418 1.00 0.00 H new ATOM 0 HB2 LYS A 48 12.562 4.157 7.109 1.00 0.00 H new ATOM 0 HB3 LYS A 48 11.283 3.751 8.236 1.00 0.00 H new ATOM 0 HG2 LYS A 48 11.969 1.336 8.130 1.00 0.00 H new ATOM 0 HG3 LYS A 48 13.262 1.759 7.025 1.00 0.00 H new ATOM 0 HD2 LYS A 48 14.376 3.131 8.662 1.00 0.00 H new ATOM 0 HD3 LYS A 48 12.955 3.213 9.684 1.00 0.00 H new ATOM 0 HE2 LYS A 48 13.202 0.696 10.073 1.00 0.00 H new ATOM 0 HE3 LYS A 48 14.736 0.782 9.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 15.030 0.993 11.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 15.493 2.431 10.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 14.007 2.347 11.647 1.00 0.00 H new ATOM 731 N GLU A 49 10.408 5.435 5.562 1.00 0.00 N ATOM 732 CA GLU A 49 9.557 6.599 5.351 1.00 0.00 C ATOM 733 C GLU A 49 8.362 6.209 4.481 1.00 0.00 C ATOM 734 O GLU A 49 7.209 6.445 4.846 1.00 0.00 O ATOM 735 CB GLU A 49 10.359 7.737 4.688 1.00 0.00 C ATOM 736 CG GLU A 49 10.248 9.060 5.456 1.00 0.00 C ATOM 737 CD GLU A 49 11.260 9.128 6.597 1.00 0.00 C ATOM 738 OE1 GLU A 49 12.464 9.367 6.320 1.00 0.00 O ATOM 739 OE2 GLU A 49 10.841 8.939 7.761 1.00 0.00 O ATOM 0 H GLU A 49 11.378 5.573 5.277 1.00 0.00 H new ATOM 0 HA GLU A 49 9.193 6.955 6.315 1.00 0.00 H new ATOM 0 HB2 GLU A 49 11.407 7.447 4.621 1.00 0.00 H new ATOM 0 HB3 GLU A 49 10.002 7.882 3.668 1.00 0.00 H new ATOM 0 HG2 GLU A 49 10.411 9.894 4.773 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.239 9.167 5.855 1.00 0.00 H new ATOM 746 N PHE A 50 8.655 5.600 3.330 1.00 0.00 N ATOM 747 CA PHE A 50 7.657 5.200 2.360 1.00 0.00 C ATOM 748 C PHE A 50 6.648 4.231 2.951 1.00 0.00 C ATOM 749 O PHE A 50 5.456 4.392 2.686 1.00 0.00 O ATOM 750 CB PHE A 50 8.326 4.569 1.142 1.00 0.00 C ATOM 751 CG PHE A 50 8.615 5.499 -0.017 1.00 0.00 C ATOM 752 CD1 PHE A 50 7.582 6.274 -0.579 1.00 0.00 C ATOM 753 CD2 PHE A 50 9.882 5.481 -0.623 1.00 0.00 C ATOM 754 CE1 PHE A 50 7.790 6.953 -1.791 1.00 0.00 C ATOM 755 CE2 PHE A 50 10.082 6.122 -1.853 1.00 0.00 C ATOM 756 CZ PHE A 50 9.018 6.812 -2.457 1.00 0.00 C ATOM 0 H PHE A 50 9.609 5.372 3.050 1.00 0.00 H new ATOM 0 HA PHE A 50 7.120 6.099 2.057 1.00 0.00 H new ATOM 0 HB2 PHE A 50 9.265 4.118 1.462 1.00 0.00 H new ATOM 0 HB3 PHE A 50 7.690 3.760 0.782 1.00 0.00 H new ATOM 0 HD1 PHE A 50 6.628 6.346 -0.077 1.00 0.00 H new ATOM 0 HD2 PHE A 50 10.703 4.972 -0.140 1.00 0.00 H new ATOM 0 HE1 PHE A 50 7.013 7.577 -2.207 1.00 0.00 H new ATOM 0 HE2 PHE A 50 11.048 6.086 -2.334 1.00 0.00 H new ATOM 0 HZ PHE A 50 9.145 7.237 -3.441 1.00 0.00 H new ATOM 766 N SER A 51 7.105 3.224 3.703 1.00 0.00 N ATOM 767 CA SER A 51 6.219 2.230 4.264 1.00 0.00 C ATOM 768 C SER A 51 5.202 2.959 5.115 1.00 0.00 C ATOM 769 O SER A 51 4.019 2.793 4.874 1.00 0.00 O ATOM 770 CB SER A 51 6.975 1.106 4.999 1.00 0.00 C ATOM 771 OG SER A 51 7.409 1.425 6.304 1.00 0.00 O ATOM 0 H SER A 51 8.090 3.086 3.931 1.00 0.00 H new ATOM 0 HA SER A 51 5.694 1.695 3.473 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.328 0.230 5.053 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.844 0.825 4.403 1.00 0.00 H new ATOM 0 HG SER A 51 7.845 2.303 6.298 1.00 0.00 H new ATOM 777 N GLU A 52 5.642 3.802 6.050 1.00 0.00 N ATOM 778 CA GLU A 52 4.714 4.549 6.894 1.00 0.00 C ATOM 779 C GLU A 52 3.675 5.314 6.074 1.00 0.00 C ATOM 780 O GLU A 52 2.488 5.158 6.352 1.00 0.00 O ATOM 781 CB GLU A 52 5.448 5.497 7.850 1.00 0.00 C ATOM 782 CG GLU A 52 6.406 4.750 8.775 1.00 0.00 C ATOM 783 CD GLU A 52 5.768 3.681 9.648 1.00 0.00 C ATOM 784 OE1 GLU A 52 5.677 2.515 9.201 1.00 0.00 O ATOM 785 OE2 GLU A 52 5.457 3.986 10.820 1.00 0.00 O ATOM 0 H GLU A 52 6.628 3.983 6.240 1.00 0.00 H new ATOM 0 HA GLU A 52 4.184 3.809 7.493 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.004 6.235 7.272 1.00 0.00 H new ATOM 0 HB3 GLU A 52 4.719 6.044 8.448 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.182 4.284 8.167 1.00 0.00 H new ATOM 0 HG3 GLU A 52 6.900 5.476 9.421 1.00 0.00 H new ATOM 792 N PHE A 53 4.088 6.079 5.056 1.00 0.00 N ATOM 793 CA PHE A 53 3.173 6.853 4.221 1.00 0.00 C ATOM 794 C PHE A 53 2.081 5.972 3.591 1.00 0.00 C ATOM 795 O PHE A 53 0.947 6.424 3.411 1.00 0.00 O ATOM 796 CB PHE A 53 3.981 7.576 3.130 1.00 0.00 C ATOM 797 CG PHE A 53 5.074 8.530 3.588 1.00 0.00 C ATOM 798 CD1 PHE A 53 4.951 9.262 4.787 1.00 0.00 C ATOM 799 CD2 PHE A 53 6.233 8.688 2.799 1.00 0.00 C ATOM 800 CE1 PHE A 53 5.981 10.126 5.192 1.00 0.00 C ATOM 801 CE2 PHE A 53 7.271 9.538 3.222 1.00 0.00 C ATOM 802 CZ PHE A 53 7.143 10.265 4.417 1.00 0.00 C ATOM 0 H PHE A 53 5.068 6.176 4.791 1.00 0.00 H new ATOM 0 HA PHE A 53 2.664 7.582 4.852 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.439 6.820 2.492 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.283 8.137 2.509 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.064 9.158 5.394 1.00 0.00 H new ATOM 0 HD2 PHE A 53 6.324 8.153 1.865 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.878 10.689 6.108 1.00 0.00 H new ATOM 0 HE2 PHE A 53 8.168 9.632 2.627 1.00 0.00 H new ATOM 0 HZ PHE A 53 7.934 10.927 4.738 1.00 0.00 H new ATOM 812 N ILE A 54 2.422 4.729 3.244 1.00 0.00 N ATOM 813 CA ILE A 54 1.508 3.737 2.693 1.00 0.00 C ATOM 814 C ILE A 54 0.627 3.174 3.808 1.00 0.00 C ATOM 815 O ILE A 54 -0.593 3.125 3.669 1.00 0.00 O ATOM 816 CB ILE A 54 2.308 2.637 1.962 1.00 0.00 C ATOM 817 CG1 ILE A 54 3.090 3.220 0.759 1.00 0.00 C ATOM 818 CG2 ILE A 54 1.383 1.524 1.453 1.00 0.00 C ATOM 819 CD1 ILE A 54 4.278 2.350 0.339 1.00 0.00 C ATOM 0 H ILE A 54 3.374 4.378 3.344 1.00 0.00 H new ATOM 0 HA ILE A 54 0.849 4.200 1.959 1.00 0.00 H new ATOM 0 HB ILE A 54 3.010 2.223 2.686 1.00 0.00 H new ATOM 0 HG12 ILE A 54 2.412 3.333 -0.087 1.00 0.00 H new ATOM 0 HG13 ILE A 54 3.449 4.217 1.015 1.00 0.00 H new ATOM 0 HG21 ILE A 54 1.975 0.764 0.943 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.860 1.072 2.296 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.656 1.945 0.758 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.785 2.811 -0.508 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.974 2.258 1.173 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.921 1.360 0.053 1.00 0.00 H new ATOM 831 N LEU A 55 1.240 2.701 4.889 1.00 0.00 N ATOM 832 CA LEU A 55 0.599 1.922 5.935 1.00 0.00 C ATOM 833 C LEU A 55 -0.412 2.765 6.694 1.00 0.00 C ATOM 834 O LEU A 55 -1.486 2.274 7.056 1.00 0.00 O ATOM 835 CB LEU A 55 1.643 1.430 6.940 1.00 0.00 C ATOM 836 CG LEU A 55 2.671 0.438 6.385 1.00 0.00 C ATOM 837 CD1 LEU A 55 3.894 0.498 7.300 1.00 0.00 C ATOM 838 CD2 LEU A 55 2.128 -0.989 6.267 1.00 0.00 C ATOM 0 H LEU A 55 2.233 2.857 5.064 1.00 0.00 H new ATOM 0 HA LEU A 55 0.098 1.080 5.457 1.00 0.00 H new ATOM 0 HB2 LEU A 55 2.175 2.294 7.338 1.00 0.00 H new ATOM 0 HB3 LEU A 55 1.125 0.961 7.777 1.00 0.00 H new ATOM 0 HG LEU A 55 2.931 0.721 5.365 1.00 0.00 H new ATOM 0 HD11 LEU A 55 4.653 -0.196 6.939 1.00 0.00 H new ATOM 0 HD12 LEU A 55 4.299 1.510 7.301 1.00 0.00 H new ATOM 0 HD13 LEU A 55 3.604 0.223 8.314 1.00 0.00 H new ATOM 0 HD21 LEU A 55 2.904 -1.642 5.868 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.825 -1.345 7.251 1.00 0.00 H new ATOM 0 HD23 LEU A 55 1.268 -0.997 5.597 1.00 0.00 H new ATOM 850 N LYS A 56 -0.061 4.023 6.972 1.00 0.00 N ATOM 851 CA LYS A 56 -0.927 4.950 7.691 1.00 0.00 C ATOM 852 C LYS A 56 -2.181 5.243 6.862 1.00 0.00 C ATOM 853 O LYS A 56 -3.218 5.589 7.424 1.00 0.00 O ATOM 854 CB LYS A 56 -0.174 6.256 8.007 1.00 0.00 C ATOM 855 CG LYS A 56 1.032 6.228 8.975 1.00 0.00 C ATOM 856 CD LYS A 56 1.263 4.983 9.841 1.00 0.00 C ATOM 857 CE LYS A 56 2.741 4.830 10.242 1.00 0.00 C ATOM 858 NZ LYS A 56 3.216 5.819 11.236 1.00 0.00 N ATOM 0 H LYS A 56 0.837 4.425 6.702 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.227 4.492 8.633 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.177 6.667 7.061 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -0.900 6.961 8.411 1.00 0.00 H new ATOM 0 HG2 LYS A 56 1.933 6.388 8.383 1.00 0.00 H new ATOM 0 HG3 LYS A 56 0.935 7.082 9.646 1.00 0.00 H new ATOM 0 HD2 LYS A 56 0.648 5.046 10.739 1.00 0.00 H new ATOM 0 HD3 LYS A 56 0.941 4.096 9.295 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.893 3.828 10.645 1.00 0.00 H new ATOM 0 HE3 LYS A 56 3.357 4.910 9.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 4.187 5.583 11.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 3.202 6.769 10.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 2.593 5.801 12.069 1.00 0.00 H new ATOM 872 N ARG A 57 -2.140 5.057 5.538 1.00 0.00 N ATOM 873 CA ARG A 57 -3.291 5.262 4.677 1.00 0.00 C ATOM 874 C ARG A 57 -4.431 4.328 5.035 1.00 0.00 C ATOM 875 O ARG A 57 -5.581 4.733 4.903 1.00 0.00 O ATOM 876 CB ARG A 57 -2.867 5.063 3.215 1.00 0.00 C ATOM 877 CG ARG A 57 -3.804 5.738 2.221 1.00 0.00 C ATOM 878 CD ARG A 57 -4.001 7.233 2.467 1.00 0.00 C ATOM 879 NE ARG A 57 -2.757 7.975 2.709 1.00 0.00 N ATOM 880 CZ ARG A 57 -2.560 9.251 2.364 1.00 0.00 C ATOM 881 NH1 ARG A 57 -3.523 10.019 1.867 1.00 0.00 N ATOM 882 NH2 ARG A 57 -1.355 9.784 2.474 1.00 0.00 N ATOM 0 H ARG A 57 -1.301 4.759 5.040 1.00 0.00 H new ATOM 0 HA ARG A 57 -3.655 6.280 4.818 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -1.859 5.456 3.079 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -2.825 3.996 2.998 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -3.412 5.595 1.214 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -4.775 5.243 2.259 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -4.508 7.667 1.605 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.661 7.364 3.324 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.992 7.484 3.171 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.461 9.640 1.734 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.325 10.988 1.618 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -0.578 9.221 2.822 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -1.202 10.758 2.211 1.00 0.00 H new ATOM 896 N LEU A 58 -4.142 3.108 5.493 1.00 0.00 N ATOM 897 CA LEU A 58 -5.194 2.160 5.835 1.00 0.00 C ATOM 898 C LEU A 58 -5.921 2.586 7.111 1.00 0.00 C ATOM 899 O LEU A 58 -7.056 2.168 7.352 1.00 0.00 O ATOM 900 CB LEU A 58 -4.652 0.722 5.951 1.00 0.00 C ATOM 901 CG LEU A 58 -4.212 0.057 4.629 1.00 0.00 C ATOM 902 CD1 LEU A 58 -5.293 0.097 3.546 1.00 0.00 C ATOM 903 CD2 LEU A 58 -2.959 0.667 4.002 1.00 0.00 C ATOM 0 H LEU A 58 -3.194 2.759 5.633 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.917 2.165 5.019 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.801 0.729 6.632 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -5.421 0.100 6.409 1.00 0.00 H new ATOM 0 HG LEU A 58 -4.007 -0.967 4.942 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -4.921 -0.386 2.643 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -6.181 -0.427 3.899 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -5.548 1.133 3.324 