USER MOD reduce.3.24.130724 H: found=0, std=0, add=1146, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1141 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 52 MET CE :methyl -137:sc= -2.67 (180deg=-1.5) USER MOD Set 1.2: A 54 MET CE :methyl 149:sc= -10.4! (180deg=-9.7!) USER MOD Set 1.3: A 93 THR OG1 : rot 73:sc= 0.44 USER MOD Single : A 1 MET CE :methyl -105:sc= -0.612 (180deg=-1.67!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -2.5! C(o=-2.5!,f=-7.3!) USER MOD Single : A 42 ASN : amide:sc= -0.187 X(o=-0.19,f=-0.043) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -1.89 X(o=-1.9,f=-1.8!) USER MOD Single : A 53 MET CE :methyl 148:sc= -3.77! (180deg=-5.15!) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 66 HIS : no HD1:sc= -6.24! C(o=-6.2!,f=-10!) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.171 F(o=-0.91,f=-0.17) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0.017 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.0764 USER MOD Single : A 83 HIS : no HD1:sc= -5.64! C(o=-5.6!,f=-11!) USER MOD Single : A 98 HIS : no HD1:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 123 HIS : no HD1:sc= -12! C(o=-12!,f=-13!) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 137 THR OG1 : rot 180:sc= 0.0106 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 ASN : amide:sc= -0.0178 K(o=-0.018,f=-1.6!) USER MOD Single : A 142 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 105.895 30.350 -18.980 1.00 0.00 N ATOM 2 CA MET A 1 106.401 29.032 -18.494 1.00 0.00 C ATOM 3 C MET A 1 107.648 29.229 -17.627 1.00 0.00 C ATOM 4 O MET A 1 108.666 28.599 -17.837 1.00 0.00 O ATOM 5 CB MET A 1 106.747 28.250 -19.763 1.00 0.00 C ATOM 6 CG MET A 1 106.685 26.749 -19.477 1.00 0.00 C ATOM 7 SD MET A 1 104.955 26.223 -19.380 1.00 0.00 S ATOM 8 CE MET A 1 104.894 25.961 -17.591 1.00 0.00 C ATOM 0 H1 MET A 1 105.049 30.202 -19.567 1.00 0.00 H new ATOM 0 H2 MET A 1 105.651 30.950 -18.166 1.00 0.00 H new ATOM 0 H3 MET A 1 106.632 30.817 -19.546 1.00 0.00 H new ATOM 0 HA MET A 1 105.668 28.509 -17.879 1.00 0.00 H new ATOM 0 HB2 MET A 1 106.051 28.507 -20.561 1.00 0.00 H new ATOM 0 HB3 MET A 1 107.744 28.523 -20.110 1.00 0.00 H new ATOM 0 HG2 MET A 1 107.200 26.197 -20.263 1.00 0.00 H new ATOM 0 HG3 MET A 1 107.197 26.525 -18.541 1.00 0.00 H new ATOM 0 HE1 MET A 1 104.906 24.892 -17.379 1.00 0.00 H new ATOM 0 HE2 MET A 1 105.758 26.433 -17.124 1.00 0.00 H new ATOM 0 HE3 MET A 1 103.980 26.400 -17.190 1.00 0.00 H new ATOM 20 N GLU A 2 107.578 30.099 -16.654 1.00 0.00 N ATOM 21 CA GLU A 2 108.760 30.333 -15.774 1.00 0.00 C ATOM 22 C GLU A 2 109.118 29.051 -15.009 1.00 0.00 C ATOM 23 O GLU A 2 110.239 28.588 -15.079 1.00 0.00 O ATOM 24 CB GLU A 2 108.330 31.441 -14.809 1.00 0.00 C ATOM 25 CG GLU A 2 108.982 32.763 -15.221 1.00 0.00 C ATOM 26 CD GLU A 2 108.092 33.476 -16.242 1.00 0.00 C ATOM 27 OE1 GLU A 2 107.676 32.829 -17.190 1.00 0.00 O ATOM 28 OE2 GLU A 2 107.839 34.654 -16.059 1.00 0.00 O ATOM 0 H GLU A 2 106.754 30.657 -16.431 1.00 0.00 H new ATOM 0 HA GLU A 2 109.646 30.616 -16.342 1.00 0.00 H new ATOM 0 HB2 GLU A 2 107.245 31.542 -14.816 1.00 0.00 H new ATOM 0 HB3 GLU A 2 108.620 31.183 -13.791 1.00 0.00 H new ATOM 0 HG2 GLU A 2 109.129 33.396 -14.346 1.00 0.00 H new ATOM 0 HG3 GLU A 2 109.967 32.577 -15.649 1.00 0.00 H new ATOM 35 N PRO A 3 108.153 28.510 -14.302 1.00 0.00 N ATOM 36 CA PRO A 3 108.393 27.267 -13.528 1.00 0.00 C ATOM 37 C PRO A 3 108.472 26.059 -14.467 1.00 0.00 C ATOM 38 O PRO A 3 107.468 25.556 -14.932 1.00 0.00 O ATOM 39 CB PRO A 3 107.170 27.166 -12.621 1.00 0.00 C ATOM 40 CG PRO A 3 106.096 27.928 -13.328 1.00 0.00 C ATOM 41 CD PRO A 3 106.773 28.993 -14.153 1.00 0.00 C ATOM 0 HA PRO A 3 109.331 27.284 -12.972 1.00 0.00 H new ATOM 0 HB2 PRO A 3 106.879 26.127 -12.466 1.00 0.00 H new ATOM 0 HB3 PRO A 3 107.372 27.591 -11.638 1.00 0.00 H new ATOM 0 HG2 PRO A 3 105.509 27.265 -13.963 1.00 0.00 H new ATOM 0 HG3 PRO A 3 105.407 28.376 -12.612 1.00 0.00 H new ATOM 0 HD2 PRO A 3 106.287 29.116 -15.121 1.00 0.00 H new ATOM 0 HD3 PRO A 3 106.742 29.962 -13.655 1.00 0.00 H new ATOM 49 N ALA A 4 109.658 25.590 -14.747 1.00 0.00 N ATOM 50 CA ALA A 4 109.801 24.414 -15.653 1.00 0.00 C ATOM 51 C ALA A 4 110.720 23.370 -15.018 1.00 0.00 C ATOM 52 O ALA A 4 111.634 22.866 -15.644 1.00 0.00 O ATOM 53 CB ALA A 4 110.417 24.976 -16.938 1.00 0.00 C ATOM 0 H ALA A 4 110.534 25.970 -14.388 1.00 0.00 H new ATOM 0 HA ALA A 4 108.850 23.918 -15.846 1.00 0.00 H new ATOM 0 HB1 ALA A 4 110.555 24.170 -17.658 1.00 0.00 H new ATOM 0 HB2 ALA A 4 109.753 25.730 -17.360 1.00 0.00 H new ATOM 0 HB3 ALA A 4 111.382 25.428 -16.711 1.00 0.00 H new ATOM 59 N ALA A 5 110.477 23.041 -13.777 1.00 0.00 N ATOM 60 CA ALA A 5 111.322 22.024 -13.077 1.00 0.00 C ATOM 61 C ALA A 5 112.811 22.322 -13.292 1.00 0.00 C ATOM 62 O ALA A 5 113.491 21.633 -14.029 1.00 0.00 O ATOM 63 CB ALA A 5 110.944 20.686 -13.715 1.00 0.00 C ATOM 0 H ALA A 5 109.724 23.435 -13.213 1.00 0.00 H new ATOM 0 HA ALA A 5 111.155 22.025 -12.000 1.00 0.00 H new ATOM 0 HB1 ALA A 5 111.523 19.886 -13.254 1.00 0.00 H new ATOM 0 HB2 ALA A 5 109.881 20.498 -13.563 1.00 0.00 H new ATOM 0 HB3 ALA A 5 111.158 20.719 -14.783 1.00 0.00 H new ATOM 69 N GLY A 6 113.318 23.347 -12.663 1.00 0.00 N ATOM 70 CA GLY A 6 114.756 23.693 -12.843 1.00 0.00 C ATOM 71 C GLY A 6 114.949 24.296 -14.235 1.00 0.00 C ATOM 72 O GLY A 6 114.778 25.482 -14.434 1.00 0.00 O ATOM 0 H GLY A 6 112.799 23.959 -12.033 1.00 0.00 H new ATOM 0 HA2 GLY A 6 115.072 24.402 -12.078 1.00 0.00 H new ATOM 0 HA3 GLY A 6 115.375 22.803 -12.728 1.00 0.00 H new ATOM 76 N SER A 7 115.293 23.485 -15.199 1.00 0.00 N ATOM 77 CA SER A 7 115.485 24.005 -16.584 1.00 0.00 C ATOM 78 C SER A 7 114.801 23.079 -17.593 1.00 0.00 C ATOM 79 O SER A 7 113.976 22.258 -17.240 1.00 0.00 O ATOM 80 CB SER A 7 116.995 24.002 -16.807 1.00 0.00 C ATOM 81 OG SER A 7 117.338 25.029 -17.729 1.00 0.00 O ATOM 0 H SER A 7 115.450 22.483 -15.087 1.00 0.00 H new ATOM 0 HA SER A 7 115.055 24.998 -16.712 1.00 0.00 H new ATOM 0 HB2 SER A 7 117.514 24.159 -15.861 1.00 0.00 H new ATOM 0 HB3 SER A 7 117.315 23.033 -17.189 1.00 0.00 H new ATOM 0 HG SER A 7 118.307 25.030 -17.872 1.00 0.00 H new ATOM 87 N SER A 8 115.144 23.201 -18.845 1.00 0.00 N ATOM 88 CA SER A 8 114.525 22.323 -19.878 1.00 0.00 C ATOM 89 C SER A 8 115.616 21.605 -20.677 1.00 0.00 C ATOM 90 O SER A 8 115.375 21.096 -21.754 1.00 0.00 O ATOM 91 CB SER A 8 113.719 23.260 -20.781 1.00 0.00 C ATOM 92 OG SER A 8 113.408 24.455 -20.074 1.00 0.00 O ATOM 0 H SER A 8 115.827 23.871 -19.198 1.00 0.00 H new ATOM 0 HA SER A 8 113.892 21.552 -19.437 1.00 0.00 H new ATOM 0 HB2 SER A 8 114.290 23.495 -21.679 1.00 0.00 H new ATOM 0 HB3 SER A 8 112.802 22.769 -21.106 1.00 0.00 H new ATOM 0 HG SER A 8 112.894 25.054 -20.654 1.00 0.00 H new ATOM 98 N MET A 9 116.814 21.556 -20.153 1.00 0.00 N ATOM 99 CA MET A 9 117.920 20.866 -20.877 1.00 0.00 C ATOM 100 C MET A 9 117.760 19.349 -20.742 1.00 0.00 C ATOM 101 O MET A 9 118.005 18.780 -19.695 1.00 0.00 O ATOM 102 CB MET A 9 119.205 21.340 -20.185 1.00 0.00 C ATOM 103 CG MET A 9 120.210 21.814 -21.237 1.00 0.00 C ATOM 104 SD MET A 9 121.439 22.893 -20.457 1.00 0.00 S ATOM 105 CE MET A 9 122.489 21.589 -19.768 1.00 0.00 C ATOM 0 H MET A 9 117.073 21.964 -19.255 1.00 0.00 H new ATOM 0 HA MET A 9 117.929 21.094 -21.943 1.00 0.00 H new ATOM 0 HB2 MET A 9 118.979 22.151 -19.492 1.00 0.00 H new ATOM 0 HB3 MET A 9 119.634 20.528 -19.597 1.00 0.00 H new ATOM 0 HG2 MET A 9 120.702 20.957 -21.697 1.00 0.00 H new ATOM 0 HG3 MET A 9 119.693 22.350 -22.033 1.00 0.00 H new ATOM 0 HE1 MET A 9 123.326 22.040 -19.234 1.00 0.00 H new ATOM 0 HE2 MET A 9 121.906 20.978 -19.079 1.00 0.00 H new ATOM 0 HE3 MET A 9 122.869 20.963 -20.575 1.00 0.00 H new ATOM 115 N GLU A 10 117.343 18.688 -21.794 1.00 0.00 N ATOM 116 CA GLU A 10 117.157 17.204 -21.732 1.00 0.00 C ATOM 117 C GLU A 10 116.199 16.838 -20.592 1.00 0.00 C ATOM 118 O GLU A 10 115.785 17.695 -19.836 1.00 0.00 O ATOM 119 CB GLU A 10 118.553 16.631 -21.468 1.00 0.00 C ATOM 120 CG GLU A 10 119.115 16.024 -22.756 1.00 0.00 C ATOM 121 CD GLU A 10 120.068 17.022 -23.416 1.00 0.00 C ATOM 122 OE1 GLU A 10 120.823 17.654 -22.695 1.00 0.00 O ATOM 123 OE2 GLU A 10 120.026 17.138 -24.631 1.00 0.00 O ATOM 0 H GLU A 10 117.123 19.113 -22.695 1.00 0.00 H new ATOM 0 HA GLU A 10 116.725 16.806 -22.651 1.00 0.00 H new ATOM 0 HB2 GLU A 10 119.216 17.416 -21.105 1.00 0.00 H new ATOM 0 HB3 GLU A 10 118.503 15.871 -20.688 1.00 0.00 H new ATOM 0 HG2 GLU A 10 119.641 15.095 -22.534 1.00 0.00 H new ATOM 0 HG3 GLU A 10 118.302 15.775 -23.438 1.00 0.00 H new ATOM 130 N PRO A 11 115.877 15.572 -20.502 1.00 0.00 N ATOM 131 CA PRO A 11 114.960 15.097 -19.437 1.00 0.00 C ATOM 132 C PRO A 11 115.679 15.086 -18.085 1.00 0.00 C ATOM 133 O PRO A 11 116.859 14.805 -18.005 1.00 0.00 O ATOM 134 CB PRO A 11 114.611 13.676 -19.868 1.00 0.00 C ATOM 135 CG PRO A 11 115.759 13.238 -20.721 1.00 0.00 C ATOM 136 CD PRO A 11 116.323 14.474 -21.372 1.00 0.00 C ATOM 0 HA PRO A 11 114.081 15.730 -19.317 1.00 0.00 H new ATOM 0 HB2 PRO A 11 114.487 13.021 -19.006 1.00 0.00 H new ATOM 0 HB3 PRO A 11 113.674 13.651 -20.424 1.00 0.00 H new ATOM 0 HG2 PRO A 11 116.518 12.739 -20.119 1.00 0.00 H new ATOM 0 HG3 PRO A 11 115.429 12.522 -21.474 1.00 0.00 H new ATOM 0 HD2 PRO A 11 117.410 14.431 -21.434 1.00 0.00 H new ATOM 0 HD3 PRO A 11 115.950 14.594 -22.389 1.00 0.00 H new ATOM 144 N SER A 12 114.978 15.382 -17.025 1.00 0.00 N ATOM 145 CA SER A 12 115.622 15.380 -15.680 1.00 0.00 C ATOM 146 C SER A 12 115.601 13.964 -15.095 1.00 0.00 C ATOM 147 O SER A 12 114.552 13.384 -14.888 1.00 0.00 O ATOM 148 CB SER A 12 114.774 16.326 -14.834 1.00 0.00 C ATOM 149 OG SER A 12 115.391 16.501 -13.568 1.00 0.00 O ATOM 0 H SER A 12 113.987 15.625 -17.032 1.00 0.00 H new ATOM 0 HA SER A 12 116.665 15.696 -15.716 1.00 0.00 H new ATOM 0 HB2 SER A 12 114.669 17.287 -15.337 1.00 0.00 H new ATOM 0 HB3 SER A 12 113.770 15.920 -14.709 1.00 0.00 H new ATOM 0 HG SER A 12 114.850 17.109 -13.022 1.00 0.00 H new ATOM 155 N ALA A 13 116.750 13.400 -14.834 1.00 0.00 N ATOM 156 CA ALA A 13 116.798 12.017 -14.272 1.00 0.00 C ATOM 157 C ALA A 13 116.224 11.986 -12.849 1.00 0.00 C ATOM 158 O ALA A 13 115.954 10.932 -12.307 1.00 0.00 O ATOM 159 CB ALA A 13 118.280 11.643 -14.260 1.00 0.00 C ATOM 0 H ALA A 13 117.659 13.837 -14.986 1.00 0.00 H new ATOM 0 HA ALA A 13 116.203 11.319 -14.862 1.00 0.00 H new ATOM 0 HB1 ALA A 13 118.398 10.636 -13.859 1.00 0.00 H new ATOM 0 HB2 ALA A 13 118.672 11.677 -15.277 1.00 0.00 H new ATOM 0 HB3 ALA A 13 118.828 12.349 -13.636 1.00 0.00 H new ATOM 165 N ASP A 14 116.033 13.129 -12.243 1.00 0.00 N ATOM 166 CA ASP A 14 115.472 13.151 -10.860 1.00 0.00 C ATOM 167 C ASP A 14 113.973 12.832 -10.883 1.00 0.00 C ATOM 168 O ASP A 14 113.348 12.698 -9.851 1.00 0.00 O ATOM 169 CB ASP A 14 115.708 14.575 -10.352 1.00 0.00 C ATOM 170 CG ASP A 14 115.582 14.602 -8.827 1.00 0.00 C ATOM 171 OD1 ASP A 14 116.534 14.220 -8.167 1.00 0.00 O ATOM 172 OD2 ASP A 14 114.536 15.006 -8.346 1.00 0.00 O ATOM 0 H ASP A 14 116.240 14.044 -12.644 1.00 0.00 H new ATOM 0 HA ASP A 14 115.943 12.406 -10.219 1.00 0.00 H new ATOM 0 HB2 ASP A 14 116.698 14.920 -10.652 1.00 0.00 H new ATOM 0 HB3 ASP A 14 114.984 15.256 -10.799 1.00 0.00 H new ATOM 177 N TRP A 15 113.392 12.706 -12.049 1.00 0.00 N ATOM 178 CA TRP A 15 111.934 12.393 -12.127 1.00 0.00 C ATOM 179 C TRP A 15 111.685 10.912 -11.819 1.00 0.00 C ATOM 180 O TRP A 15 110.558 10.482 -11.669 1.00 0.00 O ATOM 181 CB TRP A 15 111.535 12.723 -13.567 1.00 0.00 C ATOM 182 CG TRP A 15 111.570 14.208 -13.775 1.00 0.00 C ATOM 183 CD1 TRP A 15 112.075 15.109 -12.897 1.00 0.00 C ATOM 184 CD2 TRP A 15 111.090 14.977 -14.916 1.00 0.00 C ATOM 185 NE1 TRP A 15 111.934 16.377 -13.426 1.00 0.00 N ATOM 186 CE2 TRP A 15 111.334 16.350 -14.668 1.00 0.00 C ATOM 187 CE3 TRP A 15 110.474 14.622 -16.130 1.00 0.00 C ATOM 188 CZ2 TRP A 15 110.980 17.333 -15.592 1.00 0.00 C ATOM 189 CZ3 TRP A 15 110.115 15.610 -17.061 1.00 0.00 C ATOM 190 CH2 TRP A 15 110.368 16.964 -16.792 1.00 0.00 C ATOM 0 H TRP A 15 113.863 12.806 -12.948 1.00 0.00 H new ATOM 0 HA TRP A 15 111.351 12.962 -11.403 1.00 0.00 H new ATOM 0 HB2 TRP A 15 112.215 12.233 -14.264 1.00 0.00 H new ATOM 0 HB3 TRP A 15 110.535 12.341 -13.774 1.00 0.00 H new ATOM 0 HD1 TRP A 15 112.516 14.874 -11.940 1.00 0.00 H new ATOM 0 HE1 TRP A 15 112.237 17.230 -12.956 1.00 0.00 H new ATOM 0 HE3 TRP A 15 110.276 13.583 -16.347 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 111.178 18.373 -15.381 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 109.642 15.326 -17.989 1.00 0.00 H new ATOM 0 HH2 TRP A 15 110.090 17.720 -17.512 1.00 0.00 H new ATOM 201 N LEU A 16 112.730 10.133 -11.709 1.00 0.00 N ATOM 202 CA LEU A 16 112.562 8.689 -11.399 1.00 0.00 C ATOM 203 C LEU A 16 112.311 8.526 -9.893 1.00 0.00 C ATOM 204 O LEU A 16 111.371 7.876 -9.472 1.00 0.00 O ATOM 205 CB LEU A 16 113.898 8.063 -11.834 1.00 0.00 C ATOM 206 CG LEU A 16 114.282 6.910 -10.909 1.00 0.00 C ATOM 207 CD1 LEU A 16 113.256 5.785 -11.050 1.00 0.00 C ATOM 208 CD2 LEU A 16 115.672 6.388 -11.286 1.00 0.00 C ATOM 0 H LEU A 16 113.696 10.440 -11.822 1.00 0.00 H new ATOM 0 HA LEU A 16 111.719 8.217 -11.903 1.00 0.00 H new ATOM 0 HB2 LEU A 16 113.819 7.702 -12.859 1.00 0.00 H new ATOM 0 HB3 LEU A 16 114.681 8.821 -11.822 1.00 0.00 H new ATOM 0 HG LEU A 16 114.298 7.261 -9.877 1.00 0.00 H new ATOM 0 HD11 LEU A 16 113.527 4.960 -10.391 1.00 0.00 H new ATOM 0 HD12 LEU A 16 112.268 6.157 -10.778 1.00 0.00 H new ATOM 0 HD13 LEU A 16 113.240 5.434 -12.082 1.00 0.00 H new ATOM 0 HD21 LEU A 16 115.944 5.565 -10.624 1.00 0.00 H new ATOM 0 HD22 LEU A 16 115.661 6.036 -12.317 1.00 0.00 H new ATOM 0 HD23 LEU A 16 116.402 7.191 -11.185 1.00 0.00 H new ATOM 220 N ALA A 17 113.149 9.117 -9.084 1.00 0.00 N ATOM 221 CA ALA A 17 112.975 9.007 -7.607 1.00 0.00 C ATOM 222 C ALA A 17 111.879 9.959 -7.117 1.00 0.00 C ATOM 223 O ALA A 17 111.157 9.655 -6.187 1.00 0.00 O ATOM 224 CB ALA A 17 114.328 9.406 -7.021 1.00 0.00 C ATOM 0 H ALA A 17 113.950 9.673 -9.384 1.00 0.00 H new ATOM 0 HA ALA A 17 112.674 8.004 -7.306 1.00 0.00 H new ATOM 0 HB1 ALA A 17 114.284 9.351 -5.933 1.00 0.00 H new ATOM 0 HB2 ALA A 17 115.098 8.727 -7.388 1.00 0.00 H new ATOM 0 HB3 ALA A 17 114.569 10.425 -7.323 1.00 0.00 H new ATOM 230 N THR A 18 111.750 11.110 -7.729 1.00 0.00 N ATOM 231 CA THR A 18 110.700 12.074 -7.283 1.00 0.00 C ATOM 232 C THR A 18 109.309 11.471 -7.505 1.00 0.00 C ATOM 233 O THR A 18 108.428 11.601 -6.678 1.00 0.00 O ATOM 234 CB THR A 18 110.915 13.341 -8.129 1.00 0.00 C ATOM 235 OG1 THR A 18 110.541 14.484 -7.366 1.00 0.00 O ATOM 236 CG2 THR A 18 110.081 13.286 -9.416 1.00 0.00 C ATOM 0 H THR A 18 112.323 11.422 -8.513 1.00 0.00 H new ATOM 0 HA THR A 18 110.770 12.305 -6.220 1.00 0.00 H new ATOM 0 HB THR A 18 111.968 13.404 -8.404 1.00 0.00 H new ATOM 0 HG1 THR A 18 110.678 15.294 -7.901 1.00 0.00 H new ATOM 0 HG21 THR A 18 110.249 14.192 -9.998 1.00 0.00 H new ATOM 0 HG22 THR A 18 110.376 12.417 -10.004 1.00 0.00 H new ATOM 0 HG23 THR A 18 109.024 13.209 -9.162 1.00 0.00 H new ATOM 244 N ALA A 19 109.109 10.803 -8.612 1.00 0.00 N ATOM 245 CA ALA A 19 107.779 10.184 -8.870 1.00 0.00 C ATOM 246 C ALA A 19 107.513 9.123 -7.806 1.00 0.00 C ATOM 247 O ALA A 19 106.445 9.056 -7.231 1.00 0.00 O ATOM 248 CB ALA A 19 107.886 9.545 -10.257 1.00 0.00 C ATOM 0 H ALA A 19 109.806 10.661 -9.343 1.00 0.00 H new ATOM 0 HA ALA A 19 106.963 10.906 -8.833 1.00 0.00 H new ATOM 0 HB1 ALA A 19 106.939 9.069 -10.512 1.00 0.00 H new ATOM 0 HB2 ALA A 19 108.117 10.313 -10.995 1.00 0.00 H new ATOM 0 HB3 ALA A 19 108.679 8.797 -10.253 1.00 0.00 H new ATOM 254 N ALA A 20 108.492 8.303 -7.531 1.00 0.00 N ATOM 255 CA ALA A 20 108.315 7.251 -6.491 1.00 0.00 C ATOM 256 C ALA A 20 108.063 7.902 -5.126 1.00 0.00 C ATOM 257 O ALA A 20 107.089 7.612 -4.458 1.00 0.00 O ATOM 258 CB ALA A 20 109.638 6.483 -6.484 1.00 0.00 C ATOM 0 H ALA A 20 109.407 8.317 -7.982 1.00 0.00 H new ATOM 0 HA ALA A 20 107.466 6.599 -6.695 1.00 0.00 H new ATOM 0 HB1 ALA A 20 109.592 5.686 -5.742 1.00 0.00 H new ATOM 0 HB2 ALA A 20 109.813 6.051 -7.469 1.00 0.00 H new ATOM 0 HB3 ALA A 20 110.452 7.164 -6.236 1.00 0.00 H new ATOM 264 N ALA A 21 108.940 8.779 -4.712 1.00 0.00 N ATOM 265 CA ALA A 21 108.770 9.459 -3.390 1.00 0.00 C ATOM 266 C ALA A 21 107.403 10.140 -3.296 1.00 0.00 C ATOM 267 O ALA A 21 106.903 10.402 -2.219 1.00 0.00 O ATOM 268 CB ALA A 21 109.885 10.504 -3.343 1.00 0.00 C