USER MOD reduce.3.24.130724 H: found=0, std=0, add=768, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 766 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 61 ASN : amide:sc= -0.655! K(o=-0.53!,f=0.1) USER MOD Set 1.2: A 65 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 67 THR OG1 : rot 108:sc= 0.129 USER MOD Set 2.1: A 52 SER OG : rot 130:sc= -0.212 USER MOD Set 2.2: A 73 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 36 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 66 CYS SG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc=-0.000214 X(o=-0.00021,f=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 HIS : no HD1:sc= -1.08! K(o=-1.1!,f=-0.5) USER MOD Single : A 15 SER OG : rot 11:sc= 0.208 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= -0.113 X(o=-0.11,f=0) USER MOD Single : A 25 MET CE :methyl -119:sc= 0 (180deg=-0.0169) USER MOD Single : A 27 ASN : amide:sc= -0.911 K(o=-0.91,f=-0.025) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 18:sc= 0.401 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 CYS SG : rot 26:sc= 0.23 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 160:sc= -1.1 USER MOD Single : A 70 TYR OH : rot -162:sc= -4.04! USER MOD Single : A 78 TYR OH : rot 8:sc= 1.23 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -153:sc= 0.00144 (180deg=0) USER MOD Single : A 88 HIS : no HD1:sc= -1.33 K(o=-1.3,f=-0.29) USER MOD Single : A 92 SER OG : rot -110:sc= -0.603 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc=-0.00296 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.314 -25.604 20.547 1.00 0.00 N ATOM 2 CA GLY A 1 17.013 -24.306 21.123 1.00 0.00 C ATOM 3 C GLY A 1 15.758 -24.326 21.973 1.00 0.00 C ATOM 4 O GLY A 1 15.767 -24.834 23.093 1.00 0.00 O ATOM 0 H1 GLY A 1 18.180 -25.538 19.975 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.454 -26.298 21.309 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.523 -25.908 19.943 1.00 0.00 H new ATOM 0 HA2 GLY A 1 17.855 -23.978 21.732 1.00 0.00 H new ATOM 0 HA3 GLY A 1 16.895 -23.575 20.323 1.00 0.00 H new ATOM 8 N SER A 2 14.675 -23.769 21.439 1.00 0.00 N ATOM 9 CA SER A 2 13.408 -23.719 22.159 1.00 0.00 C ATOM 10 C SER A 2 12.231 -23.855 21.197 1.00 0.00 C ATOM 11 O SER A 2 12.218 -23.248 20.126 1.00 0.00 O ATOM 12 CB SER A 2 13.293 -22.410 22.942 1.00 0.00 C ATOM 13 OG SER A 2 12.000 -22.264 23.504 1.00 0.00 O ATOM 0 H SER A 2 14.650 -23.346 20.511 1.00 0.00 H new ATOM 0 HA SER A 2 13.382 -24.555 22.858 1.00 0.00 H new ATOM 0 HB2 SER A 2 14.042 -22.389 23.734 1.00 0.00 H new ATOM 0 HB3 SER A 2 13.503 -21.568 22.282 1.00 0.00 H new ATOM 0 HG SER A 2 11.953 -21.421 24.001 1.00 0.00 H new ATOM 19 N SER A 3 11.245 -24.655 21.588 1.00 0.00 N ATOM 20 CA SER A 3 10.065 -24.875 20.760 1.00 0.00 C ATOM 21 C SER A 3 9.005 -23.812 21.032 1.00 0.00 C ATOM 22 O SER A 3 8.888 -23.306 22.148 1.00 0.00 O ATOM 23 CB SER A 3 9.485 -26.267 21.019 1.00 0.00 C ATOM 24 OG SER A 3 8.260 -26.446 20.330 1.00 0.00 O ATOM 0 H SER A 3 11.240 -25.162 22.473 1.00 0.00 H new ATOM 0 HA SER A 3 10.367 -24.804 19.715 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.199 -27.027 20.701 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.328 -26.405 22.089 1.00 0.00 H new ATOM 0 HG SER A 3 7.911 -27.344 20.511 1.00 0.00 H new ATOM 30 N GLY A 4 8.233 -23.477 20.002 1.00 0.00 N ATOM 31 CA GLY A 4 7.193 -22.476 20.149 1.00 0.00 C ATOM 32 C GLY A 4 5.818 -23.013 19.803 1.00 0.00 C ATOM 33 O GLY A 4 5.633 -24.222 19.667 1.00 0.00 O ATOM 0 H GLY A 4 8.310 -23.881 19.069 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.189 -22.109 21.175 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.419 -21.625 19.507 1.00 0.00 H new ATOM 37 N SER A 5 4.851 -22.112 19.662 1.00 0.00 N ATOM 38 CA SER A 5 3.485 -22.503 19.335 1.00 0.00 C ATOM 39 C SER A 5 2.711 -21.329 18.743 1.00 0.00 C ATOM 40 O SER A 5 3.000 -20.169 19.038 1.00 0.00 O ATOM 41 CB SER A 5 2.768 -23.024 20.583 1.00 0.00 C ATOM 42 OG SER A 5 1.616 -23.771 20.234 1.00 0.00 O ATOM 0 H SER A 5 4.988 -21.107 19.769 1.00 0.00 H new ATOM 0 HA SER A 5 3.529 -23.299 18.591 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.448 -23.648 21.163 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.483 -22.186 21.219 1.00 0.00 H new ATOM 0 HG SER A 5 1.177 -24.094 21.048 1.00 0.00 H new ATOM 48 N SER A 6 1.726 -21.639 17.907 1.00 0.00 N ATOM 49 CA SER A 6 0.911 -20.610 17.270 1.00 0.00 C ATOM 50 C SER A 6 -0.290 -20.253 18.139 1.00 0.00 C ATOM 51 O SER A 6 -0.437 -19.113 18.577 1.00 0.00 O ATOM 52 CB SER A 6 0.438 -21.084 15.894 1.00 0.00 C ATOM 53 OG SER A 6 1.375 -20.746 14.887 1.00 0.00 O ATOM 0 H SER A 6 1.472 -22.594 17.654 1.00 0.00 H new ATOM 0 HA SER A 6 1.526 -19.718 17.147 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.290 -22.164 15.909 1.00 0.00 H new ATOM 0 HB3 SER A 6 -0.527 -20.633 15.663 1.00 0.00 H new ATOM 0 HG SER A 6 1.050 -21.062 14.018 1.00 0.00 H new ATOM 59 N GLY A 7 -1.150 -21.238 18.384 1.00 0.00 N ATOM 60 CA GLY A 7 -2.328 -21.009 19.199 1.00 0.00 C ATOM 61 C GLY A 7 -3.599 -21.491 18.529 1.00 0.00 C ATOM 62 O GLY A 7 -4.391 -22.215 19.132 1.00 0.00 O ATOM 0 H GLY A 7 -1.051 -22.190 18.032 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.209 -21.519 20.155 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.416 -19.944 19.414 1.00 0.00 H new ATOM 66 N ALA A 8 -3.797 -21.087 17.278 1.00 0.00 N ATOM 67 CA ALA A 8 -4.981 -21.482 16.525 1.00 0.00 C ATOM 68 C ALA A 8 -4.738 -21.374 15.024 1.00 0.00 C ATOM 69 O ALA A 8 -4.018 -20.488 14.564 1.00 0.00 O ATOM 70 CB ALA A 8 -6.174 -20.630 16.932 1.00 0.00 C ATOM 0 H ALA A 8 -3.152 -20.486 16.765 1.00 0.00 H new ATOM 0 HA ALA A 8 -5.198 -22.525 16.757 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -7.051 -20.936 16.362 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -6.369 -20.762 17.996 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -5.958 -19.581 16.730 1.00 0.00 H new ATOM 76 N ILE A 9 -5.343 -22.282 14.265 1.00 0.00 N ATOM 77 CA ILE A 9 -5.192 -22.288 12.815 1.00 0.00 C ATOM 78 C ILE A 9 -6.550 -22.331 12.121 1.00 0.00 C ATOM 79 O ILE A 9 -6.691 -22.912 11.047 1.00 0.00 O ATOM 80 CB ILE A 9 -4.348 -23.486 12.341 1.00 0.00 C ATOM 81 CG1 ILE A 9 -4.947 -24.795 12.859 1.00 0.00 C ATOM 82 CG2 ILE A 9 -2.908 -23.335 12.806 1.00 0.00 C ATOM 83 CD1 ILE A 9 -5.966 -25.405 11.922 1.00 0.00 C ATOM 0 H ILE A 9 -5.942 -23.023 14.630 1.00 0.00 H new ATOM 0 HA ILE A 9 -4.679 -21.364 12.548 1.00 0.00 H new ATOM 0 HB ILE A 9 -4.356 -23.511 11.251 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.143 -25.512 13.026 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -5.417 -24.613 13.825 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -2.324 -24.189 12.464 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.487 -22.418 12.394 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -2.880 -23.289 13.895 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.349 -26.330 12.353 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -6.789 -24.706 11.775 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -5.496 -25.619 10.962 1.00 0.00 H new ATOM 95 N ASN A 10 -7.546 -21.709 12.744 1.00 0.00 N ATOM 96 CA ASN A 10 -8.893 -21.675 12.185 1.00 0.00 C ATOM 97 C ASN A 10 -9.285 -20.252 11.796 1.00 0.00 C ATOM 98 O ASN A 10 -10.398 -19.806 12.074 1.00 0.00 O ATOM 99 CB ASN A 10 -9.899 -22.235 13.192 1.00 0.00 C ATOM 100 CG ASN A 10 -9.749 -23.732 13.387 1.00 0.00 C ATOM 101 OD1 ASN A 10 -9.400 -24.196 14.473 1.00 0.00 O ATOM 102 ND2 ASN A 10 -10.013 -24.495 12.333 1.00 0.00 N ATOM 0 H ASN A 10 -7.446 -21.222 13.635 1.00 0.00 H new ATOM 0 HA ASN A 10 -8.903 -22.294 11.288 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -9.769 -21.732 14.150 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -10.911 -22.015 12.851 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -9.930 -25.509 12.404 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -10.299 -24.067 11.452 1.00 0.00 H new ATOM 109 N SER A 11 -8.362 -19.545 11.152 1.00 0.00 N ATOM 110 CA SER A 11 -8.609 -18.172 10.728 1.00 0.00 C ATOM 111 C SER A 11 -7.444 -17.643 9.897 1.00 0.00 C ATOM 112 O SER A 11 -6.351 -17.415 10.416 1.00 0.00 O ATOM 113 CB SER A 11 -8.834 -17.273 11.944 1.00 0.00 C ATOM 114 OG SER A 11 -9.333 -16.004 11.555 1.00 0.00 O ATOM 0 H SER A 11 -7.436 -19.900 