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.721 0.140 3.078 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -3.137 1.720 3.784 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.124 0.576 4.696 1.00 0.00 H new ATOM 915 N ASP A 59 -5.291 3.441 7.916 1.00 0.00 N ATOM 916 CA ASP A 59 -5.877 4.011 9.117 1.00 0.00 C ATOM 917 C ASP A 59 -6.807 5.184 8.786 1.00 0.00 C ATOM 918 O ASP A 59 -7.703 5.515 9.565 1.00 0.00 O ATOM 919 CB ASP A 59 -4.741 4.448 10.058 1.00 0.00 C ATOM 920 CG ASP A 59 -5.099 4.311 11.538 1.00 0.00 C ATOM 921 OD1 ASP A 59 -6.232 3.920 11.908 1.00 0.00 O ATOM 922 OD2 ASP A 59 -4.192 4.501 12.377 1.00 0.00 O ATOM 0 H ASP A 59 -4.338 3.760 7.743 1.00 0.00 H new ATOM 0 HA ASP A 59 -6.491 3.258 9.611 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -3.854 3.850 9.848 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -4.483 5.486 9.848 1.00 0.00 H new ATOM 927 N ASN A 60 -6.603 5.825 7.630 1.00 0.00 N ATOM 928 CA ASN A 60 -7.262 7.070 7.243 1.00 0.00 C ATOM 929 C ASN A 60 -8.763 6.871 7.000 1.00 0.00 C ATOM 930 O ASN A 60 -9.198 5.794 6.578 1.00 0.00 O ATOM 931 CB ASN A 60 -6.595 7.620 5.974 1.00 0.00 C ATOM 932 CG ASN A 60 -6.849 9.101 5.810 1.00 0.00 C ATOM 933 OD1 ASN A 60 -6.077 9.920 6.307 1.00 0.00 O ATOM 934 ND2 ASN A 60 -7.921 9.488 5.146 1.00 0.00 N ATOM 0 H ASN A 60 -5.956 5.480 6.921 1.00 0.00 H new ATOM 0 HA ASN A 60 -7.156 7.780 8.063 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -5.521 7.437 6.018 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -6.974 7.086 5.102 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -8.122 10.482 5.037 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -8.549 8.793 4.741 1.00 0.00 H new ATOM 941 N LYS A 61 -9.571 7.911 7.232 1.00 0.00 N ATOM 942 CA LYS A 61 -11.020 7.845 7.020 1.00 0.00 C ATOM 943 C LYS A 61 -11.350 7.776 5.528 1.00 0.00 C ATOM 944 O LYS A 61 -10.602 8.335 4.718 1.00 0.00 O ATOM 945 CB LYS A 61 -11.699 9.082 7.626 1.00 0.00 C ATOM 946 CG LYS A 61 -11.479 9.297 9.134 1.00 0.00 C ATOM 947 CD LYS A 61 -12.197 8.337 10.094 1.00 0.00 C ATOM 948 CE LYS A 61 -13.610 8.796 10.470 1.00 0.00 C ATOM 949 NZ LYS A 61 -14.565 8.666 9.357 1.00 0.00 N ATOM 0 H LYS A 61 -9.242 8.816 7.569 1.00 0.00 H new ATOM 0 HA LYS A 61 -11.390 6.943 7.508 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -11.341 9.965 7.097 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -12.771 9.012 7.441 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -10.409 9.234 9.331 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -11.789 10.313 9.379 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -12.254 7.350 9.634 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -11.603 8.232 11.002 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -13.964 8.210 11.318 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -13.575 9.836 10.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -15.534 8.640 9.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -14.464 9.479 8.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -14.372 7.787 8.835 1.00 0.00 H new ATOM 963 N SER A 62 -12.509 7.171 5.221 1.00 0.00 N ATOM 964 CA SER A 62 -13.178 6.909 3.945 1.00 0.00 C ATOM 965 C SER A 62 -12.873 5.476 3.551 1.00 0.00 C ATOM 966 O SER A 62 -11.742 5.022 3.724 1.00 0.00 O ATOM 967 CB SER A 62 -12.727 7.862 2.851 1.00 0.00 C ATOM 968 OG SER A 62 -13.382 7.617 1.624 1.00 0.00 O ATOM 0 H SER A 62 -13.079 6.801 5.982 1.00 0.00 H new ATOM 0 HA SER A 62 -14.250 7.064 4.067 1.00 0.00 H new ATOM 0 HB2 SER A 62 -12.919 8.888 3.164 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.650 7.767 2.711 1.00 0.00 H new ATOM 0 HG SER A 62 -13.063 8.253 0.950 1.00 0.00 H new ATOM 974 N PRO A 63 -13.832 4.730 2.987 1.00 0.00 N ATOM 975 CA PRO A 63 -13.535 3.435 2.409 1.00 0.00 C ATOM 976 C PRO A 63 -12.501 3.540 1.277 1.00 0.00 C ATOM 977 O PRO A 63 -11.626 2.685 1.178 1.00 0.00 O ATOM 978 CB PRO A 63 -14.898 2.879 1.999 1.00 0.00 C ATOM 979 CG PRO A 63 -15.741 4.118 1.709 1.00 0.00 C ATOM 980 CD PRO A 63 -15.218 5.107 2.737 1.00 0.00 C ATOM 0 HA PRO A 63 -13.049 2.750 3.103 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -14.818 2.238 1.121 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -15.337 2.277 2.794 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -15.600 4.477 0.690 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -16.806 3.925 1.835 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -15.283 6.129 2.364 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -15.806 5.064 3.654 1.00 0.00 H new ATOM 988 N ILE A 64 -12.560 4.578 0.445 1.00 0.00 N ATOM 989 CA ILE A 64 -11.815 4.653 -0.813 1.00 0.00 C ATOM 990 C ILE A 64 -10.327 4.711 -0.550 1.00 0.00 C ATOM 991 O ILE A 64 -9.547 4.028 -1.223 1.00 0.00 O ATOM 992 CB ILE A 64 -12.285 5.909 -1.566 1.00 0.00 C ATOM 993 CG1 ILE A 64 -13.740 5.765 -2.020 1.00 0.00 C ATOM 994 CG2 ILE A 64 -11.404 6.297 -2.746 1.00 0.00 C ATOM 995 CD1 ILE A 64 -14.554 7.039 -1.794 1.00 0.00 C ATOM 0 H ILE A 64 -13.133 5.402 0.627 1.00 0.00 H new ATOM 0 HA ILE A 64 -12.003 3.764 -1.415 1.00 0.00 H new ATOM 0 HB ILE A 64 -12.203 6.722 -0.845 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -13.763 5.507 -3.079 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -14.205 4.940 -1.480 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -11.806 7.192 -3.221 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -10.392 6.496 -2.394 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -11.383 5.481 -3.468 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -15.578 6.882 -2.133 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -14.557 7.285 -0.732 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -14.108 7.860 -2.355 1.00 0.00 H new ATOM 1007 N VAL A 65 -9.937 5.504 0.451 1.00 0.00 N ATOM 1008 CA VAL A 65 -8.536 5.733 0.729 1.00 0.00 C ATOM 1009 C VAL A 65 -7.845 4.399 1.025 1.00 0.00 C ATOM 1010 O VAL A 65 -6.624 4.283 0.876 1.00 0.00 O ATOM 1011 CB VAL A 65 -8.449 6.731 1.904 1.00 0.00 C ATOM 1012 CG1 VAL A 65 -8.533 6.039 3.266 1.00 0.00 C ATOM 1013 CG2 VAL A 65 -7.198 7.583 1.784 1.00 0.00 C ATOM 0 H VAL A 65 -10.578 5.993 1.076 1.00 0.00 H new ATOM 0 HA VAL A 65 -8.018 6.164 -0.128 1.00 0.00 H new ATOM 0 HB VAL A 65 -9.318 7.386 1.843 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.467 6.785 4.058 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -9.481 5.508 3.346 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.711 5.331 3.366 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.152 8.281 2.620 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.318 6.941 1.799 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.225 8.140 0.847 1.00 0.00 H new ATOM 1023 N LYS A 66 -8.619 3.415 1.514 1.00 0.00 N ATOM 1024 CA LYS A 66 -8.022 2.147 1.904 1.00 0.00 C ATOM 1025 C LYS A 66 -7.658 1.414 0.620 1.00 0.00 C ATOM 1026 O LYS A 66 -6.484 1.113 0.409 1.00 0.00 O ATOM 1027 CB LYS A 66 -8.936 1.266 2.778 1.00 0.00 C ATOM 1028 CG LYS A 66 -8.825 1.444 4.298 1.00 0.00 C ATOM 1029 CD LYS A 66 -9.749 2.493 4.906 1.00 0.00 C ATOM 1030 CE LYS A 66 -11.179 1.952 5.042 1.00 0.00 C ATOM 1031 NZ LYS A 66 -12.050 3.010 5.594 1.00 0.00 N ATOM 0 H LYS A 66 -9.629 3.478 1.642 1.00 0.00 H new ATOM 0 HA LYS A 66 -7.150 2.354 2.525 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -9.969 1.458 2.489 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -8.727 0.222 2.543 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -9.030 0.485 4.774 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -7.796 1.707 4.541 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -9.374 2.790 5.885 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -9.752 3.386 4.282 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -11.552 1.628 4.070 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -11.189 1.079 5.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -13.046 2.764 5.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -11.885 3.097 6.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -11.833 3.915 5.130 1.00 0.00 H new ATOM 1045 N GLN A 67 -8.653 1.095 -0.214 1.00 0.00 N ATOM 1046 CA GLN A 67 -8.488 0.300 -1.425 1.00 0.00 C ATOM 1047 C GLN A 67 -7.397 0.866 -2.334 1.00 0.00 C ATOM 1048 O GLN A 67 -6.608 0.095 -2.886 1.00 0.00 O ATOM 1049 CB GLN A 67 -9.859 0.184 -2.095 1.00 0.00 C ATOM 1050 CG GLN A 67 -9.883 -0.632 -3.403 1.00 0.00 C ATOM 1051 CD GLN A 67 -9.566 0.190 -4.655 1.00 0.00 C ATOM 1052 OE1 GLN A 67 -9.714 1.407 -4.689 1.00 0.00 O ATOM 1053 NE2 GLN A 67 -9.154 -0.443 -5.736 1.00 0.00 N ATOM 0 H GLN A 67 -9.616 1.392 -0.058 1.00 0.00 H new ATOM 0 HA GLN A 67 -8.135 -0.703 -1.184 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -10.553 -0.271 -1.389 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -10.229 1.187 -2.305 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -9.164 -1.447 -3.324 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -10.867 -1.086 -3.518 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -9.028 -1.455 -5.717 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -8.961 0.079 -6.591 1.00 0.00 H new ATOM 1062 N LYS A 68 -7.282 2.193 -2.418 1.00 0.00 N ATOM 1063 CA LYS A 68 -6.213 2.828 -3.174 1.00 0.00 C ATOM 1064 C LYS A 68 -4.821 2.428 -2.674 1.00 0.00 C ATOM 1065 O LYS A 68 -3.964 2.120 -3.506 1.00 0.00 O ATOM 1066 CB LYS A 68 -6.414 4.347 -3.180 1.00 0.00 C ATOM 1067 CG LYS A 68 -7.551 4.750 -4.131 1.00 0.00 C ATOM 1068 CD LYS A 68 -7.569 6.262 -4.397 1.00 0.00 C ATOM 1069 CE LYS A 68 -8.257 6.528 -5.738 1.00 0.00 C ATOM 1070 NZ LYS A 68 -8.223 7.935 -6.178 1.00 0.00 N ATOM 0 H LYS A 68 -7.922 2.847 -1.968 1.00 0.00 H new ATOM 0 HA LYS A 68 -6.265 2.469 -4.202 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -6.641 4.691 -2.171 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -5.490 4.838 -3.484 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -7.440 4.217 -5.075 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -8.506 4.446 -3.704 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -8.097 6.778 -3.595 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -6.552 6.653 -4.413 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -7.785 5.911 -6.502 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -9.297 6.208 -5.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -8.875 8.065 -6.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -8.512 8.552 -5.