ATOM 0 H ALA A 21 109.771 9.056 -5.234 1.00 0.00 H new ATOM 0 HA ALA A 21 108.823 8.753 -2.561 1.00 0.00 H new ATOM 0 HB1 ALA A 21 109.832 11.050 -2.401 1.00 0.00 H new ATOM 0 HB2 ALA A 21 110.852 10.008 -3.421 1.00 0.00 H new ATOM 0 HB3 ALA A 21 109.767 11.200 -4.173 1.00 0.00 H new ATOM 274 N ARG A 22 106.795 10.434 -4.413 1.00 0.00 N ATOM 275 CA ARG A 22 105.463 11.103 -4.384 1.00 0.00 C ATOM 276 C ARG A 22 104.338 10.062 -4.309 1.00 0.00 C ATOM 277 O ARG A 22 103.231 10.307 -4.746 1.00 0.00 O ATOM 278 CB ARG A 22 105.389 11.889 -5.697 1.00 0.00 C ATOM 279 CG ARG A 22 105.653 13.373 -5.424 1.00 0.00 C ATOM 280 CD ARG A 22 106.332 14.010 -6.642 1.00 0.00 C ATOM 281 NE ARG A 22 105.485 15.187 -6.987 1.00 0.00 N ATOM 282 CZ ARG A 22 105.152 15.406 -8.230 1.00 0.00 C ATOM 283 NH1 ARG A 22 104.377 14.562 -8.853 1.00 0.00 N ATOM 284 NH2 ARG A 22 105.593 16.468 -8.849 1.00 0.00 N ATOM 0 H ARG A 22 107.163 10.240 -5.344 1.00 0.00 H new ATOM 0 HA ARG A 22 105.345 11.749 -3.514 1.00 0.00 H new ATOM 0 HB2 ARG A 22 106.122 11.503 -6.405 1.00 0.00 H new ATOM 0 HB3 ARG A 22 104.407 11.762 -6.154 1.00 0.00 H new ATOM 0 HG2 ARG A 22 104.715 13.885 -5.209 1.00 0.00 H new ATOM 0 HG3 ARG A 22 106.286 13.484 -4.544 1.00 0.00 H new ATOM 0 HD2 ARG A 22 107.353 14.313 -6.410 1.00 0.00 H new ATOM 0 HD3 ARG A 22 106.389 13.308 -7.474 1.00 0.00 H new ATOM 0 HE ARG A 22 105.166 15.820 -6.253 1.00 0.00 H new ATOM 0 HH11 ARG A 22 104.032 13.733 -8.369 1.00 0.00 H new ATOM 0 HH12 ARG A 22 104.115 14.731 -9.824 1.00 0.00 H new ATOM 0 HH21 ARG A 22 106.199 17.128 -8.361 1.00 0.00 H new ATOM 0 HH22 ARG A 22 105.332 16.637 -9.820 1.00 0.00 H new ATOM 298 N GLY A 23 104.616 8.905 -3.754 1.00 0.00 N ATOM 299 CA GLY A 23 103.571 7.843 -3.640 1.00 0.00 C ATOM 300 C GLY A 23 102.811 7.716 -4.960 1.00 0.00 C ATOM 301 O GLY A 23 101.626 7.449 -4.983 1.00 0.00 O ATOM 0 H GLY A 23 105.528 8.652 -3.374 1.00 0.00 H new ATOM 0 HA2 GLY A 23 104.035 6.890 -3.384 1.00 0.00 H new ATOM 0 HA3 GLY A 23 102.879 8.087 -2.834 1.00 0.00 H new ATOM 305 N ARG A 24 103.484 7.919 -6.057 1.00 0.00 N ATOM 306 CA ARG A 24 102.804 7.828 -7.380 1.00 0.00 C ATOM 307 C ARG A 24 103.429 6.717 -8.230 1.00 0.00 C ATOM 308 O ARG A 24 104.516 6.862 -8.756 1.00 0.00 O ATOM 309 CB ARG A 24 103.037 9.195 -8.021 1.00 0.00 C ATOM 310 CG ARG A 24 101.854 9.552 -8.924 1.00 0.00 C ATOM 311 CD ARG A 24 101.066 10.708 -8.302 1.00 0.00 C ATOM 312 NE ARG A 24 99.982 11.006 -9.279 1.00 0.00 N ATOM 313 CZ ARG A 24 99.051 11.869 -8.976 1.00 0.00 C ATOM 314 NH1 ARG A 24 98.210 11.611 -8.012 1.00 0.00 N ATOM 315 NH2 ARG A 24 98.963 12.990 -9.635 1.00 0.00 N ATOM 0 H ARG A 24 104.478 8.145 -6.096 1.00 0.00 H new ATOM 0 HA ARG A 24 101.745 7.588 -7.290 1.00 0.00 H new ATOM 0 HB2 ARG A 24 103.158 9.954 -7.248 1.00 0.00 H new ATOM 0 HB3 ARG A 24 103.959 9.182 -8.602 1.00 0.00 H new ATOM 0 HG2 ARG A 24 102.211 9.833 -9.915 1.00 0.00 H new ATOM 0 HG3 ARG A 24 101.207 8.685 -9.053 1.00 0.00 H new ATOM 0 HD2 ARG A 24 100.656 10.429 -7.331 1.00 0.00 H new ATOM 0 HD3 ARG A 24 101.703 11.578 -8.141 1.00 0.00 H new ATOM 0 HE ARG A 24 99.967 10.536 -10.184 1.00 0.00 H new ATOM 0 HH11 ARG A 24 98.280 10.735 -7.495 1.00 0.00 H new ATOM 0 HH12 ARG A 24 97.483 12.286 -7.776 1.00 0.00 H new ATOM 0 HH21 ARG A 24 99.622 13.192 -10.387 1.00 0.00 H new ATOM 0 HH22 ARG A 24 98.236 13.665 -9.399 1.00 0.00 H new ATOM 329 N VAL A 25 102.745 5.613 -8.372 1.00 0.00 N ATOM 330 CA VAL A 25 103.292 4.491 -9.191 1.00 0.00 C ATOM 331 C VAL A 25 103.236 4.844 -10.681 1.00 0.00 C ATOM 332 O VAL A 25 104.238 4.826 -11.369 1.00 0.00 O ATOM 333 CB VAL A 25 102.380 3.298 -8.884 1.00 0.00 C ATOM 334 CG1 VAL A 25 102.737 2.120 -9.796 1.00 0.00 C ATOM 335 CG2 VAL A 25 102.566 2.878 -7.425 1.00 0.00 C ATOM 0 H VAL A 25 101.830 5.439 -7.956 1.00 0.00 H new ATOM 0 HA VAL A 25 104.335 4.278 -8.957 1.00 0.00 H new ATOM 0 HB VAL A 25 101.343 3.587 -9.057 1.00 0.00 H new ATOM 0 HG11 VAL A 25 102.085 1.276 -9.572 1.00 0.00 H new ATOM 0 HG12 VAL A 25 102.606 2.413 -10.838 1.00 0.00 H new ATOM 0 HG13 VAL A 25 103.775 1.831 -9.628 1.00 0.00 H new ATOM 0 HG21 VAL A 25 101.918 2.030 -7.205 1.00 0.00 H new ATOM 0 HG22 VAL A 25 103.605 2.594 -7.258 1.00 0.00 H new ATOM 0 HG23 VAL A 25 102.308 3.711 -6.771 1.00 0.00 H new ATOM 345 N GLU A 26 102.067 5.154 -11.182 1.00 0.00 N ATOM 346 CA GLU A 26 101.929 5.500 -12.632 1.00 0.00 C ATOM 347 C GLU A 26 102.980 6.536 -13.050 1.00 0.00 C ATOM 348 O GLU A 26 103.381 6.593 -14.197 1.00 0.00 O ATOM 349 CB GLU A 26 100.525 6.085 -12.768 1.00 0.00 C ATOM 350 CG GLU A 26 99.537 4.970 -13.118 1.00 0.00 C ATOM 351 CD GLU A 26 98.153 5.575 -13.363 1.00 0.00 C ATOM 352 OE1 GLU A 26 97.953 6.139 -14.425 1.00 0.00 O ATOM 353 OE2 GLU A 26 97.315 5.463 -12.482 1.00 0.00 O ATOM 0 H GLU A 26 101.198 5.183 -10.648 1.00 0.00 H new ATOM 0 HA GLU A 26 102.078 4.629 -13.271 1.00 0.00 H new ATOM 0 HB2 GLU A 26 100.229 6.568 -11.837 1.00 0.00 H new ATOM 0 HB3 GLU A 26 100.513 6.852 -13.542 1.00 0.00 H new ATOM 0 HG2 GLU A 26 99.875 4.436 -14.006 1.00 0.00 H new ATOM 0 HG3 GLU A 26 99.490 4.243 -12.307 1.00 0.00 H new ATOM 360 N GLU A 27 103.438 7.344 -12.130 1.00 0.00 N ATOM 361 CA GLU A 27 104.469 8.358 -12.486 1.00 0.00 C ATOM 362 C GLU A 27 105.797 7.644 -12.739 1.00 0.00 C ATOM 363 O GLU A 27 106.477 7.908 -13.709 1.00 0.00 O ATOM 364 CB GLU A 27 104.558 9.286 -11.271 1.00 0.00 C ATOM 365 CG GLU A 27 104.008 10.668 -11.633 1.00 0.00 C ATOM 366 CD GLU A 27 104.999 11.389 -12.549 1.00 0.00 C ATOM 367 OE1 GLU A 27 106.058 11.761 -12.069 1.00 0.00 O ATOM 368 OE2 GLU A 27 104.682 11.558 -13.715 1.00 0.00 O ATOM 0 H GLU A 27 103.144 7.345 -11.153 1.00 0.00 H new ATOM 0 HA GLU A 27 104.225 8.921 -13.387 1.00 0.00 H new ATOM 0 HB2 GLU A 27 103.993 8.866 -10.439 1.00 0.00 H new ATOM 0 HB3 GLU A 27 105.594 9.371 -10.942 1.00 0.00 H new ATOM 0 HG2 GLU A 27 103.043 10.568 -12.131 1.00 0.00 H new ATOM 0 HG3 GLU A 27 103.841 11.253 -10.728 1.00 0.00 H new ATOM 375 N VAL A 28 106.155 6.718 -11.887 1.00 0.00 N ATOM 376 CA VAL A 28 107.423 5.960 -12.093 1.00 0.00 C ATOM 377 C VAL A 28 107.217 4.933 -13.209 1.00 0.00 C ATOM 378 O VAL A 28 107.971 4.878 -14.159 1.00 0.00 O ATOM 379 CB VAL A 28 107.703 5.251 -10.759 1.00 0.00 C ATOM 380 CG1 VAL A 28 109.083 4.589 -10.805 1.00 0.00 C ATOM 381 CG2 VAL A 28 107.672 6.262 -9.611 1.00 0.00 C ATOM 0 H VAL A 28 105.623 6.455 -11.058 1.00 0.00 H new ATOM 0 HA VAL A 28 108.253 6.606 -12.380 1.00 0.00 H new ATOM 0 HB VAL A 28 106.936 4.494 -10.597 1.00 0.00 H new ATOM 0 HG11 VAL A 28 109.278 4.087 -9.857 1.00 0.00 H new ATOM 0 HG12 VAL A 28 109.110 3.859 -11.614 1.00 0.00 H new ATOM 0 HG13 VAL A 28 109.845 5.349 -10.977 1.00 0.00 H new ATOM 0 HG21 VAL A 28 107.872 5.750 -8.670 1.00 0.00 H new ATOM 0 HG22 VAL A 28 108.433 7.025 -9.777 1.00 0.00 H new ATOM 0 HG23 VAL A 28 106.690 6.732 -9.567 1.00 0.00 H new ATOM 391 N ARG A 29 106.189 4.122 -13.098 1.00 0.00 N ATOM 392 CA ARG A 29 105.907 3.091 -14.149 1.00 0.00 C ATOM 393 C ARG A 29 106.072 3.695 -15.548 1.00 0.00 C ATOM 394 O ARG A 29 106.758 3.154 -16.394 1.00 0.00 O ATOM 395 CB ARG A 29 104.449 2.682 -13.916 1.00 0.00 C ATOM 396 CG ARG A 29 104.329 1.158 -13.924 1.00 0.00 C ATOM 397 CD ARG A 29 105.147 0.576 -12.769 1.00 0.00 C ATOM 398 NE ARG A 29 104.736 -0.851 -12.689 1.00 0.00 N ATOM 399 CZ ARG A 29 105.632 -1.795 -12.779 1.00 0.00 C ATOM 400 NH1 ARG A 29 106.619 -1.837 -11.929 1.00 0.00 N ATOM 401 NH2 ARG A 29 105.542 -2.697 -13.717 1.00 0.00 N ATOM 0 H ARG A 29 105.530 4.131 -12.320 1.00 0.00 H new ATOM 0 HA ARG A 29 106.589 2.243 -14.087 1.00 0.00 H new ATOM 0 HB2 ARG A 29 104.099 3.078 -12.963 1.00 0.00 H new ATOM 0 HB3 ARG A 29 103.814 3.110 -14.692 1.00 0.00 H new ATOM 0 HG2 ARG A 29 103.284 0.864 -13.828 1.00 0.00 H new ATOM 0 HG3 ARG A 29 104.686 0.759 -14.874 1.00 0.00 H new ATOM 0 HD2 ARG A 29 106.217 0.669 -12.956 1.00 0.00 H new ATOM 0 HD3 ARG A 29 104.940 1.099 -11.836 1.00 0.00 H new ATOM 0 HE ARG A 29 103.753 -1.092 -12.564 1.00 0.00 H new ATOM 0 HH11 ARG A 29 106.690 -1.133 -11.195 1.00 0.00 H new ATOM 0 HH12 ARG A 29 107.320 -2.574 -11.998 1.00 0.00 H new ATOM 0 HH21 ARG A 29 104.770 -2.665 -14.383 1.00 0.00 H new ATOM 0 HH22 ARG A 29 106.244 -3.434 -13.785 1.00 0.00 H new ATOM 415 N ALA A 30 105.450 4.817 -15.787 1.00 0.00 N ATOM 416 CA ALA A 30 105.568 5.472 -17.122 1.00 0.00 C ATOM 417 C ALA A 30 106.959 6.094 -17.279 1.00 0.00 C ATOM 418 O ALA A 30 107.626 5.898 -18.273 1.00 0.00 O ATOM 419 CB ALA A 30 104.489 6.558 -17.129 1.00 0.00 C ATOM 0 H ALA A 30 104.863 5.310 -15.114 1.00 0.00 H new ATOM 0 HA ALA A 30 105.439 4.767 -17.943 1.00 0.00 H new ATOM 0 HB1 ALA A 30 104.512 7.087 -18.082 1.00 0.00 H new ATOM 0 HB2 ALA A 30 103.510 6.099 -16.992 1.00 0.00 H new ATOM 0 HB3 ALA A 30 104.676 7.262 -16.318 1.00 0.00 H new ATOM 425 N LEU A 31 107.399 6.843 -16.301 1.00 0.00 N ATOM 426 CA LEU A 31 108.746 7.488 -16.389 1.00 0.00 C ATOM 427 C LEU A 31 109.844 6.449 -16.651 1.00 0.00 C ATOM 428 O LEU A 31 110.352 6.333 -17.750 1.00 0.00 O ATOM 429 CB LEU A 31 108.961 8.152 -15.028 1.00 0.00 C ATOM 430 CG LEU A 31 108.369 9.563 -15.045 1.00 0.00 C ATOM 431 CD1 LEU A 31 108.288 10.100 -13.614 1.00 0.00 C ATOM 432 CD2 LEU A 31 109.261 10.484 -15.888 1.00 0.00 C ATOM 0 H LEU A 31 106.883 7.037 -15.443 1.00 0.00 H new ATOM 0 HA LEU A 31 108.793 8.201 -17.212 1.00 0.00 H new ATOM 0 HB2 LEU A 31 108.490 7.559 -14.244 1.00 0.00 H new ATOM 0 HB3 LEU A 31 110.026 8.196 -14.798 1.00 0.00 H new ATOM 0 HG LEU A 31 107.369 9.531 -15.478 1.00 0.00 H new ATOM 0 HD11 LEU A 31 107.866 11.105 -13.626 1.00 0.00 H new ATOM 0 HD12 LEU A 31 107.653 9.447 -13.016 1.00 0.00 H new ATOM 0 HD13 LEU A 31 109.287 10.131 -13.180 1.00 0.00 H new ATOM 0 HD21 LEU A 31 108.839 11.489 -15.900 1.00 0.00 H new ATOM 0 HD22 LEU A 31 110.262 10.516 -15.457 1.00 0.00 H new ATOM 0 HD23 LEU A 31 109.317 10.102 -16.907 1.00 0.00 H new ATOM 444 N LEU A 32 110.228 5.711 -15.640 1.00 0.00 N ATOM 445 CA LEU A 32 111.313 4.688 -15.800 1.00 0.00 C ATOM 446 C LEU A 32 111.114 3.850 -17.069 1.00 0.00 C ATOM 447 O LEU A 32 112.026 3.675 -17.855 1.00 0.00 O ATOM 448 CB LEU A 32 111.199 3.811 -14.554 1.00 0.00 C ATOM 449 CG LEU A 32 112.595 3.500 -14.013 1.00 0.00 C ATOM 450 CD1 LEU A 32 112.494 3.017 -12.566 1.00 0.00 C ATOM 451 CD2 LEU A 32 113.241 2.405 -14.861 1.00 0.00 C ATOM 0 H LEU A 32 109.834 5.772 -14.701 1.00 0.00 H new ATOM 0 HA LEU A 32 112.294 5.152 -15.900 1.00 0.00 H new ATOM 0 HB2 LEU A 32 110.608 4.320 -13.792 1.00 0.00 H new ATOM 0 HB3 LEU A 32 110.678 2.885 -14.796 1.00 0.00 H new ATOM 0 HG LEU A 32 113.202 4.404 -14.054 1.00 0.00 H new ATOM 0 HD11 LEU A 32 113.491 2.797 -12.185 1.00 0.00 H new ATOM 0 HD12 LEU A 32 112.036 3.794 -11.954 1.00 0.00 H new ATOM 0 HD13 LEU A 32 111.883 2.115 -12.525 1.00 0.00 H new ATOM 0 HD21 LEU A 32 114.236 2.185 -14.474 1.00 0.00 H new ATOM 0 HD22 LEU A 32 112.628 1.504 -14.821 1.00 0.00 H new ATOM 0 HD23 LEU A 32 113.320 2.744 -15.894 1.00 0.00 H new ATOM 463 N GLU A 33 109.936 3.329 -17.276 1.00 0.00 N ATOM 464 CA GLU A 33 109.687 2.502 -18.495 1.00 0.00 C ATOM 465 C GLU A 33 109.715 3.372 -19.759 1.00 0.00 C ATOM 466 O GLU A 33 109.687 2.865 -20.864 1.00 0.00 O ATOM 467 CB GLU A 33 108.297 1.898 -18.288 1.00 0.00 C ATOM 468 CG GLU A 33 108.141 0.652 -19.162 1.00 0.00 C ATOM 469 CD GLU A 33 106.717 0.111 -19.019 1.00 0.00 C ATOM 470 OE1 GLU A 33 105.850 0.584 -19.735 1.00 0.00 O ATOM 471 OE2 GLU A 33 106.518 -0.765 -18.195 1.00 0.00 O ATOM 0 H GLU A 33 109.134 3.439 -16.655 1.00 0.00 H new ATOM 0 HA GLU A 33 110.451 1.736 -18.630 1.00 0.00 H new ATOM 0 HB2 GLU A 33 108.155 1.638 -17.239 1.00 0.00 H new ATOM 0 HB3 GLU A 33 107.530 2.630 -18.541 1.00 0.00 H new ATOM 0 HG2 GLU A 33 108.347 0.896 -20.204 1.00 0.00 H new ATOM 0 HG3 GLU A 33 108.863 -0.108 -18.864 1.00 0.00 H new ATOM 478 N ALA A 34 109.758 4.674 -19.616 1.00 0.00 N ATOM 479 CA ALA A 34 109.773 5.555 -20.820 1.00 0.00 C ATOM 480 C ALA A 34 111.185 6.079 -21.108 1.00 0.00 C ATOM 481 O ALA A 34 111.495 6.447 -22.224 1.00 0.00 O ATOM 482 CB ALA A 34 108.842 6.717 -20.475 1.00 0.00 C ATOM 0 H ALA A 34 109.783 5.161 -18.720 1.00 0.00 H new ATOM 0 HA ALA A 34 109.455 5.015 -21.712 1.00 0.00 H new ATOM 0 HB1 ALA A 34 108.800 7.411 -21.314 1.00 0.00 H new ATOM 0 HB2 ALA A 34 107.842 6.334 -20.271 1.00 0.00 H new ATOM 0 HB3 ALA A 34 109.219 7.236 -19.594 1.00 0.00 H new ATOM 488 N GLY A 35 112.045 6.122 -20.121 1.00 0.00 N ATOM 489 CA GLY A 35 113.425 6.627 -20.370 1.00 0.00 C ATOM 490 C GLY A 35 114.110 6.999 -19.051 1.00 0.00 C ATOM 491 O GLY A 35 115.318 6.934 -18.943 1.00 0.00 O ATOM 0 H GLY A 35 111.851 5.831 -19.163 1.00 0.00 H new ATOM 0 HA2 GLY A 35 114.009 5.865 -20.887 1.00 0.00 H new ATOM 0 HA3 GLY A 35 113.387 7.498 -21.024 1.00 0.00 H new ATOM 495 N ALA A 36 113.356 7.391 -18.050 1.00 0.00 N ATOM 496 CA ALA A 36 113.979 7.772 -16.738 1.00 0.00 C ATOM 497 C ALA A 36 115.095 6.790 -16.370 1.00 0.00 C ATOM 498 O ALA A 36 114.988 5.601 -16.597 1.00 0.00 O ATOM 499 CB ALA A 36 112.845 7.701 -15.717 1.00 0.00 C ATOM 0 H ALA A 36 112.339 7.464 -18.083 1.00 0.00 H new ATOM 0 HA ALA A 36 114.430 8.764 -16.775 1.00 0.00 H new ATOM 0 HB1 ALA A 36 113.226 7.967 -14.731 1.00 0.00 H new ATOM 0 HB2 ALA A 36 112.055 8.397 -16.001 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.443 6.688 -15.689 1.00 0.00 H new ATOM 505 N LEU A 37 116.170 7.282 -15.817 1.00 0.00 N ATOM 506 CA LEU A 37 117.301 6.379 -15.447 1.00 0.00 C ATOM 507 C LEU A 37 116.813 5.263 -14.516 1.00 0.00 C ATOM 508 O LEU A 37 115.828 5.420 -13.822 1.00 0.00 O ATOM 509 CB LEU A 37 118.316 7.278 -14.733 1.00 0.00 C ATOM 510 CG LEU A 37 119.576 7.421 -15.596 1.00 0.00 C ATOM 511 CD1 LEU A 37 119.596 8.803 -16.254 1.00 0.00 C ATOM 512 CD2 LEU A 37 120.817 7.261 -14.715 1.00 0.00 C ATOM 0 H LEU A 37 116.316 8.269 -15.605 1.00 0.00 H new ATOM 0 HA LEU A 37 117.737 5.890 -16.318 1.00 0.00 H new ATOM 0 HB2 LEU A 37 117.879 8.259 -14.545 1.00 0.00 H new ATOM 0 HB3 LEU A 37 118.574 6.853 -13.763 1.00 0.00 H new ATOM 0 HG LEU A 37 119.573 6.652 -16.369 1.00 0.00 H new ATOM 0 HD11 LEU A 37 120.492 8.901 -16.866 1.00 0.00 H new ATOM 0 HD12 LEU A 37 118.713 8.920 -16.882 1.00 0.00 H new ATOM 0 HD13 LEU A 37 119.597 9.573 -15.483 1.00 0.00 H new ATOM 0 HD21 LEU A 37 121.713 7.362 -15.327 1.00 0.00 H new ATOM 0 HD22 LEU A 37 120.816 8.030 -13.942 1.00 0.00 H new ATOM 0 HD23 LEU A 37 120.807 6.277 -14.247 1.00 0.00 H new ATOM 524 N PRO A 38 117.525 4.164 -14.533 1.00 0.00 N ATOM 525 CA PRO A 38 117.160 3.008 -13.678 1.00 0.00 C ATOM 526 C PRO A 38 117.500 3.314 -12.218 1.00 0.00 C ATOM 527 O PRO A 38 116.768 2.967 -11.311 1.00 0.00 O ATOM 528 CB PRO A 38 118.033 1.877 -14.215 1.00 0.00 C ATOM 529 CG PRO A 38 119.206 2.560 -14.842 1.00 0.00 C ATOM 530 CD PRO A 38 118.723 3.898 -15.338 1.00 0.00 C ATOM 0 HA PRO A 38 116.098 2.765 -13.705 1.00 0.00 H new ATOM 0 HB2 PRO A 38 118.347 1.207 -13.415 1.00 0.00 H new ATOM 0 HB3 PRO A 38 117.492 1.272 -14.943 1.00 0.00 H new ATOM 0 HG2 PRO A 38 120.012 2.685 -14.118 1.00 0.00 H new ATOM 0 HG3 PRO A 38 119.605 1.965 -15.664 1.00 0.00 H new ATOM 0 HD2 PRO A 38 119.478 4.672 -15.198 1.00 0.00 H new ATOM 0 HD3 PRO A 38 118.490 3.869 -16.402 1.00 0.00 H new ATOM 538 N ASN A 39 118.608 3.966 -11.991 1.00 0.00 N ATOM 539 CA ASN A 39 119.013 4.309 -10.598 1.00 0.00 C ATOM 540 C ASN A 39 119.194 5.825 -10.468 1.00 0.00 C ATOM 541 O ASN A 39 118.466 6.488 -9.756 1.00 0.00 O ATOM 542 CB ASN A 39 120.349 3.596 -10.385 1.00 0.00 C ATOM 543 CG ASN A 39 120.184 2.097 -10.631 1.00 0.00 C ATOM 544 OD1 ASN A 39 119.996 1.672 -11.753 1.00 0.00 O ATOM 545 ND2 ASN A 39 120.247 1.275 -9.624 1.00 0.00 N ATOM 0 H ASN A 39 119.254 4.278 -12.716 1.00 0.00 H new ATOM 0 HA ASN A 39 118.268 4.006 -9.863 1.00 0.00 H new ATOM 0 HB2 ASN A 39 121.100 4.004 -11.061 1.00 0.00 H new ATOM 0 HB3 ASN A 39 120.706 3.770 -9.370 1.00 0.00 H new ATOM 0 HD21 ASN A 39 120.138 0.272 -9.777 1.00 0.00 H new ATOM 0 HD22 ASN A 39 120.405 1.633 -8.682 1.00 0.00 H new ATOM 552 N ALA A 40 120.166 6.372 -11.154 1.00 0.00 N ATOM 553 CA ALA A 40 120.415 7.847 -11.084 1.00 0.00 C ATOM 554 C ALA A 40 120.744 8.263 -9.644 1.00 0.00 C ATOM 555 O ALA A 40 120.343 7.606 -8.705 1.00 0.00 O ATOM 556 CB ALA A 40 119.113 8.502 -11.553 1.00 0.00 C ATOM 0 H ALA A 40 120.802 5.858 -11.764 1.00 0.00 H new ATOM 0 HA ALA A 40 121.261 8.149 -11.701 1.00 0.00 H new ATOM 0 HB1 ALA A 40 119.222 9.586 -11.528 1.00 0.00 H new ATOM 0 HB2 ALA A 40 118.892 8.183 -12.571 1.00 0.00 H new ATOM 0 HB3 ALA A 40 118.298 8.204 -10.894 