10.912 1.00 0.00 H new ATOM 0 HA SER A 11 -9.507 -18.164 10.110 1.00 0.00 H new ATOM 0 HB2 SER A 11 -9.537 -17.750 12.628 1.00 0.00 H new ATOM 0 HB3 SER A 11 -7.897 -17.148 12.486 1.00 0.00 H new ATOM 0 HG SER A 11 -9.470 -15.448 12.351 1.00 0.00 H new ATOM 120 N ARG A 12 -7.687 -17.448 8.605 1.00 0.00 N ATOM 121 CA ARG A 12 -6.659 -16.946 7.702 1.00 0.00 C ATOM 122 C ARG A 12 -7.199 -15.807 6.843 1.00 0.00 C ATOM 123 O ARG A 12 -8.255 -15.930 6.221 1.00 0.00 O ATOM 124 CB ARG A 12 -6.142 -18.074 6.806 1.00 0.00 C ATOM 125 CG ARG A 12 -7.239 -18.788 6.032 1.00 0.00 C ATOM 126 CD ARG A 12 -7.810 -19.954 6.823 1.00 0.00 C ATOM 127 NE ARG A 12 -6.872 -21.070 6.908 1.00 0.00 N ATOM 128 CZ ARG A 12 -7.239 -22.320 7.165 1.00 0.00 C ATOM 129 NH1 ARG A 12 -8.517 -22.613 7.360 1.00 0.00 N ATOM 130 NH2 ARG A 12 -6.326 -23.282 7.226 1.00 0.00 N ATOM 0 H ARG A 12 -8.587 -17.630 8.160 1.00 0.00 H new ATOM 0 HA ARG A 12 -5.836 -16.564 8.306 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -5.419 -17.664 6.101 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -5.611 -18.801 7.421 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -8.036 -18.083 5.794 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -6.841 -19.150 5.084 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -8.067 -19.619 7.828 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -8.734 -20.292 6.354 1.00 0.00 H new ATOM 0 HE ARG A 12 -5.881 -20.879 6.762 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -9.222 -21.877 7.313 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -8.796 -23.574 7.557 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -5.342 -23.061 7.075 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.609 -24.242 7.424 1.00 0.00 H new ATOM 144 N HIS A 13 -6.468 -14.697 6.812 1.00 0.00 N ATOM 145 CA HIS A 13 -6.873 -13.535 6.029 1.00 0.00 C ATOM 146 C HIS A 13 -5.759 -12.494 5.984 1.00 0.00 C ATOM 147 O HIS A 13 -4.756 -12.612 6.689 1.00 0.00 O ATOM 148 CB HIS A 13 -8.142 -12.916 6.616 1.00 0.00 C ATOM 149 CG HIS A 13 -7.885 -12.027 7.794 1.00 0.00 C ATOM 150 ND1 HIS A 13 -8.727 -10.997 8.158 1.00 0.00 N ATOM 151 CD2 HIS A 13 -6.873 -12.018 8.693 1.00 0.00 C ATOM 152 CE1 HIS A 13 -8.243 -10.393 9.229 1.00 0.00 C ATOM 153 NE2 HIS A 13 -7.119 -10.994 9.574 1.00 0.00 N ATOM 0 H HIS A 13 -5.592 -14.578 7.320 1.00 0.00 H new ATOM 0 HA HIS A 13 -7.076 -13.867 5.011 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -8.648 -12.341 5.841 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -8.821 -13.714 6.915 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -6.029 -12.691 8.713 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -8.691 -9.551 9.736 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -6.529 -10.739 10.366 1.00 0.00 H new ATOM 162 N VAL A 14 -5.940 -11.475 5.150 1.00 0.00 N ATOM 163 CA VAL A 14 -4.950 -10.414 5.013 1.00 0.00 C ATOM 164 C VAL A 14 -5.615 -9.042 5.000 1.00 0.00 C ATOM 165 O VAL A 14 -6.685 -8.864 4.419 1.00 0.00 O ATOM 166 CB VAL A 14 -4.121 -10.582 3.726 1.00 0.00 C ATOM 167 CG1 VAL A 14 -3.092 -9.469 3.605 1.00 0.00 C ATOM 168 CG2 VAL A 14 -3.447 -11.946 3.702 1.00 0.00 C ATOM 0 H VAL A 14 -6.764 -11.362 4.559 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.287 -10.486 5.875 1.00 0.00 H new ATOM 0 HB VAL A 14 -4.793 -10.518 2.870 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -2.516 -9.604 2.690 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -3.600 -8.505 3.575 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -2.421 -9.499 4.464 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -2.865 -12.048 2.786 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -2.786 -12.041 4.564 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -4.206 -12.728 3.739 1.00 0.00 H new ATOM 178 N SER A 15 -4.972 -8.073 5.645 1.00 0.00 N ATOM 179 CA SER A 15 -5.502 -6.716 5.710 1.00 0.00 C ATOM 180 C SER A 15 -4.371 -5.692 5.750 1.00 0.00 C ATOM 181 O SER A 15 -3.207 -6.044 5.939 1.00 0.00 O ATOM 182 CB SER A 15 -6.395 -6.554 6.942 1.00 0.00 C ATOM 183 OG SER A 15 -7.667 -7.140 6.729 1.00 0.00 O ATOM 0 H SER A 15 -4.084 -8.203 6.130 1.00 0.00 H new ATOM 0 HA SER A 15 -6.096 -6.541 4.813 1.00 0.00 H new ATOM 0 HB2 SER A 15 -5.917 -7.018 7.805 1.00 0.00 H new ATOM 0 HB3 SER A 15 -6.513 -5.495 7.173 1.00 0.00 H new ATOM 0 HG SER A 15 -7.647 -7.677 5.909 1.00 0.00 H new ATOM 189 N ALA A 16 -4.723 -4.424 5.570 1.00 0.00 N ATOM 190 CA ALA A 16 -3.739 -3.348 5.587 1.00 0.00 C ATOM 191 C ALA A 16 -4.226 -2.173 6.427 1.00 0.00 C ATOM 192 O ALA A 16 -5.417 -1.863 6.449 1.00 0.00 O ATOM 193 CB ALA A 16 -3.431 -2.893 4.168 1.00 0.00 C ATOM 0 H ALA A 16 -5.682 -4.116 5.411 1.00 0.00 H new ATOM 0 HA ALA A 16 -2.825 -3.731 6.041 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.695 -2.089 4.195 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -3.033 -3.731 3.596 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.345 -2.532 3.695 1.00 0.00 H new ATOM 199 N TYR A 17 -3.297 -1.522 7.119 1.00 0.00 N ATOM 200 CA TYR A 17 -3.632 -0.382 7.964 1.00 0.00 C ATOM 201 C TYR A 17 -2.422 0.527 8.157 1.00 0.00 C ATOM 202 O TYR A 17 -1.380 0.096 8.648 1.00 0.00 O ATOM 203 CB TYR A 17 -4.146 -0.862 9.323 1.00 0.00 C ATOM 204 CG TYR A 17 -3.074 -1.482 10.191 1.00 0.00 C ATOM 205 CD1 TYR A 17 -2.306 -0.701 11.045 1.00 0.00 C ATOM 206 CD2 TYR A 17 -2.830 -2.850 10.156 1.00 0.00 C ATOM 207 CE1 TYR A 17 -1.325 -1.264 11.839 1.00 0.00 C ATOM 208 CE2 TYR A 17 -1.853 -3.421 10.947 1.00 0.00 C ATOM 209 CZ TYR A 17 -1.103 -2.624 11.787 1.00 0.00 C ATOM 210 OH TYR A 17 -0.127 -3.189 12.576 1.00 0.00 O ATOM 0 H TYR A 17 -2.306 -1.764 7.111 1.00 0.00 H new ATOM 0 HA TYR A 17 -4.417 0.189 7.467 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -4.588 -0.019 9.853 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -4.940 -1.591 9.165 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -2.478 0.364 11.089 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -3.415 -3.477 9.499 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.735 -0.642 12.497 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -1.677 -4.486 10.908 1.00 0.00 H new ATOM 0 HH TYR A 17 -0.100 -4.156 12.420 1.00 0.00 H new ATOM 220 N GLY A 18 -2.571 1.790 7.768 1.00 0.00 N ATOM 221 CA GLY A 18 -1.484 2.742 7.906 1.00 0.00 C ATOM 222 C GLY A 18 -1.873 4.135 7.455 1.00 0.00 C ATOM 223 O GLY A 18 -2.949 4.353 6.897 1.00 0.00 O ATOM 0 H GLY A 18 -3.425 2.171 7.360 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -1.165 2.776 8.948 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -0.629 2.400 7.322 1.00 0.00 H new ATOM 227 N PRO A 19 -0.984 5.110 7.697 1.00 0.00 N ATOM 228 CA PRO A 19 -1.218 6.507 7.320 1.00 0.00 C ATOM 229 C PRO A 19 -1.181 6.714 5.810 1.00 0.00 C ATOM 230 O PRO A 19 -2.021 7.417 5.249 1.00 0.00 O ATOM 231 CB PRO A 19 -0.063 7.254 7.992 1.00 0.00 C ATOM 232 CG PRO A 19 1.015 6.236 8.132 1.00 0.00 C ATOM 233 CD PRO A 19 0.319 4.923 8.357 1.00 0.00 C ATOM 0 HA PRO A 19 -2.204 6.853 7.629 1.00 0.00 H new ATOM 0 HB2 PRO A 19 0.267 8.099 7.388 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.360 7.652 8.962 1.00 0.00 H new ATOM 0 HG2 PRO A 19 1.636 6.200 7.237 1.00 0.00 H new ATOM 0 HG3 PRO A 19 1.673 6.477 8.967 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.875 4.093 7.920 1.00 0.00 H new ATOM 0 HD3 PRO A 19 0.204 4.706 9.419 1.00 0.00 H new ATOM 241 N GLY A 20 -0.201 6.097 5.157 1.00 0.00 N ATOM 242 CA GLY A 20 -0.073 6.227 3.717 1.00 0.00 C ATOM 243 C GLY A 20 -1.277 5.680 2.976 1.00 0.00 C ATOM 244 O GLY A 20 -1.620 6.158 1.894 1.00 0.00 O ATOM 0 H GLY A 20 0.506 5.510 5.599 1.00 0.00 H new ATOM 0 HA2 GLY A 20 0.061 7.278 3.461 1.00 0.00 H new ATOM 0 HA3 GLY A 20 0.823 5.702 3.386 1.00 0.00 H new ATOM 248 N LEU A 21 -1.920 4.674 3.558 1.00 0.00 N ATOM 249 CA LEU A 21 -3.093 4.059 2.945 1.00 0.00 C ATOM 250 C LEU A 21 -4.299 4.990 3.023 1.00 0.00 C ATOM 251 O LEU A 21 -5.005 5.191 2.035 1.00 0.00 O ATOM 252 CB LEU A 21 -3.414 2.730 3.632 1.00 0.00 C ATOM 253 CG LEU A 21 -2.351 1.638 3.511 1.00 0.00 C ATOM 254 CD1 LEU A 21 -2.662 0.484 4.451 1.00 0.00 C ATOM 255 CD2 LEU A 21 -2.252 1.147 2.074 1.00 0.00 C ATOM 0 H LEU A 21 -1.649 4.267 4.453 1.00 0.00 H new ATOM 0 HA LEU A 21 -2.869 3.873 1.895 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.588 2.924 4.690 