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -7.258 8.183 -6.475 1.00 0.00 H new ATOM 1084 N ALA A 69 -4.561 2.412 -1.360 1.00 0.00 N ATOM 1085 CA ALA A 69 -3.299 1.909 -0.837 1.00 0.00 C ATOM 1086 C ALA A 69 -3.169 0.405 -1.088 1.00 0.00 C ATOM 1087 O ALA A 69 -2.100 -0.053 -1.475 1.00 0.00 O ATOM 1088 CB ALA A 69 -3.186 2.218 0.657 1.00 0.00 C ATOM 0 H ALA A 69 -5.211 2.742 -0.647 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.484 2.410 -1.359 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.238 1.837 1.037 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.231 3.296 0.810 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -4.008 1.741 1.190 1.00 0.00 H new ATOM 1094 N LEU A 70 -4.238 -0.370 -0.897 1.00 0.00 N ATOM 1095 CA LEU A 70 -4.194 -1.833 -0.982 1.00 0.00 C ATOM 1096 C LEU A 70 -3.636 -2.311 -2.328 1.00 0.00 C ATOM 1097 O LEU A 70 -2.685 -3.095 -2.347 1.00 0.00 O ATOM 1098 CB LEU A 70 -5.579 -2.442 -0.691 1.00 0.00 C ATOM 1099 CG LEU A 70 -6.070 -2.239 0.754 1.00 0.00 C ATOM 1100 CD1 LEU A 70 -7.509 -2.708 0.947 1.00 0.00 C ATOM 1101 CD2 LEU A 70 -5.163 -2.946 1.759 1.00 0.00 C ATOM 0 H LEU A 70 -5.163 -0.000 -0.678 1.00 0.00 H new ATOM 0 HA LEU A 70 -3.506 -2.187 -0.214 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -6.306 -2.004 -1.374 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.545 -3.510 -0.904 1.00 0.00 H new ATOM 0 HG LEU A 70 -6.034 -1.165 0.937 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.809 -2.544 1.982 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -8.167 -2.145 0.285 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.580 -3.770 0.712 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.540 -2.781 2.768 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.149 -4.015 1.547 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -4.152 -2.547 1.680 1.00 0.00 H new ATOM 1113 N ARG A 71 -4.168 -1.795 -3.441 1.00 0.00 N ATOM 1114 CA ARG A 71 -3.668 -2.161 -4.774 1.00 0.00 C ATOM 1115 C ARG A 71 -2.258 -1.661 -5.052 1.00 0.00 C ATOM 1116 O ARG A 71 -1.533 -2.294 -5.824 1.00 0.00 O ATOM 1117 CB ARG A 71 -4.634 -1.700 -5.875 1.00 0.00 C ATOM 1118 CG ARG A 71 -4.778 -0.175 -6.012 1.00 0.00 C ATOM 1119 CD ARG A 71 -5.819 0.200 -7.069 1.00 0.00 C ATOM 1120 NE ARG A 71 -5.418 -0.234 -8.417 1.00 0.00 N ATOM 1121 CZ ARG A 71 -5.889 -1.280 -9.110 1.00 0.00 C ATOM 1122 NH1 ARG A 71 -6.869 -2.052 -8.659 1.00 0.00 N ATOM 1123 NH2 ARG A 71 -5.337 -1.564 -10.277 1.00 0.00 N ATOM 0 H ARG A 71 -4.939 -1.127 -3.448 1.00 0.00 H new ATOM 0 HA ARG A 71 -3.615 -3.250 -4.783 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.296 -2.106 -6.828 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.617 -2.127 -5.678 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -5.065 0.252 -5.051 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -3.815 0.259 -6.279 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -6.776 -0.254 -6.812 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -5.967 1.280 -7.065 1.00 0.00 H new ATOM 0 HE ARG A 71 -4.699 0.325 -8.876 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -7.294 -1.859 -7.752 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -7.198 -2.839 -9.219 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -4.570 -0.992 -10.631 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -5.678 -2.355 -10.823 1.00 0.00 H new ATOM 1137 N LEU A 72 -1.876 -0.516 -4.477 1.00 0.00 N ATOM 1138 CA LEU A 72 -0.524 0.012 -4.595 1.00 0.00 C ATOM 1139 C LEU A 72 0.457 -0.938 -3.906 1.00 0.00 C ATOM 1140 O LEU A 72 1.544 -1.137 -4.439 1.00 0.00 O ATOM 1141 CB LEU A 72 -0.466 1.440 -4.011 1.00 0.00 C ATOM 1142 CG LEU A 72 0.954 2.000 -3.787 1.00 0.00 C ATOM 1143 CD1 LEU A 72 1.696 2.242 -5.105 1.00 0.00 C ATOM 1144 CD2 LEU A 72 0.857 3.317 -3.009 1.00 0.00 C ATOM 0 H LEU A 72 -2.499 0.066 -3.918 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.236 0.080 -5.644 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.003 2.112 -4.681 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.997 1.448 -3.059 1.00 0.00 H new ATOM 0 HG LEU A 72 1.520 1.259 -3.223 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.690 2.636 -4.896 1.00 0.00 H new ATOM 0 HD12 LEU A 72 1.785 1.302 -5.650 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.141 2.960 -5.709 1.00 0.00 H new ATOM 0 HD21 LEU A 72 1.857 3.718 -2.847 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.266 4.034 -3.579 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.378 3.137 -2.046 1.00 0.00 H new ATOM 1156 N ILE A 73 0.085 -1.495 -2.743 1.00 0.00 N ATOM 1157 CA ILE A 73 1.014 -2.222 -1.884 1.00 0.00 C ATOM 1158 C ILE A 73 1.500 -3.402 -2.698 1.00 0.00 C ATOM 1159 O ILE A 73 2.662 -3.462 -3.067 1.00 0.00 O ATOM 1160 CB ILE A 73 0.374 -2.630 -0.533 1.00 0.00 C ATOM 1161 CG1 ILE A 73 0.262 -1.410 0.396 1.00 0.00 C ATOM 1162 CG2 ILE A 73 1.216 -3.700 0.196 1.00 0.00 C ATOM 1163 CD1 ILE A 73 -0.788 -1.572 1.497 1.00 0.00 C ATOM 0 H ILE A 73 -0.867 -1.451 -2.378 1.00 0.00 H new ATOM 0 HA ILE A 73 1.855 -1.593 -1.590 1.00 0.00 H new ATOM 0 HB ILE A 73 -0.612 -3.035 -0.761 1.00 0.00 H new ATOM 0 HG12 ILE A 73 1.233 -1.224 0.856 1.00 0.00 H new ATOM 0 HG13 ILE A 73 0.018 -0.531 -0.200 1.00 0.00 H new ATOM 0 HG21 ILE A 73 0.736 -3.961 1.139 1.00 0.00 H new ATOM 0 HG22 ILE A 73 1.295 -4.589 -0.429 1.00 0.00 H new ATOM 0 HG23 ILE A 73 2.213 -3.306 0.393 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.811 -0.673 2.113 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -1.768 -1.727 1.045 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -0.534 -2.431 2.118 1.00 0.00 H new ATOM 1175 N LYS A 74 0.597 -4.325 -3.015 1.00 0.00 N ATOM 1176 CA LYS A 74 0.932 -5.565 -3.701 1.00 0.00 C ATOM 1177 C LYS A 74 1.774 -5.382 -4.968 1.00 0.00 C ATOM 1178 O LYS A 74 2.569 -6.266 -5.283 1.00 0.00 O ATOM 1179 CB LYS A 74 -0.350 -6.344 -4.009 1.00 0.00 C ATOM 1180 CG LYS A 74 -1.374 -5.550 -4.837 1.00 0.00 C ATOM 1181 CD LYS A 74 -2.186 -6.544 -5.681 1.00 0.00 C ATOM 1182 CE LYS A 74 -3.060 -5.864 -6.729 1.00 0.00 C ATOM 1183 NZ LYS A 74 -3.866 -6.834 -7.502 1.00 0.00 N ATOM 0 H LYS A 74 -0.396 -4.231 -2.800 1.00 0.00 H new ATOM 0 HA LYS A 74 1.566 -6.131 -3.019 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -0.090 -7.256 -4.547 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.813 -6.649 -3.071 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -2.033 -4.981 -4.181 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -0.867 -4.831 -5.480 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -1.503 -7.233 -6.178 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -2.817 -7.141 -5.022 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -3.724 -5.152 -6.239 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -2.429 -5.294 -7.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -4.229 -6.376 -8.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -3.273 -7.646 -7.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -4.664 -7.163 -6.922 1.00 0.00 H new ATOM 1197 N TYR A 75 1.591 -4.271 -5.682 1.00 0.00 N ATOM 1198 CA TYR A 75 2.363 -3.954 -6.868 1.00 0.00 C ATOM 1199 C TYR A 75 3.796 -3.616 -6.467 1.00 0.00 C ATOM 1200 O TYR A 75 4.733 -4.236 -6.966 1.00 0.00 O ATOM 1201 CB TYR A 75 1.635 -2.856 -7.663 1.00 0.00 C ATOM 1202 CG TYR A 75 2.332 -2.355 -8.923 1.00 0.00 C ATOM 1203 CD1 TYR A 75 2.891 -3.291 -9.816 1.00 0.00 C ATOM 1204 CD2 TYR A 75 2.358 -0.984 -9.263 1.00 0.00 C ATOM 1205 CE1 TYR A 75 3.463 -2.880 -11.028 1.00 0.00 C ATOM 1206 CE2 TYR A 75 2.943 -0.565 -10.475 1.00 0.00 C ATOM 1207 CZ TYR A 75 3.487 -1.514 -11.369 1.00 0.00 C ATOM 1208 OH TYR A 75 4.031 -1.148 -12.561 1.00 0.00 O ATOM 0 H TYR A 75 0.895 -3.564 -5.445 1.00 0.00 H new ATOM 0 HA TYR A 75 2.442 -4.808 -7.540 1.00 0.00 H new ATOM 0 HB2 TYR A 75 0.651 -3.233 -7.944 1.00 0.00 H new ATOM 0 HB3 TYR A 75 1.473 -2.005 -7.001 1.00 0.00 H new ATOM 0 HD1 TYR A 75 2.879 -4.341 -9.563 1.00 0.00 H new ATOM 0 HD2 TYR A 75 1.928 -0.255 -8.592 1.00 0.00 H new ATOM 0 HE1 TYR A 75 3.886 -3.612 -11.701 1.00 0.00 H new ATOM 0 HE2 TYR A 75 2.975 0.486 -10.721 1.00 0.00 H new ATOM 0 HH TYR A 75 3.354 -0.693 -13.104 1.00 0.00 H new ATOM 1218 N ALA A 76 3.979 -2.683 -5.530 1.00 0.00 N ATOM 1219 CA ALA A 76 5.301 -2.316 -5.050 1.00 0.00 C ATOM 1220 C ALA A 76 6.003 -3.454 -4.302 1.00 0.00 C ATOM 1221 O ALA A 76 7.215 -3.601 -4.429 1.00 0.00 O ATOM 1222 CB ALA A 76 5.188 -1.078 -4.166 1.00 0.00 C ATOM 0 H ALA A 76 3.217 -2.167 -5.089 1.00 0.00 H new ATOM 0 HA ALA A 76 5.921 -2.099 -5.920 1.00 0.00 H new ATOM 0 HB1 ALA A 76 6.177 -0.798 -3.803 1.00 0.00 H new ATOM 0 HB2 ALA A 76 4.768 -0.255 -4.744 1.00 0.00 H new ATOM 0 HB3 ALA A 76 4.538 -1.295 -3.318 1.00 0.00 H new ATOM 1228 N VAL A 77 5.276 -4.291 -3.554 1.00 0.00 N ATOM 1229 CA VAL A 77 5.845 -5.438 -2.845 1.00 0.00 C ATOM 1230 C VAL A 77 6.534 -6.373 -3.844 1.00 0.00 C ATOM 1231 O VAL A 77 7.584 -6.934 -3.541 1.00 0.00 O ATOM 1232 CB VAL A 77 4.769 -6.191 -2.033 1.00 0.00 C ATOM 1233 CG1 VAL A 77 5.397 -7.375 -1.295 1.00 0.00 C ATOM 1234 CG2 VAL A 77 4.097 -5.375 -0.923 1.00 0.00 C ATOM 0 H VAL A 77 4.269 -4.189 -3.424 1.00 0.00 H new ATOM 0 HA VAL A 77 6.586 -5.072 -2.134 1.00 0.00 H new ATOM 0 HB VAL A 77 4.029 -6.463 -2.786 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.628 -7.898 -0.726 1.00 0.00 H new ATOM 0 HG12 VAL A 77 5.843 -8.059 -2.017 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.168 -7.012 -0.615 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.358 -5.993 -0.413 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.850 -5.045 -0.207 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.604 -4.506 -1.358 1.00 0.00 H new ATOM 1244 N GLY A 78 5.987 -6.529 -5.047 1.00 0.00 N ATOM 1245 CA GLY A 78 6.574 -7.388 -6.069 1.00 0.00 C ATOM 1246 C GLY A 78 7.840 -6.815 -6.721 1.00 0.00 C ATOM 1247 O GLY A 78 8.282 -7.358 -7.739 1.00 0.00 O ATOM 0 H GLY A 78 5.127 -6.065 -5.339 1.00 0.00 H new ATOM 0 HA2 GLY A 78 6.814 -8.353 -5.623 1.00 0.00 H new ATOM 0 HA3 GLY A 78 5.830 -7.571 -6.845 1.00 0.00 H new ATOM 1251 N LYS A 79 8.380 -5.692 -6.224 1.00 0.00 N ATOM 1252 CA LYS A 79 9.368 -4.869 -6.922 1.00 0.00 C ATOM 1253 C LYS A 79 10.423 -4.278 -5.996 1.00 0.00 C ATOM 1254 O LYS A 79 11.608 -4.308 -6.319 1.00 0.00 O ATOM 1255 CB LYS A 79 8.639 -3.716 -7.630 1.00 0.00 C ATOM 1256 CG LYS A 79 7.806 -4.224 -8.800 1.00 0.00 C ATOM 1257 CD LYS A 79 7.169 -3.092 -9.608 1.00 0.00 C ATOM 1258 CE LYS A 79 6.810 -3.629 -10.993 1.00 0.00 C ATOM 1259 NZ LYS A 79 7.992 -3.694 -11.876 1.00 0.00 N ATOM 0 H LYS A 79 8.133 -5.326 -5.304 1.00 0.00 H new ATOM 0 HA LYS A 79 9.884 -5.520 -7.628 1.00 0.00 H new ATOM 0 HB2 LYS A 79 7.994 -3.199 -6.919 1.00 0.00 H new ATOM 0 HB3 LYS A 79 9.367 -2.988 -7.988 1.00 0.00 H new ATOM 0 HG2 LYS A 79 8.437 -4.823 -9.457 1.00 0.00 H new ATOM 0 HG3 LYS A 79 7.022 -4.882 -8.424 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.277 -2.721 -9.103 1.00 0.00 H new ATOM 0 HD3 LYS A 79 7.859 -2.253 -9.694 1.00 0.00 H new ATOM 0 HE2 LYS A 79 6.373 -4.623 -10.896 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.052 -2.990 -11.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 7.683 -3.831 -12.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 8.530 -2.807 -11.