1.00 0.00 H new ATOM 562 N PRO A 41 121.470 9.347 -9.516 1.00 0.00 N ATOM 563 CA PRO A 41 121.849 9.845 -8.172 1.00 0.00 C ATOM 564 C PRO A 41 120.635 10.467 -7.478 1.00 0.00 C ATOM 565 O PRO A 41 119.562 10.549 -8.042 1.00 0.00 O ATOM 566 CB PRO A 41 122.910 10.902 -8.464 1.00 0.00 C ATOM 567 CG PRO A 41 122.626 11.361 -9.858 1.00 0.00 C ATOM 568 CD PRO A 41 121.998 10.201 -10.589 1.00 0.00 C ATOM 0 HA PRO A 41 122.213 9.060 -7.509 1.00 0.00 H new ATOM 0 HB2 PRO A 41 122.849 11.729 -7.756 1.00 0.00 H new ATOM 0 HB3 PRO A 41 123.914 10.486 -8.382 1.00 0.00 H new ATOM 0 HG2 PRO A 41 121.955 12.220 -9.851 1.00 0.00 H new ATOM 0 HG3 PRO A 41 123.544 11.677 -10.354 1.00 0.00 H new ATOM 0 HD2 PRO A 41 121.206 10.534 -11.260 1.00 0.00 H new ATOM 0 HD3 PRO A 41 122.730 9.670 -11.198 1.00 0.00 H new ATOM 576 N ASN A 42 120.798 10.903 -6.260 1.00 0.00 N ATOM 577 CA ASN A 42 119.652 11.517 -5.529 1.00 0.00 C ATOM 578 C ASN A 42 120.127 12.733 -4.729 1.00 0.00 C ATOM 579 O ASN A 42 121.282 12.837 -4.368 1.00 0.00 O ATOM 580 CB ASN A 42 119.147 10.417 -4.590 1.00 0.00 C ATOM 581 CG ASN A 42 117.738 9.988 -5.005 1.00 0.00 C ATOM 582 OD1 ASN A 42 116.764 10.595 -4.604 1.00 0.00 O ATOM 583 ND2 ASN A 42 117.586 8.960 -5.793 1.00 0.00 N ATOM 0 H ASN A 42 121.674 10.861 -5.739 1.00 0.00 H new ATOM 0 HA ASN A 42 118.870 11.867 -6.203 1.00 0.00 H new ATOM 0 HB2 ASN A 42 119.822 9.561 -4.621 1.00 0.00 H new ATOM 0 HB3 ASN A 42 119.139 10.779 -3.562 1.00 0.00 H new ATOM 0 HD21 ASN A 42 116.650 8.666 -6.073 1.00 0.00 H new ATOM 0 HD22 ASN A 42 118.403 8.450 -6.130 1.00 0.00 H new ATOM 590 N SER A 43 119.239 13.647 -4.443 1.00 0.00 N ATOM 591 CA SER A 43 119.633 14.851 -3.658 1.00 0.00 C ATOM 592 C SER A 43 119.626 14.528 -2.161 1.00 0.00 C ATOM 593 O SER A 43 120.037 15.329 -1.342 1.00 0.00 O ATOM 594 CB SER A 43 118.571 15.902 -3.982 1.00 0.00 C ATOM 595 OG SER A 43 118.798 16.413 -5.289 1.00 0.00 O ATOM 0 H SER A 43 118.258 13.611 -4.719 1.00 0.00 H new ATOM 0 HA SER A 43 120.637 15.196 -3.907 1.00 0.00 H new ATOM 0 HB2 SER A 43 117.576 15.461 -3.919 1.00 0.00 H new ATOM 0 HB3 SER A 43 118.608 16.710 -3.252 1.00 0.00 H new ATOM 0 HG SER A 43 118.117 17.086 -5.500 1.00 0.00 H new ATOM 601 N TYR A 44 119.159 13.362 -1.795 1.00 0.00 N ATOM 602 CA TYR A 44 119.121 12.990 -0.351 1.00 0.00 C ATOM 603 C TYR A 44 120.090 11.835 -0.075 1.00 0.00 C ATOM 604 O TYR A 44 120.014 11.185 0.949 1.00 0.00 O ATOM 605 CB TYR A 44 117.676 12.547 -0.084 1.00 0.00 C ATOM 606 CG TYR A 44 116.705 13.490 -0.762 1.00 0.00 C ATOM 607 CD1 TYR A 44 116.869 14.876 -0.638 1.00 0.00 C ATOM 608 CD2 TYR A 44 115.640 12.976 -1.514 1.00 0.00 C ATOM 609 CE1 TYR A 44 115.970 15.746 -1.267 1.00 0.00 C ATOM 610 CE2 TYR A 44 114.741 13.847 -2.143 1.00 0.00 C ATOM 611 CZ TYR A 44 114.906 15.234 -2.017 1.00 0.00 C ATOM 612 OH TYR A 44 114.023 16.097 -2.637 1.00 0.00 O ATOM 0 H TYR A 44 118.803 12.652 -2.435 1.00 0.00 H new ATOM 0 HA TYR A 44 119.418 13.819 0.291 1.00 0.00 H new ATOM 0 HB2 TYR A 44 117.525 11.532 -0.452 1.00 0.00 H new ATOM 0 HB3 TYR A 44 117.486 12.528 0.989 1.00 0.00 H new ATOM 0 HD1 TYR A 44 117.689 15.273 -0.057 1.00 0.00 H new ATOM 0 HD2 TYR A 44 115.512 11.908 -1.609 1.00 0.00 H new ATOM 0 HE1 TYR A 44 116.098 16.814 -1.173 1.00 0.00 H new ATOM 0 HE2 TYR A 44 113.922 13.451 -2.724 1.00 0.00 H new ATOM 0 HH TYR A 44 113.343 15.580 -3.118 1.00 0.00 H new ATOM 622 N GLY A 45 121.001 11.573 -0.979 1.00 0.00 N ATOM 623 CA GLY A 45 121.971 10.462 -0.767 1.00 0.00 C ATOM 624 C GLY A 45 121.214 9.159 -0.508 1.00 0.00 C ATOM 625 O GLY A 45 121.735 8.234 0.085 1.00 0.00 O ATOM 0 H GLY A 45 121.113 12.083 -1.855 1.00 0.00 H new ATOM 0 HA2 GLY A 45 122.612 10.354 -1.642 1.00 0.00 H new ATOM 0 HA3 GLY A 45 122.621 10.690 0.078 1.00 0.00 H new ATOM 629 N ARG A 46 119.988 9.077 -0.950 1.00 0.00 N ATOM 630 CA ARG A 46 119.197 7.834 -0.731 1.00 0.00 C ATOM 631 C ARG A 46 118.987 7.102 -2.058 1.00 0.00 C ATOM 632 O ARG A 46 119.358 7.586 -3.109 1.00 0.00 O ATOM 633 CB ARG A 46 117.861 8.306 -0.150 1.00 0.00 C ATOM 634 CG ARG A 46 117.958 8.309 1.378 1.00 0.00 C ATOM 635 CD ARG A 46 116.604 8.682 1.988 1.00 0.00 C ATOM 636 NE ARG A 46 116.914 9.037 3.402 1.00 0.00 N ATOM 637 CZ ARG A 46 115.962 9.064 4.292 1.00 0.00 C ATOM 638 NH1 ARG A 46 114.849 9.694 4.035 1.00 0.00 N ATOM 639 NH2 ARG A 46 116.124 8.462 5.440 1.00 0.00 N ATOM 0 H ARG A 46 119.501 9.818 -1.454 1.00 0.00 H new ATOM 0 HA ARG A 46 119.701 7.135 -0.063 1.00 0.00 H new ATOM 0 HB2 ARG A 46 117.623 9.305 -0.515 1.00 0.00 H new ATOM 0 HB3 ARG A 46 117.055 7.648 -0.475 1.00 0.00 H new ATOM 0 HG2 ARG A 46 118.268 7.326 1.733 1.00 0.00 H new ATOM 0 HG3 ARG A 46 118.720 9.019 1.701 1.00 0.00 H new ATOM 0 HD2 ARG A 46 116.148 9.520 1.460 1.00 0.00 H new ATOM 0 HD3 ARG A 46 115.902 7.850 1.933 1.00 0.00 H new ATOM 0 HE ARG A 46 117.872 9.259 3.673 1.00 0.00 H new ATOM 0 HH11 ARG A 46 114.725 10.165 3.139 1.00 0.00 H new ATOM 0 HH12 ARG A 46 114.103 9.716 4.730 1.00 0.00 H new ATOM 0 HH21 ARG A 46 116.995 7.971 5.640 1.00 0.00 H new ATOM 0 HH22 ARG A 46 115.379 8.483 6.137 1.00 0.00 H new ATOM 653 N ARG A 47 118.405 5.937 -2.014 1.00 0.00 N ATOM 654 CA ARG A 47 118.180 5.166 -3.271 1.00 0.00 C ATOM 655 C ARG A 47 116.859 5.589 -3.924 1.00 0.00 C ATOM 656 O ARG A 47 116.039 6.233 -3.299 1.00 0.00 O ATOM 657 CB ARG A 47 118.117 3.696 -2.834 1.00 0.00 C ATOM 658 CG ARG A 47 119.325 3.348 -1.952 1.00 0.00 C ATOM 659 CD ARG A 47 120.624 3.770 -2.651 1.00 0.00 C ATOM 660 NE ARG A 47 121.048 5.018 -1.951 1.00 0.00 N ATOM 661 CZ ARG A 47 121.949 5.798 -2.484 1.00 0.00 C ATOM 662 NH1 ARG A 47 121.992 5.970 -3.777 1.00 0.00 N ATOM 663 NH2 ARG A 47 122.807 6.415 -1.718 1.00 0.00 N ATOM 0 H ARG A 47 118.075 5.484 -1.162 1.00 0.00 H new ATOM 0 HA ARG A 47 118.967 5.339 -4.005 1.00 0.00 H new ATOM 0 HB2 ARG A 47 117.193 3.512 -2.286 1.00 0.00 H new ATOM 0 HB3 ARG A 47 118.101 3.049 -3.711 1.00 0.00 H new ATOM 0 HG2 ARG A 47 119.240 3.852 -0.989 1.00 0.00 H new ATOM 0 HG3 ARG A 47 119.342 2.277 -1.751 1.00 0.00 H new ATOM 0 HD2 ARG A 47 121.386 2.994 -2.572 1.00 0.00 H new ATOM 0 HD3 ARG A 47 120.461 3.949 -3.714 1.00 0.00 H new ATOM 0 HE ARG A 47 120.632 5.263 -1.052 1.00 0.00 H new ATOM 0 HH11 ARG A 47 121.319 5.494 -4.378 1.00 0.00 H new ATOM 0 HH12 ARG A 47 122.699 6.581 -4.187 1.00 0.00 H new ATOM 0 HH21 ARG A 47 122.772 6.287 -0.707 1.00 0.00 H new ATOM 0 HH22 ARG A 47 123.512 7.025 -2.131 1.00 0.00 H new ATOM 677 N PRO A 48 116.693 5.209 -5.166 1.00 0.00 N ATOM 678 CA PRO A 48 115.453 5.552 -5.902 1.00 0.00 C ATOM 679 C PRO A 48 114.258 4.786 -5.321 1.00 0.00 C ATOM 680 O PRO A 48 113.116 5.094 -5.601 1.00 0.00 O ATOM 681 CB PRO A 48 115.756 5.123 -7.336 1.00 0.00 C ATOM 682 CG PRO A 48 116.814 4.075 -7.208 1.00 0.00 C ATOM 683 CD PRO A 48 117.626 4.431 -5.993 1.00 0.00 C ATOM 0 HA PRO A 48 115.186 6.607 -5.836 1.00 0.00 H new ATOM 0 HB2 PRO A 48 114.866 4.728 -7.827 1.00 0.00 H new ATOM 0 HB3 PRO A 48 116.104 5.965 -7.935 1.00 0.00 H new ATOM 0 HG2 PRO A 48 116.369 3.086 -7.100 1.00 0.00 H new ATOM 0 HG3 PRO A 48 117.441 4.047 -8.099 1.00 0.00 H new ATOM 0 HD2 PRO A 48 117.977 3.541 -5.471 1.00 0.00 H new ATOM 0 HD3 PRO A 48 118.508 5.014 -6.258 1.00 0.00 H new ATOM 691 N ILE A 49 114.513 3.804 -4.494 1.00 0.00 N ATOM 692 CA ILE A 49 113.397 3.039 -3.871 1.00 0.00 C ATOM 693 C ILE A 49 113.330 3.392 -2.380 1.00 0.00 C ATOM 694 O ILE A 49 112.269 3.515 -1.805 1.00 0.00 O ATOM 695 CB ILE A 49 113.736 1.558 -4.102 1.00 0.00 C ATOM 696 CG1 ILE A 49 113.260 1.153 -5.506 1.00 0.00 C ATOM 697 CG2 ILE A 49 113.032 0.686 -3.053 1.00 0.00 C ATOM 698 CD1 ILE A 49 113.494 -0.344 -5.732 1.00 0.00 C ATOM 0 H ILE A 49 115.449 3.500 -4.224 1.00 0.00 H new ATOM 0 HA ILE A 49 112.421 3.271 -4.297 1.00 0.00 H new ATOM 0 HB ILE A 49 114.813 1.414 -4.015 1.00 0.00 H new ATOM 0 HG12 ILE A 49 112.201 1.384 -5.620 1.00 0.00 H new ATOM 0 HG13 ILE A 49 113.795 1.730 -6.260 1.00 0.00 H new ATOM 0 HG21 ILE A 49 113.279 -0.362 -3.226 1.00 0.00 H new ATOM 0 HG22 ILE A 49 113.363 0.977 -2.056 1.00 0.00 H new ATOM 0 HG23 ILE A 49 111.953 0.822 -3.131 1.00 0.00 H new ATOM 0 HD11 ILE A 49 113.153 -0.619 -6.730 1.00 0.00 H new ATOM 0 HD12 ILE A 49 114.557 -0.564 -5.639 1.00 0.00 H new ATOM 0 HD13 ILE A 49 112.938 -0.915 -4.988 1.00 0.00 H new ATOM 710 N GLN A 50 114.459 3.589 -1.753 1.00 0.00 N ATOM 711 CA GLN A 50 114.449 3.969 -0.307 1.00 0.00 C ATOM 712 C GLN A 50 113.632 5.256 -0.135 1.00 0.00 C ATOM 713 O GLN A 50 113.141 5.558 0.935 1.00 0.00 O ATOM 714 CB GLN A 50 115.928 4.193 0.057 1.00 0.00 C ATOM 715 CG GLN A 50 116.046 5.120 1.276 1.00 0.00 C ATOM 716 CD GLN A 50 117.181 4.638 2.185 1.00 0.00 C ATOM 717 OE1 GLN A 50 116.939 4.134 3.264 1.00 0.00 O ATOM 718 NE2 GLN A 50 118.419 4.781 1.797 1.00 0.00 N ATOM 0 H GLN A 50 115.384 3.504 -2.175 1.00 0.00 H new ATOM 0 HA GLN A 50 113.998 3.212 0.334 1.00 0.00 H new ATOM 0 HB2 GLN A 50 116.405 3.237 0.272 1.00 0.00 H new ATOM 0 HB3 GLN A 50 116.456 4.629 -0.791 1.00 0.00 H new ATOM 0 HG2 GLN A 50 116.238 6.142 0.950 1.00 0.00 H new ATOM 0 HG3 GLN A 50 115.106 5.132 1.828 1.00 0.00 H new ATOM 0 HE21 GLN A 50 118.624 5.204 0.892 1.00 0.00 H new ATOM 0 HE22 GLN A 50 119.181 4.470 2.399 1.00 0.00 H new ATOM 727 N VAL A 51 113.481 6.012 -1.193 1.00 0.00 N ATOM 728 CA VAL A 51 112.697 7.277 -1.106 1.00 0.00 C ATOM 729 C VAL A 51 111.433 7.185 -1.972 1.00 0.00 C ATOM 730 O VAL A 51 110.968 8.175 -2.496 1.00 0.00 O ATOM 731 CB VAL A 51 113.638 8.370 -1.632 1.00 0.00 C ATOM 732 CG1 VAL A 51 113.960 8.122 -3.111 1.00 0.00 C ATOM 733 CG2 VAL A 51 112.971 9.744 -1.480 1.00 0.00 C ATOM 0 H VAL A 51 113.868 5.806 -2.114 1.00 0.00 H new ATOM 0 HA VAL A 51 112.365 7.484 -0.089 1.00 0.00 H new ATOM 0 HB VAL A 51 114.563 8.346 -1.055 1.00 0.00 H new ATOM 0 HG11 VAL A 51 114.628 8.903 -3.474 1.00 0.00 H new ATOM 0 HG12 VAL A 51 114.444 7.151 -3.220 1.00 0.00 H new ATOM 0 HG13 VAL A 51 113.037 8.135 -3.691 1.00 0.00 H new ATOM 0 HG21 VAL A 51 113.642 10.517 -1.854 1.00 0.00 H new ATOM 0 HG22 VAL A 51 112.042 9.762 -2.050 1.00 0.00 H new ATOM 0 HG23 VAL A 51 112.755 9.929 -0.428 1.00 0.00 H new ATOM 743 N MET A 52 110.865 6.012 -2.118 1.00 0.00 N ATOM 744 CA MET A 52 109.622 5.889 -2.942 1.00 0.00 C ATOM 745 C MET A 52 108.392 5.917 -2.032 1.00 0.00 C ATOM 746 O MET A 52 107.397 5.273 -2.296 1.00 0.00 O ATOM 747 CB MET A 52 109.730 4.548 -3.682 1.00 0.00 C ATOM 748 CG MET A 52 109.793 3.388 -2.682 1.00 0.00 C ATOM 749 SD MET A 52 108.289 2.383 -2.785 1.00 0.00 S ATOM 750 CE MET A 52 109.014 0.821 -2.213 1.00 0.00 C ATOM 0 H MET A 52 111.204 5.143 -1.707 1.00 0.00 H new ATOM 0 HA MET A 52 109.518 6.712 -3.649 1.00 0.00 H new ATOM 0 HB2 MET A 52 108.873 4.420 -4.343 1.00 0.00 H new ATOM 0 HB3 MET A 52 110.621 4.543 -4.311 1.00 0.00 H new ATOM 0 HG2 MET A 52 110.666 2.769 -2.888 1.00 0.00 H new ATOM 0 HG3 MET A 52 109.909 3.777 -1.671 1.00 0.00 H new ATOM 0 HE1 MET A 52 108.650 0.002 -2.833 1.00 0.00 H new ATOM 0 HE2 MET A 52 110.100 0.876 -2.285 1.00 0.00 H new ATOM 0 HE3 MET A 52 108.728 0.645 -1.176 1.00 0.00 H new ATOM 760 N MET A 53 108.466 6.665 -0.956 1.00 0.00 N ATOM 761 CA MET A 53 107.318 6.767 0.007 1.00 0.00 C ATOM 762 C MET A 53 107.159 5.478 0.820 1.00 0.00 C ATOM 763 O MET A 53 106.463 5.455 1.816 1.00 0.00 O ATOM 764 CB MET A 53 106.068 7.008 -0.845 1.00 0.00 C ATOM 765 CG MET A 53 105.163 8.032 -0.152 1.00 0.00 C ATOM 766 SD MET A 53 103.849 7.174 0.748 1.00 0.00 S ATOM 767 CE MET A 53 103.057 6.402 -0.685 1.00 0.00 C ATOM 0 H MET A 53 109.284 7.217 -0.699 1.00 0.00 H new ATOM 0 HA MET A 53 107.485 7.573 0.722 1.00 0.00 H new ATOM 0 HB2 MET A 53 106.353 7.370 -1.833 1.00 0.00 H new ATOM 0 HB3 MET A 53 105.529 6.072 -0.991 1.00 0.00 H new ATOM 0 HG2 MET A 53 105.748 8.643 0.535 1.00 0.00 H new ATOM 0 HG3 MET A 53 104.730 8.708 -0.890 1.00 0.00 H new ATOM 0 HE1 MET A 53 102.631 5.442 -0.392 1.00 0.00 H new ATOM 0 HE2 MET A 53 102.265 7.052 -1.057 1.00 0.00 H new ATOM 0 HE3 MET A 53 103.797 6.246 -1.470 1.00 0.00 H new ATOM 777 N MET A 54 107.788 4.401 0.410 1.00 0.00 N ATOM 778 CA MET A 54 107.655 3.120 1.167 1.00 0.00 C ATOM 779 C MET A 54 106.176 2.808 1.417 1.00 0.00 C ATOM 780 O MET A 54 105.822 2.114 2.350 1.00 0.00 O ATOM 781 CB MET A 54 108.400 3.368 2.481 1.00 0.00 C ATOM 782 CG MET A 54 109.843 2.863 2.359 1.00 0.00 C ATOM 783 SD MET A 54 110.624 3.558 0.875 1.00 0.00 S ATOM 784 CE MET A 54 110.962 1.982 0.048 1.00 0.00 C ATOM 0 H MET A 54 108.386 4.356 -0.415 1.00 0.00 H new ATOM 0 HA MET A 54 108.063 2.265 0.628 1.00 0.00 H new ATOM 0 HB2 MET A 54 108.395 4.432 2.718 1.00 0.00 H new ATOM 0 HB3 MET A 54 107.893 2.857 3.300 1.00 0.00 H new ATOM 0 HG2 MET A 54 110.412 3.146 3.245 1.00 0.00 H new ATOM 0 HG3 MET A 54 109.852 1.774 2.308 1.00 0.00 H new ATOM 0 HE1 MET A 54 110.919 2.121 -1.032 1.00 0.00 H new ATOM 0 HE2 MET A 54 111.954 1.629 0.329 1.00 0.00 H new ATOM 0 HE3 MET A 54 110.216 1.246 0.349 1.00 0.00 H new ATOM 794 N GLY A 55 105.313 3.321 0.578 1.00 0.00 N ATOM 795 CA GLY A 55 103.854 3.066 0.747 1.00 0.00 C ATOM 796 C GLY A 55 103.275 2.506 -0.555 1.00 0.00 C ATOM 797 O GLY A 55 102.075 2.476 -0.748 1.00 0.00 O ATOM 0 H GLY A 55 105.559 3.908 -0.219 1.00 0.00 H new ATOM 0 HA2 GLY A 55 103.690 2.361 1.562 1.00 0.00 H new ATOM 0 HA3 GLY A 55 103.342 3.990 1.016 1.00 0.00 H new ATOM 801 N SER A 56 104.117 2.049 -1.445 1.00 0.00 N ATOM 802 CA SER A 56 103.617 1.476 -2.728 1.00 0.00 C ATOM 803 C SER A 56 104.657 0.512 -3.308 1.00 0.00 C ATOM 804 O SER A 56 105.558 0.910 -4.021 1.00 0.00 O ATOM 805 CB SER A 56 103.410 2.677 -3.654 1.00 0.00 C ATOM 806 OG SER A 56 102.029 2.789 -3.973 1.00 0.00 O ATOM 0 H SER A 56 105.131 2.048 -1.337 1.00 0.00 H new ATOM 0 HA SER A 56 102.695 0.910 -2.599 1.00 0.00 H new ATOM 0 HB2 SER A 56 103.759 3.589 -3.170 1.00 0.00 H new ATOM 0 HB3 SER A 56 103.997 2.555 -4.564 1.00 0.00 H new ATOM 0 HG SER A 56 101.891 3.558 -4.565 1.00 0.00 H new ATOM 812 N ALA A 57 104.536 -0.755 -3.008 1.00 0.00 N ATOM 813 CA ALA A 57 105.512 -1.755 -3.541 1.00 0.00 C ATOM 814 C ALA A 57 105.551 -1.684 -5.070 1.00 0.00 C ATOM 815 O ALA A 57 106.518 -2.075 -5.697 1.00 0.00 O ATOM 816 CB ALA A 57 104.979 -3.115 -3.081 1.00 0.00 C ATOM 0 H ALA A 57 103.802 -1.142 -2.415 1.00 0.00 H new ATOM 0 HA ALA A 57 106.527 -1.575 -3.185 1.00 0.00 H new ATOM 0 HB1 ALA A 57 105.643 -3.904 -3.434 1.00 0.00 H new ATOM 0 HB2 ALA A 57 104.934 -3.139 -1.992 1.00 0.00 H new ATOM 0 HB3 ALA A 57 103.980 -3.271 -3.489 1.00 0.00 H new ATOM 822 N ARG A 58 104.505 -1.183 -5.672 1.00 0.00 N ATOM 823 CA ARG A 58 104.467 -1.075 -7.160 1.00 0.00 C ATOM 824 C ARG A 58 105.640 -0.223 -7.658 1.00 0.00 C ATOM 825 O ARG A 58 106.254 -0.523 -8.668 1.00 0.00 O ATOM 826 CB ARG A 58 103.137 -0.380 -7.467 1.00 0.00 C ATOM 827 CG ARG A 58 102.034 -1.427 -7.651 1.00 0.00 C ATOM 828 CD ARG A 58 101.551 -1.423 -9.119 1.00 0.00 C ATOM 829 NE ARG A 58 101.426 -2.862 -9.487 1.00 0.00 N ATOM 830 CZ ARG A 58 100.399 -3.555 -9.073 1.00 0.00 C ATOM 831 NH1 ARG A 58 99.207 -3.300 -9.541 1.00 0.00 N ATOM 832 NH2 ARG A 58 100.567 -4.504 -8.193 1.00 0.00 N ATOM 0 H ARG A 58 103.671 -0.842 -5.194 1.00 0.00 H new ATOM 0 HA ARG A 58 104.547 -2.046 -7.649 1.00 0.00 H new ATOM 0 HB2 ARG A 58 102.875 0.299 -6.655 1.00 0.00 H new ATOM 0 HB3 ARG A 58 103.232 0.224 -8.369 1.00 0.00 H new ATOM 0 HG2 ARG A 58 102.409 -2.415 -7.384 1.00 0.00 H new ATOM 0 HG3 ARG A 58 101.200 -1.212 -6.983 1.00 0.00 H new ATOM 0 HD2 ARG A 58 100.597 -0.906 -9.219 1.00 0.00 H new ATOM 0 HD3 ARG A 58 102.262 -0.910 -9.767 1.00 0.00 H new ATOM 0 HE ARG A 58 102.142 -3.306 -10.062 1.00 0.00 H new ATOM 0 HH11 ARG A 58 99.077 -2.559 -10.230 1.00 0.00 H new ATOM 0 HH12 ARG A 58 98.405 -3.841 -9.217 1.00 0.00 H new ATOM 0 HH21 ARG A 58 101.499 -4.703 -7.830 1.00 0.00 H new ATOM 0 HH22 ARG A 58 99.766 -5.046 -7.869 1.00 0.00 H new ATOM 846 N VAL A 59 105.962 0.835 -6.957 1.00 0.00 N ATOM 847 CA VAL A 59 107.100 1.701 -7.397 1.00 0.00 C ATOM 848 C VAL A 59 108.355 0.850 -7.580 1.00 0.00 C ATOM 849 O VAL A 59 108.860 0.697 -8.675 1.00 0.00 O ATOM 850 CB VAL A 59 107.324 2.726 -6.280 1.00 0.00 C ATOM 851 CG1 VAL A 59 108.260 3.823 -6.791 1.00 0.00 C ATOM 852 CG2 VAL A 59 105.993 3.356 -5.851 1.00 0.00 C ATOM 0 H VAL A 59 105.490 1.136 -6.104 1.00 0.00 H new ATOM 0 HA VAL A 59 106.882 2.192 -8.346 1.00 0.00 H new ATOM 0 HB VAL A 59 107.766 2.222 -5.420 1.00 0.00 H new ATOM 0 HG11 VAL A 59 108.425 4.557 -6.002 1.00 0.00 H new ATOM 0 HG12 VAL A 59 109.213 3.382 -7.081 1.00 0.00 H new ATOM 0 HG13 VAL A 59 107.809 4.313 -7.654 1.00 0.00 H