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.348 2.347 3.220 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.388 2.062 3.796 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.895 -0.284 4.351 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.681 0.847 5.479 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -3.634 0.061 4.198 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -1.490 0.370 2.007 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.214 0.741 1.761 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -1.981 1.978 1.423 1.00 0.00 H new ATOM 267 N SER A 22 -4.528 5.556 4.204 1.00 0.00 N ATOM 268 CA SER A 22 -5.649 6.464 4.412 1.00 0.00 C ATOM 269 C SER A 22 -5.464 7.748 3.609 1.00 0.00 C ATOM 270 O SER A 22 -6.403 8.246 2.987 1.00 0.00 O ATOM 271 CB SER A 22 -5.796 6.795 5.898 1.00 0.00 C ATOM 272 OG SER A 22 -7.073 7.345 6.174 1.00 0.00 O ATOM 0 H SER A 22 -3.952 5.401 5.031 1.00 0.00 H new ATOM 0 HA SER A 22 -6.556 5.967 4.067 1.00 0.00 H new ATOM 0 HB2 SER A 22 -5.649 5.892 6.491 1.00 0.00 H new ATOM 0 HB3 SER A 22 -5.021 7.501 6.195 1.00 0.00 H new ATOM 0 HG SER A 22 -7.143 7.547 7.131 1.00 0.00 H new ATOM 278 N HIS A 23 -4.246 8.280 3.628 1.00 0.00 N ATOM 279 CA HIS A 23 -3.936 9.507 2.902 1.00 0.00 C ATOM 280 C HIS A 23 -2.429 9.734 2.839 1.00 0.00 C ATOM 281 O HIS A 23 -1.648 8.929 3.343 1.00 0.00 O ATOM 282 CB HIS A 23 -4.617 10.704 3.566 1.00 0.00 C ATOM 283 CG HIS A 23 -4.015 11.080 4.885 1.00 0.00 C ATOM 284 ND1 HIS A 23 -4.478 10.595 6.090 1.00 0.00 N ATOM 285 CD2 HIS A 23 -2.979 11.898 5.184 1.00 0.00 C ATOM 286 CE1 HIS A 23 -3.754 11.100 7.073 1.00 0.00 C ATOM 287 NE2 HIS A 23 -2.838 11.894 6.550 1.00 0.00 N ATOM 0 H HIS A 23 -3.458 7.881 4.138 1.00 0.00 H new ATOM 0 HA HIS A 23 -4.313 9.403 1.885 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -4.564 11.561 2.894 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -5.673 10.477 3.710 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -2.376 12.451 4.479 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -3.889 10.898 8.125 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -2.139 12.419 7.075 1.00 0.00 H new ATOM 296 N GLY A 24 -2.027 10.838 2.216 1.00 0.00 N ATOM 297 CA GLY A 24 -0.615 11.151 2.098 1.00 0.00 C ATOM 298 C GLY A 24 -0.371 12.477 1.405 1.00 0.00 C ATOM 299 O GLY A 24 -1.302 13.251 1.187 1.00 0.00 O ATOM 0 H GLY A 24 -2.654 11.521 1.791 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -0.167 11.176 3.092 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -0.115 10.357 1.543 1.00 0.00 H new ATOM 303 N MET A 25 0.885 12.741 1.060 1.00 0.00 N ATOM 304 CA MET A 25 1.248 13.983 0.388 1.00 0.00 C ATOM 305 C MET A 25 2.321 13.736 -0.668 1.00 0.00 C ATOM 306 O MET A 25 3.080 12.771 -0.583 1.00 0.00 O ATOM 307 CB MET A 25 1.745 15.012 1.405 1.00 0.00 C ATOM 308 CG MET A 25 0.746 15.301 2.514 1.00 0.00 C ATOM 309 SD MET A 25 1.534 15.903 4.019 1.00 0.00 S ATOM 310 CE MET A 25 2.154 14.372 4.712 1.00 0.00 C ATOM 0 H MET A 25 1.668 12.111 1.235 1.00 0.00 H new ATOM 0 HA MET A 25 0.358 14.372 -0.107 1.00 0.00 H new ATOM 0 HB2 MET A 25 2.674 14.653 1.848 1.00 0.00 H new ATOM 0 HB3 MET A 25 1.978 15.941 0.885 1.00 0.00 H new ATOM 0 HG2 MET A 25 0.026 16.041 2.165 1.00 0.00 H new ATOM 0 HG3 MET A 25 0.187 14.393 2.740 1.00 0.00 H new ATOM 0 HE1 MET A 25 1.697 14.203 5.687 1.00 0.00 H new ATOM 0 HE2 MET A 25 1.906 13.545 4.047 1.00 0.00 H new ATOM 0 HE3 MET A 25 3.236 14.436 4.825 1.00 0.00 H new ATOM 320 N VAL A 26 2.377 14.615 -1.665 1.00 0.00 N ATOM 321 CA VAL A 26 3.358 14.492 -2.737 1.00 0.00 C ATOM 322 C VAL A 26 4.779 14.501 -2.186 1.00 0.00 C ATOM 323 O VAL A 26 5.079 15.211 -1.227 1.00 0.00 O ATOM 324 CB VAL A 26 3.210 15.630 -3.764 1.00 0.00 C ATOM 325 CG1 VAL A 26 4.247 15.490 -4.869 1.00 0.00 C ATOM 326 CG2 VAL A 26 1.803 15.647 -4.342 1.00 0.00 C ATOM 0 H VAL A 26 1.755 15.419 -1.752 1.00 0.00 H new ATOM 0 HA VAL A 26 3.170 13.539 -3.231 1.00 0.00 H new ATOM 0 HB VAL A 26 3.381 16.579 -3.256 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.127 16.303 -5.585 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.247 15.531 -4.437 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.111 14.535 -5.377 1.00 0.00 H new ATOM 0 HG21 VAL A 26 1.717 16.457 -5.066 1.00 0.00 H new ATOM 0 HG22 VAL A 26 1.601 14.697 -4.836 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.082 15.799 -3.539 1.00 0.00 H new ATOM 336 N ASN A 27 5.651 13.707 -2.799 1.00 0.00 N ATOM 337 CA ASN A 27 7.042 13.623 -2.369 1.00 0.00 C ATOM 338 C ASN A 27 7.141 13.071 -0.951 1.00 0.00 C ATOM 339 O ASN A 27 7.963 13.522 -0.152 1.00 0.00 O ATOM 340 CB ASN A 27 7.703 15.001 -2.440 1.00 0.00 C ATOM 341 CG ASN A 27 8.342 15.267 -3.789 1.00 0.00 C ATOM 342 OD1 ASN A 27 9.407 14.734 -4.100 1.00 0.00 O ATOM 343 ND2 ASN A 27 7.693 16.096 -4.598 1.00 0.00 N ATOM 0 H ASN A 27 5.419 13.113 -3.595 1.00 0.00 H new ATOM 0 HA ASN A 27 7.564 12.942 -3.041 1.00 0.00 H new ATOM 0 HB2 ASN A 27 6.957 15.770 -2.236 1.00 0.00 H new ATOM 0 HB3 ASN A 27 8.461 15.078 -1.661 1.00 0.00 H new ATOM 0 HD21 ASN A 27 8.075 16.313 -5.519 1.00 0.00 H new ATOM 0 HD22 ASN A 27 6.813 16.515 -4.299 1.00 0.00 H new ATOM 350 N LYS A 28 6.298 12.091 -0.643 1.00 0.00 N ATOM 351 CA LYS A 28 6.290 11.474 0.679 1.00 0.00 C ATOM 352 C LYS A 28 5.974 9.985 0.582 1.00 0.00 C ATOM 353 O LYS A 28 4.917 9.580 0.097 1.00 0.00 O ATOM 354 CB LYS A 28 5.266 12.166 1.581 1.00 0.00 C ATOM 355 CG LYS A 28 5.520 13.653 1.761 1.00 0.00 C ATOM 356 CD LYS A 28 6.508 13.917 2.885 1.00 0.00 C ATOM 357 CE LYS A 28 7.204 15.259 2.711 1.00 0.00 C ATOM 358 NZ LYS A 28 8.281 15.460 3.719 1.00 0.00 N ATOM 0 H LYS A 28 5.611 11.707 -1.291 1.00 0.00 H new ATOM 0 HA LYS A 28 7.283 11.589 1.113 1.00 0.00 H new ATOM 0 HB2 LYS A 28 4.270 12.024 1.161 1.00 0.00 H new ATOM 0 HB3 LYS A 28 5.271 11.684 2.559 1.00 0.00 H new ATOM 0 HG2 LYS A 28 5.904 14.073 0.831 1.00 0.00 H new ATOM 0 HG3 LYS A 28 4.579 14.161 1.975 1.00 0.00 H new ATOM 0 HD2 LYS A 28 5.986 13.898 3.842 1.00 0.00 H new ATOM 0 HD3 LYS A 28 7.252 13.121 2.912 1.00 0.00 H new ATOM 0 HE2 LYS A 28 7.628 15.321 1.709 1.00 0.00 H new ATOM 0 HE3 LYS A 28 6.472 16.062 2.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 8.731 16.385 3.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 7.873 15.427 4.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 8.993 14.709 3.620 1.00 0.00 H new ATOM 372 N PRO A 29 6.910 9.149 1.056 1.00 0.00 N ATOM 373 CA PRO A 29 6.752 7.692 1.036 1.00 0.00 C ATOM 374 C PRO A 29 5.687 7.210 2.015 1.00 0.00 C ATOM 375 O PRO A 29 5.927 7.131 3.219 1.00 0.00 O ATOM 376 CB PRO A 29 8.133 7.180 1.454 1.00 0.00 C ATOM 377 CG PRO A 29 8.723 8.291 2.253 1.00 0.00 C ATOM 378 CD PRO A 29 8.193 9.562 1.648 1.00 0.00 C ATOM 0 HA PRO A 29 6.425 7.331 0.061 1.00 0.00 H new ATOM 0 HB2 PRO A 29 8.055 6.267 2.044 1.00 0.00 H new ATOM 0 HB3 PRO A 29 8.749 6.947 0.585 1.00 0.00 H new ATOM 0 HG2 PRO A 29 8.440 8.210 3.302 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.812 8.264 2.214 1.00 0.00 H new ATOM 0 HD2 PRO A 29 8.057 10.339 2.400 1.00 0.00 H new ATOM 0 HD3 PRO A 29 8.872 9.963 0.896 1.00 0.00 H new ATOM 386 N ALA A 30 4.509 6.890 1.489 1.00 0.00 N ATOM 387 CA ALA A 30 3.407 6.414 2.317 1.00 0.00 C ATOM 388 C ALA A 30 3.733 5.060 2.938 1.00 0.00 C ATOM 389 O ALA A 30 3.657 4.025 2.274 1.00 0.00 O ATOM 390 CB ALA A 30 2.129 6.326 1.495 1.00 0.00 C ATOM 0 H ALA A 30 4.293 6.952 0.494 1.00 0.00 H new ATOM 0 HA ALA A 30 3.257 7.129 3.126 1.00 0.00 H new ATOM 0 HB1 ALA A 30 1.315 5.969 2.126 1.00 0.00 H new ATOM 0 HB2 ALA A 30 1.880 7.312 1.103 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.276 5.633 0.666 1.00 0.00 H new ATOM 396 N THR A 31 4.096 5.072 4.217 1.00 0.00 N ATOM 397 CA THR A 31 4.436 3.846 4.927 1.00 0.00 C ATOM 398 C THR A 31 3.203 3.229 5.579 1.00 0.00 C ATOM 399 O THR A 31 2.473 3.901 6.309 1.00 0.00 O ATOM 400 CB THR A 31 5.502 4.100 6.009 1.00 0.00 C ATOM 401 OG1 THR A 31 4.952 4.901 7.061 1.00 0.00 O ATOM 402 CG2 THR A 31 6.718 4.796 5.418 1.00 0.00 C ATOM 0 H THR A 31 4.162 5.918 4.782 1.00 0.00 H new ATOM 0 HA THR A 31 4.838 3.154 4.187 1.00 0.00 H new ATOM 0 HB THR A 31 5.815 3.137 6.412 1.00 0.00 H new ATOM 0 HG1 THR A 31 3.973 4.870 7.018 1.00 0.00 H new ATOM 0 HG21 THR A 31 7.457 4.965 6.201 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.152 