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 8.597 -4.490 -11.589 1.00 0.00 H new ATOM 1273 N SER A 80 9.988 -3.681 -4.892 1.00 0.00 N ATOM 1274 CA SER A 80 10.751 -2.725 -4.112 1.00 0.00 C ATOM 1275 C SER A 80 12.053 -3.313 -3.574 1.00 0.00 C ATOM 1276 O SER A 80 13.054 -2.597 -3.520 1.00 0.00 O ATOM 1277 CB SER A 80 9.829 -2.234 -2.996 1.00 0.00 C ATOM 1278 OG SER A 80 10.424 -1.240 -2.191 1.00 0.00 O ATOM 0 H SER A 80 9.061 -3.859 -4.505 1.00 0.00 H new ATOM 0 HA SER A 80 11.069 -1.892 -4.739 1.00 0.00 H new ATOM 0 HB2 SER A 80 8.913 -1.839 -3.436 1.00 0.00 H new ATOM 0 HB3 SER A 80 9.543 -3.079 -2.370 1.00 0.00 H new ATOM 0 HG SER A 80 11.136 -1.640 -1.650 1.00 0.00 H new ATOM 1284 N GLY A 81 12.061 -4.578 -3.154 1.00 0.00 N ATOM 1285 CA GLY A 81 13.233 -5.228 -2.592 1.00 0.00 C ATOM 1286 C GLY A 81 12.945 -5.966 -1.292 1.00 0.00 C ATOM 1287 O GLY A 81 11.805 -6.028 -0.817 1.00 0.00 O ATOM 0 H GLY A 81 11.241 -5.183 -3.197 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.634 -5.932 -3.321 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.005 -4.479 -2.414 1.00 0.00 H new ATOM 1291 N SER A 82 13.995 -6.566 -0.740 1.00 0.00 N ATOM 1292 CA SER A 82 13.954 -7.404 0.454 1.00 0.00 C ATOM 1293 C SER A 82 13.522 -6.645 1.707 1.00 0.00 C ATOM 1294 O SER A 82 12.868 -7.202 2.582 1.00 0.00 O ATOM 1295 CB SER A 82 15.341 -8.022 0.678 1.00 0.00 C ATOM 1296 OG SER A 82 16.397 -7.321 0.016 1.00 0.00 O ATOM 0 H SER A 82 14.935 -6.478 -1.127 1.00 0.00 H new ATOM 0 HA SER A 82 13.204 -8.176 0.283 1.00 0.00 H new ATOM 0 HB2 SER A 82 15.549 -8.048 1.748 1.00 0.00 H new ATOM 0 HB3 SER A 82 15.329 -9.055 0.331 1.00 0.00 H new ATOM 0 HG SER A 82 16.669 -6.552 0.559 1.00 0.00 H new ATOM 1302 N GLU A 83 13.868 -5.372 1.779 1.00 0.00 N ATOM 1303 CA GLU A 83 13.668 -4.472 2.892 1.00 0.00 C ATOM 1304 C GLU A 83 12.165 -4.202 3.018 1.00 0.00 C ATOM 1305 O GLU A 83 11.522 -4.585 3.997 1.00 0.00 O ATOM 1306 CB GLU A 83 14.496 -3.205 2.595 1.00 0.00 C ATOM 1307 CG GLU A 83 16.021 -3.346 2.812 1.00 0.00 C ATOM 1308 CD GLU A 83 16.814 -4.314 1.906 1.00 0.00 C ATOM 1309 OE1 GLU A 83 16.327 -4.835 0.877 1.00 0.00 O ATOM 1310 OE2 GLU A 83 17.997 -4.572 2.244 1.00 0.00 O ATOM 0 H GLU A 83 14.332 -4.908 0.998 1.00 0.00 H new ATOM 0 HA GLU A 83 14.000 -4.879 3.847 1.00 0.00 H new ATOM 0 HB2 GLU A 83 14.319 -2.909 1.561 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.129 -2.395 3.226 1.00 0.00 H new ATOM 0 HG2 GLU A 83 16.463 -2.356 2.704 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.180 -3.655 3.845 1.00 0.00 H new ATOM 1317 N PHE A 84 11.581 -3.607 1.973 1.00 0.00 N ATOM 1318 CA PHE A 84 10.190 -3.172 1.960 1.00 0.00 C ATOM 1319 C PHE A 84 9.206 -4.297 2.264 1.00 0.00 C ATOM 1320 O PHE A 84 8.172 -4.036 2.885 1.00 0.00 O ATOM 1321 CB PHE A 84 9.885 -2.536 0.605 1.00 0.00 C ATOM 1322 CG PHE A 84 8.445 -2.096 0.423 1.00 0.00 C ATOM 1323 CD1 PHE A 84 7.969 -0.920 1.032 1.00 0.00 C ATOM 1324 CD2 PHE A 84 7.568 -2.886 -0.340 1.00 0.00 C ATOM 1325 CE1 PHE A 84 6.624 -0.549 0.890 1.00 0.00 C ATOM 1326 CE2 PHE A 84 6.224 -2.508 -0.484 1.00 0.00 C ATOM 1327 CZ PHE A 84 5.740 -1.350 0.146 1.00 0.00 C ATOM 0 H PHE A 84 12.073 -3.413 1.101 1.00 0.00 H new ATOM 0 HA PHE A 84 10.061 -2.442 2.759 1.00 0.00 H new ATOM 0 HB2 PHE A 84 10.535 -1.672 0.470 1.00 0.00 H new ATOM 0 HB3 PHE A 84 10.135 -3.249 -0.181 1.00 0.00 H new ATOM 0 HD1 PHE A 84 8.641 -0.302 1.610 1.00 0.00 H new ATOM 0 HD2 PHE A 84 7.929 -3.786 -0.816 1.00 0.00 H new ATOM 0 HE1 PHE A 84 6.265 0.357 1.355 1.00 0.00 H new ATOM 0 HE2 PHE A 84 5.558 -3.111 -1.083 1.00 0.00 H new ATOM 0 HZ PHE A 84 4.699 -1.077 0.060 1.00 0.00 H new ATOM 1337 N ARG A 85 9.486 -5.539 1.847 1.00 0.00 N ATOM 1338 CA ARG A 85 8.551 -6.627 2.157 1.00 0.00 C ATOM 1339 C ARG A 85 8.423 -6.790 3.667 1.00 0.00 C ATOM 1340 O ARG A 85 7.308 -6.900 4.165 1.00 0.00 O ATOM 1341 CB ARG A 85 8.863 -7.956 1.440 1.00 0.00 C ATOM 1342 CG ARG A 85 10.304 -8.452 1.591 1.00 0.00 C ATOM 1343 CD ARG A 85 10.597 -9.797 0.922 1.00 0.00 C ATOM 1344 NE ARG A 85 10.214 -10.963 1.744 1.00 0.00 N ATOM 1345 CZ ARG A 85 11.019 -11.980 2.091 1.00 0.00 C ATOM 1346 NH1 ARG A 85 12.317 -11.957 1.802 1.00 0.00 N ATOM 1347 NH2 ARG A 85 10.527 -13.020 2.749 1.00 0.00 N ATOM 0 H ARG A 85 10.315 -5.808 1.317 1.00 0.00 H new ATOM 0 HA ARG A 85 7.582 -6.335 1.753 1.00 0.00 H new ATOM 0 HB2 ARG A 85 8.189 -8.723 1.821 1.00 0.00 H new ATOM 0 HB3 ARG A 85 8.645 -7.838 0.379 1.00 0.00 H new ATOM 0 HG2 ARG A 85 10.976 -7.702 1.175 1.00 0.00 H new ATOM 0 HG3 ARG A 85 10.535 -8.533 2.653 1.00 0.00 H new ATOM 0 HD2 ARG A 85 10.066 -9.843 -0.029 1.00 0.00 H new ATOM 0 HD3 ARG A 85 11.662 -9.856 0.696 1.00 0.00 H new ATOM 0 HE ARG A 85 9.251 -10.999 2.078 1.00 0.00 H new ATOM 0 HH11 ARG A 85 12.716 -11.158 1.309 1.00 0.00 H new ATOM 0 HH12 ARG A 85 12.914 -12.738 2.073 1.00 0.00 H new ATOM 0 HH21 ARG A 85 9.537 -13.048 2.992 1.00 0.00 H new ATOM 0 HH22 ARG A 85 11.139 -13.793 3.013 1.00 0.00 H new ATOM 1361 N ARG A 86 9.533 -6.803 4.410 1.00 0.00 N ATOM 1362 CA ARG A 86 9.488 -7.019 5.854 1.00 0.00 C ATOM 1363 C ARG A 86 8.828 -5.829 6.552 1.00 0.00 C ATOM 1364 O ARG A 86 8.058 -6.031 7.487 1.00 0.00 O ATOM 1365 CB ARG A 86 10.895 -7.291 6.412 1.00 0.00 C ATOM 1366 CG ARG A 86 11.711 -8.361 5.656 1.00 0.00 C ATOM 1367 CD ARG A 86 11.069 -9.746 5.458 1.00 0.00 C ATOM 1368 NE ARG A 86 10.799 -10.412 6.742 1.00 0.00 N ATOM 1369 CZ ARG A 86 10.281 -11.629 6.941 1.00 0.00 C ATOM 1370 NH1 ARG A 86 10.107 -12.485 5.939 1.00 0.00 N ATOM 1371 NH2 ARG A 86 9.934 -11.985 8.168 1.00 0.00 N ATOM 0 H ARG A 86 10.471 -6.666 4.034 1.00 0.00 H new ATOM 0 HA ARG A 86 8.882 -7.902 6.054 1.00 0.00 H new ATOM 0 HB2 ARG A 86 11.457 -6.357 6.405 1.00 0.00 H new ATOM 0 HB3 ARG A 86 10.801 -7.598 7.454 1.00 0.00 H new ATOM 0 HG2 ARG A 86 11.956 -7.962 4.672 1.00 0.00 H new ATOM 0 HG3 ARG A 86 12.653 -8.501 6.187 1.00 0.00 H new ATOM 0 HD2 ARG A 86 10.138 -9.639 4.901 1.00 0.00 H new ATOM 0 HD3 ARG A 86 11.730 -10.370 4.857 1.00 0.00 H new ATOM 0 HE ARG A 86 11.035 -9.882 7.581 1.00 0.00 H new ATOM 0 HH11 ARG A 86 10.371 -12.220 4.990 1.00 0.00 H new ATOM 0 HH12 ARG A 86 9.710 -13.407 6.119 1.00 0.00 H new ATOM 0 HH21 ARG A 86 10.063 -11.335 8.943 1.00 0.00 H new ATOM 0 HH22 ARG A 86 9.537 -12.909 8.338 1.00 0.00 H new ATOM 1385 N GLU A 87 9.043 -4.606 6.068 1.00 0.00 N ATOM 1386 CA GLU A 87 8.362 -3.414 6.580 1.00 0.00 C ATOM 1387 C GLU A 87 6.845 -3.508 6.376 1.00 0.00 C ATOM 1388 O GLU A 87 6.073 -3.170 7.277 1.00 0.00 O ATOM 1389 CB GLU A 87 8.964 -2.153 5.929 1.00 0.00 C ATOM 1390 CG GLU A 87 9.877 -1.364 6.883 1.00 0.00 C ATOM 1391 CD GLU A 87 11.072 -2.158 7.433 1.00 0.00 C ATOM 1392 OE1 GLU A 87 10.883 -3.014 8.331 1.00 0.00 O ATOM 1393 OE2 GLU A 87 12.234 -1.852 7.084 1.00 0.00 O ATOM 0 H GLU A 87 9.695 -4.412 5.308 1.00 0.00 H new ATOM 0 HA GLU A 87 8.521 -3.346 7.656 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.534 -2.443 5.046 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.156 -1.505 5.589 1.00 0.00 H new ATOM 0 HG2 GLU A 87 10.253 -0.485 6.360 1.00 0.00 H new ATOM 0 HG3 GLU A 87 9.280 -1.005 7.721 1.00 0.00 H new ATOM 1400 N MET A 88 6.396 -4.027 5.231 1.00 0.00 N ATOM 1401 CA MET A 88 4.983 -4.303 5.011 1.00 0.00 C ATOM 1402 C MET A 88 4.481 -5.387 5.972 1.00 0.00 C ATOM 1403 O MET A 88 3.392 -5.233 6.516 1.00 0.00 O ATOM 1404 CB MET A 88 4.733 -4.687 3.549 1.00 0.00 C ATOM 1405 CG MET A 88 4.882 -3.489 2.608 1.00 0.00 C ATOM 1406 SD MET A 88 3.506 -2.305 2.654 1.00 0.00 S ATOM 1407 CE MET A 88 4.288 -0.934 3.535 1.00 0.00 C ATOM 0 H MET A 88 6.997 -4.264 4.442 1.00 0.00 H new ATOM 0 HA MET A 88 4.416 -3.395 5.219 1.00 0.00 H new ATOM 0 HB2 MET A 88 5.433 -5.469 3.255 1.00 0.00 H new ATOM 0 HB3 MET A 88 3.731 -5.103 3.450 1.00 0.00 H new ATOM 0 HG2 MET A 88 5.804 -2.963 2.857 1.00 0.00 H new ATOM 0 HG3 MET A 88 4.991 -3.858 1.588 1.00 0.00 H new ATOM 0 HE1 MET A 88 3.702 -0.026 3.389 1.00 0.00 H new ATOM 0 HE2 MET A 88 4.338 -1.166 4.599 1.00 0.00 H new ATOM 0 HE3 MET A 88 5.296 -0.781 3.149 1.00 0.00 H new ATOM 1417 N GLN A 89 5.245 -6.462 6.217 1.00 0.00 N ATOM 1418 CA GLN A 89 4.875 -7.513 7.168 1.00 0.00 C ATOM 1419 C GLN A 89 4.664 -6.946 8.570 1.00 0.00 C ATOM 1420 O GLN A 89 3.609 -7.188 9.161 1.00 0.00 O ATOM 1421 CB GLN A 89 5.913 -8.642 7.214 1.00 0.00 C ATOM 1422 CG GLN A 89 5.940 -9.446 5.924 1.00 0.00 C ATOM 1423 CD GLN A 89 6.795 -10.695 6.031 1.00 0.00 C ATOM 1424 OE1 GLN A 89 7.110 -11.192 7.109 1.00 0.00 O ATOM 1425 NE2 GLN A 89 7.169 -11.232 4.893 1.00 0.00 N ATOM 0 H GLN A 89 6.141 -6.625 5.757 1.00 0.00 H new ATOM 0 HA GLN A 89 3.934 -7.933 6.812 1.00 0.00 H new ATOM 0 HB2 GLN A 89 6.901 -8.219 7.398 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.690 -9.305 8.050 1.00 0.00 H new ATOM 0 HG2 GLN A 89 4.922 -9.729 5.656 1.00 0.00 H new ATOM 0 HG3 GLN A 89 6.320 -8.819 5.117 1.00 0.00 H new ATOM 0 HE21 GLN A 89 6.894 -10.800 4.011 1.00 0.00 H new ATOM 0 HE22 GLN A 89 7.734 -12.081 4.891 1.00 0.00 H new ATOM 1434 N ARG A 90 5.622 -6.160 9.075 1.00 0.00 N ATOM 1435 CA ARG A 90 5.577 -5.549 10.404 1.00 0.00 C ATOM 1436 C ARG A 90 4.217 -4.924 10.693 1.00 0.00 C ATOM 1437 O ARG A 90 3.643 -5.165 11.752 1.00 0.00 O ATOM 1438 CB ARG A 90 6.681 -4.486 10.521 1.00 0.00 C ATOM 1439 CG ARG A 90 8.042 -5.066 10.919 1.00 0.00 C ATOM 1440 CD ARG A 90 9.063 -3.927 11.057 1.00 0.00 C ATOM 1441 NE ARG A 90 10.301 -4.357 11.725 1.00 0.00 N ATOM 1442 CZ ARG A 90 10.435 -4.603 13.036 1.00 0.00 C ATOM 1443 NH1 ARG A 90 9.414 -4.431 13.864 1.00 0.00 N ATOM 1444 NH2 ARG A 90 11.595 -5.035 13.513 1.00 0.00 N ATOM 0 H ARG A 90 6.469 -5.927 8.557 1.00 0.00 H new ATOM 0 HA ARG A 90 5.741 -6.334 11.142 1.00 0.00 H new ATOM 0 HB2 ARG A 90 6.780 -3.968 9.567 1.00 0.00 H new ATOM 0 HB3 ARG A 90 6.382 -3.741 11.258 1.00 0.00 H new ATOM 0 HG2 ARG A 90 7.957 -5.609 11.861 1.00 0.00 H new ATOM 0 HG3 ARG A 90 8.378 -5.781 10.168 1.00 0.00 H new ATOM 0 HD2 ARG A 90 9.304 -3.538 10.068 1.00 0.00 H new ATOM 0 HD3 ARG A 90 8.615 -3.109 11.621 1.00 0.00 H new ATOM 0 HE ARG A 90 11.128 -4.478 11.141 1.00 0.00 H new ATOM 0 HH11 ARG A 90 8.515 -4.108 13.505 1.00 0.00 H new ATOM 0 HH12 ARG A 90 9.527 -4.621 14.860 1.00 0.00 H new ATOM 0 HH21 ARG A 90 12.384 -5.180 12.882 1.00 0.00 H new ATOM 0 HH22 ARG A 90 11.698 -5.223 14.510 1.00 0.00 H new ATOM 1458 N ASN A 91 3.694 -4.141 9.748 1.00 0.00 N ATOM 1459 CA ASN A 91 2.481 -3.342 9.920 1.00 0.00 C ATOM 1460 C ASN A 91 1.345 -3.890 9.049 1.00 0.00 C ATOM 1461 O ASN A 91 0.481 -3.143 8.584 1.00 0.00 O ATOM 1462 CB ASN A 91 2.815 -1.870 9.635 1.00 0.00 C ATOM 1463 CG ASN A 91 3.788 -1.316 10.664 1.00 0.00 C ATOM 1464 OD1 ASN A 91 3.554 -1.441 11.862 1.00 0.00 O ATOM 1465 ND2 ASN A 91 4.895 -0.727 10.253 1.00 0.00 N ATOM 0 H ASN A 91 4.111 -4.043 8.822 1.00 0.00 H new ATOM 0 HA ASN A 91 2.121 -3.406 10.947 1.00 0.00 H new ATOM 0 HB2 ASN A 91 3.246 -1.779 8.638 1.00 0.00 H new ATOM 0 HB3 ASN A 91 1.899 -1.279 9.642 1.00 0.00 H new ATOM 0 HD21 ASN A 91 5.566 -0.370 10.934 1.00 0.00 H new ATOM 0 HD22 ASN A 91 5.080 -0.628 9.255 1.00 0.00 H new ATOM 1472 N SER A 92 1.368 -5.194 8.763 1.00 0.00 N ATOM 1473 CA SER A 92 0.444 -5.841 7.828 1.00 0.00 C ATOM 1474 C SER A 92 -0.913 -6.022 8.481 1.00 0.00 C ATOM 1475 O SER A 92 -1.920 -6.209 7.807 1.00 0.00 O ATOM 1476 CB SER A 92 0.972 -7.217 7.411 1.00 0.00 C ATOM 1477 OG SER A 92 1.231 -8.037 8.538 1.00 0.00 O ATOM 0 H SER A 92 2.039 -5.839 9.180 1.00 0.00 H new ATOM 0 HA SER A 92 0.355 -5.204 6.948 1.00 0.00 H new ATOM 0 HB2 SER A 92 0.244 -7.706 6.763 1.00 0.00 H new ATOM 0 HB3 SER A 92 1.886 -7.096 6.830 1.00 0.00 H new ATOM 0 HG SER A 92 2.113 -7.818 8.906 1.00 0.00 H new ATOM 1483 N VAL A 93 -0.923 -5.986 9.807 1.00 0.00 N ATOM 1484 CA VAL A 93 -2.080 -6.065 10.653 1.00 0.00 C ATOM 1485 C VAL A 93 -3.130 -5.046 10.233 1.00 0.00 C ATOM 1486 O VAL A 93 -4.297 -5.398 10.130 1.00 0.00 O ATOM 1487 CB VAL A 93 -1.655 -5.822 12.118 1.00 0.00 C ATOM 1488 CG1 VAL A 93 -1.787 -7.127 12.890 1.00 0.00 C ATOM 1489 CG2 VAL A 93 -0.286 -5.155 12.336 1.00 0.00 C ATOM 0 H VAL A 93 -0.060 -5.895 10.344 1.00 0.00 H new ATOM 0 HA VAL A 93 -2.521 -7.058 10.559 1.00 0.00 H new ATOM 0 HB VAL A 93 -2.340 -5.068 12.506 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -1.490 -6.968 13.927 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -2.822 -7.466 12.857 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -1.144 -7.883 12.440 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -0.104 -5.039 13.404 1.00 0.00 H new ATOM 0 HG22 VAL A 93 0.495 -5.777 11.900 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -0.279 -4.175 11.859 1.00 0.00 H new ATOM 1499 N ALA A 94 -2.712 -3.812 9.944 1.00 0.00 N ATOM 1500 CA ALA A 94 -3.611 -2.743 9.555 1.00 0.00 C ATOM 1501 C ALA A 94 -4.439 -3.143 8.327 1.00 0.00 C ATOM 1502 O ALA A 94 -5.652 -2.952 8.289 1.00 0.00 O ATOM 1503 CB ALA A 94 -2.762 -1.516 9.240 1.00 0.00 C ATOM 0 H ALA A 94 -1.732 -3.533 9.976 1.00 0.00 H new ATOM 0 HA ALA A 94 -4.309 -2.531 10.365 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -3.410 -0.692 8.943 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.193 -1.230 10.125 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -2.075 -1.748 8.426 1.00 0.00 H new ATOM 1509 N VAL A 95 -3.760 -3.707 7.325 1.00 0.00 N ATOM 1510 CA VAL A 95 -4.337 -4.274 6.122 1.00 0.00 C ATOM 1511 C VAL A 95 -5.264 -5.428 6.554 1.00 0.00 C ATOM 1512 O VAL A 95 -6.459 -5.407 6.253 1.00 0.00 O ATOM 1513 CB VAL A 95 -3.186 -4.703 5.170 1.00 0.00 C ATOM 1514 CG1 VAL A 95 -3.638 -5.023 3.740 1.00 0.00 C ATOM 1515 CG2 VAL A 95 -2.030 -3.686 5.096 1.00 0.00 C ATOM 0 H VAL A 95 -2.743 -3.780 7.340 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.942 -3.561 5.562 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.826 -5.621 5.634 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.774 -5.313 3.142 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.357 -5.842 3.760 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.104 -4.141 3.300 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -1.265 -4.054 4.413 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.409 -2.730 4.735 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -1.598 -3.554 6.088 1.00 0.00 H new ATOM 1525 N ARG A 96 -4.732 -6.424 7.277 1.00 0.00 N ATOM 1526 CA ARG A 96 -5.409 -7.660 7.685 1.00 0.00 C ATOM 1527 C ARG A 96 -6.692 -7.403 8.448 1.00 0.00 C ATOM 1528 O ARG A 96 -7.634 -8.186 8.317 1.00 0.00 O ATOM 1529 CB ARG A 96 -4.464 -8.521 8.546 1.00 0.00 C ATOM 1530 CG ARG A 96 -3.510 -9.311 7.667 1.00 0.00 C ATOM 1531 CD ARG A 96 -2.694 -10.391 8.373 1.00 0.00 C ATOM 1532 NE ARG A 96 -1.476 -9.863 9.003 1.00 0.00 N ATOM 1533 CZ ARG A 96 -0.831 -10.439 10.024 1.00 0.00 C ATOM 1534 NH1 ARG A 96 -1.225 -11.605 10.516 1.00 0.00 N ATOM 1535 NH2 ARG A 96 0.217 -9.817 10.542 1.00 0.00 N ATOM 0 H ARG A 96 -3.768 -6.386 7.609 1.00 0.00 H new ATOM 0 HA ARG A 96 -5.675 -8.189 6.770 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -3.898 -7.882 9.224 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -5.047 -9.204 9.164 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -4.086 -9.781 6.869 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -2.820 -8.613 7.193 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -3.313 -10.869 9.133 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -2.420 -11.162 7.653 1.00 0.00 H new ATOM 0 HE ARG A 96 -1.094 -8.992 8.634 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -2.034 -12.080 10.116 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -0.719 -12.027 11.295 1.00 0.00 H new ATOM 0 HH21 ARG A 96 0.516 -8.919 10.162 1.00 0.00 H new ATOM 0 HH22 ARG A 96 0.725 -10.236 11.321 1.00 0.00 H new ATOM 1549 N ASN A 97 -6.755 -6.329 9.225 1.00 0.00 N ATOM 1550 CA ASN A 97 -7.919 -5.976 10.014 1.00 0.00 C ATOM 1551 C ASN A 97 -9.115 -5.646 9.114 1.00 0.00 C ATOM 1552 O ASN A 97 -10.265 -5.825 9.513 1.00 0.00 O ATOM 1553 CB ASN A 97 -7.551 -4.802 10.924 1.00 0.00 C ATOM 1554 CG ASN A 97 -8.525 -4.704 12.084 1.00 0.00 C ATOM 1555 OD1 ASN A 97 -9.558 -4.039 12.013 1.00 0.00 O ATOM 1556 ND2 ASN A 97 -8.199 -5.361 13.182 1.00 0.00 N ATOM 0 H ASN A 97 -5.983 -5.670 9.323 1.00 0.00 H new ATOM 0 HA ASN A 97 -8.221 -6.823 10.630 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -6.537 -4.931 11.303 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -7.562 -3.874 10.353 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -8.810 -5.325 13.998 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -7.337 -5.905 13.214 1.00 0.00 H new ATOM 1563 N LEU A 98 -8.860 -5.189 7.882 1.00 0.00 N ATOM 1564 CA LEU A 98 -9.876 -4.827 6.898 1.00 0.00 C ATOM 1565 C LEU A 98 -10.462 -6.033 6.169 1.00 0.00 C ATOM 1566 O LEU A 98 -11.418 -5.822 5.423 1.00 0.00 O ATOM 1567 CB LEU A 98 -9.306 -3.839 5.863 1.00 0.00 C ATOM 1568 CG LEU A 98 -8.782 -2.511 6.439 1.00 0.00 C ATOM 1569 CD1 LEU A 98 -7.876 -1.852 5.402 1.00 0.00 C ATOM 1570 CD2 LEU A 98 -9.924 -1.557 6.821 1.00 0.00 C ATOM 0 H LEU A 98 -7.909 -5.058 7.536 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.683 -4.358 7.461 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -8.493 -4.329 5.327 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.083 -3.617 5.131 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.226 -2.726 7.352 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.497 -0.909 5.797 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -7.039 -2.514 5.177 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.444 -1.662 4.491 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.507 -0.633 7.223 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -10.521 -1.332 5.937 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.555 -2.028 7.574 1.00 0.00 H new ATOM 1582 N PHE A 99 -9.998 -7.266 6.422 1.00 0.00 N ATOM 1583 CA PHE A 99 -10.613 -8.494 5.883 1.00 0.00 C ATOM 1584 C PHE A 99 -12.126 -8.560 6.167 1.00 0.00 C ATOM 1585 O PHE A 99 -12.853 -9.279 5.487 1.00 0.00 O ATOM 1586 CB PHE A 99 -9.949 -9.747 6.480 1.00 0.00 C ATOM 1587 CG PHE A 99 -8.724 -10.265 5.758 1.00 0.00 C ATOM 1588 CD1 PHE A 99 -7.660 -9.400 5.464 1.00 0.00 C ATOM 1589 CD2 PHE A 99 -8.588 -11.640 5.469 1.00 0.00 C ATOM 1590 CE1 PHE A 99 -6.490 -9.924 4.904 1.00 0.00 C ATOM 1591 CE2 PHE A 99 -7.408 -12.137 4.883 1.00 0.00 C ATOM 1592 CZ PHE A 99 -6.358 -11.264 4.570 1.00 0.00 C ATOM 0 H PHE A 99 -9.182 -7.443 7.008 1.00 0.00 H new ATOM 0 HA PHE A 99 -10.459 -8.465 4.804 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -9.672 -9.529 7.511 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -10.691 -10.545 6.512 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.743 -8.343 5.667 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -9.397 -12.317 5.700 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -5.657 -9.260 4.725 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -7.312 -13.192 4.675 1.00 0.00 H new ATOM 0 HZ PHE A 99 -5.466 -11.626 4.080 1.00 0.00 H new ATOM 1602 N HIS A 100 -12.619 -7.799 7.151 1.00 0.00 N ATOM 1603 CA HIS A 100 -14.024 -7.754 7.531 1.00 0.00 C ATOM 1604 C HIS A 100 -14.603 -6.332 7.484 1.00 0.00 C ATOM 1605 O HIS A 100 -15.651 -6.074 8.081 1.00 0.00 O ATOM 1606 CB HIS A 100 -14.186 -8.438 8.898 1.00 0.00 C ATOM 1607 CG HIS A 100 -13.707 -9.871 8.909 1.00 0.00 C ATOM 1608 ND1 HIS A 100 -14.368 -10.939 8.347 1.00 0.00 N ATOM 1609 CD2 HIS A 100 -12.514 -10.337 9.400 1.00 0.00 C ATOM 1610 CE1 HIS A 100 -13.590 -12.020 8.494 1.00 0.00 C ATOM 1611 NE2 HIS A 100 -12.453 -11.711 9.140 1.00 0.00 N ATOM 0 H HIS A 100 -12.032 -7.184 7.715 1.00 0.00 H new ATOM 0 HA HIS A 100 -14.615 -8.305 6.799 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -13.634 -7.872 9.648 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -15.236 -8.411 9.188 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -11.757 -9.749 9.898 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -13.843 -13.008 8.140 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -11.698 -12.349 9.390 1.00 0.00 H new ATOM 1619 N TYR A 101 -13.944 -5.372 6.822 1.00 0.00 N ATOM 1620 CA TYR A 101 -14.408 -3.988 6.805 1.00 0.00 C ATOM 1621 C TYR A 101 -15.721 -3.891 6.028 1.00 0.00 C ATOM 1622 O TYR A 101 -15.931 -4.600 5.034 1.00 0.00 O ATOM 1623 CB TYR A 101 -13.323 -3.072 6.215 1.00 0.00 C ATOM 1624 CG TYR A 101 -13.752 -1.632 6.032 1.00 0.00 C ATOM 1625 CD1 TYR A 101 -13.795 -0.756 7.128 1.00 0.00 C ATOM 1626 CD2 TYR A 101 -14.140 -1.180 4.762 1.00 0.00 C ATOM 1627 CE1 TYR A 101 -14.245 0.569 6.967 1.00 0.00 C ATOM 1628 CE2 TYR A 101 -14.542 0.150 4.584 1.00 0.00 C ATOM 1629 CZ TYR A 101 -14.619 1.028 5.687 1.00 0.00 C ATOM 1630 OH TYR A 101 -14.992 2.323 5.480 1.00 0.00 O ATOM 0 H TYR A 101 -13.088 -5.534 6.292 1.00 0.00 H new ATOM 0 HA TYR A 101 -14.599 -3.653 7.825 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -12.449 -3.098 6.866 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -13.013 -3.472 5.249 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -13.481 -1.101 8.102 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -14.129 -1.858 3.921 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -14.303 1.230 7.819 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -14.795 0.506 3.596 1.00 0.00 H new ATOM 0 HH TYR A 101 -14.894 2.829 6.313 1.00 0.00 H new ATOM 1640 N LYS A 102 -16.609 -2.990 6.453 1.00 0.00 N ATOM 1641 CA LYS A 102 -17.863 -2.719 5.749 1.00 0.00 C ATOM 1642 C LYS A 102 -18.340 -1.283 5.843 1.00 0.00 C ATOM 1643 O LYS A 102 -18.908 -0.778 4.888 1.00 0.00 O ATOM 1644 CB LYS A 102 -18.955 -3.668 6.221 1.00 0.00 C ATOM 1645 CG LYS A 102 -19.406 -3.605 7.689 1.00 0.00 C ATOM 1646 CD LYS A 102 -20.635 -2.698 7.877 1.00 0.00 C ATOM 1647 CE LYS A 102 -21.282 -2.858 9.256 1.00 0.00 C ATOM 1648 NZ LYS A 102 -21.958 -4.161 9.406 1.00 0.00 N ATOM 0 H LYS A 102 -16.479 -2.428 7.294 1.00 0.00 H new ATOM 0 HA LYS A 102 -17.646 -2.890 4.695 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -19.833 -3.497 5.598 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -18.617 -4.685 6.023 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -19.640 -4.610 8.040 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -18.586 -3.236 8.305 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -20.339 -1.658 7.738 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -21.371 -2.926 7.106 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -20.519 -2.755 10.028 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -22.003 -2.056 9.