new ATOM 0 HG21 VAL A 59 106.173 4.081 -5.057 1.00 0.00 H new ATOM 0 HG22 VAL A 59 105.536 3.858 -6.704 1.00 0.00 H new ATOM 0 HG23 VAL A 59 105.323 2.578 -5.486 1.00 0.00 H new ATOM 862 N ALA A 60 108.858 0.287 -6.511 1.00 0.00 N ATOM 863 CA ALA A 60 110.075 -0.564 -6.618 1.00 0.00 C ATOM 864 C ALA A 60 109.868 -1.636 -7.688 1.00 0.00 C ATOM 865 O ALA A 60 110.787 -2.018 -8.378 1.00 0.00 O ATOM 866 CB ALA A 60 110.236 -1.207 -5.241 1.00 0.00 C ATOM 0 H ALA A 60 108.476 0.382 -5.570 1.00 0.00 H new ATOM 0 HA ALA A 60 110.957 0.009 -6.902 1.00 0.00 H new ATOM 0 HB1 ALA A 60 111.115 -1.851 -5.241 1.00 0.00 H new ATOM 0 HB2 ALA A 60 110.357 -0.428 -4.488 1.00 0.00 H new ATOM 0 HB3 ALA A 60 109.351 -1.801 -5.011 1.00 0.00 H new ATOM 872 N GLU A 61 108.660 -2.116 -7.838 1.00 0.00 N ATOM 873 CA GLU A 61 108.385 -3.162 -8.869 1.00 0.00 C ATOM 874 C GLU A 61 109.016 -2.763 -10.206 1.00 0.00 C ATOM 875 O GLU A 61 109.614 -3.571 -10.888 1.00 0.00 O ATOM 876 CB GLU A 61 106.863 -3.210 -8.986 1.00 0.00 C ATOM 877 CG GLU A 61 106.427 -4.600 -9.446 1.00 0.00 C ATOM 878 CD GLU A 61 104.908 -4.624 -9.617 1.00 0.00 C ATOM 879 OE1 GLU A 61 104.223 -4.161 -8.719 1.00 0.00 O ATOM 880 OE2 GLU A 61 104.454 -5.105 -10.642 1.00 0.00 O ATOM 0 H GLU A 61 107.850 -1.828 -7.289 1.00 0.00 H new ATOM 0 HA GLU A 61 108.803 -4.132 -8.598 1.00 0.00 H new ATOM 0 HB2 GLU A 61 106.407 -2.975 -8.024 1.00 0.00 H new ATOM 0 HB3 GLU A 61 106.519 -2.457 -9.695 1.00 0.00 H new ATOM 0 HG2 GLU A 61 106.914 -4.853 -10.388 1.00 0.00 H new ATOM 0 HG3 GLU A 61 106.734 -5.350 -8.717 1.00 0.00 H new ATOM 887 N LEU A 62 108.903 -1.515 -10.567 1.00 0.00 N ATOM 888 CA LEU A 62 109.508 -1.045 -11.839 1.00 0.00 C ATOM 889 C LEU A 62 110.990 -0.747 -11.602 1.00 0.00 C ATOM 890 O LEU A 62 111.841 -1.071 -12.410 1.00 0.00 O ATOM 891 CB LEU A 62 108.718 0.221 -12.182 1.00 0.00 C ATOM 892 CG LEU A 62 109.614 1.225 -12.893 1.00 0.00 C ATOM 893 CD1 LEU A 62 110.088 0.634 -14.224 1.00 0.00 C ATOM 894 CD2 LEU A 62 108.829 2.506 -13.154 1.00 0.00 C ATOM 0 H LEU A 62 108.414 -0.798 -10.031 1.00 0.00 H new ATOM 0 HA LEU A 62 109.461 -1.771 -12.650 1.00 0.00 H new ATOM 0 HB2 LEU A 62 107.869 -0.033 -12.817 1.00 0.00 H new ATOM 0 HB3 LEU A 62 108.314 0.664 -11.272 1.00 0.00 H new ATOM 0 HG LEU A 62 110.479 1.449 -12.269 1.00 0.00 H new ATOM 0 HD11 LEU A 62 110.730 1.353 -14.733 1.00 0.00 H new ATOM 0 HD12 LEU A 62 110.647 -0.283 -14.036 1.00 0.00 H new ATOM 0 HD13 LEU A 62 109.225 0.410 -14.851 1.00 0.00 H new ATOM 0 HD21 LEU A 62 109.468 3.227 -13.663 1.00 0.00 H new ATOM 0 HD22 LEU A 62 107.965 2.282 -13.779 1.00 0.00 H new ATOM 0 HD23 LEU A 62 108.492 2.926 -12.206 1.00 0.00 H new ATOM 906 N LEU A 63 111.299 -0.138 -10.489 1.00 0.00 N ATOM 907 CA LEU A 63 112.720 0.181 -10.174 1.00 0.00 C ATOM 908 C LEU A 63 113.520 -1.116 -10.023 1.00 0.00 C ATOM 909 O LEU A 63 114.428 -1.385 -10.785 1.00 0.00 O ATOM 910 CB LEU A 63 112.664 0.953 -8.853 1.00 0.00 C ATOM 911 CG LEU A 63 112.917 2.435 -9.126 1.00 0.00 C ATOM 912 CD1 LEU A 63 112.215 3.281 -8.062 1.00 0.00 C ATOM 913 CD2 LEU A 63 114.421 2.705 -9.083 1.00 0.00 C ATOM 0 H LEU A 63 110.624 0.153 -9.782 1.00 0.00 H new ATOM 0 HA LEU A 63 113.208 0.762 -10.957 1.00 0.00 H new ATOM 0 HB2 LEU A 63 111.691 0.819 -8.381 1.00 0.00 H new ATOM 0 HB3 LEU A 63 113.411 0.566 -8.160 1.00 0.00 H new ATOM 0 HG LEU A 63 112.525 2.697 -10.109 1.00 0.00 H new ATOM 0 HD11 LEU A 63 112.397 4.338 -8.259 1.00 0.00 H new ATOM 0 HD12 LEU A 63 111.143 3.086 -8.091 1.00 0.00 H new ATOM 0 HD13 LEU A 63 112.604 3.023 -7.077 1.00 0.00 H new ATOM 0 HD21 LEU A 63 114.607 3.761 -9.277 1.00 0.00 H new ATOM 0 HD22 LEU A 63 114.810 2.443 -8.099 1.00 0.00 H new ATOM 0 HD23 LEU A 63 114.921 2.103 -9.842 1.00 0.00 H new ATOM 925 N LEU A 64 113.180 -1.929 -9.054 1.00 0.00 N ATOM 926 CA LEU A 64 113.906 -3.224 -8.858 1.00 0.00 C ATOM 927 C LEU A 64 114.017 -3.964 -10.197 1.00 0.00 C ATOM 928 O LEU A 64 115.059 -4.484 -10.546 1.00 0.00 O ATOM 929 CB LEU A 64 113.044 -4.023 -7.877 1.00 0.00 C ATOM 930 CG LEU A 64 113.799 -4.211 -6.561 1.00 0.00 C ATOM 931 CD1 LEU A 64 112.812 -4.131 -5.389 1.00 0.00 C ATOM 932 CD2 LEU A 64 114.486 -5.579 -6.564 1.00 0.00 C ATOM 0 H LEU A 64 112.428 -1.752 -8.387 1.00 0.00 H new ATOM 0 HA LEU A 64 114.918 -3.079 -8.481 1.00 0.00 H new ATOM 0 HB2 LEU A 64 112.104 -3.502 -7.697 1.00 0.00 H new ATOM 0 HB3 LEU A 64 112.793 -4.993 -8.305 1.00 0.00 H new ATOM 0 HG LEU A 64 114.549 -3.428 -6.453 1.00 0.00 H new ATOM 0 HD11 LEU A 64 113.350 -4.265 -4.451 1.00 0.00 H new ATOM 0 HD12 LEU A 64 112.323 -3.157 -5.391 1.00 0.00 H new ATOM 0 HD13 LEU A 64 112.061 -4.914 -5.492 1.00 0.00 H new ATOM 0 HD21 LEU A 64 115.026 -5.717 -5.627 1.00 0.00 H new ATOM 0 HD22 LEU A 64 113.736 -6.363 -6.670 1.00 0.00 H new ATOM 0 HD23 LEU A 64 115.186 -5.633 -7.397 1.00 0.00 H new ATOM 944 N LEU A 65 112.949 -3.995 -10.953 1.00 0.00 N ATOM 945 CA LEU A 65 112.983 -4.677 -12.275 1.00 0.00 C ATOM 946 C LEU A 65 114.059 -4.028 -13.148 1.00 0.00 C ATOM 947 O LEU A 65 114.822 -4.696 -13.820 1.00 0.00 O ATOM 948 CB LEU A 65 111.579 -4.462 -12.866 1.00 0.00 C ATOM 949 CG LEU A 65 111.641 -4.322 -14.395 1.00 0.00 C ATOM 950 CD1 LEU A 65 112.245 -5.589 -15.007 1.00 0.00 C ATOM 951 CD2 LEU A 65 110.224 -4.115 -14.935 1.00 0.00 C ATOM 0 H LEU A 65 112.053 -3.574 -10.707 1.00 0.00 H new ATOM 0 HA LEU A 65 113.224 -5.738 -12.206 1.00 0.00 H new ATOM 0 HB2 LEU A 65 110.936 -5.301 -12.600 1.00 0.00 H new ATOM 0 HB3 LEU A 65 111.131 -3.567 -12.433 1.00 0.00 H new ATOM 0 HG LEU A 65 112.264 -3.468 -14.659 1.00 0.00 H new ATOM 0 HD11 LEU A 65 112.287 -5.485 -16.091 1.00 0.00 H new ATOM 0 HD12 LEU A 65 113.252 -5.737 -14.617 1.00 0.00 H new ATOM 0 HD13 LEU A 65 111.626 -6.448 -14.749 1.00 0.00 H new ATOM 0 HD21 LEU A 65 110.259 -4.015 -16.020 1.00 0.00 H new ATOM 0 HD22 LEU A 65 109.605 -4.972 -14.670 1.00 0.00 H new ATOM 0 HD23 LEU A 65 109.798 -3.211 -14.501 1.00 0.00 H new ATOM 963 N HIS A 66 114.120 -2.725 -13.132 1.00 0.00 N ATOM 964 CA HIS A 66 115.124 -2.009 -13.939 1.00 0.00 C ATOM 965 C HIS A 66 116.478 -2.003 -13.217 1.00 0.00 C ATOM 966 O HIS A 66 117.453 -1.471 -13.711 1.00 0.00 O ATOM 967 CB HIS A 66 114.547 -0.607 -14.042 1.00 0.00 C ATOM 968 CG HIS A 66 113.795 -0.467 -15.339 1.00 0.00 C ATOM 969 ND1 HIS A 66 112.434 -0.711 -15.427 1.00 0.00 N ATOM 970 CD2 HIS A 66 114.194 -0.103 -16.600 1.00 0.00 C ATOM 971 CE1 HIS A 66 112.064 -0.491 -16.702 1.00 0.00 C ATOM 972 NE2 HIS A 66 113.098 -0.118 -17.460 1.00 0.00 N ATOM 0 H HIS A 66 113.504 -2.125 -12.583 1.00 0.00 H new ATOM 0 HA HIS A 66 115.307 -2.461 -14.914 1.00 0.00 H new ATOM 0 HB2 HIS A 66 113.881 -0.414 -13.201 1.00 0.00 H new ATOM 0 HB3 HIS A 66 115.347 0.132 -13.992 1.00 0.00 H new ATOM 0 HD2 HIS A 66 115.204 0.156 -16.883 1.00 0.00 H new ATOM 0 HE1 HIS A 66 111.054 -0.603 -17.068 1.00 0.00 H new ATOM 0 HE2 HIS A 66 113.088 0.107 -18.455 1.00 0.00 H new ATOM 980 N GLY A 67 116.543 -2.602 -12.053 1.00 0.00 N ATOM 981 CA GLY A 67 117.817 -2.649 -11.301 1.00 0.00 C ATOM 982 C GLY A 67 118.004 -1.366 -10.489 1.00 0.00 C ATOM 983 O GLY A 67 118.968 -0.650 -10.669 1.00 0.00 O ATOM 0 H GLY A 67 115.756 -3.062 -11.595 1.00 0.00 H new ATOM 0 HA2 GLY A 67 117.822 -3.512 -10.636 1.00 0.00 H new ATOM 0 HA3 GLY A 67 118.650 -2.774 -11.992 1.00 0.00 H new ATOM 987 N ALA A 68 117.102 -1.072 -9.583 1.00 0.00 N ATOM 988 CA ALA A 68 117.261 0.159 -8.757 1.00 0.00 C ATOM 989 C ALA A 68 118.478 -0.004 -7.851 1.00 0.00 C ATOM 990 O ALA A 68 119.433 -0.673 -8.196 1.00 0.00 O ATOM 991 CB ALA A 68 115.977 0.248 -7.929 1.00 0.00 C ATOM 0 H ALA A 68 116.271 -1.628 -9.383 1.00 0.00 H new ATOM 0 HA ALA A 68 117.413 1.058 -9.354 1.00 0.00 H new ATOM 0 HB1 ALA A 68 116.016 1.131 -7.292 1.00 0.00 H new ATOM 0 HB2 ALA A 68 115.118 0.319 -8.596 1.00 0.00 H new ATOM 0 HB3 ALA A 68 115.882 -0.643 -7.309 1.00 0.00 H new ATOM 997 N GLU A 69 118.445 0.578 -6.688 1.00 0.00 N ATOM 998 CA GLU A 69 119.594 0.431 -5.751 1.00 0.00 C ATOM 999 C GLU A 69 119.143 -0.334 -4.495 1.00 0.00 C ATOM 1000 O GLU A 69 119.341 0.130 -3.390 1.00 0.00 O ATOM 1001 CB GLU A 69 120.010 1.865 -5.400 1.00 0.00 C ATOM 1002 CG GLU A 69 121.517 2.044 -5.619 1.00 0.00 C ATOM 1003 CD GLU A 69 121.757 3.027 -6.770 1.00 0.00 C ATOM 1004 OE1 GLU A 69 121.487 4.202 -6.585 1.00 0.00 O ATOM 1005 OE2 GLU A 69 122.205 2.585 -7.816 1.00 0.00 O ATOM 0 H GLU A 69 117.673 1.149 -6.344 1.00 0.00 H new ATOM 0 HA GLU A 69 120.422 -0.129 -6.186 1.00 0.00 H new ATOM 0 HB2 GLU A 69 119.458 2.574 -6.017 1.00 0.00 H new ATOM 0 HB3 GLU A 69 119.757 2.082 -4.362 1.00 0.00 H new ATOM 0 HG2 GLU A 69 121.986 2.415 -4.707 1.00 0.00 H new ATOM 0 HG3 GLU A 69 121.978 1.083 -5.846 1.00 0.00 H new ATOM 1012 N PRO A 70 118.544 -1.488 -4.701 1.00 0.00 N ATOM 1013 CA PRO A 70 118.064 -2.306 -3.557 1.00 0.00 C ATOM 1014 C PRO A 70 119.260 -2.893 -2.808 1.00 0.00 C ATOM 1015 O PRO A 70 119.224 -3.094 -1.610 1.00 0.00 O ATOM 1016 CB PRO A 70 117.253 -3.414 -4.221 1.00 0.00 C ATOM 1017 CG PRO A 70 117.817 -3.523 -5.599 1.00 0.00 C ATOM 1018 CD PRO A 70 118.263 -2.142 -5.987 1.00 0.00 C ATOM 0 HA PRO A 70 117.482 -1.738 -2.831 1.00 0.00 H new ATOM 0 HB2 PRO A 70 117.349 -4.354 -3.678 1.00 0.00 H new ATOM 0 HB3 PRO A 70 116.192 -3.167 -4.246 1.00 0.00 H new ATOM 0 HG2 PRO A 70 118.653 -4.222 -5.622 1.00 0.00 H new ATOM 0 HG3 PRO A 70 117.068 -3.899 -6.296 1.00 0.00 H new ATOM 0 HD2 PRO A 70 119.148 -2.172 -6.622 1.00 0.00 H new ATOM 0 HD3 PRO A 70 117.489 -1.614 -6.543 1.00 0.00 H new ATOM 1026 N ASN A 71 120.326 -3.164 -3.516 1.00 0.00 N ATOM 1027 CA ASN A 71 121.537 -3.729 -2.862 1.00 0.00 C ATOM 1028 C ASN A 71 122.352 -2.592 -2.250 1.00 0.00 C ATOM 1029 O ASN A 71 122.345 -2.385 -1.054 1.00 0.00 O ATOM 1030 CB ASN A 71 122.314 -4.415 -3.991 1.00 0.00 C ATOM 1031 CG ASN A 71 122.302 -5.930 -3.781 1.00 0.00 C ATOM 1032 OD1 ASN A 71 123.145 -6.464 -2.940 1.00 0.00 O flip ATOM 1033 ND2 ASN A 71 121.520 -6.635 -4.388 1.00 0.00 N flip ATOM 0 H ASN A 71 120.407 -3.017 -4.522 1.00 0.00 H new ATOM 0 HA ASN A 71 121.302 -4.429 -2.060 1.00 0.00 H new ATOM 0 HB2 ASN A 71 121.868 -4.168 -4.954 1.00 0.00 H new ATOM 0 HB3 ASN A 71 123.341 -4.050 -4.013 1.00 0.00 H new ATOM 0 HD21 ASN A 71 120.861 -6.217 -5.045 1.00 0.00 H new ATOM 0 HD22 ASN A 71 121.522 -7.644 -4.240 1.00 0.00 H new ATOM 1040 N CYS A 72 123.044 -1.846 -3.069 1.00 0.00 N ATOM 1041 CA CYS A 72 123.856 -0.709 -2.553 1.00 0.00 C ATOM 1042 C CYS A 72 123.006 0.192 -1.647 1.00 0.00 C ATOM 1043 O CYS A 72 121.793 0.116 -1.644 1.00 0.00 O ATOM 1044 CB CYS A 72 124.291 0.050 -3.806 1.00 0.00 C ATOM 1045 SG CYS A 72 125.934 0.761 -3.542 1.00 0.00 S ATOM 0 H CYS A 72 123.081 -1.977 -4.080 1.00 0.00 H new ATOM 0 HA CYS A 72 124.703 -1.042 -1.954 1.00 0.00 H new ATOM 0 HB2 CYS A 72 124.308 -0.622 -4.664 1.00 0.00 H new ATOM 0 HB3 CYS A 72 123.574 0.839 -4.033 1.00 0.00 H new ATOM 0 HG CYS A 72 126.305 1.405 -4.609 1.00 0.00 H new ATOM 1051 N ALA A 73 123.637 1.040 -0.878 1.00 0.00 N ATOM 1052 CA ALA A 73 122.872 1.944 0.031 1.00 0.00 C ATOM 1053 C ALA A 73 123.689 3.218 0.318 1.00 0.00 C ATOM 1054 O ALA A 73 124.137 3.888 -0.594 1.00 0.00 O ATOM 1055 CB ALA A 73 122.655 1.114 1.299 1.00 0.00 C ATOM 0 H ALA A 73 124.651 1.146 -0.840 1.00 0.00 H new ATOM 0 HA ALA A 73 121.927 2.280 -0.395 1.00 0.00 H new ATOM 0 HB1 ALA A 73 122.097 1.702 2.028 1.00 0.00 H new ATOM 0 HB2 ALA A 73 122.093 0.213 1.053 1.00 0.00 H new ATOM 0 HB3 ALA A 73 123.621 0.835 1.721 1.00 0.00 H new ATOM 1061 N ASP A 74 123.892 3.563 1.567 1.00 0.00 N ATOM 1062 CA ASP A 74 124.681 4.790 1.887 1.00 0.00 C ATOM 1063 C ASP A 74 126.030 4.398 2.507 1.00 0.00 C ATOM 1064 O ASP A 74 126.077 3.578 3.400 1.00 0.00 O ATOM 1065 CB ASP A 74 123.835 5.552 2.910 1.00 0.00 C ATOM 1066 CG ASP A 74 123.099 6.699 2.217 1.00 0.00 C ATOM 1067 OD1 ASP A 74 123.697 7.326 1.357 1.00 0.00 O ATOM 1068 OD2 ASP A 74 121.951 6.931 2.557 1.00 0.00 O ATOM 0 H ASP A 74 123.545 3.048 2.376 1.00 0.00 H new ATOM 0 HA ASP A 74 124.890 5.388 1.000 1.00 0.00 H new ATOM 0 HB2 ASP A 74 123.118 4.877 3.378 1.00 0.00 H new ATOM 0 HB3 ASP A 74 124.471 5.942 3.704 1.00 0.00 H new ATOM 1073 N PRO A 75 127.088 4.995 2.024 1.00 0.00 N ATOM 1074 CA PRO A 75 128.435 4.683 2.564 1.00 0.00 C ATOM 1075 C PRO A 75 128.596 5.253 3.980 1.00 0.00 C ATOM 1076 O PRO A 75 129.552 4.957 4.671 1.00 0.00 O ATOM 1077 CB PRO A 75 129.384 5.366 1.584 1.00 0.00 C ATOM 1078 CG PRO A 75 128.577 6.463 0.966 1.00 0.00 C ATOM 1079 CD PRO A 75 127.144 6.000 0.952 1.00 0.00 C ATOM 0 HA PRO A 75 128.623 3.613 2.651 1.00 0.00 H new ATOM 0 HB2 PRO A 75 130.262 5.761 2.095 1.00 0.00 H new ATOM 0 HB3 PRO A 75 129.743 4.666 0.829 1.00 0.00 H new ATOM 0 HG2 PRO A 75 128.679 7.386 1.537 1.00 0.00 H new ATOM 0 HG3 PRO A 75 128.924 6.674 -0.045 1.00 0.00 H new ATOM 0 HD2 PRO A 75 126.456 6.824 1.140 1.00 0.00 H new ATOM 0 HD3 PRO A 75 126.872 5.571 -0.012 1.00 0.00 H new ATOM 1087 N ALA A 76 127.668 6.066 4.419 1.00 0.00 N ATOM 1088 CA ALA A 76 127.767 6.649 5.789 1.00 0.00 C ATOM 1089 C ALA A 76 127.146 5.703 6.816 1.00 0.00 C ATOM 1090 O ALA A 76 127.842 5.046 7.564 1.00 0.00 O ATOM 1091 CB ALA A 76 126.981 7.958 5.722 1.00 0.00 C ATOM 0 H ALA A 76 126.846 6.350 3.886 1.00 0.00 H new ATOM 0 HA ALA A 76 128.801 6.810 6.093 1.00 0.00 H new ATOM 0 HB1 ALA A 76 127.007 8.448 6.695 1.00 0.00 H new ATOM 0 HB2 ALA A 76 127.428 8.613 4.974 1.00 0.00 H new ATOM 0 HB3 ALA A 76 125.947 7.748 5.449 1.00 0.00 H new ATOM 1097 N THR A 77 125.845 5.627 6.859 1.00 0.00 N ATOM 1098 CA THR A 77 125.187 4.724 7.842 1.00 0.00 C ATOM 1099 C THR A 77 124.750 3.421 7.164 1.00 0.00 C ATOM 1100 O THR A 77 124.044 2.623 7.744 1.00 0.00 O ATOM 1101 CB THR A 77 123.963 5.496 8.345 1.00 0.00 C ATOM 1102 OG1 THR A 77 124.028 6.845 7.903 1.00 0.00 O ATOM 1103 CG2 THR A 77 123.925 5.461 9.873 1.00 0.00 C ATOM 0 H THR A 77 125.210 6.151 6.256 1.00 0.00 H new ATOM 0 HA THR A 77 125.860 4.451 8.654 1.00 0.00 H new ATOM 0 HB THR A 77 123.060 5.031 7.949 1.00 0.00 H new ATOM 0 HG1 THR A 77 123.242 7.333 8.226 1.00 0.00 H new ATOM 0 HG21 THR A 77 123.053 6.011 10.228 1.00 0.00 H new ATOM 0 HG22 THR A 77 123.864 4.427 10.212 1.00 0.00 H new ATOM 0 HG23 THR A 77 124.830 5.920 10.270 1.00 0.00 H new ATOM 1111 N LEU A 78 125.156 3.204 5.939 1.00 0.00 N ATOM 1112 CA LEU A 78 124.754 1.955 5.225 1.00 0.00 C ATOM 1113 C LEU A 78 123.235 1.762 5.304 1.00 0.00 C ATOM 1114 O LEU A 78 122.748 0.662 5.478 1.00 0.00 O ATOM 1115 CB LEU A 78 125.481 0.819 5.956 1.00 0.00 C ATOM 1116 CG LEU A 78 126.604 0.261 5.073 1.00 0.00 C ATOM 1117 CD1 LEU A 78 127.222 -0.962 5.754 1.00 0.00 C ATOM 1118 CD2 LEU A 78 126.036 -0.154 3.713 1.00 0.00 C ATOM 0 H LEU A 78 125.748 3.838 5.403 1.00 0.00 H new ATOM 0 HA LEU A 78 125.014 1.987 4.167 1.00 0.00 H new ATOM 0 HB2 LEU A 78 125.894 1.186 6.896 1.00 0.00 H new ATOM 0 HB3 LEU A 78 124.776 0.026 6.206 1.00 0.00 H new ATOM 0 HG LEU A 78 127.364 1.029 4.929 1.00 0.00 H new ATOM 0 HD11 LEU A 78 128.021 -1.362 5.129 1.00 0.00 H new ATOM 0 HD12 LEU A 78 127.629 -0.672 6.723 1.00 0.00 H new ATOM 0 HD13 LEU A 78 126.457 -1.725 5.896 1.00 0.00 H new ATOM 0 HD21 LEU A 78 126.838 -0.550 3.089 1.00 0.00 H new ATOM 0 HD22 LEU A 78 125.275 -0.921 3.855 1.00 0.00 H new ATOM 0 HD23 LEU A 78 125.591 0.713 3.225 1.00 0.00 H new ATOM 1130 N THR A 79 122.486 2.826 5.178 1.00 0.00 N ATOM 1131 CA THR A 79 120.998 2.706 5.248 1.00 0.00 C ATOM 1132 C THR A 79 120.485 1.863 4.079 1.00 0.00 C ATOM 1133 O THR A 79 120.287 2.355 2.986 1.00 0.00 O ATOM 1134 CB THR A 79 120.467 4.140 5.149 1.00 0.00 C ATOM 1135 OG1 THR A 79 121.416 5.042 5.700 1.00 0.00 O ATOM 1136 CG2 THR A 79 119.152 4.250 5.923 1.00 0.00 C ATOM 0 H THR A 79 122.839 3.772 5.030 1.00 0.00 H new ATOM 0 HA THR A 79 120.669 2.219 6.166 1.00 0.00 H new ATOM 0 HB THR A 79 120.298 4.390 4.102 1.00 0.00 H new ATOM 0 HG1 THR A 79 121.074 5.958 5.633 1.00 0.00 H new ATOM 0 HG21 THR A 79 118.773 5.270 5.853 1.00 0.00 H new ATOM 0 HG22 THR A 79 118.421 3.562 5.498 1.00 0.00 H new ATOM 0 HG23 THR A 79 119.323 3.997 6.969 1.00 0.00 H new ATOM 1144 N ARG A 80 120.274 0.596 4.303 1.00 0.00 N ATOM 1145 CA ARG A 80 119.780 -0.291 3.207 1.00 0.00 C ATOM 1146 C ARG A 80 118.305 -0.010 2.909 1.00 0.00 C ATOM 1147 O ARG A 80 117.552 0.332 3.799 1.00 0.00 O ATOM 1148 CB ARG A 80 119.943 -1.713 3.754 1.00 0.00 C ATOM 1149 CG ARG A 80 120.293 -2.686 2.620 1.00 0.00 C ATOM 1150 CD ARG A 80 121.531 -2.187 1.867 1.00 0.00 C ATOM 1151 NE ARG A 80 122.179 -3.412 1.321 1.00 0.00 N ATOM 1152 CZ ARG A 80 123.477 -3.454 1.147 1.00 0.00 C ATOM 1153 