4.170 4.638 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.418 5.753 4.990 1.00 0.00 H new ATOM 410 N PHE A 32 2.977 1.947 5.312 1.00 0.00 N ATOM 411 CA PHE A 32 1.832 1.240 5.873 1.00 0.00 C ATOM 412 C PHE A 32 2.193 -0.206 6.200 1.00 0.00 C ATOM 413 O PHE A 32 3.183 -0.740 5.699 1.00 0.00 O ATOM 414 CB PHE A 32 0.655 1.276 4.896 1.00 0.00 C ATOM 415 CG PHE A 32 0.940 0.594 3.589 1.00 0.00 C ATOM 416 CD1 PHE A 32 0.678 -0.757 3.426 1.00 0.00 C ATOM 417 CD2 PHE A 32 1.470 1.303 2.523 1.00 0.00 C ATOM 418 CE1 PHE A 32 0.939 -1.388 2.224 1.00 0.00 C ATOM 419 CE2 PHE A 32 1.733 0.678 1.319 1.00 0.00 C ATOM 420 CZ PHE A 32 1.468 -0.670 1.170 1.00 0.00 C ATOM 0 H PHE A 32 3.572 1.377 4.711 1.00 0.00 H new ATOM 0 HA PHE A 32 1.543 1.742 6.797 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.209 0.803 5.363 1.00 0.00 H new ATOM 0 HB3 PHE A 32 0.385 2.314 4.704 1.00 0.00 H new ATOM 0 HD1 PHE A 32 0.265 -1.324 4.248 1.00 0.00 H new ATOM 0 HD2 PHE A 32 1.680 2.357 2.634 1.00 0.00 H new ATOM 0 HE1 PHE A 32 0.729 -2.441 2.110 1.00 0.00 H new ATOM 0 HE2 PHE A 32 2.145 1.242 0.496 1.00 0.00 H new ATOM 0 HZ PHE A 32 1.674 -1.161 0.231 1.00 0.00 H new ATOM 430 N THR A 33 1.381 -0.836 7.043 1.00 0.00 N ATOM 431 CA THR A 33 1.614 -2.220 7.439 1.00 0.00 C ATOM 432 C THR A 33 0.589 -3.153 6.805 1.00 0.00 C ATOM 433 O THR A 33 -0.558 -2.767 6.577 1.00 0.00 O ATOM 434 CB THR A 33 1.562 -2.383 8.970 1.00 0.00 C ATOM 435 OG1 THR A 33 2.796 -1.947 9.551 1.00 0.00 O ATOM 436 CG2 THR A 33 1.299 -3.832 9.351 1.00 0.00 C ATOM 0 H THR A 33 0.556 -0.410 7.465 1.00 0.00 H new ATOM 0 HA THR A 33 2.611 -2.486 7.087 1.00 0.00 H new ATOM 0 HB THR A 33 0.745 -1.770 9.352 1.00 0.00 H new ATOM 0 HG1 THR A 33 2.754 -2.052 10.524 1.00 0.00 H new ATOM 0 HG21 THR A 33 1.267 -3.923 10.437 1.00 0.00 H new ATOM 0 HG22 THR A 33 0.345 -4.151 8.932 1.00 0.00 H new ATOM 0 HG23 THR A 33 2.097 -4.462 8.958 1.00 0.00 H new ATOM 444 N ILE A 34 1.010 -4.381 6.522 1.00 0.00 N ATOM 445 CA ILE A 34 0.127 -5.370 5.915 1.00 0.00 C ATOM 446 C ILE A 34 0.049 -6.633 6.767 1.00 0.00 C ATOM 447 O ILE A 34 1.039 -7.346 6.931 1.00 0.00 O ATOM 448 CB ILE A 34 0.595 -5.748 4.498 1.00 0.00 C ATOM 449 CG1 ILE A 34 0.725 -4.495 3.629 1.00 0.00 C ATOM 450 CG2 ILE A 34 -0.373 -6.738 3.867 1.00 0.00 C ATOM 451 CD1 ILE A 34 1.303 -4.768 2.258 1.00 0.00 C ATOM 0 H ILE A 34 1.957 -4.715 6.703 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.861 -4.915 5.852 1.00 0.00 H new ATOM 0 HB ILE A 34 1.574 -6.222 4.569 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -0.258 -4.038 3.516 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.356 -3.770 4.143 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -0.029 -6.996 2.865 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.421 -7.640 4.477 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -1.364 -6.289 3.805 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.366 -3.835 1.697 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.300 -5.197 2.362 1.00 0.00 H new ATOM 0 HD13 ILE A 34 0.660 -5.469 1.725 1.00 0.00 H new ATOM 463 N VAL A 35 -1.136 -6.905 7.304 1.00 0.00 N ATOM 464 CA VAL A 35 -1.345 -8.084 8.136 1.00 0.00 C ATOM 465 C VAL A 35 -1.239 -9.363 7.314 1.00 0.00 C ATOM 466 O VAL A 35 -2.197 -9.777 6.661 1.00 0.00 O ATOM 467 CB VAL A 35 -2.721 -8.045 8.829 1.00 0.00 C ATOM 468 CG1 VAL A 35 -2.943 -9.308 9.646 1.00 0.00 C ATOM 469 CG2 VAL A 35 -2.842 -6.806 9.703 1.00 0.00 C ATOM 0 H VAL A 35 -1.966 -6.325 7.178 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.563 -8.078 8.895 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.494 -7.997 8.062 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.920 -9.263 10.128 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -2.902 -10.178 8.990 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -2.167 -9.391 10.407 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -3.820 -6.795 10.185 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.062 -6.820 10.465 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.731 -5.914 9.087 1.00 0.00 H new ATOM 479 N THR A 36 -0.065 -9.987 7.350 1.00 0.00 N ATOM 480 CA THR A 36 0.168 -11.219 6.607 1.00 0.00 C ATOM 481 C THR A 36 0.696 -12.319 7.521 1.00 0.00 C ATOM 482 O THR A 36 1.420 -13.212 7.080 1.00 0.00 O ATOM 483 CB THR A 36 1.167 -11.000 5.455 1.00 0.00 C ATOM 484 OG1 THR A 36 2.397 -10.475 5.967 1.00 0.00 O ATOM 485 CG2 THR A 36 0.596 -10.047 4.417 1.00 0.00 C ATOM 0 H THR A 36 0.739 -9.659 7.886 1.00 0.00 H new ATOM 0 HA THR A 36 -0.792 -11.525 6.191 1.00 0.00 H new ATOM 0 HB THR A 36 1.354 -11.962 4.977 1.00 0.00 H new ATOM 0 HG1 THR A 36 3.027 -10.340 5.229 1.00 0.00 H new ATOM 0 HG21 THR A 36 1.319 -9.908 3.614 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.325 -10.463 4.008 1.00 0.00 H new ATOM 0 HG23 THR A 36 0.383 -9.085 4.884 1.00 0.00 H new ATOM 493 N LYS A 37 0.328 -12.251 8.795 1.00 0.00 N ATOM 494 CA LYS A 37 0.762 -13.242 9.772 1.00 0.00 C ATOM 495 C LYS A 37 -0.146 -14.468 9.744 1.00 0.00 C ATOM 496 O LYS A 37 0.326 -15.599 9.625 1.00 0.00 O ATOM 497 CB LYS A 37 0.773 -12.635 11.176 1.00 0.00 C ATOM 498 CG LYS A 37 0.909 -13.665 12.284 1.00 0.00 C ATOM 499 CD LYS A 37 1.528 -13.062 13.534 1.00 0.00 C ATOM 500 CE LYS A 37 1.325 -13.959 14.745 1.00 0.00 C ATOM 501 NZ LYS A 37 2.382 -15.003 14.846 1.00 0.00 N ATOM 0 H LYS A 37 -0.271 -11.519 9.176 1.00 0.00 H new ATOM 0 HA LYS A 37 1.773 -13.554 9.510 1.00 0.00 H new ATOM 0 HB2 LYS A 37 1.597 -11.925 11.249 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -0.148 -12.072 11.326 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -0.072 -14.074 12.524 1.00 0.00 H new ATOM 0 HG3 LYS A 37 1.524 -14.495 11.937 1.00 0.00 H new ATOM 0 HD2 LYS A 37 2.594 -12.903 13.373 1.00 0.00 H new ATOM 0 HD3 LYS A 37 1.085 -12.085 13.725 1.00 0.00 H new ATOM 0 HE2 LYS A 37 1.326 -13.352 15.651 1.00 0.00 H new ATOM 0 HE3 LYS A 37 0.347 -14.437 14.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 2.208 -15.593 15.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 2.365 -15.598 13.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 3.313 -14.547 14.931 1.00 0.00 H new ATOM 515 N ASP A 38 -1.449 -14.235 9.852 1.00 0.00 N ATOM 516 CA ASP A 38 -2.423 -15.320 9.836 1.00 0.00 C ATOM 517 C ASP A 38 -2.412 -16.041 8.491 1.00 0.00 C ATOM 518 O ASP A 38 -2.287 -17.264 8.433 1.00 0.00 O ATOM 519 CB ASP A 38 -3.824 -14.781 10.127 1.00 0.00 C ATOM 520 CG ASP A 38 -3.928 -14.152 11.503 1.00 0.00 C ATOM 521 OD1 ASP A 38 -3.441 -13.015 11.674 1.00 0.00 O ATOM 522 OD2 ASP A 38 -4.497 -14.797 12.408 1.00 0.00 O ATOM 0 H ASP A 38 -1.855 -13.305 9.952 1.00 0.00 H new ATOM 0 HA ASP A 38 -2.148 -16.033 10.613 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -4.090 -14.042 9.372 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -4.547 -15.593 10.046 1.00 0.00 H new ATOM 527 N ALA A 39 -2.544 -15.275 7.414 1.00 0.00 N ATOM 528 CA ALA A 39 -2.548 -15.841 6.070 1.00 0.00 C ATOM 529 C ALA A 39 -1.272 -16.632 5.804 1.00 0.00 C ATOM 530 O ALA A 39 -1.317 -17.743 5.278 1.00 0.00 O ATOM 531 CB ALA A 39 -2.714 -14.739 5.034 1.00 0.00 C ATOM 0 H ALA A 39 -2.650 -14.261 7.445 1.00 0.00 H new ATOM 0 HA ALA A 39 -3.392 -16.527 5.993 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -2.715 -15.176 4.035 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -3.657 -14.219 5.204 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -1.889 -14.032 5.120 1.00 0.00 H new ATOM 537 N GLY A 40 -0.133 -16.051 6.170 1.00 0.00 N ATOM 538 CA GLY A 40 1.139 -16.716 5.962 1.00 0.00 C ATOM 539 C GLY A 40 1.703 -16.469 4.576 1.00 0.00 C ATOM 540 O GLY A 40 0.957 -16.398 3.600 1.00 0.00 O ATOM 0 H GLY A 40 -0.069 -15.131 6.607 1.00 0.00 H new ATOM 0 HA2 GLY A 40 1.853 -16.369 6.709 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.014 -17.788 6.114 1.00 0.00 H new ATOM 544 N GLU A 41 3.023 -16.336 4.490 1.00 0.00 N ATOM 545 CA GLU A 41 3.684 -16.093 3.214 1.00 0.00 C ATOM 546 C GLU A 41 3.043 -16.920 2.103 1.00 0.00 C ATOM 547 O GLU A 41 2.926 -18.140 2.211 1.00 0.00 O ATOM 548 CB GLU A 41 5.175 -16.423 3.315 1.00 0.00 C ATOM 549 CG GLU A 41 5.455 -17.888 3.602 1.00 0.00 C ATOM 550 CD GLU A 41 6.923 -18.159 3.873 1.00 0.00 C ATOM 551 OE1 GLU A 41 7.774 -17.567 3.177 1.00 0.00 O ATOM 552 OE2 GLU A 41 7.220 -18.964 4.780 1.00 0.00 O ATOM 0 H