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -22.522 -4.161 10.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -22.583 -4.324 8.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -21.246 -4.918 9.453 1.00 0.00 H new ATOM 1662 N GLY A 103 -18.017 -0.596 6.923 1.00 0.00 N ATOM 1663 CA GLY A 103 -18.253 0.835 7.054 1.00 0.00 C ATOM 1664 C GLY A 103 -19.747 1.161 7.029 1.00 0.00 C ATOM 1665 O GLY A 103 -20.399 1.004 8.058 1.00 0.00 O ATOM 0 H GLY A 103 -17.579 -1.017 7.743 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -17.817 1.193 7.987 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -17.751 1.363 6.244 1.00 0.00 H new ATOM 1669 N HIS A 104 -20.275 1.689 5.922 1.00 0.00 N ATOM 1670 CA HIS A 104 -21.661 2.142 5.764 1.00 0.00 C ATOM 1671 C HIS A 104 -22.095 1.976 4.299 1.00 0.00 C ATOM 1672 O HIS A 104 -21.220 1.913 3.431 1.00 0.00 O ATOM 1673 CB HIS A 104 -21.770 3.632 6.154 1.00 0.00 C ATOM 1674 CG HIS A 104 -21.966 3.868 7.629 1.00 0.00 C ATOM 1675 ND1 HIS A 104 -23.178 4.052 8.264 1.00 0.00 N ATOM 1676 CD2 HIS A 104 -20.981 3.939 8.577 1.00 0.00 C ATOM 1677 CE1 HIS A 104 -22.924 4.248 9.569 1.00 0.00 C ATOM 1678 NE2 HIS A 104 -21.607 4.133 9.811 1.00 0.00 N ATOM 0 H HIS A 104 -19.724 1.819 5.073 1.00 0.00 H new ATOM 0 HA HIS A 104 -22.306 1.545 6.409 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -20.866 4.148 5.831 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -22.603 4.079 5.611 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -19.918 3.860 8.403 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -23.672 4.467 10.317 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -21.151 4.179 10.722 1.00 0.00 H new ATOM 1686 N PRO A 105 -23.410 2.004 4.005 1.00 0.00 N ATOM 1687 CA PRO A 105 -23.919 2.005 2.641 1.00 0.00 C ATOM 1688 C PRO A 105 -23.523 3.264 1.867 1.00 0.00 C ATOM 1689 O PRO A 105 -22.921 4.196 2.409 1.00 0.00 O ATOM 1690 CB PRO A 105 -25.441 1.924 2.761 1.00 0.00 C ATOM 1691 CG PRO A 105 -25.732 2.508 4.137 1.00 0.00 C ATOM 1692 CD PRO A 105 -24.518 2.069 4.949 1.00 0.00 C ATOM 0 HA PRO A 105 -23.497 1.167 2.086 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -25.935 2.493 1.973 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -25.794 0.896 2.681 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -25.827 3.593 4.105 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -26.661 2.119 4.554 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -24.307 2.777 5.751 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -24.690 1.100 5.417 1.00 0.00 H new ATOM 1700 N ASP A 106 -23.899 3.309 0.588 1.00 0.00 N ATOM 1701 CA ASP A 106 -23.546 4.361 -0.347 1.00 0.00 C ATOM 1702 C ASP A 106 -24.736 4.785 -1.216 1.00 0.00 C ATOM 1703 O ASP A 106 -25.620 3.965 -1.471 1.00 0.00 O ATOM 1704 CB ASP A 106 -22.392 3.881 -1.221 1.00 0.00 C ATOM 1705 CG ASP A 106 -21.051 4.472 -0.773 1.00 0.00 C ATOM 1706 OD1 ASP A 106 -20.884 5.712 -0.768 1.00 0.00 O ATOM 1707 OD2 ASP A 106 -20.147 3.687 -0.411 1.00 0.00 O ATOM 0 H ASP A 106 -24.479 2.584 0.166 1.00 0.00 H new ATOM 0 HA ASP A 106 -23.244 5.239 0.223 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -22.339 2.793 -1.186 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -22.582 4.158 -2.258 1.00 0.00 H new ATOM 1712 N PRO A 107 -24.757 6.031 -1.730 1.00 0.00 N ATOM 1713 CA PRO A 107 -25.938 6.586 -2.378 1.00 0.00 C ATOM 1714 C PRO A 107 -26.236 5.992 -3.754 1.00 0.00 C ATOM 1715 O PRO A 107 -27.391 6.041 -4.187 1.00 0.00 O ATOM 1716 CB PRO A 107 -25.705 8.097 -2.485 1.00 0.00 C ATOM 1717 CG PRO A 107 -24.193 8.259 -2.367 1.00 0.00 C ATOM 1718 CD PRO A 107 -23.769 7.076 -1.508 1.00 0.00 C ATOM 0 HA PRO A 107 -26.814 6.339 -1.778 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -26.074 8.489 -3.433 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -26.225 8.636 -1.693 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -23.711 8.238 -3.344 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -23.927 9.208 -1.901 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -22.772 6.733 -1.785 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -23.729 7.355 -0.455 1.00 0.00 H new ATOM 1726 N LEU A 108 -25.230 5.450 -4.439 1.00 0.00 N ATOM 1727 CA LEU A 108 -25.323 4.876 -5.781 1.00 0.00 C ATOM 1728 C LEU A 108 -24.534 3.577 -5.919 1.00 0.00 C ATOM 1729 O LEU A 108 -24.855 2.760 -6.782 1.00 0.00 O ATOM 1730 CB LEU A 108 -24.799 5.857 -6.847 1.00 0.00 C ATOM 1731 CG LEU A 108 -23.490 6.614 -6.529 1.00 0.00 C ATOM 1732 CD1 LEU A 108 -22.497 6.526 -7.693 1.00 0.00 C ATOM 1733 CD2 LEU A 108 -23.798 8.082 -6.222 1.00 0.00 C ATOM 0 H LEU A 108 -24.286 5.397 -4.057 1.00 0.00 H new ATOM 0 HA LEU A 108 -26.382 4.671 -5.937 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -24.651 5.302 -7.773 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -25.578 6.595 -7.038 1.00 0.00 H new ATOM 0 HG LEU A 108 -23.034 6.145 -5.657 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -21.587 7.069 -7.437 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -22.254 5.481 -7.886 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -22.943 6.966 -8.585 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -22.871 8.609 -5.999 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -24.278 8.542 -7.086 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -24.465 8.142 -5.362 1.00 0.00 H new ATOM 1745 N LYS A 109 -23.475 3.402 -5.128 1.00 0.00 N ATOM 1746 CA LYS A 109 -22.569 2.267 -5.266 1.00 0.00 C ATOM 1747 C LYS A 109 -23.138 1.009 -4.622 1.00 0.00 C ATOM 1748 O LYS A 109 -22.698 -0.070 -4.985 1.00 0.00 O ATOM 1749 CB LYS A 109 -21.205 2.628 -4.670 1.00 0.00 C ATOM 1750 CG LYS A 109 -20.472 3.684 -5.521 1.00 0.00 C ATOM 1751 CD LYS A 109 -19.689 3.114 -6.715 1.00 0.00 C ATOM 1752 CE LYS A 109 -18.674 2.051 -6.267 1.00 0.00 C ATOM 1753 NZ LYS A 109 -17.521 1.947 -7.181 1.00 0.00 N ATOM 0 H LYS A 109 -23.223 4.043 -4.376 1.00 0.00 H new ATOM 0 HA LYS A 109 -22.447 2.047 -6.327 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -21.339 3.007 -3.657 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -20.591 1.730 -4.596 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -21.202 4.403 -5.892 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -19.782 4.233 -4.880 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -20.384 2.676 -7.431 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -19.168 3.922 -7.229 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -18.318 2.293 -5.265 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -19.171 1.083 -6.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -17.043 1.035 -7.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -17.851 2.011 -8.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -16.854 2.721 -6.988 1.00 0.00 H new ATOM 1767 N GLY A 110 -24.084 1.153 -3.696 1.00 0.00 N ATOM 1768 CA GLY A 110 -24.852 0.072 -3.116 1.00 0.00 C ATOM 1769 C GLY A 110 -23.989 -1.015 -2.478 1.00 0.00 C ATOM 1770 O GLY A 110 -23.932 -2.127 -2.997 1.00 0.00 O ATOM 0 H GLY A 110 -24.341 2.066 -3.320 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -25.525 0.479 -2.362 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -25.474 -0.377 -3.890 1.00 0.00 H new ATOM 1774 N ASP A 111 -23.335 -0.692 -1.359 1.00 0.00 N ATOM 1775 CA ASP A 111 -22.455 -1.574 -0.575 1.00 0.00 C ATOM 1776 C ASP A 111 -21.487 -2.339 -1.486 1.00 0.00 C ATOM 1777 O ASP A 111 -21.478 -3.574 -1.552 1.00 0.00 O ATOM 1778 CB ASP A 111 -23.240 -2.488 0.387 1.00 0.00 C ATOM 1779 CG ASP A 111 -23.808 -1.713 1.570 1.00 0.00 C ATOM 1780 OD1 ASP A 111 -24.832 -1.019 1.345 1.00 0.00 O ATOM 1781 OD2 ASP A 111 -23.234 -1.791 2.677 1.00 0.00 O ATOM 0 H ASP A 111 -23.406 0.240 -0.951 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.844 -0.942 0.070 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -24.053 -2.972 -0.154 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -22.585 -3.279 0.752 1.00 0.00 H new ATOM 1786 N ALA A 112 -20.672 -1.565 -2.207 1.00 0.00 N ATOM 1787 CA ALA A 112 -19.699 -2.049 -3.178 1.00 0.00 C ATOM 1788 C ALA A 112 -18.319 -1.429 -2.983 1.00 0.00 C ATOM 1789 O ALA A 112 -17.318 -2.033 -3.382 1.00 0.00 O ATOM 1790 CB ALA A 112 -20.171 -1.701 -4.586 1.00 0.00 C ATOM 0 H ALA A 112 -20.675 -0.548 -2.125 1.00 0.00 H new ATOM 0 HA ALA A 112 -19.618 -3.126 -3.034 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -19.444 -2.063 -5.313 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -21.136 -2.172 -4.773 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -20.271 -0.620 -4.679 1.00 0.00 H new ATOM 1796 N LEU A 113 -18.245 -0.205 -2.449 1.00 0.00 N ATOM 1797 CA LEU A 113 -16.973 0.450 -2.205 1.00 0.00 C ATOM 1798 C LEU A 113 -16.272 -0.315 -1.094 1.00 0.00 C ATOM 1799 O LEU A 113 -15.169 -0.823 -1.271 1.00 0.00 O ATOM 1800 CB LEU A 113 -17.129 1.957 -1.933 1.00 0.00 C ATOM 1801 CG LEU A 113 -15.914 2.750 -2.437 1.00 0.00 C ATOM 1802 CD1 LEU A 113 -14.671 2.546 -1.576 1.00 0.00 C ATOM 1803 CD2 LEU A 113 -15.613 2.563 -3.927 1.00 0.00 C ATOM 0 H LEU A 113 -19.059 0.347 -2.180 1.00 0.00 H new ATOM 0 HA LEU A 113 -16.349 0.420 -3.098 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -18.032 2.324 -2.421 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -17.255 2.123 -0.863 1.00 0.00 H new ATOM 0 HG LEU A 113 -16.211 3.793 -2.328 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -13.847 3.132 -1.983 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -14.878 2.870 -0.556 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -14.399 1.490 -1.573 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -14.741 3.157 -4.199 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -15.412 1.511 -4.128 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -16.471 2.888 -4.515 1.00 0.00 H new ATOM 1815 N ASN A 114 -16.908 -0.399 0.067 1.00 0.00 N ATOM 1816 CA ASN A 114 -16.336 -0.987 1.269 1.00 0.00 C ATOM 1817 C ASN A 114 -16.117 -2.486 1.076 1.00 0.00 C ATOM 1818 O ASN A 114 -15.156 -3.032 1.612 1.00 0.00 O ATOM 1819 CB ASN A 114 -17.249 -0.740 2.487 1.00 0.00 C ATOM 1820 CG ASN A 114 -18.089 0.539 2.417 1.00 0.00 C ATOM 1821 OD1 ASN A 114 -19.003 0.639 1.605 1.00 0.00 O ATOM 