NH1 ARG A 80 124.186 -2.353 1.156 1.00 0.00 N ATOM 1154 NH2 ARG A 80 124.068 -4.601 0.951 1.00 0.00 N ATOM 0 H ARG A 80 120.422 0.133 5.200 1.00 0.00 H new ATOM 0 HA ARG A 80 120.327 -0.135 2.277 1.00 0.00 H new ATOM 0 HB2 ARG A 80 120.727 -1.730 4.511 1.00 0.00 H new ATOM 0 HB3 ARG A 80 119.021 -2.030 4.242 1.00 0.00 H new ATOM 0 HG2 ARG A 80 120.480 -3.680 3.027 1.00 0.00 H new ATOM 0 HG3 ARG A 80 119.451 -2.776 1.934 1.00 0.00 H new ATOM 0 HD2 ARG A 80 121.255 -1.499 1.068 1.00 0.00 H new ATOM 0 HD3 ARG A 80 122.206 -1.648 2.532 1.00 0.00 H new ATOM 0 HE ARG A 80 121.609 -4.223 1.081 1.00 0.00 H new ATOM 0 HH11 ARG A 80 123.728 -1.453 1.299 1.00 0.00 H new ATOM 0 HH12 ARG A 80 125.196 -2.396 1.020 1.00 0.00 H new ATOM 0 HH21 ARG A 80 123.520 -5.461 0.934 1.00 0.00 H new ATOM 0 HH22 ARG A 80 125.078 -4.638 0.815 1.00 0.00 H new ATOM 1168 N PRO A 81 117.928 -0.191 1.667 1.00 0.00 N ATOM 1169 CA PRO A 81 116.516 0.019 1.275 1.00 0.00 C ATOM 1170 C PRO A 81 115.649 -1.065 1.922 1.00 0.00 C ATOM 1171 O PRO A 81 114.441 -0.953 1.991 1.00 0.00 O ATOM 1172 CB PRO A 81 116.539 -0.096 -0.249 1.00 0.00 C ATOM 1173 CG PRO A 81 117.754 -0.910 -0.554 1.00 0.00 C ATOM 1174 CD PRO A 81 118.758 -0.604 0.526 1.00 0.00 C ATOM 0 HA PRO A 81 116.100 0.974 1.595 1.00 0.00 H new ATOM 0 HB2 PRO A 81 115.636 -0.579 -0.623 1.00 0.00 H new ATOM 0 HB3 PRO A 81 116.593 0.886 -0.719 1.00 0.00 H new ATOM 0 HG2 PRO A 81 117.514 -1.973 -0.570 1.00 0.00 H new ATOM 0 HG3 PRO A 81 118.153 -0.658 -1.537 1.00 0.00 H new ATOM 0 HD2 PRO A 81 119.365 -1.477 0.767 1.00 0.00 H new ATOM 0 HD3 PRO A 81 119.444 0.187 0.223 1.00 0.00 H new ATOM 1182 N VAL A 82 116.266 -2.105 2.423 1.00 0.00 N ATOM 1183 CA VAL A 82 115.489 -3.182 3.097 1.00 0.00 C ATOM 1184 C VAL A 82 114.827 -2.599 4.347 1.00 0.00 C ATOM 1185 O VAL A 82 113.747 -3.002 4.740 1.00 0.00 O ATOM 1186 CB VAL A 82 116.531 -4.242 3.461 1.00 0.00 C ATOM 1187 CG1 VAL A 82 115.880 -5.373 4.261 1.00 0.00 C ATOM 1188 CG2 VAL A 82 117.126 -4.813 2.173 1.00 0.00 C ATOM 0 H VAL A 82 117.275 -2.252 2.393 1.00 0.00 H new ATOM 0 HA VAL A 82 114.698 -3.605 2.478 1.00 0.00 H new ATOM 0 HB VAL A 82 117.312 -3.785 4.068 1.00 0.00 H new ATOM 0 HG11 VAL A 82 116.633 -6.120 4.513 1.00 0.00 H new ATOM 0 HG12 VAL A 82 115.448 -4.969 5.177 1.00 0.00 H new ATOM 0 HG13 VAL A 82 115.095 -5.836 3.663 1.00 0.00 H new ATOM 0 HG21 VAL A 82 117.870 -5.570 2.420 1.00 0.00 H new ATOM 0 HG22 VAL A 82 116.334 -5.264 1.575 1.00 0.00 H new ATOM 0 HG23 VAL A 82 117.598 -4.012 1.604 1.00 0.00 H new ATOM 1198 N HIS A 83 115.462 -1.634 4.962 1.00 0.00 N ATOM 1199 CA HIS A 83 114.866 -1.002 6.172 1.00 0.00 C ATOM 1200 C HIS A 83 113.617 -0.225 5.757 1.00 0.00 C ATOM 1201 O HIS A 83 112.603 -0.249 6.420 1.00 0.00 O ATOM 1202 CB HIS A 83 115.931 -0.042 6.710 1.00 0.00 C ATOM 1203 CG HIS A 83 117.154 -0.820 7.099 1.00 0.00 C ATOM 1204 ND1 HIS A 83 117.894 -1.543 6.164 1.00 0.00 N ATOM 1205 CD2 HIS A 83 117.788 -1.005 8.309 1.00 0.00 C ATOM 1206 CE1 HIS A 83 118.916 -2.124 6.814 1.00 0.00 C ATOM 1207 NE2 HIS A 83 118.880 -1.820 8.102 1.00 0.00 N ATOM 0 H HIS A 83 116.366 -1.258 4.677 1.00 0.00 H new ATOM 0 HA HIS A 83 114.579 -1.734 6.927 1.00 0.00 H new ATOM 0 HB2 HIS A 83 116.184 0.699 5.952 1.00 0.00 H new ATOM 0 HB3 HIS A 83 115.544 0.502 7.571 1.00 0.00 H new ATOM 0 HD2 HIS A 83 117.482 -0.584 9.255 1.00 0.00 H new ATOM 0 HE1 HIS A 83 119.663 -2.752 6.351 1.00 0.00 H new ATOM 0 HE2 HIS A 83 119.541 -2.133 8.813 1.00 0.00 H new ATOM 1215 N ASP A 84 113.699 0.459 4.644 1.00 0.00 N ATOM 1216 CA ASP A 84 112.534 1.250 4.141 1.00 0.00 C ATOM 1217 C ASP A 84 111.282 0.376 4.069 1.00 0.00 C ATOM 1218 O ASP A 84 110.236 0.730 4.579 1.00 0.00 O ATOM 1219 CB ASP A 84 112.941 1.699 2.740 1.00 0.00 C ATOM 1220 CG ASP A 84 113.714 3.013 2.823 1.00 0.00 C ATOM 1221 OD1 ASP A 84 113.113 4.010 3.188 1.00 0.00 O ATOM 1222 OD2 ASP A 84 114.894 2.999 2.519 1.00 0.00 O ATOM 0 H ASP A 84 114.531 0.504 4.056 1.00 0.00 H new ATOM 0 HA ASP A 84 112.298 2.089 4.795 1.00 0.00 H new ATOM 0 HB2 ASP A 84 113.556 0.934 2.267 1.00 0.00 H new ATOM 0 HB3 ASP A 84 112.056 1.826 2.117 1.00 0.00 H new ATOM 1227 N ALA A 85 111.382 -0.765 3.441 1.00 0.00 N ATOM 1228 CA ALA A 85 110.198 -1.669 3.339 1.00 0.00 C ATOM 1229 C ALA A 85 109.633 -1.931 4.741 1.00 0.00 C ATOM 1230 O ALA A 85 108.528 -1.537 5.059 1.00 0.00 O ATOM 1231 CB ALA A 85 110.740 -2.959 2.725 1.00 0.00 C ATOM 0 H ALA A 85 112.231 -1.111 2.994 1.00 0.00 H new ATOM 0 HA ALA A 85 109.392 -1.246 2.739 1.00 0.00 H new ATOM 0 HB1 ALA A 85 109.929 -3.679 2.616 1.00 0.00 H new ATOM 0 HB2 ALA A 85 111.168 -2.744 1.746 1.00 0.00 H new ATOM 0 HB3 ALA A 85 111.510 -3.376 3.374 1.00 0.00 H new ATOM 1237 N ALA A 86 110.393 -2.585 5.581 1.00 0.00 N ATOM 1238 CA ALA A 86 109.920 -2.866 6.964 1.00 0.00 C ATOM 1239 C ALA A 86 109.595 -1.562 7.700 1.00 0.00 C ATOM 1240 O ALA A 86 108.770 -1.537 8.586 1.00 0.00 O ATOM 1241 CB ALA A 86 111.093 -3.574 7.643 1.00 0.00 C ATOM 0 H ALA A 86 111.325 -2.937 5.365 1.00 0.00 H new ATOM 0 HA ALA A 86 109.011 -3.467 6.969 1.00 0.00 H new ATOM 0 HB1 ALA A 86 110.825 -3.817 8.671 1.00 0.00 H new ATOM 0 HB2 ALA A 86 111.327 -4.491 7.102 1.00 0.00 H new ATOM 0 HB3 ALA A 86 111.964 -2.919 7.640 1.00 0.00 H new ATOM 1247 N ARG A 87 110.241 -0.478 7.344 1.00 0.00 N ATOM 1248 CA ARG A 87 109.964 0.819 8.039 1.00 0.00 C ATOM 1249 C ARG A 87 108.468 1.142 8.000 1.00 0.00 C ATOM 1250 O ARG A 87 107.868 1.454 9.010 1.00 0.00 O ATOM 1251 CB ARG A 87 110.766 1.876 7.271 1.00 0.00 C ATOM 1252 CG ARG A 87 111.863 2.451 8.177 1.00 0.00 C ATOM 1253 CD ARG A 87 111.688 3.969 8.312 1.00 0.00 C ATOM 1254 NE ARG A 87 110.271 4.167 8.734 1.00 0.00 N ATOM 1255 CZ ARG A 87 109.758 5.367 8.756 1.00 0.00 C ATOM 1256 NH1 ARG A 87 110.499 6.389 9.087 1.00 0.00 N ATOM 1257 NH2 ARG A 87 108.502 5.545 8.446 1.00 0.00 N ATOM 0 H ARG A 87 110.944 -0.435 6.607 1.00 0.00 H new ATOM 0 HA ARG A 87 110.250 0.783 9.090 1.00 0.00 H new ATOM 0 HB2 ARG A 87 111.212 1.433 6.381 1.00 0.00 H new ATOM 0 HB3 ARG A 87 110.105 2.674 6.933 1.00 0.00 H new ATOM 0 HG2 ARG A 87 111.817 1.982 9.160 1.00 0.00 H new ATOM 0 HG3 ARG A 87 112.845 2.225 7.762 1.00 0.00 H new ATOM 0 HD2 ARG A 87 112.379 4.380 9.048 1.00 0.00 H new ATOM 0 HD3 ARG A 87 111.891 4.474 7.367 1.00 0.00 H new ATOM 0 HE ARG A 87 109.703 3.365 9.005 1.00 0.00 H new ATOM 0 HH11 ARG A 87 111.480 6.250 9.329 1.00 0.00 H new ATOM 0 HH12 ARG A 87 110.097 7.326 9.104 1.00 0.00 H new ATOM 0 HH21 ARG A 87 107.923 4.747 8.187 1.00 0.00 H new ATOM 0 HH22 ARG A 87 108.100 6.482 8.463 1.00 0.00 H new ATOM 1271 N GLU A 88 107.859 1.068 6.848 1.00 0.00 N ATOM 1272 CA GLU A 88 106.401 1.367 6.758 1.00 0.00 C ATOM 1273 C GLU A 88 105.583 0.069 6.853 1.00 0.00 C ATOM 1274 O GLU A 88 104.375 0.079 6.723 1.00 0.00 O ATOM 1275 CB GLU A 88 106.211 2.028 5.392 1.00 0.00 C ATOM 1276 CG GLU A 88 105.056 3.029 5.465 1.00 0.00 C ATOM 1277 CD GLU A 88 105.594 4.404 5.868 1.00 0.00 C ATOM 1278 OE1 GLU A 88 106.535 4.446 6.644 1.00 0.00 O ATOM 1279 OE2 GLU A 88 105.055 5.391 5.397 1.00 0.00 O ATOM 0 H GLU A 88 108.306 0.814 5.967 1.00 0.00 H new ATOM 0 HA GLU A 88 106.063 2.012 7.569 1.00 0.00 H new ATOM 0 HB2 GLU A 88 107.128 2.536 5.091 1.00 0.00 H new ATOM 0 HB3 GLU A 88 106.003 1.271 4.636 1.00 0.00 H new ATOM 0 HG2 GLU A 88 104.554 3.092 4.499 1.00 0.00 H new ATOM 0 HG3 GLU A 88 104.314 2.691 6.188 1.00 0.00 H new ATOM 1286 N GLY A 89 106.231 -1.046 7.082 1.00 0.00 N ATOM 1287 CA GLY A 89 105.489 -2.338 7.188 1.00 0.00 C ATOM 1288 C GLY A 89 104.993 -2.759 5.808 1.00 0.00 C ATOM 1289 O GLY A 89 103.916 -3.303 5.667 1.00 0.00 O ATOM 0 H GLY A 89 107.242 -1.116 7.200 1.00 0.00 H new ATOM 0 HA2 GLY A 89 106.139 -3.109 7.603 1.00 0.00 H new ATOM 0 HA3 GLY A 89 104.646 -2.230 7.871 1.00 0.00 H new ATOM 1293 N PHE A 90 105.764 -2.505 4.787 1.00 0.00 N ATOM 1294 CA PHE A 90 105.327 -2.886 3.415 1.00 0.00 C ATOM 1295 C PHE A 90 106.042 -4.157 2.948 1.00 0.00 C ATOM 1296 O PHE A 90 107.029 -4.096 2.242 1.00 0.00 O ATOM 1297 CB PHE A 90 105.712 -1.698 2.538 1.00 0.00 C ATOM 1298 CG PHE A 90 104.592 -1.421 1.574 1.00 0.00 C ATOM 1299 CD1 PHE A 90 104.326 -2.326 0.543 1.00 0.00 C ATOM 1300 CD2 PHE A 90 103.816 -0.266 1.712 1.00 0.00 C ATOM 1301 CE1 PHE A 90 103.284 -2.076 -0.354 1.00 0.00 C ATOM 1302 CE2 PHE A 90 102.774 -0.017 0.814 1.00 0.00 C ATOM 1303 CZ PHE A 90 102.509 -0.921 -0.219 1.00 0.00 C ATOM 0 H PHE A 90 106.676 -2.051 4.843 1.00 0.00 H new ATOM 0 HA PHE A 90 104.259 -3.101 3.371 1.00 0.00 H new ATOM 0 HB2 PHE A 90 105.904 -0.820 3.155 1.00 0.00 H new ATOM 0 HB3 PHE A 90 106.632 -1.913 1.995 1.00 0.00 H new ATOM 0 HD1 PHE A 90 104.926 -3.218 0.439 1.00 0.00 H new ATOM 0 HD2 PHE A 90 104.021 0.432 2.510 1.00 0.00 H new ATOM 0 HE1 PHE A 90 103.078 -2.775 -1.151 1.00 0.00 H new ATOM 0 HE2 PHE A 90 102.173 0.874 0.918 1.00 0.00 H new ATOM 0 HZ PHE A 90 101.705 -0.727 -0.913 1.00 0.00 H new ATOM 1313 N LEU A 91 105.546 -5.305 3.329 1.00 0.00 N ATOM 1314 CA LEU A 91 106.195 -6.580 2.900 1.00 0.00 C ATOM 1315 C LEU A 91 106.225 -6.670 1.373 1.00 0.00 C ATOM 1316 O LEU A 91 107.190 -7.126 0.791 1.00 0.00 O ATOM 1317 CB LEU A 91 105.329 -7.697 3.483 1.00 0.00 C ATOM 1318 CG LEU A 91 106.191 -8.596 4.371 1.00 0.00 C ATOM 1319 CD1 LEU A 91 105.334 -9.173 5.497 1.00 0.00 C ATOM 1320 CD2 LEU A 91 106.768 -9.740 3.532 1.00 0.00 C ATOM 0 H LEU A 91 104.721 -5.415 3.918 1.00 0.00 H new ATOM 0 HA LEU A 91 107.226 -6.647 3.246 1.00 0.00 H new ATOM 0 HB2 LEU A 91 104.510 -7.272 4.063 1.00 0.00 H new ATOM 0 HB3 LEU A 91 104.881 -8.282 2.680 1.00 0.00 H new ATOM 0 HG LEU A 91 107.006 -8.011 4.798 1.00 0.00 H new ATOM 0 HD11 LEU A 91 105.948 -9.814 6.130 1.00 0.00 H new ATOM 0 HD12 LEU A 91 104.923 -8.359 6.095 1.00 0.00 H new ATOM 0 HD13 LEU A 91 104.519 -9.758 5.071 1.00 0.00 H new ATOM 0 HD21 LEU A 91 107.382 -10.381 4.164 1.00 0.00 H new ATOM 0 HD22 LEU A 91 105.953 -10.325 3.105 1.00 0.00 H new ATOM 0 HD23 LEU A 91 107.380 -9.329 2.729 1.00 0.00 H new ATOM 1332 N ASP A 92 105.173 -6.238 0.721 1.00 0.00 N ATOM 1333 CA ASP A 92 105.136 -6.293 -0.769 1.00 0.00 C ATOM 1334 C ASP A 92 106.439 -5.730 -1.347 1.00 0.00 C ATOM 1335 O ASP A 92 106.964 -6.228 -2.324 1.00 0.00 O ATOM 1336 CB ASP A 92 103.945 -5.423 -1.169 1.00 0.00 C ATOM 1337 CG ASP A 92 102.657 -6.054 -0.640 1.00 0.00 C ATOM 1338 OD1 ASP A 92 102.567 -6.253 0.559 1.00 0.00 O ATOM 1339 OD2 ASP A 92 101.782 -6.330 -1.445 1.00 0.00 O ATOM 0 H ASP A 92 104.338 -5.849 1.160 1.00 0.00 H new ATOM 0 HA ASP A 92 105.036 -7.311 -1.146 1.00 0.00 H new ATOM 0 HB2 ASP A 92 104.063 -4.417 -0.766 1.00 0.00 H new ATOM 0 HB3 ASP A 92 103.898 -5.328 -2.254 1.00 0.00 H new ATOM 1344 N THR A 93 106.967 -4.707 -0.733 1.00 0.00 N ATOM 1345 CA THR A 93 108.245 -4.116 -1.222 1.00 0.00 C ATOM 1346 C THR A 93 109.370 -5.146 -1.079 1.00 0.00 C ATOM 1347 O THR A 93 110.148 -5.361 -1.988 1.00 0.00 O ATOM 1348 CB THR A 93 108.489 -2.907 -0.311 1.00 0.00 C ATOM 1349 OG1 THR A 93 107.472 -1.942 -0.532 1.00 0.00 O ATOM 1350 CG2 THR A 93 109.853 -2.287 -0.621 1.00 0.00 C ATOM 0 H THR A 93 106.567 -4.254 0.089 1.00 0.00 H new ATOM 0 HA THR A 93 108.208 -3.826 -2.272 1.00 0.00 H new ATOM 0 HB THR A 93 108.472 -3.231 0.730 1.00 0.00 H new ATOM 0 HG1 THR A 93 106.632 -2.256 -0.137 1.00 0.00 H new ATOM 0 HG21 THR A 93 110.019 -1.429 0.030 1.00 0.00 H new ATOM 0 HG22 THR A 93 110.636 -3.027 -0.453 1.00 0.00 H new ATOM 0 HG23 THR A 93 109.877 -1.963 -1.661 1.00 0.00 H new ATOM 1358 N LEU A 94 109.457 -5.789 0.059 1.00 0.00 N ATOM 1359 CA LEU A 94 110.526 -6.811 0.266 1.00 0.00 C ATOM 1360 C LEU A 94 110.341 -7.971 -0.711 1.00 0.00 C ATOM 1361 O LEU A 94 111.287 -8.422 -1.328 1.00 0.00 O ATOM 1362 CB LEU A 94 110.355 -7.282 1.712 1.00 0.00 C ATOM 1363 CG LEU A 94 110.690 -6.127 2.663 1.00 0.00 C ATOM 1364 CD1 LEU A 94 109.437 -5.720 3.433 1.00 0.00 C ATOM 1365 CD2 LEU A 94 111.770 -6.566 3.654 1.00 0.00 C ATOM 0 H LEU A 94 108.833 -5.649 0.854 1.00 0.00 H new ATOM 0 HA LEU A 94 111.524 -6.409 0.091 1.00 0.00 H new ATOM 0 HB2 LEU A 94 109.332 -7.620 1.878 1.00 0.00 H new ATOM 0 HB3 LEU A 94 111.008 -8.132 1.909 1.00 0.00 H new ATOM 0 HG LEU A 94 111.055 -5.281 2.081 1.00 0.00 H new ATOM 0 HD11 LEU A 94 109.676 -4.899 4.109 1.00 0.00 H new ATOM 0 HD12 LEU A 94 108.667 -5.400 2.731 1.00 0.00 H new ATOM 0 HD13 LEU A 94 109.072 -6.570 4.010 1.00 0.00 H new ATOM 0 HD21 LEU A 94 112.003 -5.741 4.327 1.00 0.00 H new ATOM 0 HD22 LEU A 94 111.408 -7.416 4.233 1.00 0.00 H new ATOM 0 HD23 LEU A 94 112.668 -6.855 3.109 1.00 0.00 H new ATOM 1377 N VAL A 95 109.131 -8.454 -0.868 1.00 0.00 N ATOM 1378 CA VAL A 95 108.895 -9.582 -1.824 1.00 0.00 C ATOM 1379 C VAL A 95 109.559 -9.259 -3.164 1.00 0.00 C ATOM 1380 O VAL A 95 110.219 -10.089 -3.756 1.00 0.00 O ATOM 1381 CB VAL A 95 107.372 -9.674 -1.984 1.00 0.00 C ATOM 1382 CG1 VAL A 95 107.023 -10.624 -3.134 1.00 0.00 C ATOM 1383 CG2 VAL A 95 106.757 -10.208 -0.688 1.00 0.00 C ATOM 0 H VAL A 95 108.302 -8.118 -0.379 1.00 0.00 H new ATOM 0 HA VAL A 95 109.313 -10.524 -1.468 1.00 0.00 H new ATOM 0 HB VAL A 95 106.976 -8.682 -2.202 1.00 0.00 H new ATOM 0 HG11 VAL A 95 105.940 -10.684 -3.241 1.00 0.00 H new ATOM 0 HG12 VAL A 95 107.459 -10.250 -4.060 1.00 0.00 H new ATOM 0 HG13 VAL A 95 107.422 -11.616 -2.920 1.00 0.00 H new ATOM 0 HG21 VAL A 95 105.675 -10.274 -0.799 1.00 0.00 H new ATOM 0 HG22 VAL A 95 107.161 -11.197 -0.474 1.00 0.00 H new ATOM 0 HG23 VAL A 95 106.997 -9.533 0.134 1.00 0.00 H new ATOM 1393 N VAL A 96 109.399 -8.050 -3.633 1.00 0.00 N ATOM 1394 CA VAL A 96 110.030 -7.659 -4.926 1.00 0.00 C ATOM 1395 C VAL A 96 111.552 -7.648 -4.759 1.00 0.00 C ATOM 1396 O VAL A 96 112.283 -8.166 -5.580 1.00 0.00 O ATOM 1397 CB VAL A 96 109.513 -6.249 -5.235 1.00 0.00 C ATOM 1398 CG1 VAL A 96 109.864 -5.895 -6.680 1.00 0.00 C ATOM 1399 CG2 VAL A 96 107.988 -6.190 -5.055 1.00 0.00 C ATOM 0 H VAL A 96 108.858 -7.316 -3.176 1.00 0.00 H new ATOM 0 HA VAL A 96 109.787 -8.351 -5.733 1.00 0.00 H new ATOM 0 HB VAL A 96 109.978 -5.539 -4.551 1.00 0.00 H new ATOM 0 HG11 VAL A 96 109.500 -4.893 -6.908 1.00 0.00 H new ATOM 0 HG12 VAL A 96 110.946 -5.926 -6.810 1.00 0.00 H new ATOM 0 HG13 VAL A 96 109.397 -6.613 -7.354 1.00 0.00 H new ATOM 0 HG21 VAL A 96 107.634 -5.183 -5.278 1.00 0.00 H new ATOM 0 HG22 VAL A 96 107.514 -6.900 -5.733 1.00 0.00 H new ATOM 0 HG23 VAL A 96 107.733 -6.445 -4.026 1.00 0.00 H new ATOM 1409 N LEU A 97 112.031 -7.071 -3.685 1.00 0.00 N ATOM 1410 CA LEU A 97 113.505 -7.031 -3.440 1.00 0.00 C ATOM 1411 C LEU A 97 114.086 -8.447 -3.527 1.00 0.00 C ATOM 1412 O LEU A 97 115.125 -8.670 -4.116 1.00 0.00 O ATOM 1413 CB LEU A 97 113.658 -6.481 -2.018 1.00 0.00 C ATOM 1414 CG LEU A 97 113.925 -4.973 -2.069 1.00 0.00 C ATOM 1415 CD1 LEU A 97 112.623 -4.213 -1.810 1.00 0.00 C ATOM 1416 CD2 LEU A 97 114.950 -4.597 -0.995 1.00 0.00 C ATOM 0 H LEU A 97 111.462 -6.625 -2.965 1.00 0.00 H new ATOM 0 HA LEU A 97 114.030 -6.418 -4.173 1.00 0.00 H new ATOM 0 HB2 LEU A 97 112.754 -6.680 -1.442 1.00 0.00 H new ATOM 0 HB3 LEU A 97 114.478 -6.987 -1.509 1.00 0.00 H new ATOM 0 HG LEU A 97 114.313 -4.710 -3.053 1.00 0.00 H new ATOM 0 HD11 LEU A 97 112.814 -3.141 -1.847 1.00 0.00 H new ATOM 0 HD12 LEU A 97 111.890 -4.477 -2.572 1.00 0.00 H new ATOM 0 HD13 LEU A 97 112.236 -4.479 -0.826 1.00 0.00 H new ATOM 0 HD21 LEU A 97 115.139 -3.524 -1.032 1.00 0.00 H new ATOM 0 HD22 LEU A 97 114.561 -4.863 -0.012 1.00 0.00 H new ATOM 0 HD23 LEU A 97 115.880 -5.136 -1.175 1.00 0.00 H new ATOM 1428 N HIS A 98 113.413 -9.402 -2.944 1.00 0.00 N ATOM 1429 CA HIS A 98 113.904 -10.812 -2.983 1.00 0.00 C ATOM 1430 C HIS A 98 113.474 -11.483 -4.293 1.00 0.00 C ATOM 1431 O HIS A 98 114.171 -12.316 -4.839 1.00 0.00 O ATOM 1432 CB HIS A 98 113.225 -11.485 -1.787 1.00 0.00 C ATOM 1433 CG HIS A 98 114.046 -12.657 -1.327 1.00 0.00 C ATOM 1434 ND1 HIS A 98 114.574 -12.729 -0.050 1.00 0.00 N ATOM 1435 CD2 HIS A 98 114.429 -13.813 -1.959 1.00 0.00 C ATOM 1436 CE1 HIS A 98 115.241 -13.894 0.048 1.00 0.00 C ATOM 1437 NE2 HIS A 98 115.183 -14.594 -1.088 1.00 0.00 N ATOM 0 H HIS A 98 112.538 -9.266 -2.438 1.00 0.00 H new ATOM 0 HA HIS A 98 114.991 -10.881 -2.934 1.00 0.00 H new ATOM 0 HB2 HIS A 98 113.109 -10.769 -0.973 1.00 0.00 H new ATOM 0 HB3 HIS A 98 112.225 -11.817 -2.065 1.00 0.00 H new ATOM 0 HD2 HIS A 98 114.183 -14.077 -2.977 1.00 0.00 H new ATOM 0 HE1 HIS A 98 115.760 -14.223 0.937 1.00 0.00 H new ATOM 0 HE2 HIS A 98 115.601 -15.505 -1.277 1.00 0.00 H new ATOM 1445 N ARG A 99 112.325 -11.118 -4.795 1.00 0.00 N ATOM 1446 CA ARG A 99 111.818 -11.717 -6.070 