GLU A 41 3.655 -16.392 5.289 1.00 0.00 H new ATOM 0 HA GLU A 41 3.569 -15.037 2.970 1.00 0.00 H new ATOM 0 HB2 GLU A 41 5.664 -16.144 2.382 1.00 0.00 H new ATOM 0 HB3 GLU A 41 5.621 -15.815 4.103 1.00 0.00 H new ATOM 0 HG2 GLU A 41 4.866 -18.205 4.463 1.00 0.00 H new ATOM 0 HG3 GLU A 41 5.129 -18.489 2.754 1.00 0.00 H new ATOM 559 N GLY A 42 2.630 -16.246 1.034 1.00 0.00 N ATOM 560 CA GLY A 42 2.005 -16.934 -0.081 1.00 0.00 C ATOM 561 C GLY A 42 2.189 -16.197 -1.393 1.00 0.00 C ATOM 562 O GLY A 42 3.273 -15.694 -1.684 1.00 0.00 O ATOM 0 H GLY A 42 2.717 -15.236 0.920 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.426 -17.936 -0.168 1.00 0.00 H new ATOM 0 HA3 GLY A 42 0.940 -17.052 0.120 1.00 0.00 H new ATOM 566 N GLY A 43 1.125 -16.133 -2.188 1.00 0.00 N ATOM 567 CA GLY A 43 1.195 -15.452 -3.467 1.00 0.00 C ATOM 568 C GLY A 43 0.590 -14.063 -3.419 1.00 0.00 C ATOM 569 O GLY A 43 -0.380 -13.775 -4.121 1.00 0.00 O ATOM 0 H GLY A 43 0.216 -16.541 -1.969 1.00 0.00 H new ATOM 0 HA2 GLY A 43 2.237 -15.380 -3.780 1.00 0.00 H new ATOM 0 HA3 GLY A 43 0.676 -16.045 -4.220 1.00 0.00 H new ATOM 573 N LEU A 44 1.161 -13.199 -2.586 1.00 0.00 N ATOM 574 CA LEU A 44 0.671 -11.832 -2.447 1.00 0.00 C ATOM 575 C LEU A 44 1.119 -10.970 -3.622 1.00 0.00 C ATOM 576 O LEU A 44 2.129 -11.256 -4.265 1.00 0.00 O ATOM 577 CB LEU A 44 1.167 -11.223 -1.134 1.00 0.00 C ATOM 578 CG LEU A 44 0.563 -9.872 -0.751 1.00 0.00 C ATOM 579 CD1 LEU A 44 -0.728 -10.066 0.029 1.00 0.00 C ATOM 580 CD2 LEU A 44 1.558 -9.053 0.058 1.00 0.00 C ATOM 0 H LEU A 44 1.964 -13.421 -1.997 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.419 -11.862 -2.438 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.965 -11.930 -0.329 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.249 -11.110 -1.195 1.00 0.00 H new ATOM 0 HG LEU A 44 0.332 -9.327 -1.666 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -1.143 -9.093 0.293 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.445 -10.612 -0.584 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.522 -10.631 0.938 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.111 -8.095 0.322 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.820 -9.594 0.967 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.457 -8.883 -0.535 1.00 0.00 H new ATOM 592 N SER A 45 0.362 -9.913 -3.897 1.00 0.00 N ATOM 593 CA SER A 45 0.681 -9.009 -4.996 1.00 0.00 C ATOM 594 C SER A 45 0.575 -7.554 -4.551 1.00 0.00 C ATOM 595 O SER A 45 -0.214 -7.218 -3.667 1.00 0.00 O ATOM 596 CB SER A 45 -0.255 -9.262 -6.180 1.00 0.00 C ATOM 597 OG SER A 45 0.377 -8.943 -7.407 1.00 0.00 O ATOM 0 H SER A 45 -0.477 -9.661 -3.374 1.00 0.00 H new ATOM 0 HA SER A 45 1.708 -9.202 -5.306 1.00 0.00 H new ATOM 0 HB2 SER A 45 -0.563 -10.308 -6.187 1.00 0.00 H new ATOM 0 HB3 SER A 45 -1.159 -8.664 -6.067 1.00 0.00 H new ATOM 0 HG SER A 45 -0.241 -9.115 -8.148 1.00 0.00 H new ATOM 603 N LEU A 46 1.374 -6.693 -5.171 1.00 0.00 N ATOM 604 CA LEU A 46 1.371 -5.272 -4.841 1.00 0.00 C ATOM 605 C LEU A 46 1.459 -4.419 -6.102 1.00 0.00 C ATOM 606 O LEU A 46 2.282 -4.675 -6.981 1.00 0.00 O ATOM 607 CB LEU A 46 2.538 -4.943 -3.907 1.00 0.00 C ATOM 608 CG LEU A 46 2.401 -5.430 -2.464 1.00 0.00 C ATOM 609 CD1 LEU A 46 3.771 -5.674 -1.851 1.00 0.00 C ATOM 610 CD2 LEU A 46 1.614 -4.426 -1.635 1.00 0.00 C ATOM 0 H LEU A 46 2.032 -6.954 -5.905 1.00 0.00 H new ATOM 0 HA LEU A 46 0.433 -5.044 -4.336 1.00 0.00 H new ATOM 0 HB2 LEU A 46 3.447 -5.372 -4.329 1.00 0.00 H new ATOM 0 HB3 LEU A 46 2.672 -3.861 -3.893 1.00 0.00 H new ATOM 0 HG LEU A 46 1.855 -6.373 -2.469 1.00 0.00 H new ATOM 0 HD11 LEU A 46 3.654 -6.020 -0.824 1.00 0.00 H new ATOM 0 HD12 LEU A 46 4.299 -6.431 -2.431 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.343 -4.746 -1.858 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.526 -4.789 -0.611 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.132 -3.467 -1.637 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.619 -4.302 -2.062 1.00 0.00 H new ATOM 622 N ALA A 47 0.606 -3.403 -6.184 1.00 0.00 N ATOM 623 CA ALA A 47 0.590 -2.510 -7.335 1.00 0.00 C ATOM 624 C ALA A 47 -0.257 -1.272 -7.058 1.00 0.00 C ATOM 625 O ALA A 47 -1.319 -1.359 -6.441 1.00 0.00 O ATOM 626 CB ALA A 47 0.071 -3.242 -8.564 1.00 0.00 C ATOM 0 H ALA A 47 -0.083 -3.178 -5.466 1.00 0.00 H new ATOM 0 HA ALA A 47 1.613 -2.184 -7.524 1.00 0.00 H new ATOM 0 HB1 ALA A 47 0.064 -2.563 -9.416 1.00 0.00 H new ATOM 0 HB2 ALA A 47 0.718 -4.091 -8.782 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.942 -3.597 -8.375 1.00 0.00 H new ATOM 632 N VAL A 48 0.219 -0.120 -7.518 1.00 0.00 N ATOM 633 CA VAL A 48 -0.494 1.136 -7.320 1.00 0.00 C ATOM 634 C VAL A 48 -0.873 1.769 -8.654 1.00 0.00 C ATOM 635 O VAL A 48 -0.047 1.873 -9.560 1.00 0.00 O ATOM 636 CB VAL A 48 0.348 2.139 -6.510 1.00 0.00 C ATOM 637 CG1 VAL A 48 -0.357 3.484 -6.425 1.00 0.00 C ATOM 638 CG2 VAL A 48 0.637 1.591 -5.120 1.00 0.00 C ATOM 0 H VAL A 48 1.096 -0.030 -8.031 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.400 0.900 -6.762 1.00 0.00 H new ATOM 0 HB VAL A 48 1.298 2.286 -7.023 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.254 4.179 -5.849 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.508 3.880 -7.429 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.323 3.358 -5.936 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.233 2.312 -4.561 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.302 1.413 -4.596 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.188 0.654 -5.205 1.00 0.00 H new ATOM 648 N GLU A 49 -2.129 2.191 -8.768 1.00 0.00 N ATOM 649 CA GLU A 49 -2.617 2.814 -9.992 1.00 0.00 C ATOM 650 C GLU A 49 -3.234 4.179 -9.700 1.00 0.00 C ATOM 651 O GLU A 49 -4.299 4.274 -9.091 1.00 0.00 O ATOM 652 CB GLU A 49 -3.648 1.912 -10.674 1.00 0.00 C ATOM 653 CG GLU A 49 -3.030 0.813 -11.521 1.00 0.00 C ATOM 654 CD GLU A 49 -2.606 1.302 -12.892 1.00 0.00 C ATOM 655 OE1 GLU A 49 -3.491 1.673 -13.691 1.00 0.00 O ATOM 656 OE2 GLU A 49 -1.387 1.315 -13.166 1.00 0.00 O ATOM 0 H GLU A 49 -2.826 2.112 -8.028 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.768 2.954 -10.661 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.282 1.459 -9.912 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.294 2.524 -11.303 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.164 0.403 -11.002 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.747 0.000 -11.635 1.00 0.00 H new ATOM 663 N GLY A 50 -2.555 5.235 -10.139 1.00 0.00 N ATOM 664 CA GLY A 50 -3.050 6.580 -9.914 1.00 0.00 C ATOM 665 C GLY A 50 -2.594 7.552 -10.985 1.00 0.00 C ATOM 666 O GLY A 50 -2.291 7.166 -12.114 1.00 0.00 O ATOM 0 H GLY A 50 -1.672 5.183 -10.646 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.139 6.563 -9.883 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.709 6.931 -8.940 1.00 0.00 H new ATOM 670 N PRO A 51 -2.544 8.845 -10.633 1.00 0.00 N ATOM 671 CA PRO A 51 -2.124 9.901 -11.559 1.00 0.00 C ATOM 672 C PRO A 51 -0.636 9.830 -11.884 1.00 0.00 C ATOM 673 O PRO A 51 -0.125 10.624 -12.674 1.00 0.00 O ATOM 674 CB PRO A 51 -2.444 11.189 -10.797 1.00 0.00 C ATOM 675 CG PRO A 51 -2.406 10.798 -9.360 1.00 0.00 C ATOM 676 CD PRO A 51 -2.892 9.376 -9.305 1.00 0.00 C ATOM 0 HA PRO A 51 -2.629 9.822 -12.522 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -1.715 11.969 -11.014 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -3.422 11.581 -11.075 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.396 10.881 -8.960 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -3.041 11.451 -8.761 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -2.404 8.815 -8.508 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -3.965 9.325 -9.120 1.00 0.00 H new ATOM 684 N SER A 52 0.054 8.874 -11.271 1.00 0.00 N ATOM 685 CA SER A 52 1.485 8.701 -11.493 1.00 0.00 C ATOM 686 C SER A 52 1.972 7.385 -10.896 1.00 0.00 C ATOM 687 O SER A 52 1.532 6.975 -9.821 1.00 0.00 O ATOM 688 CB SER A 52 2.261 9.869 -10.882 1.00 0.00 C ATOM 689 OG SER A 52 3.490 10.074 -11.558 1.00 0.00 O ATOM 0 H SER A 52 -0.355 8.207 -10.616 1.00 0.00 H new ATOM 0 HA SER A 52 1.661 8.679 -12.568 1.00 0.00 H new ATOM 0 HB2 SER A 52 1.659 10.776 -10.933 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.451 9.671 -9.827 1.00 0.00 H new ATOM 0 HG SER A 52 3.577 11.020 -11.799 1.00 0.00 H new ATOM 695 N LYS A 53 2.884 6.724 -11.601 1.00 0.00 N ATOM 696 CA LYS A 53 3.434 5.454 -11.143 1.00 0.00 C ATOM 697 C LYS A 53 4.403 5.667 -9.984 1.00 0.00 C ATOM 698 O LYS A 53 5.547 6.073 -10.186 1.00 0.00 O ATOM 699 CB LYS A 53 4.147 4.739 -12.293 1.00 0.00 C ATOM 700 CG LYS A 53 4.147 3.226 -12.161 1.00 0.00 C ATOM 701 CD LYS A 53 4.574 2.554 -13.455 1.00 0.00 C ATOM 702 CE LYS A 53 6.089 2.508 -13.586 1.00 0.00 C ATOM 703 NZ LYS A 53 6.515 1.980 -14.912 1.00 0.00 N ATOM 0 H LYS A 53 3.258 7.048 -12.493 1.00 0.00 H new ATOM 0 HA LYS A 53 2.608 4.834 -10.794 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.668 5.013 -13.233 1.00 0.00 H new ATOM 0 HB3 LYS A 53 5.177 5.091 -12.345 1.00 0.00 H new ATOM 0 HG2 LYS A 53 4.820 2.930 -11.357 1.00 0.00 H new ATOM 0 HG3 LYS A 53 3.150 2.884 -11.884 1.00 0.00 H new ATOM 0 HD2 LYS A 53 4.174 1.541 -13.489 1.00 0.00 H new ATOM 0 HD3 LYS A 53 4.151 3.093 -14.303 1.00 0.00 H new ATOM 0 HE2 LYS A 53 6.496 3.509 -13.446 1.00 0.00 H new ATOM 0 HE3 LYS A 53 6.503 1.882 -12.