1822 ND2 ASN A 114 -17.787 1.564 3.192 1.00 0.00 N ATOM 0 H ASN A 114 -17.858 -0.052 0.201 1.00 0.00 H new ATOM 0 HA ASN A 114 -15.374 -0.510 1.455 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -17.920 -1.592 2.598 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -16.631 -0.702 3.384 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -18.313 2.435 3.114 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -17.028 1.485 3.869 1.00 0.00 H new ATOM 1829 N LYS A 115 -16.950 -3.134 0.256 1.00 0.00 N ATOM 1830 CA LYS A 115 -16.745 -4.487 -0.234 1.00 0.00 C ATOM 1831 C LYS A 115 -15.381 -4.593 -0.913 1.00 0.00 C ATOM 1832 O LYS A 115 -14.595 -5.458 -0.533 1.00 0.00 O ATOM 1833 CB LYS A 115 -17.889 -4.839 -1.198 1.00 0.00 C ATOM 1834 CG LYS A 115 -17.887 -6.314 -1.629 1.00 0.00 C ATOM 1835 CD LYS A 115 -18.231 -6.466 -3.116 1.00 0.00 C ATOM 1836 CE LYS A 115 -17.038 -6.088 -3.998 1.00 0.00 C ATOM 1837 NZ LYS A 115 -16.284 -7.266 -4.472 1.00 0.00 N ATOM 0 H LYS A 115 -17.811 -2.712 -0.092 1.00 0.00 H new ATOM 0 HA LYS A 115 -16.754 -5.198 0.592 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -18.841 -4.608 -0.721 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -17.816 -4.208 -2.084 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -16.907 -6.749 -1.435 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -18.607 -6.870 -1.029 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -18.527 -7.495 -3.321 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -19.084 -5.834 -3.362 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -17.393 -5.519 -4.857 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -16.369 -5.435 -3.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -15.304 -6.989 -4.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -16.285 -7.999 -3.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -16.731 -7.641 -5.333 1.00 0.00 H new ATOM 1851 N ALA A 116 -15.102 -3.722 -1.886 1.00 0.00 N ATOM 1852 CA ALA A 116 -13.824 -3.727 -2.573 1.00 0.00 C ATOM 1853 C ALA A 116 -12.673 -3.545 -1.596 1.00 0.00 C ATOM 1854 O ALA A 116 -11.684 -4.257 -1.743 1.00 0.00 O ATOM 1855 CB ALA A 116 -13.780 -2.673 -3.683 1.00 0.00 C ATOM 0 H ALA A 116 -15.751 -3.005 -2.211 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.709 -4.703 -3.044 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -12.809 -2.705 -4.176 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -14.564 -2.879 -4.412 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -13.936 -1.684 -3.252 1.00 0.00 H new ATOM 1861 N VAL A 117 -12.771 -2.671 -0.585 1.00 0.00 N ATOM 1862 CA VAL A 117 -11.732 -2.538 0.442 1.00 0.00 C ATOM 1863 C VAL A 117 -11.374 -3.911 1.008 1.00 0.00 C ATOM 1864 O VAL A 117 -10.194 -4.235 1.099 1.00 0.00 O ATOM 1865 CB VAL A 117 -12.148 -1.591 1.585 1.00 0.00 C ATOM 1866 CG1 VAL A 117 -11.042 -1.477 2.650 1.00 0.00 C ATOM 1867 CG2 VAL A 117 -12.480 -0.193 1.066 1.00 0.00 C ATOM 0 H VAL A 117 -13.564 -2.043 -0.457 1.00 0.00 H new ATOM 0 HA VAL A 117 -10.860 -2.098 -0.041 1.00 0.00 H new ATOM 0 HB VAL A 117 -13.040 -2.025 2.036 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -11.367 -0.802 3.442 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -10.841 -2.461 3.072 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -10.134 -1.087 2.191 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.769 0.446 1.901 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.605 0.229 0.572 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -13.304 -0.255 0.355 1.00 0.00 H new ATOM 1877 N ARG A 118 -12.375 -4.686 1.429 1.00 0.00 N ATOM 1878 CA ARG A 118 -12.202 -5.953 2.115 1.00 0.00 C ATOM 1879 C ARG A 118 -11.453 -6.908 1.201 1.00 0.00 C ATOM 1880 O ARG A 118 -10.379 -7.385 1.553 1.00 0.00 O ATOM 1881 CB ARG A 118 -13.605 -6.401 2.570 1.00 0.00 C ATOM 1882 CG ARG A 118 -13.954 -7.894 2.499 1.00 0.00 C ATOM 1883 CD ARG A 118 -15.465 -8.070 2.672 1.00 0.00 C ATOM 1884 NE ARG A 118 -15.993 -7.409 3.879 1.00 0.00 N ATOM 1885 CZ ARG A 118 -16.881 -7.902 4.745 1.00 0.00 C ATOM 1886 NH1 ARG A 118 -17.223 -9.179 4.757 1.00 0.00 N ATOM 1887 NH2 ARG A 118 -17.428 -7.094 5.635 1.00 0.00 N ATOM 0 H ARG A 118 -13.355 -4.436 1.295 1.00 0.00 H new ATOM 0 HA ARG A 118 -11.585 -5.900 3.012 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -13.738 -6.078 3.602 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -14.337 -5.860 1.970 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -13.635 -8.308 1.543 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -13.421 -8.441 3.277 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -15.973 -7.670 1.795 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -15.697 -9.134 2.717 1.00 0.00 H new ATOM 0 HE ARG A 118 -15.641 -6.472 4.074 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -16.804 -9.825 4.088 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -17.906 -9.518 5.435 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -17.170 -6.107 5.654 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -18.108 -7.457 6.303 1.00 0.00 H new ATOM 1901 N GLU A 119 -11.996 -7.140 0.013 1.00 0.00 N ATOM 1902 CA GLU A 119 -11.516 -8.170 -0.893 1.00 0.00 C ATOM 1903 C GLU A 119 -10.129 -7.794 -1.418 1.00 0.00 C ATOM 1904 O GLU A 119 -9.244 -8.642 -1.530 1.00 0.00 O ATOM 1905 CB GLU A 119 -12.515 -8.296 -2.047 1.00 0.00 C ATOM 1906 CG GLU A 119 -13.954 -8.613 -1.587 1.00 0.00 C ATOM 1907 CD GLU A 119 -14.157 -10.072 -1.154 1.00 0.00 C ATOM 1908 OE1 GLU A 119 -13.363 -10.959 -1.542 1.00 0.00 O ATOM 1909 OE2 GLU A 119 -15.141 -10.327 -0.419 1.00 0.00 O ATOM 0 H GLU A 119 -12.790 -6.612 -0.350 1.00 0.00 H new ATOM 0 HA GLU A 119 -11.433 -9.125 -0.375 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -12.521 -7.366 -2.615 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -12.178 -9.081 -2.724 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.213 -7.957 -0.756 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -14.644 -8.385 -2.399 1.00 0.00 H new ATOM 1916 N THR A 120 -9.905 -6.512 -1.705 1.00 0.00 N ATOM 1917 CA THR A 120 -8.609 -6.030 -2.162 1.00 0.00 C ATOM 1918 C THR A 120 -7.550 -6.233 -1.069 1.00 0.00 C ATOM 1919 O THR A 120 -6.390 -6.482 -1.389 1.00 0.00 O ATOM 1920 CB THR A 120 -8.727 -4.562 -2.610 1.00 0.00 C ATOM 1921 OG1 THR A 120 -9.807 -4.397 -3.512 1.00 0.00 O ATOM 1922 CG2 THR A 120 -7.484 -4.081 -3.342 1.00 0.00 C ATOM 0 H THR A 120 -10.615 -5.784 -1.627 1.00 0.00 H new ATOM 0 HA THR A 120 -8.283 -6.607 -3.027 1.00 0.00 H new ATOM 0 HB THR A 120 -8.873 -3.986 -1.696 1.00 0.00 H new ATOM 0 HG1 THR A 120 -10.628 -4.212 -3.009 1.00 0.00 H new ATOM 0 HG21 THR A 120 -7.616 -3.040 -3.638 1.00 0.00 H new ATOM 0 HG22 THR A 120 -6.619 -4.165 -2.684 1.00 0.00 H new ATOM 0 HG23 THR A 120 -7.325 -4.693 -4.230 1.00 0.00 H new ATOM 1930 N ALA A 121 -7.935 -6.170 0.209 1.00 0.00 N ATOM 1931 CA ALA A 121 -7.039 -6.391 1.331 1.00 0.00 C ATOM 1932 C ALA A 121 -6.518 -7.830 1.341 1.00 0.00 C ATOM 1933 O ALA A 121 -5.377 -8.040 1.748 1.00 0.00 O ATOM 1934 CB ALA A 121 -7.752 -6.022 2.643 1.00 0.00 C ATOM 0 H ALA A 121 -8.893 -5.961 0.490 1.00 0.00 H new ATOM 0 HA ALA A 121 -6.167 -5.745 1.228 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -7.078 -6.189 3.483 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -8.045 -4.972 2.615 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -8.640 -6.643 2.762 1.00 0.00 H new ATOM 1940 N HIS A 122 -7.324 -8.802 0.910 1.00 0.00 N ATOM 1941 CA HIS A 122 -6.932 -10.208 0.852 1.00 0.00 C ATOM 1942 C HIS A 122 -5.810 -10.393 -0.188 1.00 0.00 C ATOM 1943 O HIS A 122 -4.799 -11.054 0.072 1.00 0.00 O ATOM 1944 CB HIS A 122 -8.155 -11.066 0.498 1.00 0.00 C ATOM 1945 CG HIS A 122 -9.278 -11.156 1.514 1.00 0.00 C ATOM 1946 ND1 HIS A 122 -10.222 -12.158 1.545 1.00 0.00 N ATOM 1947 CD2 HIS A 122 -9.641 -10.240 2.466 1.00 0.00 C ATOM 1948 CE1 HIS A 122 -11.132 -11.855 2.486 1.00 0.00 C ATOM 1949 NE2 HIS A 122 -10.817 -10.691 3.074 1.00 0.00 N ATOM 0 H HIS A 122 -8.277 -8.632 0.588 1.00 0.00 H new ATOM 0 HA HIS A 122 -6.554 -10.526 1.824 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -8.575 -10.682 -0.431 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -7.806 -12.078 0.295 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -9.112 -9.329 2.705 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -11.992 -12.460 2.733 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -11.335 -10.225 3.820 1.00 0.00 H new ATOM 1957 N GLU A 123 -5.947 -9.738 -1.351 1.00 0.00 N ATOM 1958 CA GLU A 123 -4.902 -9.713 -2.375 1.00 0.00 C ATOM 1959 C GLU A 123 -3.602 -9.194 -1.755 1.00 0.00 C ATOM 1960 O GLU A 123 -2.541 -9.782 -1.933 1.00 0.00 O ATOM 1961 CB GLU A 123 -5.250 -8.769 -3.536 1.00 0.00 C ATOM 1962 CG GLU A 123 -6.574 -8.947 -4.284 1.00 0.00 C ATOM 1963 CD GLU A 123 -6.862 -7.735 -5.186 1.00 0.00 C ATOM 1964 OE1 GLU A 123 -5.909 -7.089 -5.686 1.00 0.00 O ATOM 1965 OE2 GLU A 123 -8.041 -7.338 -5.329 1.00 0.00 O ATOM 0 H GLU A 123 -6.784 -9.213 -1.604 1.00 0.00 H new ATOM 0 HA GLU A 123 -4.803 -10.730 -2.754 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.230 -7.751 -3.146 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -4.448 -8.845 -4.270 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -6.536 -9.854 -4.888 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -7.386 -9.074 -3.568 1.00 0.00 H new ATOM 1972 N THR A 124 -3.683 -8.076 -1.026 1.00 0.00 N ATOM 1973 CA THR A 124 -2.519 -7.390 -0.508 1.00 0.00 C ATOM 1974 C THR A 124 -1.664 -8.314 0.364 1.00 0.00 C ATOM 1975 O THR A 124 -0.449 -8.346 0.175 1.00 0.00 O ATOM 1976 CB THR A 124 -2.956 -6.106 0.211 1.00 0.00 C ATOM 1977 OG1 THR A 124 -3.692 -5.277 -0.670 1.00 0.00 O ATOM 1978 CG2 THR A 124 -1.753 -5.318 0.715 1.00 0.00 C ATOM 0 H THR A 124 -4.567 -7.628 -0.784 1.00 0.00 H new ATOM 0 HA THR A 124 -1.873 -7.097 -1.335 1.00 0.00 H new ATOM 0 HB THR A 124 -3.574 -6.403 1.058 1.00 0.00 H new ATOM 0 HG1 THR A 124 -3.087 -4.634 -1.095 1.00 0.00 H new ATOM 0 HG21 THR A 124 -2.095 -4.414 1.219 1.00 0.00 H new ATOM 0 HG22 THR A 124 -1.184 -5.931 1.414 1.00 0.00 H new ATOM 0 HG23 THR A 124 -1.118 -5.045 -0.128 1.00 0.00 H new ATOM 1986 N ILE A 125 -2.255 -9.059 1.302 1.00 0.00 N ATOM 1987 CA ILE A 125 -1.481 -9.922 2.201 1.00 0.00 C ATOM 1988 C ILE A 125 -0.751 -11.000 1.417 1.00 0.00 C ATOM 1989 O ILE A 125 0.400 -11.308 1.726 1.00 0.00 O ATOM 1990 CB ILE A 125 -2.386 -10.540 3.278 1.00 0.00 C ATOM 1991 CG1 ILE A 125 -3.091 -9.445 4.073 1.00 0.00 C ATOM 1992 CG2 ILE A 125 -1.639 -11.437 4.272 1.00 0.00 C ATOM 1993 CD1 ILE A 125 -2.201 -8.337 4.637 1.00 0.00 C ATOM 0 H ILE A 125 -3.263 -9.083 1.459 1.00 0.00 H new ATOM 0 HA ILE A 125 -0.734 -9.308 2.703 1.00 0.00 H new ATOM 0 HB ILE A 125 -3.099 -11.160 2.735 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -3.843 -8.986 3.431 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -3.622 -9.912 4.902 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -2.343 -11.837 5.002 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -1.166 -12.260 3.736 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -0.876 -10.853 4.787 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -2.815 -7.619 5.181 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -1.464 -8.771 5.313 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.689 -7.830 3.819 1.00 0.00 H new ATOM 2005 N SER A 126 -1.400 -11.525 0.383 1.00 0.00 N ATOM 2006 CA SER A 126 -0.790 -12.494 -0.507 1.00 0.00 C ATOM 2007 C SER A 126 0.533 -11.963 -1.098 1.00 0.00 C ATOM 2008 O SER A 126 1.469 -12.747 -1.262 1.00 0.00 O ATOM 2009 CB SER A 126 -1.824 -12.931 -1.556 1.00 0.00 C ATOM 2010 OG SER A 126 -3.056 -13.314 -0.938 1.00 0.00 O ATOM 0 H SER A 126 -2.362 -11.288 0.142 1.00 0.00 H new ATOM 0 HA SER A 126 -0.500 -13.387 0.047 1.00 0.00 H new ATOM 0 HB2 SER A 126 -2.003 -12.115 -2.256 1.00 0.00 H new ATOM 0 HB3 SER A 126 -1.429 -13.766 -2.134 1.00 0.00 H new ATOM 0 HG SER A 126 -3.596 -12.515 -0.763 1.00 0.00 H new ATOM 2016 N ALA A 127 0.665 -10.651 -1.337 1.00 0.00 N ATOM 2017 CA ALA A 127 1.919 -10.040 -1.761 1.00 0.00 C ATOM 2018 C ALA A 127 2.858 -9.823 -0.575 1.00 0.00 C ATOM 2019 O ALA A 127 4.041 -10.159 -0.676 1.00 0.00 O ATOM 2020 CB ALA A 127 1.628 -8.723 -2.470 1.00 0.00 C ATOM 0 H ALA A 127 -0.102 -9.986 -1.239 1.00 0.00 H new ATOM 0 HA ALA A 127 2.421 -10.716 -2.453 1.00 0.00 H new ATOM 0 HB1 ALA A 127 2.565 -8.266 -2.787 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.002 -8.910 -3.342 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.108 -8.050 -1.788 1.00 0.00 H new ATOM 2026 N ILE A 128 2.358 -9.265 0.539 1.00 0.00 N ATOM 2027 CA ILE A 128 3.147 -8.984 1.745 1.00 0.00 C ATOM 2028 C ILE A 128 3.942 -10.231 2.184 1.00 0.00 C ATOM 2029 O ILE A 128 5.095 -10.102 2.599 1.00 0.00 O ATOM 2030 CB ILE A 128 2.246 -8.408 2.871 1.00 0.00 C ATOM 2031 CG1 ILE A 128 1.657 -7.027 2.493 1.00 0.00 C ATOM 2032 CG2 ILE A 128 3.042 -8.299 4.175 1.00 0.00 C ATOM 2033 CD1 ILE A 128 0.898 -6.302 3.624 1.00 0.00 C ATOM 0 H ILE A 128 1.379 -8.993 0.627 1.00 0.00 H new ATOM 0 HA ILE A 128 3.884 -8.215 1.515 1.00 0.00 H new ATOM 0 HB ILE A 128 1.411 -9.095 3.008 1.00 0.00 H new ATOM 0 HG12 ILE A 128 2.469 -6.385 2.153 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.980 -7.158 1.649 1.00 0.00 H new ATOM 0 HG21 ILE A 128 2.402 -7.894 4.959 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.395 -9.287 4.469 1.00 0.00 H new ATOM 0 HG23 ILE A 128 3.896 -7.638 4.026 1.00 0.00 H new ATOM 0 HD11 ILE A 128 0.526 -5.345 3.257 1.00 0.00 H new ATOM 0 HD12 ILE A 128 0.059 -6.916 3.952 1.00 0.00 H new ATOM 0 HD13 ILE A 128 1.572 -6.131 4.463 1.00 0.00 H new ATOM 2045 N PHE A 129 3.358 -11.423 2.047 1.00 0.00 N ATOM 2046 CA PHE A 129 3.961 -12.696 2.429 1.00 0.00 C ATOM 2047 C PHE A 129 4.171 -13.594 1.200 1.00 0.00 C ATOM 2048 O PHE A 129 4.063 -14.818 1.285 1.00 0.00 O ATOM 2049 CB PHE A 129 3.112 -13.345 3.528 1.00 0.00 C ATOM 2050 CG PHE A 129 2.962 -12.502 4.787 1.00 0.00 C ATOM 2051 CD1 PHE A 129 3.932 -12.553 5.804 1.00 0.00 C ATOM 2052 CD2 PHE A 129 1.834 -11.677 4.952 1.00 0.00 C ATOM 2053 CE1 PHE A 129 3.755 -11.814 6.987 1.00 0.00 C ATOM 2054 CE2 PHE A 129 1.663 -10.926 6.129 1.00 0.00 C ATOM 2055 CZ PHE A 129 2.622 -11.000 7.153 1.00 0.00 C ATOM 0 H PHE A 129 2.423 -11.529 1.654 1.00 0.00 H new ATOM 0 HA PHE A 129 4.956 -12.533 2.842 1.00 0.00 H new ATOM 0 HB2 PHE A 129 2.121 -13.557 3.127 1.00 0.00 H new ATOM 0 HB3 PHE A 129 3.558 -14.302 3.797 1.00 0.00 H new ATOM 0 HD1 PHE A 129 4.815 -13.161 5.676 1.00 0.00 H new ATOM 0 HD2 PHE A 129 1.093 -11.620 4.168 1.00 0.00 H new ATOM 0 HE1 PHE A 129 4.494 -11.872 7.772 1.00 0.00 H new ATOM 0 HE2 PHE A 129 0.796 -10.293 6.245 1.00 0.00 H new ATOM 0 HZ PHE A 129 2.489 -10.434 8.063 1.00 0.00 H new ATOM 2065 N SER A 130 4.465 -12.998 0.041 1.00 0.00 N ATOM 2066 CA SER A 130 4.982 -13.719 -1.115 1.00 0.00 C ATOM 2067 C SER A 130 6.355 -14.304 -0.730 1.00 0.00 C ATOM 2068 O SER A 130 7.106 -13.685 0.033 1.00 0.00 O ATOM 2069 CB SER A 130 5.037 -12.761 -2.317 1.00 0.00 C ATOM 2070 OG SER A 130 5.158 -13.447 -3.551 1.00 0.00 O ATOM 0 H SER A 130 4.349 -11.997 -0.118 1.00 0.00 H new ATOM 0 HA SER A 130 4.339 -14.549 -1.409 1.00 0.00 H new ATOM 0 HB2 SER A 130 4.135 -12.149 -2.332 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.881 -12.082 -2.198 1.00 0.00 H new ATOM 0 HG SER A 130 5.187 -12.798 -4.285 1.00 0.00 H new ATOM 2076 N GLU A 131 6.713 -15.478 -1.248 1.00 0.00 N ATOM 2077 CA GLU A 131 7.911 -16.219 -0.840 1.00 0.00 C ATOM 2078 C GLU A 131 8.994 -16.262 -1.929 1.00 0.00 C ATOM 2079 O GLU A 131 10.005 -16.941 -1.760 1.00 0.00 O ATOM 2080 CB GLU A 131 7.537 -17.604 -0.277 1.00 0.00 C ATOM 2081 CG GLU A 131 6.891 -17.521 1.118 1.00 0.00 C ATOM 2082 CD GLU A 131 7.745 -16.758 2.145 1.00 0.00 C ATOM 2083 OE1 GLU A 131 8.988 -16.921 2.166 1.00 0.00 O ATOM 2084 OE2 GLU A 131 7.186 -15.940 2.907 1.00 0.00 O ATOM 0 H GLU A 131 6.173 -15.950 -1.973 1.00 0.00 H new ATOM 0 HA GLU A 131 8.376 -15.666 -0.024 1.00 0.00 H new ATOM 0 HB2 GLU A 131 6.849 -18.097 -0.963 1.00 0.00 H new ATOM 0 HB3 GLU A 131 8.432 -18.224 -0.223 1.00 0.00 H new ATOM 0 HG2 GLU A 131 5.920 -17.034 1.032 1.00 0.00 H new ATOM 0 HG3 GLU A 131 6.710 -18.531 1.486 1.00 0.00 H new ATOM 2091 N GLU A 132 8.826 -15.474 -2.995 1.00 0.00 N ATOM 2092 CA GLU A 132 9.741 -15.332 -4.132 1.00 0.00 C ATOM 2093 C GLU A 132 11.215 -15.177 -3.725 1.00 0.00 C ATOM 2094 O GLU A 132 12.103 -15.639 -4.439 1.00 0.00 O ATOM 2095 CB GLU A 132 9.282 -14.091 -4.918 1.00 0.00 C ATOM 2096 CG GLU A 132 10.070 -13.775 -6.199 1.00 0.00 C ATOM 2097 CD GLU A 132 9.760 -12.359 -6.674 1.00 0.00 C ATOM 2098 OE1 GLU A 132 8.573 -12.058 -6.949 1.00 0.00 O ATOM 2099 OE2 GLU A 132 10.683 -11.506 -6.727 1.00 0.00 O ATOM 0 H GLU A 132 8.000 -14.884 -3.093 1.00 0.00 H new ATOM 0 HA GLU A 132 9.700 -16.244 -4.728 1.00 0.00 H new ATOM 0 HB2 GLU A 132 8.233 -14.221 -5.183 1.00 0.00 H new ATOM 0 HB3 GLU A 132 9.339 -13.226 -4.258 1.00 0.00 H new ATOM 0 HG2 GLU A 132 11.139 -13.877 -6.011 1.00 0.00 H new ATOM 0 HG3 GLU A 132 9.813 -14.492 -6.979 1.00 0.00 H new ATOM 2106 N ASN A 133 11.499 -14.481 -2.623 1.00 0.00 N ATOM 2107 CA ASN A 133 12.851 -14.135 -2.211 1.00 0.00 C ATOM 2108 C ASN A 133 13.233 -14.927 -0.962 1.00 0.00 C ATOM 2109 O ASN A 133 13.409 -14.364 0.120 1.00 0.00 O ATOM 2110 CB ASN A 133 12.966 -12.614 -2.035 1.00 0.00 C ATOM 2111 CG ASN A 133 14.401 -12.176 -1.780 1.00 0.00 C ATOM 2112 OD1 ASN A 133 15.347 -12.957 -1.884 1.00 0.00 O ATOM 2113 ND2 ASN A 133 14.609 -10.902 -1.517 1.00 0.00 N ATOM 0 H ASN A 133 10.781 -14.139 -1.985 1.00 0.00 H new ATOM 0 HA ASN A 133 13.569 -14.413 -2.982 1.00 0.00 H new ATOM 0 HB2 ASN A 133 12.588 -12.116 -2.928 1.00 0.00 H new ATOM 0 HB3 ASN A 133 12.337 -12.297 -1.203 1.00 0.00 H new ATOM 0 HD21 ASN A 133 15.561 -10.555 -1.398 1.00 0.00 H new ATOM 0 HD22 ASN A 133 13.818 -10.263 -1.433 1.00 0.00 H new ATOM 2120 N GLY A 134 13.353 -16.247 -1.106 1.00 0.00 N ATOM 2121 CA GLY A 134 13.804 -17.151 -0.060 1.00 0.00 C ATOM 2122 C GLY A 134 14.108 -18.519 -0.659 1.00 0.00 C ATOM 2123 O GLY A 134 13.745 -18.800 -1.804 1.00 0.00 O ATOM 0 H GLY A 134 13.132 -16.725 -1.979 1.00 0.00 H new ATOM 0 HA2 GLY A 134 14.695 -16.749 0.423 1.00 0.00 H new ATOM 0 HA3 GLY A 134 13.038 -17.243 0.710 1.00 0.00 H new ATOM 2127 N SER A 135 14.807 -19.358 0.099 1.00 0.00 N ATOM 2128 CA SER A 135 15.216 -20.699 -0.291 1.00 0.00 C ATOM 2129 C SER A 135 14.104 -21.724 -0.025 1.00 0.00 C ATOM 2130 O SER A 135 14.034 -22.730 -0.732 1.00 0.00 O ATOM 2131 CB SER A 135 16.500 -21.050 0.465 1.00 0.00 C ATOM 2132 OG SER A 135 17.489 -20.062 0.204 1.00 0.00 O ATOM 0 H SER A 135 15.115 -19.110 1.039 1.00 0.00 H new ATOM 0 HA SER A 135 15.407 -20.727 -1.364 1.00 0.00 H new ATOM 0 HB2 SER A 135 16.301 -21.107 1.535 1.00 0.00 H new ATOM 0 HB3 SER A 135 16.860 -22.031 0.156 1.00 0.00 H new ATOM 0 HG SER A 135 18.311 -20.285 0.689 1.00 0.00 H new ATOM 2138 N GLY A 136 13.178 -21.445 0.896 1.00 0.00 N ATOM 2139 CA GLY A 136 11.984 -22.255 1.141 1.00 0.00 C ATOM 2140 C GLY A 136 11.834 -22.519 2.637 1.00 0.00 C ATOM 2141 O GLY A 136 12.197 -23.610 3.090 1.00 0.00 O ATOM 0 H GLY A 136 13.240 -20.630 1.506 1.00 0.00 H new ATOM 0 HA2 GLY A 136 11.101 -21.740 0.763 1.00 0.00 H new ATOM 0 HA3 GLY A 136 12.057 -23.199 0.602 1.00 0.00 H new ATOM 2145 N PRO A 137 11.377 -21.535 3.427 1.00 0.00 N ATOM 2146 CA PRO A 137 11.278 -21.667 4.872 1.00 0.00 C ATOM 2147 C PRO A 137 10.061 -22.498 5.311 1.00 0.00 C ATOM 2148 O PRO A 137 10.115 -23.134 6.370 1.00 0.00 O ATOM 2149 CB PRO A 137 11.197 -20.226 5.375 1.00 0.00 C ATOM 2150 CG PRO A 137 10.439 -19.508 4.258 1.00 0.00 C ATOM 2151 CD PRO A 137 10.936 -20.212 2.999 1.00 0.00 C ATOM 0 HA PRO A 137 12.129 -22.207 5.287 1.00 0.00 H new ATOM 0 HB2 PRO A 137 10.669 -20.161 6.326 1.00 0.00 H new ATOM 0 HB3 PRO A 137 12.187 -19.797 5.530 1.00 0.00 H new ATOM 0 HG2 PRO A 137 9.360 -19.605 4.375 1.00 0.00 H new ATOM 0 HG3 PRO A 137 10.663 -18.441 4.239 1.00 0.00 H new ATOM 0 HD2 PRO A 137 10.143 -20.287 2.255 1.00 0.00 H new ATOM 0 HD3 PRO A 137 11.754 -19.658 2.539 1.00 0.00 H new ATOM 2159 N SER A 138 8.980 -22.519 4.522 1.00 0.00 N ATOM 2160 CA SER A 138 7.749 -23.275 4.738 1.00 0.00 C ATOM 2161 C SER A 138 7.059 -23.027 6.098 1.00 0.00 C ATOM 2162 O SER A 138 6.170 -23.799 6.467 1.00 0.00 O ATOM 2163 CB SER A 138 8.045 -24.753 4.443 1.00 0.00 C ATOM 2164 OG SER A 138 6.858 -25.519 4.366 1.00 0.00 O ATOM 0 H SER A 138 8.944 -21.972 3.662 1.00 0.00 H new ATOM 0 HA SER A 138 6.992 -22.910 4.044 1.00 0.00 H new ATOM 0 HB2 SER A 138 8.592 -24.834 3.504 1.00 0.00 H new ATOM 0 HB3 SER A 138 8.689 -25.158 5.223 1.00 0.00 H new ATOM 0 HG SER A 138 6.216 -25.196 5.033 1.00 0.00 H new ATOM 2170 N SER A 139 7.460 -22.004 6.858 1.00 0.00 N ATOM 2171 CA SER A 139 7.003 -21.755 8.219 1.00 0.00 C ATOM 2172 C SER A 139 5.554 -21.256 8.262 1.00 0.00 C ATOM 2173 O SER A 139 4.975 -20.851 7.241 1.00 0.00 O ATOM 2174 CB SER A 139 7.901 -20.692 8.872 1.00 0.00 C ATOM 2175 OG SER A 139 9.254 -20.760 8.439 1.00 0.00 O ATOM 0 H SER A 139 8.131 -21.309 6.530 1.00 0.00 H new ATOM 0 HA SER A 139 7.056 -22.701 8.757 1.00 0.00 H new ATOM 0 HB2 SER A 139 7.504 -19.702 8.648 1.00 0.00 H new ATOM 0 HB3 SER A 139 7.866 -20.811 9.955 1.00 0.00 H new ATOM 0 HG SER A 139 9.776 -20.061 8.885 1.00 0.00 H new ATOM 2181 N GLY A 140 5.016 -21.172 9.477 1.00 0.00 N ATOM 2182 CA GLY A 140 3.999 -20.213 9.847 1.00 0.00 C ATOM 2183 C GLY A 140 4.745 -19.005 10.357 1.00 0.00 C ATOM 2184 O GLY A 140 4.885 -18.889 11.593 1.00 0.00 O ATOM 0 H GLY A 140 5.287 -21.787 10.244 1.00 0.00 H new ATOM 0 HA2 GLY A 140 3.374 -19.955 8.992 1.00 0.00 H new ATOM 0 HA3 GLY A 140 3.339 -20.618 10.614 1.00 0.00 H new TER 2188 GLY A 140