1.00 0.00 C ATOM 1447 C ARG A 99 112.707 -11.319 -7.248 1.00 0.00 C ATOM 1448 O ARG A 99 112.577 -11.851 -8.334 1.00 0.00 O ATOM 1449 CB ARG A 99 110.406 -11.136 -6.227 1.00 0.00 C ATOM 1450 CG ARG A 99 109.913 -11.269 -7.673 1.00 0.00 C ATOM 1451 CD ARG A 99 108.524 -10.636 -7.784 1.00 0.00 C ATOM 1452 NE ARG A 99 107.834 -11.390 -8.866 1.00 0.00 N ATOM 1453 CZ ARG A 99 106.846 -12.191 -8.575 1.00 0.00 C ATOM 1454 NH1 ARG A 99 105.952 -11.834 -7.694 1.00 0.00 N ATOM 1455 NH2 ARG A 99 106.752 -13.351 -9.169 1.00 0.00 N ATOM 0 H ARG A 99 111.708 -10.424 -4.374 1.00 0.00 H new ATOM 0 HA ARG A 99 111.818 -12.807 -6.048 1.00 0.00 H new ATOM 0 HB2 ARG A 99 109.720 -11.653 -5.556 1.00 0.00 H new ATOM 0 HB3 ARG A 99 110.407 -10.086 -5.935 1.00 0.00 H new ATOM 0 HG2 ARG A 99 110.607 -10.777 -8.354 1.00 0.00 H new ATOM 0 HG3 ARG A 99 109.873 -12.319 -7.962 1.00 0.00 H new ATOM 0 HD2 ARG A 99 107.980 -10.713 -6.842 1.00 0.00 H new ATOM 0 HD3 ARG A 99 108.593 -9.575 -8.026 1.00 0.00 H new ATOM 0 HE ARG A 99 108.133 -11.281 -9.835 1.00 0.00 H new ATOM 0 HH11 ARG A 99 106.025 -10.928 -7.232 1.00 0.00 H new ATOM 0 HH12 ARG A 99 105.180 -12.461 -7.468 1.00 0.00 H new ATOM 0 HH21 ARG A 99 107.450 -13.629 -9.859 1.00 0.00 H new ATOM 0 HH22 ARG A 99 105.980 -13.979 -8.943 1.00 0.00 H new ATOM 1469 N ALA A 100 113.594 -10.385 -7.059 1.00 0.00 N ATOM 1470 CA ALA A 100 114.457 -9.962 -8.186 1.00 0.00 C ATOM 1471 C ALA A 100 115.927 -9.904 -7.762 1.00 0.00 C ATOM 1472 O ALA A 100 116.741 -10.682 -8.221 1.00 0.00 O ATOM 1473 CB ALA A 100 113.933 -8.579 -8.556 1.00 0.00 C ATOM 0 H ALA A 100 113.756 -9.900 -6.176 1.00 0.00 H new ATOM 0 HA ALA A 100 114.421 -10.657 -9.025 1.00 0.00 H new ATOM 0 HB1 ALA A 100 114.514 -8.180 -9.388 1.00 0.00 H new ATOM 0 HB2 ALA A 100 112.885 -8.653 -8.848 1.00 0.00 H new ATOM 0 HB3 ALA A 100 114.025 -7.914 -7.698 1.00 0.00 H new ATOM 1479 N GLY A 101 116.279 -8.987 -6.900 1.00 0.00 N ATOM 1480 CA GLY A 101 117.696 -8.888 -6.466 1.00 0.00 C ATOM 1481 C GLY A 101 117.844 -7.785 -5.416 1.00 0.00 C ATOM 1482 O GLY A 101 117.783 -6.611 -5.726 1.00 0.00 O ATOM 0 H GLY A 101 115.646 -8.306 -6.481 1.00 0.00 H new ATOM 0 HA2 GLY A 101 118.026 -9.841 -6.053 1.00 0.00 H new ATOM 0 HA3 GLY A 101 118.334 -8.674 -7.324 1.00 0.00 H new ATOM 1486 N ALA A 102 118.042 -8.154 -4.178 1.00 0.00 N ATOM 1487 CA ALA A 102 118.200 -7.126 -3.107 1.00 0.00 C ATOM 1488 C ALA A 102 118.728 -7.774 -1.823 1.00 0.00 C ATOM 1489 O ALA A 102 118.077 -8.612 -1.231 1.00 0.00 O ATOM 1490 CB ALA A 102 116.795 -6.567 -2.882 1.00 0.00 C ATOM 0 H ALA A 102 118.101 -9.122 -3.862 1.00 0.00 H new ATOM 0 HA ALA A 102 118.910 -6.348 -3.387 1.00 0.00 H new ATOM 0 HB1 ALA A 102 116.828 -5.802 -2.106 1.00 0.00 H new ATOM 0 HB2 ALA A 102 116.425 -6.128 -3.809 1.00 0.00 H new ATOM 0 HB3 ALA A 102 116.129 -7.372 -2.571 1.00 0.00 H new ATOM 1496 N ARG A 103 119.898 -7.388 -1.383 1.00 0.00 N ATOM 1497 CA ARG A 103 120.454 -7.982 -0.132 1.00 0.00 C ATOM 1498 C ARG A 103 119.649 -7.500 1.075 1.00 0.00 C ATOM 1499 O ARG A 103 119.651 -6.331 1.406 1.00 0.00 O ATOM 1500 CB ARG A 103 121.895 -7.478 -0.047 1.00 0.00 C ATOM 1501 CG ARG A 103 122.601 -8.142 1.141 1.00 0.00 C ATOM 1502 CD ARG A 103 123.618 -9.166 0.630 1.00 0.00 C ATOM 1503 NE ARG A 103 124.947 -8.551 0.892 1.00 0.00 N ATOM 1504 CZ ARG A 103 125.717 -9.042 1.823 1.00 0.00 C ATOM 1505 NH1 ARG A 103 125.423 -8.853 3.079 1.00 0.00 N ATOM 1506 NH2 ARG A 103 126.778 -9.728 1.498 1.00 0.00 N ATOM 0 H ARG A 103 120.490 -6.690 -1.834 1.00 0.00 H new ATOM 0 HA ARG A 103 120.409 -9.071 -0.139 1.00 0.00 H new ATOM 0 HB2 ARG A 103 122.426 -7.705 -0.972 1.00 0.00 H new ATOM 0 HB3 ARG A 103 121.906 -6.394 0.069 1.00 0.00 H new ATOM 0 HG2 ARG A 103 123.103 -7.387 1.746 1.00 0.00 H new ATOM 0 HG3 ARG A 103 121.869 -8.631 1.784 1.00 0.00 H new ATOM 0 HD2 ARG A 103 123.514 -10.119 1.150 1.00 0.00 H new ATOM 0 HD3 ARG A 103 123.478 -9.366 -0.432 1.00 0.00 H new ATOM 0 HE ARG A 103 125.255 -7.747 0.345 1.00 0.00 H new ATOM 0 HH11 ARG A 103 124.591 -8.321 3.334 1.00 0.00 H new ATOM 0 HH12 ARG A 103 126.025 -9.237 3.807 1.00 0.00 H new ATOM 0 HH21 ARG A 103 127.006 -9.880 0.515 1.00 0.00 H new ATOM 0 HH22 ARG A 103 127.380 -10.112 2.226 1.00 0.00 H new ATOM 1520 N LEU A 104 118.955 -8.391 1.731 1.00 0.00 N ATOM 1521 CA LEU A 104 118.143 -7.981 2.913 1.00 0.00 C ATOM 1522 C LEU A 104 118.814 -8.455 4.207 1.00 0.00 C ATOM 1523 O LEU A 104 118.162 -8.655 5.213 1.00 0.00 O ATOM 1524 CB LEU A 104 116.784 -8.668 2.729 1.00 0.00 C ATOM 1525 CG LEU A 104 116.245 -8.401 1.313 1.00 0.00 C ATOM 1526 CD1 LEU A 104 116.161 -9.718 0.536 1.00 0.00 C ATOM 1527 CD2 LEU A 104 114.848 -7.780 1.406 1.00 0.00 C ATOM 0 H LEU A 104 118.915 -9.384 1.500 1.00 0.00 H new ATOM 0 HA LEU A 104 118.042 -6.898 2.985 1.00 0.00 H new ATOM 0 HB2 LEU A 104 116.885 -9.741 2.892 1.00 0.00 H new ATOM 0 HB3 LEU A 104 116.077 -8.298 3.472 1.00 0.00 H new ATOM 0 HG LEU A 104 116.917 -7.716 0.796 1.00 0.00 H new ATOM 0 HD11 LEU A 104 115.779 -9.525 -0.466 1.00 0.00 H new ATOM 0 HD12 LEU A 104 117.153 -10.163 0.467 1.00 0.00 H new ATOM 0 HD13 LEU A 104 115.491 -10.404 1.054 1.00 0.00 H new ATOM 0 HD21 LEU A 104 114.466 -7.591 0.403 1.00 0.00 H new ATOM 0 HD22 LEU A 104 114.179 -8.466 1.926 1.00 0.00 H new ATOM 0 HD23 LEU A 104 114.903 -6.841 1.956 1.00 0.00 H new ATOM 1539 N ASP A 105 120.109 -8.636 4.188 1.00 0.00 N ATOM 1540 CA ASP A 105 120.820 -9.099 5.418 1.00 0.00 C ATOM 1541 C ASP A 105 122.008 -8.187 5.728 1.00 0.00 C ATOM 1542 O ASP A 105 123.102 -8.646 5.993 1.00 0.00 O ATOM 1543 CB ASP A 105 121.299 -10.518 5.096 1.00 0.00 C ATOM 1544 CG ASP A 105 122.047 -10.527 3.760 1.00 0.00 C ATOM 1545 OD1 ASP A 105 123.181 -10.077 3.735 1.00 0.00 O ATOM 1546 OD2 ASP A 105 121.474 -10.987 2.787 1.00 0.00 O ATOM 0 H ASP A 105 120.705 -8.483 3.375 1.00 0.00 H new ATOM 0 HA ASP A 105 120.172 -9.078 6.295 1.00 0.00 H new ATOM 0 HB2 ASP A 105 121.952 -10.879 5.890 1.00 0.00 H new ATOM 0 HB3 ASP A 105 120.447 -11.197 5.050 1.00 0.00 H new ATOM 1551 N VAL A 106 121.800 -6.897 5.704 1.00 0.00 N ATOM 1552 CA VAL A 106 122.912 -5.955 6.003 1.00 0.00 C ATOM 1553 C VAL A 106 122.643 -5.231 7.329 1.00 0.00 C ATOM 1554 O VAL A 106 121.750 -5.589 8.072 1.00 0.00 O ATOM 1555 CB VAL A 106 122.925 -4.978 4.815 1.00 0.00 C ATOM 1556 CG1 VAL A 106 121.907 -3.849 5.023 1.00 0.00 C ATOM 1557 CG2 VAL A 106 124.327 -4.384 4.659 1.00 0.00 C ATOM 0 H VAL A 106 120.905 -6.457 5.490 1.00 0.00 H new ATOM 0 HA VAL A 106 123.874 -6.454 6.118 1.00 0.00 H new ATOM 0 HB VAL A 106 122.652 -5.525 3.913 1.00 0.00 H new ATOM 0 HG11 VAL A 106 121.935 -3.172 4.170 1.00 0.00 H new ATOM 0 HG12 VAL A 106 120.907 -4.273 5.116 1.00 0.00 H new ATOM 0 HG13 VAL A 106 122.154 -3.299 5.931 1.00 0.00 H new ATOM 0 HG21 VAL A 106 124.337 -3.692 3.817 1.00 0.00 H new ATOM 0 HG22 VAL A 106 124.600 -3.852 5.570 1.00 0.00 H new ATOM 0 HG23 VAL A 106 125.044 -5.185 4.478 1.00 0.00 H new ATOM 1567 N ARG A 107 123.409 -4.219 7.624 1.00 0.00 N ATOM 1568 CA ARG A 107 123.203 -3.464 8.896 1.00 0.00 C ATOM 1569 C ARG A 107 123.399 -1.965 8.656 1.00 0.00 C ATOM 1570 O ARG A 107 124.204 -1.558 7.840 1.00 0.00 O ATOM 1571 CB ARG A 107 124.268 -4.000 9.858 1.00 0.00 C ATOM 1572 CG ARG A 107 125.655 -3.884 9.214 1.00 0.00 C ATOM 1573 CD ARG A 107 126.695 -4.573 10.102 1.00 0.00 C ATOM 1574 NE ARG A 107 127.987 -3.910 9.767 1.00 0.00 N ATOM 1575 CZ ARG A 107 129.118 -4.469 10.102 1.00 0.00 C ATOM 1576 NH1 ARG A 107 129.591 -5.463 9.398 1.00 0.00 N ATOM 1577 NH2 ARG A 107 129.778 -4.036 11.140 1.00 0.00 N ATOM 0 H ARG A 107 124.172 -3.879 7.039 1.00 0.00 H new ATOM 0 HA ARG A 107 122.197 -3.594 9.294 1.00 0.00 H new ATOM 0 HB2 ARG A 107 124.243 -3.439 10.792 1.00 0.00 H new ATOM 0 HB3 ARG A 107 124.057 -5.041 10.105 1.00 0.00 H new ATOM 0 HG2 ARG A 107 125.647 -4.342 8.225 1.00 0.00 H new ATOM 0 HG3 ARG A 107 125.917 -2.835 9.078 1.00 0.00 H new ATOM 0 HD2 ARG A 107 126.453 -4.455 11.158 1.00 0.00 H new ATOM 0 HD3 ARG A 107 126.737 -5.644 9.903 1.00 0.00 H new ATOM 0 HE ARG A 107 127.987 -3.017 9.274 1.00 0.00 H new ATOM 0 HH11 ARG A 107 129.076 -5.803 8.586 1.00 0.00 H new ATOM 0 HH12 ARG A 107 130.475 -5.899 9.661 1.00 0.00 H new ATOM 0 HH21 ARG A 107 129.411 -3.260 11.691 1.00 0.00 H new ATOM 0 HH22 ARG A 107 130.662 -4.473 11.401 1.00 0.00 H new ATOM 1591 N ASP A 108 122.670 -1.140 9.361 1.00 0.00 N ATOM 1592 CA ASP A 108 122.818 0.333 9.171 1.00 0.00 C ATOM 1593 C ASP A 108 124.148 0.809 9.761 1.00 0.00 C ATOM 1594 O ASP A 108 124.181 1.547 10.724 1.00 0.00 O ATOM 1595 CB ASP A 108 121.637 0.958 9.920 1.00 0.00 C ATOM 1596 CG ASP A 108 120.603 1.466 8.915 1.00 0.00 C ATOM 1597 OD1 ASP A 108 119.998 0.642 8.251 1.00 0.00 O ATOM 1598 OD2 ASP A 108 120.434 2.670 8.826 1.00 0.00 O ATOM 0 H ASP A 108 121.981 -1.421 10.058 1.00 0.00 H new ATOM 0 HA ASP A 108 122.819 0.615 8.118 1.00 0.00 H new ATOM 0 HB2 ASP A 108 121.183 0.222 10.583 1.00 0.00 H new ATOM 0 HB3 ASP A 108 121.984 1.780 10.546 1.00 0.00 H new ATOM 1603 N ALA A 109 125.244 0.388 9.181 1.00 0.00 N ATOM 1604 CA ALA A 109 126.589 0.802 9.691 1.00 0.00 C ATOM 1605 C ALA A 109 126.703 0.534 11.196 1.00 0.00 C ATOM 1606 O ALA A 109 127.200 -0.492 11.615 1.00 0.00 O ATOM 1607 CB ALA A 109 126.691 2.299 9.395 1.00 0.00 C ATOM 0 H ALA A 109 125.266 -0.230 8.370 1.00 0.00 H new ATOM 0 HA ALA A 109 127.394 0.242 9.215 1.00 0.00 H new ATOM 0 HB1 ALA A 109 127.654 2.674 9.742 1.00 0.00 H new ATOM 0 HB2 ALA A 109 126.603 2.464 8.321 1.00 0.00 H new ATOM 0 HB3 ALA A 109 125.889 2.827 9.910 1.00 0.00 H new ATOM 1613 N TRP A 110 126.244 1.447 12.011 1.00 0.00 N ATOM 1614 CA TRP A 110 126.326 1.242 13.483 1.00 0.00 C ATOM 1615 C TRP A 110 124.928 1.330 14.113 1.00 0.00 C ATOM 1616 O TRP A 110 124.791 1.470 15.313 1.00 0.00 O ATOM 1617 CB TRP A 110 127.228 2.376 13.982 1.00 0.00 C ATOM 1618 CG TRP A 110 126.508 3.682 13.859 1.00 0.00 C ATOM 1619 CD1 TRP A 110 125.634 4.168 14.766 1.00 0.00 C ATOM 1620 CD2 TRP A 110 126.571 4.665 12.787 1.00 0.00 C ATOM 1621 NE1 TRP A 110 125.159 5.388 14.324 1.00 0.00 N ATOM 1622 CE2 TRP A 110 125.705 5.737 13.108 1.00 0.00 C ATOM 1623 CE3 TRP A 110 127.287 4.731 11.578 1.00 0.00 C ATOM 1624 CZ2 TRP A 110 125.555 6.836 12.262 1.00 0.00 C ATOM 1625 CZ3 TRP A 110 127.138 5.836 10.722 1.00 0.00 C ATOM 1626 CH2 TRP A 110 126.272 6.885 11.064 1.00 0.00 C ATOM 0 H TRP A 110 125.816 2.326 11.719 1.00 0.00 H new ATOM 0 HA TRP A 110 126.721 0.261 13.748 1.00 0.00 H new ATOM 0 HB2 TRP A 110 127.509 2.201 15.020 1.00 0.00 H new ATOM 0 HB3 TRP A 110 128.151 2.402 13.402 1.00 0.00 H new ATOM 0 HD1 TRP A 110 125.352 3.682 15.688 1.00 0.00 H new ATOM 0 HE1 TRP A 110 124.487 5.960 14.835 1.00 0.00 H new ATOM 0 HE3 TRP A 110 127.955 3.928 11.306 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 124.890 7.643 12.531 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 127.693 5.877 9.796 1.00 0.00 H new ATOM 0 HH2 TRP A 110 126.160 7.730 10.401 1.00 0.00 H new ATOM 1637 N GLY A 111 123.892 1.255 13.316 1.00 0.00 N ATOM 1638 CA GLY A 111 122.518 1.340 13.867 1.00 0.00 C ATOM 1639 C GLY A 111 122.020 -0.058 14.222 1.00 0.00 C ATOM 1640 O GLY A 111 122.056 -0.470 15.364 1.00 0.00 O ATOM 0 H GLY A 111 123.946 1.138 12.304 1.00 0.00 H new ATOM 0 HA2 GLY A 111 122.509 1.976 14.752 1.00 0.00 H new ATOM 0 HA3 GLY A 111 121.851 1.800 13.138 1.00 0.00 H new ATOM 1644 N ARG A 112 121.551 -0.792 13.247 1.00 0.00 N ATOM 1645 CA ARG A 112 121.043 -2.172 13.515 1.00 0.00 C ATOM 1646 C ARG A 112 120.626 -2.847 12.204 1.00 0.00 C ATOM 1647 O ARG A 112 120.974 -2.403 11.127 1.00 0.00 O ATOM 1648 CB ARG A 112 119.825 -1.989 14.429 1.00 0.00 C ATOM 1649 CG ARG A 112 119.948 -2.914 15.643 1.00 0.00 C ATOM 1650 CD ARG A 112 119.464 -2.184 16.899 1.00 0.00 C ATOM 1651 NE ARG A 112 118.383 -3.048 17.453 1.00 0.00 N ATOM 1652 CZ ARG A 112 118.615 -3.814 18.484 1.00 0.00 C ATOM 1653 NH1 ARG A 112 119.418 -4.838 18.372 1.00 0.00 N ATOM 1654 NH2 ARG A 112 118.039 -3.560 19.628 1.00 0.00 N ATOM 0 H ARG A 112 121.497 -0.495 12.273 1.00 0.00 H new ATOM 0 HA ARG A 112 121.804 -2.803 13.975 1.00 0.00 H new ATOM 0 HB2 ARG A 112 119.756 -0.951 14.756 1.00 0.00 H new ATOM 0 HB3 ARG A 112 118.910 -2.212 13.881 1.00 0.00 H new ATOM 0 HG2 ARG A 112 119.358 -3.817 15.486 1.00 0.00 H new ATOM 0 HG3 ARG A 112 120.984 -3.228 15.770 1.00 0.00 H new ATOM 0 HD2 ARG A 112 120.274 -2.055 17.617 1.00 0.00 H new ATOM 0 HD3 ARG A 112 119.090 -1.189 16.658 1.00 0.00 H new ATOM 0 HE ARG A 112 117.457 -3.041 17.024 1.00 0.00 H new ATOM 0 HH11 ARG A 112 119.865 -5.040 17.478 1.00 0.00 H new ATOM 0 HH12 ARG A 112 119.598 -5.435 19.179 1.00 0.00 H new ATOM 0 HH21 ARG A 112 117.408 -2.763 19.716 1.00 0.00 H new ATOM 0 HH22 ARG A 112 118.220 -4.158 20.434 1.00 0.00 H new ATOM 1668 N LEU A 113 119.881 -3.917 12.293 1.00 0.00 N ATOM 1669 CA LEU A 113 119.434 -4.628 11.058 1.00 0.00 C ATOM 1670 C LEU A 113 118.029 -4.162 10.658 1.00 0.00 C ATOM 1671 O LEU A 113 117.322 -3.583 11.457 1.00 0.00 O ATOM 1672 CB LEU A 113 119.407 -6.110 11.442 1.00 0.00 C ATOM 1673 CG LEU A 113 120.806 -6.563 11.849 1.00 0.00 C ATOM 1674 CD1 LEU A 113 120.713 -7.897 12.592 1.00 0.00 C ATOM 1675 CD2 LEU A 113 121.675 -6.734 10.599 1.00 0.00 C ATOM 0 H LEU A 113 119.562 -4.330 13.169 1.00 0.00 H new ATOM 0 HA LEU A 113 120.092 -4.433 10.211 1.00 0.00 H new ATOM 0 HB2 LEU A 113 118.709 -6.270 12.264 1.00 0.00 H new ATOM 0 HB3 LEU A 113 119.051 -6.707 10.602 1.00 0.00 H new ATOM 0 HG LEU A 113 121.254 -5.813 12.501 1.00 0.00 H new ATOM 0 HD11 LEU A 113 121.712 -8.222 12.883 1.00 0.00 H new ATOM 0 HD12 LEU A 113 120.097 -7.775 13.483 1.00 0.00 H new ATOM 0 HD13 LEU A 113 120.264 -8.646 11.940 1.00 0.00 H new ATOM 0 HD21 LEU A 113 122.674 -7.058 10.892 1.00 0.00 H new ATOM 0 HD22 LEU A 113 121.228 -7.483 9.945 1.00 0.00 H new ATOM 0 HD23 LEU A 113 121.742 -5.783 10.070 1.00 0.00 H new ATOM 1687 N PRO A 114 117.665 -4.446 9.433 1.00 0.00 N ATOM 1688 CA PRO A 114 116.320 -4.065 8.927 1.00 0.00 C ATOM 1689 C PRO A 114 115.229 -4.834 9.680 1.00 0.00 C ATOM 1690 O PRO A 114 114.078 -4.444 9.689 1.00 0.00 O ATOM 1691 CB PRO A 114 116.365 -4.466 7.453 1.00 0.00 C ATOM 1692 CG PRO A 114 117.415 -5.527 7.387 1.00 0.00 C ATOM 1693 CD PRO A 114 118.450 -5.145 8.408 1.00 0.00 C ATOM 0 HA PRO A 114 116.090 -3.008 9.065 1.00 0.00 H new ATOM 0 HB2 PRO A 114 115.399 -4.841 7.114 1.00 0.00 H new ATOM 0 HB3 PRO A 114 116.618 -3.617 6.818 1.00 0.00 H new ATOM 0 HG2 PRO A 114 116.994 -6.508 7.606 1.00 0.00 H new ATOM 0 HG3 PRO A 114 117.852 -5.583 6.390 1.00 0.00 H new ATOM 0 HD2 PRO A 114 118.956 -6.020 8.815 1.00 0.00 H new ATOM 0 HD3 PRO A 114 119.219 -4.502 7.981 1.00 0.00 H new ATOM 1701 N VAL A 115 115.585 -5.919 10.316 1.00 0.00 N ATOM 1702 CA VAL A 115 114.570 -6.707 11.075 1.00 0.00 C ATOM 1703 C VAL A 115 114.293 -6.046 12.428 1.00 0.00 C ATOM 1704 O VAL A 115 113.176 -6.037 12.908 1.00 0.00 O ATOM 1705 CB VAL A 115 115.191 -8.096 11.261 1.00 0.00 C ATOM 1706 CG1 VAL A 115 116.461 -7.992 12.109 1.00 0.00 C ATOM 1707 CG2 VAL A 115 114.187 -9.010 11.968 1.00 0.00 C ATOM 0 H VAL A 115 116.534 -6.293 10.343 1.00 0.00 H new ATOM 0 HA VAL A 115 113.616 -6.764 10.551 1.00 0.00 H new ATOM 0 HB VAL A 115 115.444 -8.508 10.284 1.00 0.00 H new ATOM 0 HG11 VAL A 115 116.896 -8.983 12.236 1.00 0.00 H new ATOM 0 HG12 VAL A 115 117.180 -7.342 11.610 1.00 0.00 H new ATOM 0 HG13 VAL A 115 116.213 -7.576 13.086 1.00 0.00 H new ATOM 0 HG21 VAL A 115 114.626 -9.999 12.101 1.00 0.00 H new ATOM 0 HG22 VAL A 115 113.936 -8.590 12.942 1.00 0.00 H new ATOM 0 HG23 VAL A 115 113.283 -9.093 11.365 1.00 0.00 H new ATOM 1717 N ASP A 116 115.303 -5.489 13.045 1.00 0.00 N ATOM 1718 CA ASP A 116 115.097 -4.826 14.369 1.00 0.00 C ATOM 1719 C ASP A 116 114.221 -3.579 14.210 1.00 0.00 C ATOM 1720 O ASP A 116 113.371 -3.296 15.032 1.00 0.00 O ATOM 1721 CB ASP A 116 116.498 -4.440 14.843 1.00 0.00 C ATOM 1722 CG ASP A 116 117.192 -5.663 15.443 1.00 0.00 C ATOM 1723 OD1 ASP A 116 116.989 -6.749 14.925 1.00 0.00 O ATOM 1724 OD2 ASP A 116 117.914 -5.495 16.410 1.00 0.00 O ATOM 0 H ASP A 116 116.259 -5.464 12.691 1.00 0.00 H new ATOM 0 HA ASP A 116 114.591 -5.479 15.081 1.00 0.00 H new ATOM 0 HB2 ASP A 116 117.081 -4.052 14.008 1.00 0.00 H new ATOM 0 HB3 ASP A 116 116.435 -3.644 15.585 1.00 0.00 H new ATOM 1729 N LEU A 117 114.425 -2.832 13.158 1.00 0.00 N ATOM 1730 CA LEU A 117 113.608 -1.601 12.941 1.00 0.00 C ATOM 1731 C LEU A 117 112.160 -1.985 12.614 1.00 0.00 C ATOM 1732 O LEU A 117 111.226 -1.312 13.006 1.00 0.00 O ATOM 1733 CB LEU A 117 114.278 -0.893 11.754 1.00 0.00 C ATOM 1734 CG LEU A 117 113.336 0.167 11.171 1.00 0.00 C ATOM 1735 CD1 LEU A 117 114.140 1.413 10.787 1.00 0.00 C ATOM 1736 CD2 LEU A 117 112.640 -0.397 9.926 1.00 0.00 C ATOM 0 H LEU A 117 115.123 -3.021 12.438 1.00 0.00 H new ATOM 0 HA LEU A 117 113.567 -0.959 13.821 1.00 0.00 H new ATOM 0 HB2 LEU A 117 115.208 -0.425 12.078 1.00 0.00 H new ATOM 0 HB3 LEU A 117 114.538 -1.621 10.986 1.00 0.00 H new ATOM 0 HG LEU A 117 112.587 0.435 11.916 1.00 0.00 H new ATOM 0 HD11 LEU A 117 113.469 2.166 10.373 1.00 0.00 H new ATOM 0 HD12 LEU A 117 114.634 1.815 11.672 1.00 0.00 H new ATOM 0 HD13 LEU A 117 114.890 1.147 10.043 1.00 0.00 H new ATOM 0 HD21 LEU A 117 111.970 0.356 9.511 1.00 0.00 H new ATOM 0 HD22 LEU A 117 113.389 -0.666 9.181 1.00 0.00 H new ATOM 0 HD23 LEU A 117 112.066 -1.282 10.200 1.00 0.00 H new ATOM 1748 N ALA A 118 111.970 -3.061 11.899 1.00 0.00 N ATOM 1749 CA ALA A 118 110.583 -3.493 11.543 1.00 0.00 C ATOM 1750 C ALA A 118 109.735 -3.671 12.806 1.00 0.00 C ATOM 1751 O ALA A 118 108.684 -3.077 12.947 1.00 0.00 O ATOM 1752 CB ALA A 118 110.755 -4.831 10.823 1.00 0.00 C ATOM 0 H ALA A 118 112.714 -3.662 11.545 1.00 0.00 H new ATOM 0 HA ALA A 118 110.073 -2.756 10.922 1.00 0.00 H new ATOM 0 HB1 ALA A 118 109.778 -5.214 10.529 1.00 0.00 H new ATOM 0 HB2 ALA A 118 111.372 -4.690 9.935 1.00 0.00 H new ATOM 0 HB3 ALA A 118 111.238 -5.544 11.491 1.00 0.00 H new ATOM 1758 N GLU A 119 110.183 -4.489 13.721 1.00 0.00 N ATOM 1759 CA GLU A 119 109.403 -4.712 14.976 1.00 0.00 C ATOM 1760 C GLU A 119 109.238 -3.399 15.744 1.00 0.00 C ATOM 1761 O GLU A 119 108.178 -3.105 16.260 1.00 0.00 O ATOM 1762 CB GLU A 119 110.228 -5.704 15.794 1.00 0.00 C ATOM 1763 CG GLU A 119 109.833 -7.131 15.413 1.00 0.00 C ATOM 1764 CD GLU A 119 110.914 -8.104 15.883 1.00 0.00 C ATOM 1765 OE1 GLU A 119 111.275 -8.041 17.046 1.00 0.00 O ATOM 1766 OE2 GLU A 119 111.363 -8.898 15.072 1.00 0.00 O ATOM 0 H GLU A 119 111.056 -5.013 13.655 1.00 0.00 H new ATOM 0 HA GLU A 119 108.401 -5.088 14.769 1.00 0.00 H new ATOM 0 HB2 GLU A 119 111.291 -5.548 15.610 1.00 0.00 H new ATOM 0 HB3 GLU A 119 110.061 -5.541 16.859 1.00 0.00 H new ATOM 0 HG2 GLU A 119 108.876 -7.388 15.867 1.00 0.00 H new ATOM 0 HG3 GLU A 119 109.705 -7.208 14.333 1.00 0.00 H new ATOM 1773 N GLU A 120 110.276 -2.606 15.822 1.00 0.00 N ATOM 1774 CA GLU A 120 110.172 -1.309 16.558 1.00 0.00 C ATOM 1775 C GLU A 120 109.015 -0.481 15.997 1.00 0.00 C ATOM 1776 O GLU A 120 108.302 0.183 16.724 1.00 0.00 O ATOM 1777 CB GLU A 120 111.506 -0.600 16.313 1.00 0.00 C ATOM 1778 CG GLU A 120 112.613 -1.309 17.096 1.00 0.00 C ATOM 1779 CD GLU A 120 112.578 -0.852 18.555 1.00 0.00 C ATOM 1780 OE1 GLU A 120 111.776 -1.385 19.304 1.00 0.00 O ATOM 1781 OE2 GLU A 120 113.355 0.024 18.900 1.00 0.00 O ATOM 0 H GLU A 120 111.189 -2.799 15.409 1.00 0.00 H new ATOM 0 HA GLU A 120 109.979 -1.452 17.621 1.00 0.00 H new ATOM 0 HB2 GLU A 120 111.741 -0.602 15.249 1.00 0.00 H new ATOM 0 HB3 GLU A 120 111.438 0.443 16.623 1.00 0.00 H new ATOM 0 HG2 GLU A 120 112.479 -2.389 17.039 1.00 0.00 H new ATOM 0 HG3 GLU A 120 113.585 -1.085 16.657 1.00 0.00 H new ATOM 1788 N LEU A 121 108.821 -0.520 14.705 1.00 0.00 N ATOM 1789 CA LEU A 121 107.710 0.258 14.091 1.00 0.00 C ATOM 1790 C LEU A 121 106.410 -0.555 14.116 1.00 0.00 C ATOM 1791 O LEU A 121 105.365 -0.080 13.713 1.00 0.00 O ATOM 1792 CB LEU A 121 108.165 0.512 12.656 1.00 0.00 C ATOM 1793 CG LEU A 121 109.193 1.642 12.640 1.00 0.00 C ATOM 1794 CD1 LEU A 121 110.129 1.462 11.445 1.00 0.00 C ATOM 1795 CD2 LEU A 121 108.474 2.988 12.526 1.00 0.00 C ATOM 0 H LEU A 121 109.386 -1.059 14.049 1.00 0.00 H new ATOM 0 HA LEU A 121 107.504 1.185 14.626 1.00 0.00 H new ATOM 0 HB2 LEU A 121 108.599 -0.395 12.235 1.00 0.00 H new ATOM 0 HB3 LEU A 121 107.310 0.775 12.033 1.00 0.00 H new ATOM 0 HG LEU A 121 109.772 1.618 13.563 1.00 0.00 H new ATOM 0 HD11 LEU A 121 110.863 2.268 11.433 1.00 0.00 H new ATOM 0 HD12 LEU A 121 110.643 0.504 11.527 1.00 0.00 H new ATOM 0 HD13 LEU A 121 109.549 1.485 10.522 1.00 0.00 H new ATOM 0 HD21 LEU A 121 109.209 3.793 12.515 1.00 0.00 H new ATOM 0 HD22 LEU A 121 107.894 3.013 11.604 1.00 0.00 H new ATOM 0 HD23 LEU A 121 107.807 3.117 13.378 1.00 0.00 H new ATOM 1807 N GLY A 122 106.460 -1.769 14.600 1.00 0.00 N ATOM 1808 CA GLY A 122 105.227 -2.604 14.671 1.00 0.00 C ATOM 1809 C GLY A 122 105.017 -3.365 13.360 1.00 0.00 C ATOM 1810 O GLY A 122 103.906 -3.726 13.021 1.00 0.00 O ATOM 0 H GLY A 122 107.306 -2.219 14.950 1.00 0.00 H new ATOM 0 HA2 GLY A 122 105.306 -3.309 15.499 1.00 0.00 H new ATOM 0 HA3 GLY A 122 104.363 -1.971 14.873 1.00 0.00 H new ATOM 1814 N HIS A 123 106.061 -3.623 12.619 1.00 0.00 N ATOM 1815 CA HIS A 123 105.895 -4.367 11.345 1.00 0.00 C ATOM 1816 C HIS A 123 106.337 -5.817 11.538 1.00 0.00 C ATOM 1817 O HIS A 123 107.057 -6.373 10.732 1.00 0.00 O ATOM 1818 CB HIS A 123 106.786 -3.626 10.348 1.00 0.00 C ATOM 1819 CG HIS A 123 106.310 -2.203 10.245 1.00 0.00 C ATOM 1820 ND1 HIS A 123 104.986 -1.885 9.988 1.00 0.00 N ATOM 1821 CD2 HIS A 123 106.961 -1.004 10.382 1.00 0.00 C ATOM 1822 CE1 HIS A 123 104.884 -0.544 9.979 1.00 0.00 C ATOM 1823 NE2 HIS A 123 106.060 0.043 10.214 1.00 0.00 N ATOM 0 H HIS A 123 107.018 -3.350 12.843 1.00 0.00 H new ATOM 0 HA HIS A 123 104.863 -4.406 10.997 1.00 0.00 H new ATOM 0 HB2 HIS A 123 107.825 -3.655 10.675 1.00 0.00 H new ATOM 0 HB3 HIS A 123 106.746 -4.110 9.372 1.00 0.00 H new ATOM 0 HD2 HIS A 123 108.015 -0.889 10.589 1.00 0.00 H new ATOM 0 HE1 HIS A 123 103.963 -0.007 9.803 1.00 0.00 H new ATOM 0 HE2 HIS A 123 106.256 1.043 10.260 1.00 0.00 H new ATOM 1831 N ARG A 124 105.899 -6.428 12.614 1.00 0.00 N ATOM 1832 CA ARG A 124 106.271 -7.849 12.897 1.00 0.00 C ATOM 1833 C ARG A 124 106.113 -8.701 11.637 1.00 0.00 C ATOM 1834 O ARG A 124 106.906 -9.582 11.367 1.00 0.00 O ATOM 1835 CB ARG A 124 105.282 -8.311 13.965 1.00 0.00 C ATOM 1836 CG ARG A 124 105.614 -7.647 15.300 1.00 0.00 C ATOM 1837 CD ARG A 124 104.550 -8.029 16.330 1.00 0.00 C ATOM 1838 NE ARG A 124 103.380 -7.165 16.005 1.00 0.00 N ATOM 1839 CZ ARG A 124 103.178 -6.062 16.671 1.00 0.00 C ATOM 1840 NH1 ARG A 124 103.155 -6.081 17.976 1.00 0.00 N ATOM 1841 NH2 ARG A 124 102.995 -4.937 16.032 1.00 0.00 N ATOM 0 H ARG A 124 105.294 -5.998 13.314 1.00 0.00 H new ATOM 0 HA ARG A 124 107.307 -7.943 13.222 1.00 0.00 H new ATOM 0 HB2 ARG A 124 104.265 -8.058 13.666 1.00 0.00 H new ATOM 0 HB3 ARG A 124 105.324 -9.395 14.067 1.00 0.00 H new ATOM 0 HG2 ARG A 124 106.599 -7.964 15.642 1.00 0.00 H new ATOM 0 HG3 ARG A 124 105.651 -6.564 15.182 1.00 0.00 H new ATOM 0 HD2 ARG A 124 104.293 -9.086 16.260 1.00 0.00 H new ATOM 0 HD3 ARG A 124 104.902 -7.853 17.347 1.00 0.00 H new ATOM 0 HE ARG A 124 102.737 -7.436 15.261 1.00 0.00 H new ATOM 0 HH11 ARG A 124 103.295 -6.959 18.476 1.00 0.00 H new ATOM 0 HH12 ARG A 124 102.997 -5.218 18.496 1.00 0.00 H new ATOM 0 HH21 ARG A 124 103.010 -4.921 15.012 1.00 0.00 H new ATOM 0 HH22 ARG A 124 102.837 -4.074 16.553 1.00 0.00 H new ATOM 1855 N ASP A 125 105.097 -8.436 10.862 1.00 0.00 N ATOM 1856 CA ASP A 125 104.888 -9.221 9.613 1.00 0.00 C ATOM 1857 C ASP A 125 106.125 -9.090 8.724 1.00 0.00 C ATOM 1858 O ASP A 125 106.598 -10.050 8.152 1.00 0.00 O ATOM 1859 CB ASP A 125 103.668 -8.595 8.929 1.00 0.00 C ATOM 1860 CG ASP A 125 102.494 -8.527 9.911 1.00 0.00 C ATOM 1861 OD1 ASP A 125 102.615 -7.825 10.903 1.00 0.00 O ATOM 1862 OD2 ASP A 125 101.493 -9.175 9.654 1.00 0.00 O ATOM 0 H ASP A 125 104.403 -7.710 11.040 1.00 0.00 H new ATOM 0 HA ASP A 125 104.729 -10.281 9.810 1.00 0.00 H new ATOM 0 HB2 ASP A 125 103.914 -7.594 8.573 1.00 0.00 H new ATOM 0 HB3 ASP A 125 103.388 -9.184 8.055 1.00 0.00 H new ATOM 1867 N VAL A 126 106.654 -7.900 8.615 1.00 0.00 N ATOM 1868 CA VAL A 126 107.865 -7.693 7.768 1.00 0.00 C ATOM 1869 C VAL A 126 109.110 -8.217 8.489 1.00 0.00 C ATOM 1870 O VAL A 126 109.995 -8.787 7.881 1.00 0.00 O ATOM 1871 CB VAL A 126 107.957 -6.178 7.537 1.00 0.00 C ATOM 1872 CG1 VAL A 126 109.004 -5.906 6.458 1.00 0.00 C ATOM 1873 CG2 VAL A 126 106.595 -5.649 7.067 1.00 0.00 C ATOM 0 H VAL A 126 106.300 -7.062 9.076 1.00 0.00 H new ATOM 0 HA VAL A 126 107.800 -8.232 6.823 1.00 0.00 H new ATOM 0 HB VAL A 126 108.239 -5.679 8.464 1.00 0.00 H new ATOM 0 HG11 VAL A 126 109.078 -4.832 6.285 1.00 0.00 H new ATOM 0 HG12 VAL A 126 109.971 -6.289 6.785 1.00 0.00 H new ATOM 0 HG13 VAL A 126 108.711 -6.403 5.533 1.00 0.00 H new ATOM 0 HG21 VAL A 126 106.659 -4.573 6.903 1.00 0.00 H new ATOM 0 HG22 VAL A 126 106.315 -6.142 6.136 1.00 0.00 H new ATOM 0 HG23 VAL A 126 105.842 -5.855 7.828 1.00 0.00 H new ATOM 1883 N ALA A 127 109.183 -8.037 9.782 1.00 0.00 N ATOM 1884 CA ALA A 127 110.371 -8.532 10.542 1.00 0.00 C ATOM 1885 C ALA A 127 110.527 -10.044 10.352 1.00 0.00 C ATOM 1886 O ALA A 127 111.621 -10.547 10.169 1.00 0.00 O ATOM 1887 CB ALA A 127 110.072 -8.202 12.004 1.00 0.00 C ATOM 0 H ALA A 127 108.473 -7.569 10.345 1.00 0.00 H new ATOM 0 HA ALA A 127 111.300 -8.072 10.203 1.00 0.00 H new ATOM 0 HB1 ALA A 127 110.900 -8.535 12.629 1.00 0.00 H new ATOM 0 HB2 ALA A 127 109.944 -7.125 12.115 1.00 0.00 H new ATOM 0 HB3 ALA A 127 109.158 -8.710 12.312 1.00 0.00 H new ATOM 1893 N ARG A 128 109.441 -10.774 10.386 1.00 0.00 N ATOM 1894 CA ARG A 128 109.529 -12.255 10.199 1.00 0.00 C ATOM 1895 C ARG A 128 110.216 -12.565 8.867 1.00 0.00 C ATOM 1896 O ARG A 128 111.271 -13.169 8.826 1.00 0.00 O ATOM 1897 CB ARG A 128 108.079 -12.744 10.187 1.00 0.00 C ATOM 1898 CG ARG A 128 108.049 -14.263 9.994 1.00 0.00 C ATOM 1899 CD ARG A 128 106.729 -14.666 9.335 1.00 0.00 C ATOM 1900 NE ARG A 128 106.899 -16.102 8.982 1.00 0.00 N ATOM 1901 CZ ARG A 128 106.845 -16.477 7.733 1.00 0.00 C ATOM 1902 NH1 ARG A 128 107.539 -15.839 6.831 1.00 0.00 N ATOM 1903 NH2 ARG A 128 106.096 -17.487 7.385 1.00 0.00 N ATOM 0 H ARG A 128 108.500 -10.410 10.535 1.00 0.00 H new ATOM 0 HA ARG A 128 110.109 -12.742 10.983 1.00 0.00 H new ATOM 0 HB2 ARG A 128 107.587 -12.477 11.122 1.00 0.00 H new ATOM 0 HB3 ARG A 128 107.527 -12.255 9.385 1.00 0.00 H new ATOM 0 HG2 ARG A 128 108.889 -14.578 9.374 1.00 0.00 H new ATOM 0 HG3 ARG A 128 108.156 -14.765 10.956 1.00 0.00 H new ATOM 0 HD2 ARG A 128 105.889 -14.523 10.014 1.00 0.00 H new ATOM 0 HD3 ARG A 128 106.529 -14.063 8.450 1.00 0.00 H new ATOM 0 HE ARG A 128 107.058 -16.793 9.716 1.00 0.00 H new ATOM 0 HH11 ARG A 128 108.123 -15.048 7.102 1.00 0.00 H new ATOM 0 HH12 ARG A 128 107.498 -16.131 5.855 1.00 0.00 H new ATOM 0 HH21 ARG A 128 105.552 -17.985 8.089 1.00 0.00 H new ATOM 0 HH22 ARG A 128 106.055 -17.779 6.409 1.00 0.00 H new ATOM 1917 N TYR A 129 109.635 -12.136 7.777 1.00 0.00 N ATOM 1918 CA TYR A 129 110.265 -12.385 6.446 1.00 0.00 C ATOM 1919 C TYR A 129 111.674 -11.784 6.428 1.00 0.00 C ATOM 1920 O TYR A 129 112.538 -12.219 5.692 1.00 0.00 O ATOM 1921 CB TYR A 129 109.362 -11.675 5.438 1.00 0.00 C ATOM 1922 CG TYR A 129 109.720 -12.117 4.040 1.00 0.00 C ATOM 1923 CD1 TYR A 129 109.319 -13.376 3.577 1.00 0.00 C ATOM 1924 CD2 TYR A 129 110.452 -11.264 3.205 1.00 0.00 C ATOM 1925 CE1 TYR A 129 109.651 -13.782 2.278 1.00 0.00 C ATOM 1926 CE2 TYR A 129 110.784 -11.670 1.907 1.00 0.00 C ATOM 1927 CZ TYR A 129 110.383 -12.930 1.443 1.00 0.00 C ATOM 1928 OH TYR A 129 110.709 -13.330 0.164 1.00 0.00 O ATOM 0 H TYR A 129 108.753 -11.625 7.751 1.00 0.00 H new ATOM 0 HA TYR A 129 110.361 -13.447 6.218 1.00 0.00 H new ATOM 0 HB2 TYR A 129 108.317 -11.904 5.646 1.00 0.00 H new ATOM 0 HB3 TYR A 129 109.476 -10.595 5.529 1.00 0.00 H new ATOM 0 HD1 TYR A 129 108.754 -14.034 4.221 1.00 0.00 H new ATOM 0 HD2 TYR A 129 110.761 -10.293 3.562 1.00 0.00 H new ATOM 0 HE1 TYR A 129 109.342 -14.753 1.921 1.00 0.00 H new ATOM 0 HE2 TYR A 129 111.349 -11.012 1.263 1.00 0.00 H new ATOM 0 HH TYR A 129 111.217 -12.620 -0.281 1.00 0.00 H new ATOM 1938 N LEU A 130 111.912 -10.792 7.249 1.00 0.00 N ATOM 1939 CA LEU A 130 113.264 -10.167 7.298 1.00 0.00 C ATOM 1940 C LEU A 130 114.224 -11.085 8.050 1.00 0.00 C ATOM 1941 O LEU A 130 115.277 -11.434 7.557 1.00 0.00 O ATOM 1942 CB LEU A 130 113.075 -8.853 8.060 1.00 0.00 C ATOM 1943 CG LEU A 130 112.762 -7.719 7.080 1.00 0.00 C ATOM 1944 CD1 LEU A 130 112.626 -6.405 7.854 1.00 0.00 C ATOM 1945 CD2 LEU A 130 113.897 -7.588 6.061 1.00 0.00 C ATOM 0 H LEU A 130 111.226 -10.389 7.887 1.00 0.00 H new ATOM 0 HA LEU A 130 113.681 -9.999 6.305 1.00 0.00 H new ATOM 0 HB2 LEU A 130 112.264 -8.955 8.782 1.00 0.00 H new ATOM 0 HB3 LEU A 130 113.977 -8.618 8.625 1.00 0.00 H new ATOM 0 HG LEU A 130 111.831 -7.940 6.558 1.00 0.00 H new ATOM 0 HD11 LEU A 130 112.403 -5.595 7.159 1.00 0.00 H new ATOM 0 HD12 LEU A 130 111.818 -6.493 8.581 1.00 0.00 H new ATOM 0 HD13 LEU A 130 113.560 -6.191 8.374 1.00 0.00 H new ATOM 0 HD21 LEU A 130 113.670 -6.780 5.366 1.00 0.00 H new ATOM 0 HD22 LEU A 130 114.829 -7.368 6.581 1.00 0.00 H new ATOM 0 HD23 LEU A 130 114.001 -8.523 5.510 1.00 0.00 H new ATOM 1957 N ARG A 131 113.861 -11.490 9.241 1.00 0.00 N ATOM 1958 CA ARG A 131 114.747 -12.400 10.030 1.00 0.00 C ATOM 1959 C ARG A 131 115.169 -13.602 9.173 1.00 0.00 C ATOM 1960 O ARG A 131 116.182 -14.224 9.419 1.00 0.00 O ATOM 1961 CB ARG A 131 113.894 -12.847 11.225 1.00 0.00 C ATOM 1962 CG ARG A 131 114.661 -13.885 12.053 1.00 0.00 C ATOM 1963 CD ARG A 131 113.895 -14.183 13.349 1.00 0.00 C ATOM 1964 NE ARG A 131 114.897 -14.020 14.442 1.00 0.00 N ATOM 1965 CZ ARG A 131 114.737 -13.091 15.348 1.00 0.00 C ATOM 1966 NH1 ARG A 131 114.226 -11.935 15.018 1.00 0.00 N ATOM 1967 NH2 ARG A 131 115.086 -13.319 16.585 1.00 0.00 N ATOM 0 H ARG A 131 112.989 -11.230 9.701 1.00 0.00 H new ATOM 0 HA ARG A 131 115.666 -11.910 10.353 1.00 0.00 H new ATOM 0 HB2 ARG A 131 113.643 -11.987 11.846 1.00 0.00 H new ATOM 0 HB3 ARG A 131 112.954 -13.272 10.873 1.00 0.00 H new ATOM 0 HG2 ARG A 131 114.789 -14.801 11.476 1.00 0.00 H new ATOM 0 HG3 ARG A 131 115.659 -13.513 12.286 1.00 0.00 H new ATOM 0 HD2 ARG A 131 113.057 -13.498 13.478 1.00 0.00 H new ATOM 0 HD3 ARG A 131 113.483 -15.192 13.340 1.00 0.00 H new ATOM 0 HE ARG A 131 115.710 -14.635 14.483 1.00 0.00 H new ATOM 0 HH11 ARG A 131 113.951 -11.756 14.052 1.00 0.00 H new ATOM 0 HH12 ARG A 131 114.102 -11.211 15.726 1.00 0.00 H new ATOM 0 HH21 ARG A 131 115.483 -14.222 16.845 1.00 0.00 H new ATOM 0 HH22 ARG A 131 114.961 -12.594 17.292 1.00 0.00 H new ATOM 1981 N ALA A 132 114.401 -13.922 8.163 1.00 0.00 N ATOM 1982 CA ALA A 132 114.758 -15.070 7.284 1.00 0.00 C ATOM 1983 C ALA A 132 115.750 -14.616 6.206 1.00 0.00 C ATOM 1984 O ALA A 132 116.836 -15.148 6.083 1.00 0.00 O ATOM 1985 CB ALA A 132 113.440 -15.505 6.644 1.00 0.00 C ATOM 0 H ALA A 132 113.541 -13.435 7.911 1.00 0.00 H new ATOM 0 HA ALA A 132 115.231 -15.882 7.836 1.00 0.00 H new ATOM 0 HB1 ALA A 132 113.620 -16.350 5.979 1.00 0.00 H new ATOM 0 HB2 ALA A 132 112.737 -15.799 7.423 1.00 0.00 H new ATOM 0 HB3 ALA A 132 113.022 -14.676 6.072 1.00 0.00 H new ATOM 1991 N ALA A 133 115.379 -13.636 5.424 1.00 0.00 N ATOM 1992 CA ALA A 133 116.290 -13.142 4.349 1.00 0.00 C ATOM 1993 C ALA A 133 117.378 -12.228 4.927 1.00 0.00 C ATOM 1994 O ALA A 133 118.231 -11.743 4.208 1.00 0.00 O ATOM 1995 CB ALA A 133 115.388 -12.353 3.399 1.00 0.00 C ATOM 0 H ALA A 133 114.482 -13.155 5.484 1.00 0.00 H new ATOM 0 HA ALA A 133 116.805 -13.962 3.850 1.00 0.00 H new ATOM 0 HB1 ALA A 133 115.984 -11.955 2.578 1.00 0.00 H new ATOM 0 HB2 ALA A 133 114.615 -13.011 3.001 1.00 0.00 H new ATOM 0 HB3 ALA A 133 114.921 -11.530 3.940 1.00 0.00 H new ATOM 2001 N ALA A 134 117.356 -11.979 6.212 1.00 0.00 N ATOM 2002 CA ALA A 134 118.390 -11.089 6.815 1.00 0.00 C ATOM 2003 C ALA A 134 119.392 -11.907 7.633 1.00 0.00 C ATOM 2004 O ALA A 134 120.584 -11.670 7.584 1.00 0.00 O ATOM 2005 CB ALA A 134 117.612 -10.129 7.719 1.00 0.00 C ATOM 0 H ALA A 134 116.669 -12.353 6.866 1.00 0.00 H new ATOM 0 HA ALA A 134 118.965 -10.558 6.056 1.00 0.00 H new ATOM 0 HB1 ALA A 134 118.306 -9.440 8.200 1.00 0.00 H new ATOM 0 HB2 ALA A 134 116.897 -9.565 7.121 1.00 0.00 H new ATOM 0 HB3 ALA A 134 117.079 -10.698 8.481 1.00 0.00 H new ATOM 2011 N GLY A 135 118.919 -12.864 8.384 1.00 0.00 N ATOM 2012 CA GLY A 135 119.844 -13.697 9.204 1.00 0.00 C ATOM 2013 C GLY A 135 119.923 -15.107 8.621 1.00 0.00 C ATOM 2014 O GLY A 135 120.584 -15.341 7.627 1.00 0.00 O ATOM 0 H GLY A 135 117.931 -13.105 8.465 1.00 0.00 H new ATOM 0 HA2 GLY A 135 120.836 -13.245 9.223 1.00 0.00 H new ATOM 0 HA3 GLY A 135 119.493 -13.739 10.235 1.00 0.00 H new ATOM 2018 N GLY A 136 119.260 -16.052 9.232 1.00 0.00 N ATOM 2019 CA GLY A 