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 7.554 1.964 -14.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 6.148 1.015 -15.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 6.141 2.592 -15.666 1.00 0.00 H new ATOM 717 N ALA A 54 3.938 5.390 -8.771 1.00 0.00 N ATOM 718 CA ALA A 54 4.764 5.548 -7.581 1.00 0.00 C ATOM 719 C ALA A 54 5.510 4.258 -7.255 1.00 0.00 C ATOM 720 O ALA A 54 4.915 3.182 -7.207 1.00 0.00 O ATOM 721 CB ALA A 54 3.910 5.978 -6.398 1.00 0.00 C ATOM 0 H ALA A 54 2.993 5.055 -8.586 1.00 0.00 H new ATOM 0 HA ALA A 54 5.503 6.324 -7.783 1.00 0.00 H new ATOM 0 HB1 ALA A 54 4.541 6.092 -5.516 1.00 0.00 H new ATOM 0 HB2 ALA A 54 3.427 6.929 -6.624 1.00 0.00 H new ATOM 0 HB3 ALA A 54 3.149 5.222 -6.205 1.00 0.00 H new ATOM 727 N GLU A 55 6.816 4.375 -7.033 1.00 0.00 N ATOM 728 CA GLU A 55 7.642 3.217 -6.714 1.00 0.00 C ATOM 729 C GLU A 55 7.215 2.592 -5.389 1.00 0.00 C ATOM 730 O GLU A 55 7.064 3.287 -4.384 1.00 0.00 O ATOM 731 CB GLU A 55 9.118 3.617 -6.650 1.00 0.00 C ATOM 732 CG GLU A 55 9.724 3.927 -8.008 1.00 0.00 C ATOM 733 CD GLU A 55 10.952 4.811 -7.911 1.00 0.00 C ATOM 734 OE1 GLU A 55 10.801 5.998 -7.554 1.00 0.00 O ATOM 735 OE2 GLU A 55 12.064 4.316 -8.192 1.00 0.00 O ATOM 0 H GLU A 55 7.324 5.259 -7.068 1.00 0.00 H new ATOM 0 HA GLU A 55 7.507 2.478 -7.504 1.00 0.00 H new ATOM 0 HB2 GLU A 55 9.221 4.491 -6.007 1.00 0.00 H new ATOM 0 HB3 GLU A 55 9.684 2.811 -6.184 1.00 0.00 H new ATOM 0 HG2 GLU A 55 9.991 2.994 -8.504 1.00 0.00 H new ATOM 0 HG3 GLU A 55 8.977 4.417 -8.632 1.00 0.00 H new ATOM 742 N ILE A 56 7.022 1.278 -5.396 1.00 0.00 N ATOM 743 CA ILE A 56 6.613 0.559 -4.196 1.00 0.00 C ATOM 744 C ILE A 56 7.758 -0.281 -3.641 1.00 0.00 C ATOM 745 O ILE A 56 8.270 -1.175 -4.314 1.00 0.00 O ATOM 746 CB ILE A 56 5.406 -0.357 -4.471 1.00 0.00 C ATOM 747 CG1 ILE A 56 4.344 0.392 -5.280 1.00 0.00 C ATOM 748 CG2 ILE A 56 4.820 -0.869 -3.164 1.00 0.00 C ATOM 749 CD1 ILE A 56 3.517 -0.508 -6.172 1.00 0.00 C ATOM 0 H ILE A 56 7.142 0.689 -6.220 1.00 0.00 H new ATOM 0 HA ILE A 56 6.327 1.311 -3.461 1.00 0.00 H new ATOM 0 HB ILE A 56 5.744 -1.213 -5.054 1.00 0.00 H new ATOM 0 HG12 ILE A 56 3.681 0.919 -4.594 1.00 0.00 H new ATOM 0 HG13 ILE A 56 4.833 1.148 -5.894 1.00 0.00 H new ATOM 0 HG21 ILE A 56 3.968 -1.515 -3.376 1.00 0.00 H new ATOM 0 HG22 ILE A 56 5.578 -1.434 -2.622 1.00 0.00 H new ATOM 0 HG23 ILE A 56 4.494 -0.025 -2.556 1.00 0.00 H new ATOM 0 HD11 ILE A 56 2.785 0.091 -6.715 1.00 0.00 H new ATOM 0 HD12 ILE A 56 4.170 -1.015 -6.882 1.00 0.00 H new ATOM 0 HD13 ILE A 56 2.999 -1.248 -5.562 1.00 0.00 H new ATOM 761 N THR A 57 8.155 0.012 -2.406 1.00 0.00 N ATOM 762 CA THR A 57 9.239 -0.717 -1.759 1.00 0.00 C ATOM 763 C THR A 57 8.712 -1.603 -0.636 1.00 0.00 C ATOM 764 O THR A 57 8.188 -1.109 0.363 1.00 0.00 O ATOM 765 CB THR A 57 10.298 0.244 -1.186 1.00 0.00 C ATOM 766 OG1 THR A 57 10.734 1.155 -2.202 1.00 0.00 O ATOM 767 CG2 THR A 57 11.491 -0.527 -0.644 1.00 0.00 C ATOM 0 H THR A 57 7.742 0.749 -1.834 1.00 0.00 H new ATOM 0 HA THR A 57 9.701 -1.341 -2.524 1.00 0.00 H new ATOM 0 HB THR A 57 9.844 0.803 -0.368 1.00 0.00 H new ATOM 0 HG1 THR A 57 11.406 1.764 -1.829 1.00 0.00 H new ATOM 0 HG21 THR A 57 12.225 0.173 -0.245 1.00 0.00 H new ATOM 0 HG22 THR A 57 11.161 -1.198 0.149 1.00 0.00 H new ATOM 0 HG23 THR A 57 11.943 -1.109 -1.447 1.00 0.00 H new ATOM 775 N CYS A 58 8.856 -2.912 -0.805 1.00 0.00 N ATOM 776 CA CYS A 58 8.395 -3.868 0.196 1.00 0.00 C ATOM 777 C CYS A 58 9.548 -4.324 1.084 1.00 0.00 C ATOM 778 O CYS A 58 10.614 -4.696 0.594 1.00 0.00 O ATOM 779 CB CYS A 58 7.748 -5.076 -0.482 1.00 0.00 C ATOM 780 SG CYS A 58 8.881 -6.038 -1.512 1.00 0.00 S ATOM 0 H CYS A 58 9.288 -3.336 -1.626 1.00 0.00 H new ATOM 0 HA CYS A 58 7.653 -3.372 0.822 1.00 0.00 H new ATOM 0 HB2 CYS A 58 7.328 -5.728 0.284 1.00 0.00 H new ATOM 0 HB3 CYS A 58 6.917 -4.732 -1.098 1.00 0.00 H new ATOM 0 HG CYS A 58 10.097 -5.889 -1.076 1.00 0.00 H new ATOM 786 N LYS A 59 9.327 -4.291 2.394 1.00 0.00 N ATOM 787 CA LYS A 59 10.347 -4.701 3.353 1.00 0.00 C ATOM 788 C LYS A 59 9.953 -6.004 4.042 1.00 0.00 C ATOM 789 O LYS A 59 8.784 -6.388 4.044 1.00 0.00 O ATOM 790 CB LYS A 59 10.564 -3.604 4.398 1.00 0.00 C ATOM 791 CG LYS A 59 11.632 -2.597 4.009 1.00 0.00 C ATOM 792 CD LYS A 59 11.783 -1.510 5.060 1.00 0.00 C ATOM 793 CE LYS A 59 12.411 -0.254 4.477 1.00 0.00 C ATOM 794 NZ LYS A 59 12.511 0.836 5.487 1.00 0.00 N ATOM 0 H LYS A 59 8.451 -3.985 2.816 1.00 0.00 H new ATOM 0 HA LYS A 59 11.277 -4.865 2.809 1.00 0.00 H new ATOM 0 HB2 LYS A 59 9.623 -3.078 4.562 1.00 0.00 H new ATOM 0 HB3 LYS A 59 10.840 -4.066 5.346 1.00 0.00 H new ATOM 0 HG2 LYS A 59 12.585 -3.109 3.875 1.00 0.00 H new ATOM 0 HG3 LYS A 59 11.375 -2.145 3.051 1.00 0.00 H new ATOM 0 HD2 LYS A 59 10.806 -1.269 5.478 1.00 0.00 H new ATOM 0 HD3 LYS A 59 12.399 -1.879 5.880 1.00 0.00 H new ATOM 0 HE2 LYS A 59 13.405 -0.488 4.096 1.00 0.00 H new ATOM 0 HE3 LYS A 59 11.817 0.089 3.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 12.944 1.675 5.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 11.560 1.077 5.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 13.099 0.518 6.284 1.00 0.00 H new ATOM 808 N ASP A 60 10.937 -6.678 4.627 1.00 0.00 N ATOM 809 CA ASP A 60 10.693 -7.937 5.322 1.00 0.00 C ATOM 810 C ASP A 60 10.851 -7.765 6.830 1.00 0.00 C ATOM 811 O ASP A 60 11.914 -7.378 7.312 1.00 0.00 O ATOM 812 CB ASP A 60 11.650 -9.017 4.817 1.00 0.00 C ATOM 813 CG ASP A 60 11.980 -10.043 5.883 1.00 0.00 C ATOM 814 OD1 ASP A 60 11.175 -10.977 6.077 1.00 0.00 O ATOM 815 OD2 ASP A 60 13.044 -9.912 6.525 1.00 0.00 O ATOM 0 H ASP A 60 11.911 -6.374 4.634 1.00 0.00 H new ATOM 0 HA ASP A 60 9.668 -8.245 5.115 1.00 0.00 H new ATOM 0 HB2 ASP A 60 11.205 -9.520 3.958 1.00 0.00 H new ATOM 0 HB3 ASP A 60 12.571 -8.549 4.470 1.00 0.00 H new ATOM 820 N ASN A 61 9.784 -8.053 7.568 1.00 0.00 N ATOM 821 CA ASN A 61 9.804 -7.929 9.021 1.00 0.00 C ATOM 822 C ASN A 61 10.248 -9.234 9.673 1.00 0.00 C ATOM 823 O ASN A 61 11.019 -9.231 10.634 1.00 0.00 O ATOM 824 CB ASN A 61 8.419 -7.533 9.539 1.00 0.00 C ATOM 825 CG ASN A 61 7.992 -6.161 9.055 1.00 0.00 C ATOM 826 OD1 ASN A 61 8.458 -5.139 9.559 1.00 0.00 O ATOM 827 ND2 ASN A 61 7.099 -6.132 8.072 1.00 0.00 N ATOM 0 H ASN A 61 8.895 -8.374 7.184 1.00 0.00 H new ATOM 0 HA ASN A 61 10.520 -7.150 9.284 1.00 0.00 H new ATOM 0 HB2 ASN A 61 7.688 -8.273 9.215 1.00 0.00 H new ATOM 0 HB3 ASN A 61 8.424 -7.546 10.629 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.773 -5.238 7.705 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.739 -7.004 7.684 1.00 0.00 H new ATOM 834 N LYS A 62 9.758 -10.350 9.144 1.00 0.00 N ATOM 835 CA LYS A 62 10.106 -11.665 9.672 1.00 0.00 C ATOM 836 C LYS A 62 9.430 -11.907 11.018 1.00 0.00 C ATOM 837 O LYS A 62 9.931 -12.665 11.848 1.00 0.00 O ATOM 838 CB LYS A 62 11.624 -11.792 9.822 1.00 0.00 C ATOM 839 CG LYS A 62 12.136 -13.209 9.635 1.00 0.00 C ATOM 840 CD LYS A 62 13.379 -13.468 10.470 1.00 0.00 C ATOM 841 CE LYS A 62 14.218 -14.595 9.888 1.00 0.00 C ATOM 842 NZ LYS A 62 13.644 -15.933 10.203 1.00 0.00 N ATOM 0 H LYS A 62 9.118 -10.371 8.350 1.00 0.00 H new ATOM 0 HA LYS A 62 9.752 -12.417 8.967 1.00 0.00 H new ATOM 0 HB2 LYS A 62 12.108 -11.140 9.095 1.00 0.00 H new ATOM 0 HB3 LYS A 62 11.914 -11.437 10.811 1.00 0.00 H new ATOM 0 HG2 LYS A 62 11.356 -13.918 9.912 1.00 0.00 H new ATOM 0 HG3 LYS A 62 12.362 -13.379 8.582 1.00 0.00 H new ATOM 0 HD2 LYS A 62 13.978 -12.559 10.525 1.00 0.00 H new ATOM 0 HD3 LYS A 62 13.087 -13.720 11.490 1.00 0.00 H new ATOM 0 HE2 LYS A 62 14.288 -14.475 8.807 1.00 0.00 H new ATOM 0 HE3 LYS A 62 15.233 -14.533 10.