136 119.305 -17.448 8.715 1.00 0.00 C ATOM 2020 C GLY A 136 120.553 -18.144 9.255 1.00 0.00 C ATOM 2021 O GLY A 136 121.630 -18.018 8.708 1.00 0.00 O ATOM 0 H GLY A 136 118.690 -15.916 10.067 1.00 0.00 H new ATOM 0 HA2 GLY A 136 118.410 -17.991 9.021 1.00 0.00 H new ATOM 0 HA3 GLY A 136 119.319 -17.445 7.625 1.00 0.00 H new ATOM 2025 N THR A 137 120.417 -18.876 10.328 1.00 0.00 N ATOM 2026 CA THR A 137 121.596 -19.579 10.909 1.00 0.00 C ATOM 2027 C THR A 137 121.759 -20.972 10.285 1.00 0.00 C ATOM 2028 O THR A 137 122.448 -21.820 10.817 1.00 0.00 O ATOM 2029 CB THR A 137 121.290 -19.689 12.404 1.00 0.00 C ATOM 2030 OG1 THR A 137 120.045 -20.347 12.583 1.00 0.00 O ATOM 2031 CG2 THR A 137 121.222 -18.290 13.021 1.00 0.00 C ATOM 0 H THR A 137 119.539 -19.017 10.828 1.00 0.00 H new ATOM 0 HA THR A 137 122.527 -19.045 10.719 1.00 0.00 H new ATOM 0 HB THR A 137 122.079 -20.260 12.894 1.00 0.00 H new ATOM 0 HG1 THR A 137 119.848 -20.420 13.540 1.00 0.00 H new ATOM 0 HG21 THR A 137 121.004 -18.372 14.086 1.00 0.00 H new ATOM 0 HG22 THR A 137 122.178 -17.785 12.884 1.00 0.00 H new ATOM 0 HG23 THR A 137 120.435 -17.715 12.533 1.00 0.00 H new ATOM 2039 N ARG A 138 121.135 -21.215 9.161 1.00 0.00 N ATOM 2040 CA ARG A 138 121.263 -22.552 8.508 1.00 0.00 C ATOM 2041 C ARG A 138 122.222 -22.464 7.318 1.00 0.00 C ATOM 2042 O ARG A 138 122.316 -21.448 6.658 1.00 0.00 O ATOM 2043 CB ARG A 138 119.849 -22.902 8.042 1.00 0.00 C ATOM 2044 CG ARG A 138 119.819 -24.346 7.534 1.00 0.00 C ATOM 2045 CD ARG A 138 118.625 -24.535 6.596 1.00 0.00 C ATOM 2046 NE ARG A 138 118.011 -25.827 7.011 1.00 0.00 N ATOM 2047 CZ ARG A 138 116.714 -25.931 7.106 1.00 0.00 C ATOM 2048 NH1 ARG A 138 116.089 -25.381 8.112 1.00 0.00 N ATOM 2049 NH2 ARG A 138 116.043 -26.583 6.196 1.00 0.00 N ATOM 0 H ARG A 138 120.543 -20.546 8.668 1.00 0.00 H new ATOM 0 HA ARG A 138 121.664 -23.309 9.182 1.00 0.00 H new ATOM 0 HB2 ARG A 138 119.144 -22.780 8.864 1.00 0.00 H new ATOM 0 HB3 ARG A 138 119.537 -22.221 7.250 1.00 0.00 H new ATOM 0 HG2 ARG A 138 120.746 -24.577 7.010 1.00 0.00 H new ATOM 0 HG3 ARG A 138 119.747 -25.036 8.374 1.00 0.00 H new ATOM 0 HD2 ARG A 138 117.916 -23.713 6.689 1.00 0.00 H new ATOM 0 HD3 ARG A 138 118.943 -24.565 5.554 1.00 0.00 H new ATOM 0 HE ARG A 138 118.604 -26.630 7.221 1.00 0.00 H new ATOM 0 HH11 ARG A 138 116.615 -24.871 8.822 1.00 0.00 H new ATOM 0 HH12 ARG A 138 115.075 -25.461 8.188 1.00 0.00 H new ATOM 0 HH21 ARG A 138 116.533 -27.011 5.410 1.00 0.00 H new ATOM 0 HH22 ARG A 138 115.029 -26.664 6.270 1.00 0.00 H new ATOM 2063 N GLY A 139 122.939 -23.522 7.042 1.00 0.00 N ATOM 2064 CA GLY A 139 123.896 -23.496 5.898 1.00 0.00 C ATOM 2065 C GLY A 139 124.973 -24.561 6.105 1.00 0.00 C ATOM 2066 O GLY A 139 124.766 -25.729 5.834 1.00 0.00 O ATOM 0 H GLY A 139 122.903 -24.401 7.558 1.00 0.00 H new ATOM 0 HA2 GLY A 139 123.366 -23.678 4.963 1.00 0.00 H new ATOM 0 HA3 GLY A 139 124.355 -22.511 5.818 1.00 0.00 H new ATOM 2070 N SER A 140 126.122 -24.165 6.582 1.00 0.00 N ATOM 2071 CA SER A 140 127.220 -25.149 6.809 1.00 0.00 C ATOM 2072 C SER A 140 128.377 -24.487 7.563 1.00 0.00 C ATOM 2073 O SER A 140 128.385 -23.290 7.779 1.00 0.00 O ATOM 2074 CB SER A 140 127.668 -25.575 5.410 1.00 0.00 C ATOM 2075 OG SER A 140 127.607 -24.457 4.535 1.00 0.00 O ATOM 0 H SER A 140 126.348 -23.201 6.825 1.00 0.00 H new ATOM 0 HA SER A 140 126.894 -25.998 7.409 1.00 0.00 H new ATOM 0 HB2 SER A 140 128.684 -25.968 5.445 1.00 0.00 H new ATOM 0 HB3 SER A 140 127.029 -26.376 5.039 1.00 0.00 H new ATOM 0 HG SER A 140 127.895 -24.727 3.638 1.00 0.00 H new ATOM 2081 N ASN A 141 129.356 -25.259 7.963 1.00 0.00 N ATOM 2082 CA ASN A 141 130.523 -24.687 8.705 1.00 0.00 C ATOM 2083 C ASN A 141 130.051 -23.856 9.902 1.00 0.00 C ATOM 2084 O ASN A 141 129.711 -22.697 9.769 1.00 0.00 O ATOM 2085 CB ASN A 141 131.247 -23.799 7.689 1.00 0.00 C ATOM 2086 CG ASN A 141 131.821 -24.664 6.563 1.00 0.00 C ATOM 2087 OD1 ASN A 141 131.827 -25.878 6.651 1.00 0.00 O ATOM 2088 ND2 ASN A 141 132.308 -24.086 5.500 1.00 0.00 N ATOM 0 H ASN A 141 129.398 -26.266 7.807 1.00 0.00 H new ATOM 0 HA ASN A 141 131.172 -25.467 9.103 1.00 0.00 H new ATOM 0 HB2 ASN A 141 130.557 -23.062 7.279 1.00 0.00 H new ATOM 0 HB3 ASN A 141 132.048 -23.246 8.180 1.00 0.00 H new ATOM 0 HD21 ASN A 141 132.693 -24.651 4.743 1.00 0.00 H new ATOM 0 HD22 ASN A 141 132.303 -23.069 5.425 1.00 0.00 H new ATOM 2095 N HIS A 142 130.029 -24.438 11.073 1.00 0.00 N ATOM 2096 CA HIS A 142 129.580 -23.679 12.277 1.00 0.00 C ATOM 2097 C HIS A 142 130.398 -22.386 12.430 1.00 0.00 C ATOM 2098 O HIS A 142 130.032 -21.353 11.903 1.00 0.00 O ATOM 2099 CB HIS A 142 129.817 -24.625 13.458 1.00 0.00 C ATOM 2100 CG HIS A 142 128.554 -25.389 13.753 1.00 0.00 C ATOM 2101 ND1 HIS A 142 128.400 -26.723 13.412 1.00 0.00 N ATOM 2102 CD2 HIS A 142 127.380 -25.019 14.359 1.00 0.00 C ATOM 2103 CE1 HIS A 142 127.173 -27.103 13.810 1.00 0.00 C ATOM 2104 NE2 HIS A 142 126.509 -26.103 14.394 1.00 0.00 N ATOM 0 H HIS A 142 130.302 -25.405 11.247 1.00 0.00 H new ATOM 0 HA HIS A 142 128.535 -23.377 12.209 1.00 0.00 H new ATOM 0 HB2 HIS A 142 130.627 -25.317 13.226 1.00 0.00 H new ATOM 0 HB3 HIS A 142 130.124 -24.057 14.336 1.00 0.00 H new ATOM 0 HD2 HIS A 142 127.165 -24.035 14.750 1.00 0.00 H new ATOM 0 HE1 HIS A 142 126.773 -28.097 13.674 1.00 0.00 H new ATOM 0 HE2 HIS A 142 125.566 -26.128 14.782 1.00 0.00 H new ATOM 2112 N ALA A 143 131.499 -22.430 13.143 1.00 0.00 N ATOM 2113 CA ALA A 143 132.332 -21.200 13.327 1.00 0.00 C ATOM 2114 C ALA A 143 131.453 -20.014 13.743 1.00 0.00 C ATOM 2115 O ALA A 143 131.781 -18.871 13.496 1.00 0.00 O ATOM 2116 CB ALA A 143 132.969 -20.937 11.961 1.00 0.00 C ATOM 0 H ALA A 143 131.856 -23.266 13.606 1.00 0.00 H new ATOM 0 HA ALA A 143 133.081 -21.330 14.108 1.00 0.00 H new ATOM 0 HB1 ALA A 143 133.596 -20.047 12.017 1.00 0.00 H new ATOM 0 HB2 ALA A 143 133.579 -21.793 11.673 1.00 0.00 H new ATOM 0 HB3 ALA A 143 132.186 -20.782 11.218 1.00 0.00 H new ATOM 2122 N ARG A 144 130.335 -20.279 14.368 1.00 0.00 N ATOM 2123 CA ARG A 144 129.432 -19.170 14.793 1.00 0.00 C ATOM 2124 C ARG A 144 129.939 -18.542 16.095 1.00 0.00 C ATOM 2125 O ARG A 144 130.510 -19.208 16.935 1.00 0.00 O ATOM 2126 CB ARG A 144 128.069 -19.829 15.000 1.00 0.00 C ATOM 2127 CG ARG A 144 126.963 -18.805 14.736 1.00 0.00 C ATOM 2128 CD ARG A 144 125.598 -19.500 14.750 1.00 0.00 C ATOM 2129 NE ARG A 144 125.517 -20.181 16.073 1.00 0.00 N ATOM 2130 CZ ARG A 144 124.574 -21.053 16.300 1.00 0.00 C ATOM 2131 NH1 ARG A 144 124.488 -22.129 15.565 1.00 0.00 N ATOM 2132 NH2 ARG A 144 123.714 -20.848 17.259 1.00 0.00 N ATOM 0 H ARG A 144 130.009 -21.217 14.602 1.00 0.00 H new ATOM 0 HA ARG A 144 129.386 -18.367 14.057 1.00 0.00 H new ATOM 0 HB2 ARG A 144 127.959 -20.681 14.329 1.00 0.00 H new ATOM 0 HB3 ARG A 144 127.989 -20.213 16.017 1.00 0.00 H new ATOM 0 HG2 ARG A 144 126.991 -18.023 15.494 1.00 0.00 H new ATOM 0 HG3 ARG A 144 127.125 -18.321 13.773 1.00 0.00 H new ATOM 0 HD2 ARG A 144 124.789 -18.780 14.628 1.00 0.00 H new ATOM 0 HD3 ARG A 144 125.513 -20.216 13.933 1.00 0.00 H new ATOM 0 HE ARG A 144 126.199 -19.965 16.801 1.00 0.00 H new ATOM 0 HH11 ARG A 144 125.159 -22.288 14.813 1.00 0.00 H new ATOM 0 HH12 ARG A 144 123.750 -22.811 15.743 1.00 0.00 H new ATOM 0 HH21 ARG A 144 123.779 -20.006 17.831 1.00 0.00 H new ATOM 0 HH22 ARG A 144 122.976 -21.530 17.437 1.00 0.00 H new ATOM 2146 N ILE A 145 129.745 -17.260 16.262 1.00 0.00 N ATOM 2147 CA ILE A 145 130.228 -16.583 17.503 1.00 0.00 C ATOM 2148 C ILE A 145 129.337 -16.935 18.701 1.00 0.00 C ATOM 2149 O ILE A 145 128.145 -17.128 18.567 1.00 0.00 O ATOM 2150 CB ILE A 145 130.165 -15.082 17.186 1.00 0.00 C ATOM 2151 CG1 ILE A 145 130.936 -14.302 18.256 1.00 0.00 C ATOM 2152 CG2 ILE A 145 128.705 -14.606 17.152 1.00 0.00 C ATOM 2153 CD1 ILE A 145 131.939 -13.367 17.579 1.00 0.00 C ATOM 0 H ILE A 145 129.273 -16.652 15.593 1.00 0.00 H new ATOM 0 HA ILE A 145 131.235 -16.897 17.776 1.00 0.00 H new ATOM 0 HB ILE A 145 130.615 -14.906 16.209 1.00 0.00 H new ATOM 0 HG12 ILE A 145 130.244 -13.727 18.872 1.00 0.00 H new ATOM 0 HG13 ILE A 145 131.456 -14.992 18.920 1.00 0.00 H new ATOM 0 HG21 ILE A 145 128.675 -13.540 16.926 1.00 0.00 H new ATOM 0 HG22 ILE A 145 128.161 -15.155 16.383 1.00 0.00 H new ATOM 0 HG23 ILE A 145 128.241 -14.785 18.122 1.00 0.00 H new ATOM 0 HD11 ILE A 145 132.488 -12.811 18.339 1.00 0.00 H new ATOM 0 HD12 ILE A 145 132.638 -13.953 16.982 1.00 0.00 H new ATOM 0 HD13 ILE A 145 131.407 -12.669 16.933 1.00 0.00 H new ATOM 2165 N ASP A 146 129.915 -17.019 19.877 1.00 0.00 N ATOM 2166 CA ASP A 146 129.123 -17.352 21.099 1.00 0.00 C ATOM 2167 C ASP A 146 130.064 -17.547 22.295 1.00 0.00 C ATOM 2168 O ASP A 146 130.027 -18.556 22.972 1.00 0.00 O ATOM 2169 CB ASP A 146 128.382 -18.658 20.779 1.00 0.00 C ATOM 2170 CG ASP A 146 126.871 -18.420 20.844 1.00 0.00 C ATOM 2171 OD1 ASP A 146 126.453 -17.300 20.601 1.00 0.00 O ATOM 2172 OD2 ASP A 146 126.156 -19.364 21.138 1.00 0.00 O ATOM 0 H ASP A 146 130.911 -16.869 20.041 1.00 0.00 H new ATOM 0 HA ASP A 146 128.426 -16.556 21.360 1.00 0.00 H new ATOM 0 HB2 ASP A 146 128.662 -19.013 19.787 1.00 0.00 H new ATOM 0 HB3 ASP A 146 128.669 -19.434 21.489 1.00 0.00 H new ATOM 2177 N ALA A 147 130.908 -16.584 22.555 1.00 0.00 N ATOM 2178 CA ALA A 147 131.856 -16.702 23.705 1.00 0.00 C ATOM 2179 C ALA A 147 132.621 -15.387 23.889 1.00 0.00 C ATOM 2180 O ALA A 147 133.701 -15.211 23.361 1.00 0.00 O ATOM 2181 CB ALA A 147 132.815 -17.832 23.317 1.00 0.00 C ATOM 0 H ALA A 147 130.983 -15.719 22.020 1.00 0.00 H new ATOM 0 HA ALA A 147 131.345 -16.910 24.645 1.00 0.00 H new ATOM 0 HB1 ALA A 147 133.544 -17.980 24.114 1.00 0.00 H new ATOM 0 HB2 ALA A 147 132.251 -18.752 23.166 1.00 0.00 H new ATOM 0 HB3 ALA A 147 133.333 -17.569 22.395 1.00 0.00 H new ATOM 2187 N ALA A 148 132.069 -14.461 24.631 1.00 0.00 N ATOM 2188 CA ALA A 148 132.765 -13.155 24.845 1.00 0.00 C ATOM 2189 C ALA A 148 134.203 -13.386 25.314 1.00 0.00 C ATOM 2190 O ALA A 148 134.443 -13.907 26.387 1.00 0.00 O ATOM 2191 CB ALA A 148 131.959 -12.439 25.928 1.00 0.00 C ATOM 0 H ALA A 148 131.167 -14.552 25.098 1.00 0.00 H new ATOM 0 HA ALA A 148 132.821 -12.570 23.927 1.00 0.00 H new ATOM 0 HB1 ALA A 148 132.412 -11.470 26.138 1.00 0.00 H new ATOM 0 HB2 ALA A 148 130.935 -12.294 25.583 1.00 0.00 H new ATOM 0 HB3 ALA A 148 131.954 -13.042 26.836 1.00 0.00 H new ATOM 2197 N GLU A 149 135.158 -13.004 24.515 1.00 0.00 N ATOM 2198 CA GLU A 149 136.584 -13.199 24.903 1.00 0.00 C ATOM 2199 C GLU A 149 137.033 -12.073 25.837 1.00 0.00 C ATOM 2200 O GLU A 149 136.567 -10.955 25.744 1.00 0.00 O ATOM 2201 CB GLU A 149 137.361 -13.155 23.586 1.00 0.00 C ATOM 2202 CG GLU A 149 138.462 -14.219 23.605 1.00 0.00 C ATOM 2203 CD GLU A 149 139.458 -13.942 22.476 1.00 0.00 C ATOM 2204 OE1 GLU A 149 139.175 -14.332 21.355 1.00 0.00 O ATOM 2205 OE2 GLU A 149 140.486 -13.346 22.752 1.00 0.00 O ATOM 0 H GLU A 149 135.013 -12.563 23.606 1.00 0.00 H new ATOM 0 HA GLU A 149 136.746 -14.135 25.437 1.00 0.00 H new ATOM 0 HB2 GLU A 149 136.686 -13.330 22.748 1.00 0.00 H new ATOM 0 HB3 GLU A 149 137.798 -12.167 23.443 1.00 0.00 H new ATOM 0 HG2 GLU A 149 138.975 -14.210 24.567 1.00 0.00 H new ATOM 0 HG3 GLU A 149 138.026 -15.211 23.485 1.00 0.00 H new ATOM 2212 N GLY A 150 137.933 -12.360 26.739 1.00 0.00 N ATOM 2213 CA GLY A 150 138.409 -11.308 27.683 1.00 0.00 C ATOM 2214 C GLY A 150 137.264 -10.906 28.618 1.00 0.00 C ATOM 2215 O GLY A 150 136.381 -10.166 28.229 1.00 0.00 O ATOM 0 H GLY A 150 138.359 -13.278 26.863 1.00 0.00 H new ATOM 0 HA2 GLY A 150 139.253 -11.680 28.263 1.00 0.00 H new ATOM 0 HA3 GLY A 150 138.762 -10.439 27.128 1.00 0.00 H new ATOM 2219 N PRO A 151 137.311 -11.409 29.825 1.00 0.00 N ATOM 2220 CA PRO A 151 136.254 -11.097 30.822 1.00 0.00 C ATOM 2221 C PRO A 151 136.370 -9.646 31.293 1.00 0.00 C ATOM 2222 O PRO A 151 137.451 -9.096 31.380 1.00 0.00 O ATOM 2223 CB PRO A 151 136.548 -12.063 31.967 1.00 0.00 C ATOM 2224 CG PRO A 151 138.004 -12.374 31.840 1.00 0.00 C ATOM 2225 CD PRO A 151 138.337 -12.304 30.374 1.00 0.00 C ATOM 0 HA PRO A 151 135.245 -11.206 30.424 1.00 0.00 H new ATOM 0 HB2 PRO A 151 136.323 -11.611 32.933 1.00 0.00 H new ATOM 0 HB3 PRO A 151 135.942 -12.966 31.888 1.00 0.00 H new ATOM 0 HG2 PRO A 151 138.603 -11.661 32.407 1.00 0.00 H new ATOM 0 HG3 PRO A 151 138.224 -13.364 32.240 1.00 0.00 H new ATOM 0 HD2 PRO A 151 139.340 -11.911 30.210 1.00 0.00 H new ATOM 0 HD3 PRO A 151 138.300 -13.289 29.908 1.00 0.00 H new ATOM 2233 N SER A 152 135.264 -9.025 31.604 1.00 0.00 N ATOM 2234 CA SER A 152 135.303 -7.612 32.076 1.00 0.00 C ATOM 2235 C SER A 152 135.287 -7.564 33.606 1.00 0.00 C ATOM 2236 O SER A 152 134.321 -7.945 34.237 1.00 0.00 O ATOM 2237 CB SER A 152 134.042 -6.970 31.502 1.00 0.00 C ATOM 2238 OG SER A 152 134.320 -6.471 30.200 1.00 0.00 O ATOM 0 H SER A 152 134.333 -9.437 31.551 1.00 0.00 H new ATOM 0 HA SER A 152 136.206 -7.092 31.755 1.00 0.00 H new ATOM 0 HB2 SER A 152 133.235 -7.701 31.459 1.00 0.00 H new ATOM 0 HB3 SER A 152 133.705 -6.161 32.150 1.00 0.00 H new ATOM 0 HG SER A 152 133.512 -6.060 29.828 1.00 0.00 H new ATOM 2244 N ASP A 153 136.351 -7.099 34.206 1.00 0.00 N ATOM 2245 CA ASP A 153 136.400 -7.027 35.698 1.00 0.00 C ATOM 2246 C ASP A 153 135.358 -6.031 36.221 1.00 0.00 C ATOM 2247 O ASP A 153 134.931 -5.137 35.515 1.00 0.00 O ATOM 2248 CB ASP A 153 137.819 -6.553 36.029 1.00 0.00 C ATOM 2249 CG ASP A 153 138.078 -5.194 35.377 1.00 0.00 C ATOM 2250 OD1 ASP A 153 137.929 -5.097 34.170 1.00 0.00 O ATOM 2251 OD2 ASP A 153 138.424 -4.271 36.096 1.00 0.00 O ATOM 0 H ASP A 153 137.188 -6.766 33.728 1.00 0.00 H new ATOM 0 HA ASP A 153 136.175 -7.987 36.163 1.00 0.00 H new ATOM 0 HB2 ASP A 153 137.944 -6.478 37.109 1.00 0.00 H new ATOM 0 HB3 ASP A 153 138.548 -7.282 35.674 1.00 0.00 H new ATOM 2256 N ILE A 154 134.945 -6.184 37.452 1.00 0.00 N ATOM 2257 CA ILE A 154 133.926 -5.256 38.027 1.00 0.00 C ATOM 2258 C ILE A 154 134.452 -4.614 39.320 1.00 0.00 C ATOM 2259 O ILE A 154 134.376 -5.211 40.375 1.00 0.00 O ATOM 2260 CB ILE A 154 132.714 -6.141 38.334 1.00 0.00 C ATOM 2261 CG1 ILE A 154 132.206 -6.794 37.042 1.00 0.00 C ATOM 2262 CG2 ILE A 154 131.595 -5.293 38.951 1.00 0.00 C ATOM 2263 CD1 ILE A 154 131.814 -5.715 36.030 1.00 0.00 C ATOM 0 H ILE A 154 135.270 -6.914 38.086 1.00 0.00 H new ATOM 0 HA ILE A 154 133.683 -4.443 37.343 1.00 0.00 H new ATOM 0 HB ILE A 154 133.011 -6.917 39.039 1.00 0.00 H new ATOM 0 HG12 ILE A 154 132.980 -7.436 36.621 1.00 0.00 H new ATOM 0 HG13 ILE A 154 131.348 -7.430 37.259 1.00 0.00 H new ATOM 0 HG21 ILE A 154 130.735 -5.927 39.168 1.00 0.00 H new ATOM 0 HG22 ILE A 154 131.951 -4.837 39.875 1.00 0.00 H new ATOM 0 HG23 ILE A 154 131.302 -4.511 38.250 1.00 0.00 H new ATOM 0 HD11 ILE A 154 131.454 -6.187 35.116 1.00 0.00 H new ATOM 0 HD12 ILE A 154 131.025 -5.091 36.451 1.00 0.00 H new ATOM 0 HD13 ILE A 154 132.683 -5.097 35.802 1.00 0.00 H new ATOM 2275 N PRO A 155 134.963 -3.412 39.202 1.00 0.00 N ATOM 2276 CA PRO A 155 135.492 -2.698 40.392 1.00 0.00 C ATOM 2277 C PRO A 155 134.335 -2.253 41.297 1.00 0.00 C ATOM 2278 O PRO A 155 133.491 -1.475 40.899 1.00 0.00 O ATOM 2279 CB PRO A 155 136.211 -1.491 39.794 1.00 0.00 C ATOM 2280 CG PRO A 155 135.553 -1.267 38.471 1.00 0.00 C ATOM 2281 CD PRO A 155 135.097 -2.614 37.975 1.00 0.00 C ATOM 0 HA PRO A 155 136.147 -3.312 41.010 1.00 0.00 H new ATOM 0 HB2 PRO A 155 136.114 -0.616 40.436 1.00 0.00 H new ATOM 0 HB3 PRO A 155 137.277 -1.685 39.677 1.00 0.00 H new ATOM 0 HG2 PRO A 155 134.708 -0.586 38.571 1.00 0.00 H new ATOM 0 HG3 PRO A 155 136.248 -0.811 37.766 1.00 0.00 H new ATOM 0 HD2 PRO A 155 134.151 -2.543 37.438 1.00 0.00 H new ATOM 0 HD3 PRO A 155 135.821 -3.054 37.289 1.00 0.00 H new ATOM 2289 N ASP A 156 134.287 -2.745 42.509 1.00 0.00 N ATOM 2290 CA ASP A 156 133.181 -2.356 43.441 1.00 0.00 C ATOM 2291 C ASP A 156 131.818 -2.597 42.780 1.00 0.00 C ATOM 2292 O ASP A 156 131.618 -3.684 42.265 1.00 0.00 O ATOM 2293 CB ASP A 156 133.394 -0.865 43.725 1.00 0.00 C ATOM 2294 CG ASP A 156 134.446 -0.695 44.823 1.00 0.00 C ATOM 2295 OD1 ASP A 156 135.299 -1.559 44.940 1.00 0.00 O ATOM 2296 OD2 ASP A 156 134.380 0.298 45.530 1.00 0.00 O ATOM 2297 OXT ASP A 156 130.999 -1.691 42.801 1.00 0.00 O ATOM 0 H ASP A 156 134.966 -3.400 42.895 1.00 0.00 H new ATOM 0 HA ASP A 156 133.193 -2.944 44.359 1.00 0.00 H new ATOM 0 HB2 ASP A 156 133.716 -0.354 42.817 1.00 0.00 H new ATOM 0 HB3 ASP A 156 132.455 -0.406 44.033 1.00 0.00 H new TER 2302 ASP A 156