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 14.244 -16.674 9.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 13.601 -16.058 11.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 12.685 -16.002 9.806 1.00 0.00 H new ATOM 856 N ASP A 63 8.289 -11.259 11.226 1.00 0.00 N ATOM 857 CA ASP A 63 7.542 -11.406 12.470 1.00 0.00 C ATOM 858 C ASP A 63 6.082 -11.748 12.191 1.00 0.00 C ATOM 859 O ASP A 63 5.427 -12.418 12.988 1.00 0.00 O ATOM 860 CB ASP A 63 7.630 -10.122 13.297 1.00 0.00 C ATOM 861 CG ASP A 63 6.454 -9.960 14.240 1.00 0.00 C ATOM 862 OD1 ASP A 63 6.330 -10.773 15.181 1.00 0.00 O ATOM 863 OD2 ASP A 63 5.657 -9.020 14.038 1.00 0.00 O ATOM 0 H ASP A 63 7.861 -10.627 10.549 1.00 0.00 H new ATOM 0 HA ASP A 63 7.985 -12.225 13.037 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.556 -10.126 13.872 1.00 0.00 H new ATOM 0 HB3 ASP A 63 7.676 -9.264 12.627 1.00 0.00 H new ATOM 868 N GLY A 64 5.577 -11.280 11.053 1.00 0.00 N ATOM 869 CA GLY A 64 4.198 -11.545 10.689 1.00 0.00 C ATOM 870 C GLY A 64 3.533 -10.353 10.029 1.00 0.00 C ATOM 871 O GLY A 64 2.330 -10.139 10.183 1.00 0.00 O ATOM 0 H GLY A 64 6.099 -10.722 10.377 1.00 0.00 H new ATOM 0 HA2 GLY A 64 4.162 -12.398 10.012 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.637 -11.822 11.581 1.00 0.00 H new ATOM 875 N THR A 65 4.317 -9.572 9.294 1.00 0.00 N ATOM 876 CA THR A 65 3.799 -8.393 8.611 1.00 0.00 C ATOM 877 C THR A 65 4.718 -7.969 7.471 1.00 0.00 C ATOM 878 O THR A 65 5.821 -8.496 7.322 1.00 0.00 O ATOM 879 CB THR A 65 3.626 -7.211 9.583 1.00 0.00 C ATOM 880 OG1 THR A 65 4.895 -6.838 10.131 1.00 0.00 O ATOM 881 CG2 THR A 65 2.668 -7.572 10.709 1.00 0.00 C ATOM 0 H THR A 65 5.314 -9.735 9.156 1.00 0.00 H new ATOM 0 HA THR A 65 2.825 -8.666 8.206 1.00 0.00 H new ATOM 0 HB THR A 65 3.209 -6.371 9.028 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.777 -6.085 10.747 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.562 -6.722 11.383 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.694 -7.827 10.291 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.061 -8.426 11.261 1.00 0.00 H new ATOM 889 N CYS A 66 4.258 -7.014 6.671 1.00 0.00 N ATOM 890 CA CYS A 66 5.040 -6.518 5.544 1.00 0.00 C ATOM 891 C CYS A 66 5.020 -4.994 5.496 1.00 0.00 C ATOM 892 O CYS A 66 3.963 -4.380 5.351 1.00 0.00 O ATOM 893 CB CYS A 66 4.499 -7.088 4.232 1.00 0.00 C ATOM 894 SG CYS A 66 5.151 -8.722 3.813 1.00 0.00 S ATOM 0 H CYS A 66 3.348 -6.568 6.782 1.00 0.00 H new ATOM 0 HA CYS A 66 6.071 -6.845 5.677 1.00 0.00 H new ATOM 0 HB2 CYS A 66 3.412 -7.147 4.295 1.00 0.00 H new ATOM 0 HB3 CYS A 66 4.734 -6.396 3.423 1.00 0.00 H new ATOM 0 HG CYS A 66 4.633 -9.121 2.689 1.00 0.00 H new ATOM 900 N THR A 67 6.197 -4.388 5.621 1.00 0.00 N ATOM 901 CA THR A 67 6.315 -2.935 5.596 1.00 0.00 C ATOM 902 C THR A 67 6.563 -2.429 4.180 1.00 0.00 C ATOM 903 O THR A 67 7.656 -2.589 3.635 1.00 0.00 O ATOM 904 CB THR A 67 7.454 -2.448 6.510 1.00 0.00 C ATOM 905 OG1 THR A 67 7.254 -2.933 7.843 1.00 0.00 O ATOM 906 CG2 THR A 67 7.525 -0.929 6.524 1.00 0.00 C ATOM 0 H THR A 67 7.082 -4.881 5.741 1.00 0.00 H new ATOM 0 HA THR A 67 5.370 -2.534 5.962 1.00 0.00 H new ATOM 0 HB THR A 67 8.394 -2.836 6.119 1.00 0.00 H new ATOM 0 HG1 THR A 67 7.905 -3.640 8.035 1.00 0.00 H new ATOM 0 HG21 THR A 67 8.337 -0.609 7.177 1.00 0.00 H new ATOM 0 HG22 THR A 67 7.706 -0.564 5.513 1.00 0.00 H new ATOM 0 HG23 THR A 67 6.582 -0.524 6.892 1.00 0.00 H new ATOM 914 N VAL A 68 5.543 -1.816 3.588 1.00 0.00 N ATOM 915 CA VAL A 68 5.651 -1.284 2.235 1.00 0.00 C ATOM 916 C VAL A 68 5.504 0.233 2.227 1.00 0.00 C ATOM 917 O VAL A 68 4.718 0.795 2.991 1.00 0.00 O ATOM 918 CB VAL A 68 4.588 -1.897 1.304 1.00 0.00 C ATOM 919 CG1 VAL A 68 4.852 -1.502 -0.141 1.00 0.00 C ATOM 920 CG2 VAL A 68 4.557 -3.410 1.454 1.00 0.00 C ATOM 0 H VAL A 68 4.632 -1.676 4.025 1.00 0.00 H new ATOM 0 HA VAL A 68 6.642 -1.552 1.868 1.00 0.00 H new ATOM 0 HB VAL A 68 3.611 -1.506 1.590 1.00 0.00 H new ATOM 0 HG11 VAL A 68 4.091 -1.944 -0.784 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.819 -0.416 -0.233 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.836 -1.862 -0.443 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.800 -3.826 0.789 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.533 -3.821 1.196 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.316 -3.669 2.485 1.00 0.00 H new ATOM 930 N SER A 69 6.265 0.892 1.359 1.00 0.00 N ATOM 931 CA SER A 69 6.222 2.346 1.254 1.00 0.00 C ATOM 932 C SER A 69 6.219 2.785 -0.207 1.00 0.00 C ATOM 933 O SER A 69 7.052 2.347 -1.000 1.00 0.00 O ATOM 934 CB SER A 69 7.415 2.967 1.983 1.00 0.00 C ATOM 935 OG SER A 69 7.535 2.450 3.297 1.00 0.00 O ATOM 0 H SER A 69 6.919 0.442 0.718 1.00 0.00 H new ATOM 0 HA SER A 69 5.300 2.692 1.721 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.330 2.767 1.425 1.00 0.00 H new ATOM 0 HB3 SER A 69 7.297 4.050 2.024 1.00 0.00 H new ATOM 0 HG SER A 69 8.447 2.598 3.625 1.00 0.00 H new ATOM 941 N TYR A 70 5.275 3.653 -0.555 1.00 0.00 N ATOM 942 CA TYR A 70 5.161 4.151 -1.921 1.00 0.00 C ATOM 943 C TYR A 70 5.354 5.664 -1.967 1.00 0.00 C ATOM 944 O TYR A 70 4.769 6.401 -1.172 1.00 0.00 O ATOM 945 CB TYR A 70 3.798 3.781 -2.508 1.00 0.00 C ATOM 946 CG TYR A 70 2.672 4.673 -2.034 1.00 0.00 C ATOM 947 CD1 TYR A 70 2.506 5.951 -2.553 1.00 0.00 C ATOM 948 CD2 TYR A 70 1.775 4.237 -1.066 1.00 0.00 C ATOM 949 CE1 TYR A 70 1.480 6.769 -2.123 1.00 0.00 C ATOM 950 CE2 TYR A 70 0.745 5.048 -0.631 1.00 0.00 C ATOM 951 CZ TYR A 70 0.602 6.313 -1.162 1.00 0.00 C ATOM 952 OH TYR A 70 -0.422 7.124 -0.730 1.00 0.00 O ATOM 0 H TYR A 70 4.578 4.026 0.090 1.00 0.00 H new ATOM 0 HA TYR A 70 5.945 3.685 -2.518 1.00 0.00 H new ATOM 0 HB2 TYR A 70 3.855 3.829 -3.595 1.00 0.00 H new ATOM 0 HB3 TYR A 70 3.567 2.748 -2.246 1.00 0.00 H new ATOM 0 HD1 TYR A 70 3.191 6.311 -3.306 1.00 0.00 H new ATOM 0 HD2 TYR A 70 1.885 3.248 -0.647 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.366 7.760 -2.537 1.00 0.00 H new ATOM 0 HE2 TYR A 70 0.055 4.694 0.121 1.00 0.00 H new ATOM 0 HH TYR A 70 -0.769 6.787 0.123 1.00 0.00 H new ATOM 962 N LEU A 71 6.177 6.120 -2.904 1.00 0.00 N ATOM 963 CA LEU A 71 6.448 7.545 -3.057 1.00 0.00 C ATOM 964 C LEU A 71 5.761 8.100 -4.300 1.00 0.00 C ATOM 965 O LEU A 71 6.242 7.952 -5.424 1.00 0.00 O ATOM 966 CB LEU A 71 7.956 7.792 -3.141 1.00 0.00 C ATOM 967 CG LEU A 71 8.384 9.220 -3.479 1.00 0.00 C ATOM 968 CD1 LEU A 71 8.558 10.039 -2.209 1.00 0.00 C ATOM 969 CD2 LEU A 71 9.671 9.213 -4.291 1.00 0.00 C ATOM 0 H LEU A 71 6.669 5.524 -3.570 1.00 0.00 H new ATOM 0 HA LEU A 71 6.049 8.061 -2.183 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.403 7.517 -2.186 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.372 7.122 -3.893 1.00 0.00 H new ATOM 0 HG LEU A 71 7.601 9.681 -4.081 1.00 0.00 H new ATOM 0 HD11 LEU A 71 8.863 11.053 -2.469 1.00 0.00 H new ATOM 0 HD12 LEU A 71 7.614 10.072 -1.665 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.322 9.580 -1.582 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.961 10.238 -4.523 1.00 0.00 H new ATOM 0 HD22 LEU A 71 10.462 8.734 -3.715 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.513 8.662 -5.218 1.00 0.00 H new ATOM 981 N PRO A 72 4.609 8.756 -4.097 1.00 0.00 N ATOM 982 CA PRO A 72 3.832 9.349 -5.189 1.00 0.00 C ATOM 983 C PRO A 72 4.526 10.559 -5.804 1.00 0.00 C ATOM 984 O PRO A 72 5.371 11.192 -5.170 1.00 0.00 O ATOM 985 CB PRO A 72 2.527 9.770 -4.509 1.00 0.00 C ATOM 986 CG PRO A 72 2.893 9.971 -3.079 1.00 0.00 C ATOM 987 CD PRO A 72 3.976 8.970 -2.784 1.00 0.00 C ATOM 0 HA PRO A 72 3.692 8.651 -6.015 1.00 0.00 H new ATOM 0 HB2 PRO A 72 2.129 10.685 -4.948 1.00 0.00 H new ATOM 0 HB3 PRO A 72 1.759 9.004 -4.617 1.00 0.00 H new ATOM 0 HG2 PRO A 72 3.244 10.988 -2.905 1.00 0.00 H new ATOM 0 HG3 PRO A 72 2.031 9.816 -2.430 1.00 0.00 H new ATOM 0 HD2 PRO A 72 4.688 9.352 -2.052 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.568 8.044 -2.379 1.00 0.00 H new ATOM 995 N THR A 73 4.164 10.877 -7.043 1.00 0.00 N ATOM 996 CA THR A 73 4.753 12.012 -7.744 1.00 0.00 C ATOM 997 C THR A 73 3.741 13.139 -7.914 1.00 0.00 C ATOM 998 O THR A 73 4.109 14.311 -7.981 1.00 0.00 O ATOM 999 CB THR A 73 5.284 11.601 -9.131 1.00 0.00 C ATOM 1000 OG1 THR A 73 6.065 10.406 -9.022 1.00 0.00 O ATOM 1001 CG2 THR A 73 6.129 12.712 -9.737 1.00 0.00 C ATOM 0 H THR A 73 3.466 10.365 -7.582 1.00 0.00 H new ATOM 0 HA THR A 73 5.585 12.363 -7.133 1.00 0.00 H new ATOM 0 HB THR A 73 4.430 11.418 -9.783 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.397 10.150 -9.908 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.493 12.400 -10.716 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.523 13.612 -9.845 1.00 0.00 H new ATOM 0 HG23 THR A 73 6.977 12.922 -9.085 1.00 0.00 H new ATOM 1009 N ALA A 74 2.464 12.776 -7.982 1.00 0.00 N ATOM 1010 CA ALA A 74 1.398 13.758 -8.141 1.00 0.00 C ATOM 1011 C ALA A 74 0.245 13.476 -7.185 1.00 0.00 C ATOM 1012 O ALA A 74 -0.082 12.326 -6.890 1.00 0.00 O ATOM 1013 CB ALA A 74 0.903 13.770 -9.580 1.00 0.00 C ATOM 0 H ALA A 74 2.143 11.809 -7.929 1.00 0.00 H new ATOM 0 HA ALA A 74 1.803 14.741 -7.899 1.00 0.00 H new ATOM 0 HB1 ALA A 74 0.107 14.507 -9.685 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.727 14.028 -10.246 1.00 0.00 H new ATOM 0 HB3 ALA A 74 0.520 12.783 -9.841 1.00 0.00 H new ATOM 1019 N PRO A 75 -0.388 14.549 -6.687 1.00 0.00 N ATOM 1020 CA PRO A 75 -1.515 14.441 -5.755 1.00 0.00 C ATOM 1021 C PRO A 75 -2.769 13.890 -6.424 1.00 0.00 C ATOM 1022 O PRO A 75 -3.083 14.240 -7.561 1.00 0.00 O ATOM 1023 CB PRO A 75 -1.740 15.887 -5.304 1.00 0.00 C ATOM 1024 CG PRO A 75 -1.207 16.719 -6.418 1.00 0.00 C ATOM 1025 CD PRO A 75 -0.052 15.949 -6.995 1.00 0.00 C ATOM 0 HA PRO A 75 -1.304 13.752 -4.937 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.797 16.088 -5.131 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.219 16.096 -4.370 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.973 16.897 -7.173 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -0.883 17.695 -6.056 1.00 0.00 H new ATOM 0 HD2 PRO A 75 0.044 16.113 -8.068 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.894 16.244 -6.542 1.00 0.00 H new ATOM 1033 N GLY A 76 -3.484 13.026 -5.710 1.00 0.00 N ATOM 1034 CA GLY A 76 -4.697 12.441 -6.251 1.00 0.00 C ATOM 1035 C GLY A 76 -5.115 11.185 -5.512 1.00 0.00 C ATOM 1036 O GLY A 76 -4.568 10.868 -4.456 1.00 0.00 O ATOM 0 H GLY A 76 -3.245 12.721 -4.767 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.503 13.173 -6.202 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -4.545 12.205 -7.304 1.00 0.00 H new ATOM 1040 N ASP A 77 -6.087 10.470 -6.067 1.00 0.00 N ATOM 1041 CA ASP A 77 -6.579 9.243 -5.453 1.00 0.00 C ATOM 1042 C ASP A 77 -5.839 8.027 -6.001 1.00 0.00 C ATOM 1043 O ASP A 77 -6.116 7.567 -7.110 1.00 0.00 O ATOM 1044 CB ASP A 77 -8.082 9.092 -5.695 1.00 0.00 C ATOM 1045 CG ASP A 77 -8.501 9.594 -7.063 1.00 0.00 C ATOM 1046 OD1 ASP A 77 -7.845 9.222 -8.058 1.00 0.00 O ATOM 1047 OD2 ASP A 77 -9.485 10.360 -7.138 1.00 0.00 O ATOM 0 H ASP A 77 -6.550 10.719 -6.941 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.396 9.305 -4.380 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -8.360 8.043 -5.595 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.628 9.640 -4.927 1.00 0.00 H new ATOM 1052 N TYR A 78 -4.897 7.512 -5.219 1.00 0.00 N ATOM 1053 CA TYR A 78 -4.114 6.351 -5.628 1.00 0.00 C ATOM 1054 C TYR A 78 -4.845 5.055 -5.291 1.00 0.00 C ATOM 1055 O TYR A 78 -5.491 4.946 -4.248 1.00 0.00 O ATOM 1056 CB TYR A 78 -2.744 6.369 -4.948 1.00 0.00 C ATOM 1057 CG TYR A 78 -1.766 7.333 -5.582 1.00 0.00 C ATOM 1058 CD1 TYR A 78 -1.812 8.691 -5.292 1.00 0.00 C ATOM 1059 CD2 TYR A 78 -0.796 6.884 -6.470 1.00 0.00 C ATOM 1060 CE1 TYR A 78 -0.921 9.574 -5.870 1.00 0.00 C ATOM 1061 CE2 TYR A 78 0.100 7.761 -7.051 1.00 0.00 C ATOM 1062 CZ TYR A 78 0.033 9.104 -6.748 1.00 0.00 C ATOM 1063 OH TYR A 78 0.924 9.982 -7.324 1.00 0.00 O ATOM 0 H TYR A 78 -4.657 7.880 -4.298 1.00 0.00 H new ATOM 0 HA TYR A 78 -3.977 6.399 -6.708 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -2.872 6.633 -3.898 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.321 5.365 -4.975 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -2.557 9.062 -4.603 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -0.742 5.832 -6.710 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -0.971 10.627 -5.636 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.849 7.396 -7.739 1.00 0.00 H new ATOM 0 HH TYR A 78 0.826 10.866 -6.912 1.00 0.00 H new ATOM 1073 N SER A 79 -4.737 4.074 -6.181 1.00 0.00 N ATOM 1074 CA SER A 79 -5.389 2.785 -5.981 1.00 0.00 C ATOM 1075 C SER A 79 -4.361 1.695 -5.695 1.00 0.00 C ATOM 1076 O SER A 79 -3.691 1.205 -6.604 1.00 0.00 O ATOM 1077 CB SER A 79 -6.217 2.412 -7.213 1.00 0.00 C ATOM 1078 OG SER A 79 -7.461 3.089 -7.215 1.00 0.00 O ATOM 0 H SER A 79 -4.204 4.147 -7.048 1.00 0.00 H new ATOM 0 HA SER A 79 -6.051 2.870 -5.119 1.00 0.00 H new ATOM 0 HB2 SER A 79 -5.662 2.662 -8.117 1.00 0.00 H new ATOM 0 HB3 SER A 79 -6.385 1.335 -7.230 1.00 0.00 H new ATOM 0 HG SER A 79 -7.970 2.835 -8.013 1.00 0.00 H new ATOM 1084 N ILE A 80 -4.244 1.320 -4.426 1.00 0.00 N ATOM 1085 CA ILE A 80 -3.299 0.287 -4.019 1.00 0.00 C ATOM 1086 C ILE A 80 -3.926 -1.100 -4.115 1.00 0.00 C ATOM 1087 O ILE A 80 -4.666 -1.520 -3.225 1.00 0.00 O ATOM 1088 CB ILE A 80 -2.800 0.515 -2.580 1.00 0.00 C ATOM 1089 CG1 ILE A 80 -2.104 1.872 -2.467 1.00 0.00 C ATOM 1090 CG2 ILE A 80 -1.860 -0.605 -2.162 1.00 0.00 C ATOM 1091 CD1 ILE A 80 -2.222 2.500 -1.095 1.00 0.00 C ATOM 0 H ILE A 80 -4.792 1.716 -3.662 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.452 0.348 -4.702 1.00 0.00 H new ATOM 0 HB ILE A 80 -3.659 0.512 -1.909 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -1.049 1.752 -2.713 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -2.528 2.551 -3.206 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -1.516 -0.430 -1.143 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.387 -1.558 -2.208 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -1.003 -0.631 -2.835 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.705 3.460 -1.088 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -3.274 2.653 -0.854 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -1.772 1.841 -0.353 1.00 0.00 H new ATOM 1103 N ILE A 81 -3.623 -1.807 -5.199 1.00 0.00 N ATOM 1104 CA ILE A 81 -4.154 -3.147 -5.409 1.00 0.00 C ATOM 1105 C ILE A 81 -3.279 -4.198 -4.734 1.00 0.00 C ATOM 1106 O ILE A 81 -2.078 -4.281 -4.993 1.00 0.00 O ATOM 1107 CB ILE A 81 -4.270 -3.479 -6.908 1.00 0.00 C ATOM 1108 CG1 ILE A 81 -5.190 -2.474 -7.605 1.00 0.00 C ATOM 1109 CG2 ILE A 81 -4.785 -4.897 -7.099 1.00 0.00 C ATOM 1110 CD1 ILE A 81 -4.837 -2.238 -9.057 1.00 0.00 C ATOM 0 H ILE A 81 -3.012 -1.473 -5.945 1.00 0.00 H new ATOM 0 HA ILE A 81 -5.149 -3.164 -4.963 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.280 -3.410 -7.358 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -6.218 -2.831 -7.543 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -5.149 -1.525 -7.071 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -4.861 -5.116 -8.164 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -4.095 -5.600 -6.632 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.768 -4.992 -6.638 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -5.530 -1.515 -9.487 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.820 -1.851 -9.126 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -4.906 -3.177 -9.606 1.00 0.00 H new ATOM 1122 N VAL A 82 -3.889 -5.000 -3.867 1.00 0.00 N ATOM 1123 CA VAL A 82 -3.166 -6.048 -3.156 1.00 0.00 C ATOM 1124 C VAL A 82 -3.925 -7.369 -3.204 1.00 0.00 C ATOM 1125 O VAL A 82 -4.927 -7.546 -2.511 1.00 0.00 O ATOM 1126 CB VAL A 82 -2.920 -5.663 -1.685 1.00 0.00 C ATOM 1127 CG1 VAL A 82 -2.189 -6.779 -0.955 1.00 0.00 C ATOM 1128 CG2 VAL A 82 -2.142 -4.359 -1.600 1.00 0.00 C ATOM 0 H VAL A 82 -4.882 -4.944 -3.640 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.206 -6.165 -3.658 1.00 0.00 H new ATOM 0 HB VAL A 82 -3.885 -5.517 -1.199 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -2.024 -6.488 0.083 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -2.789 -7.688 -0.986 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.229 -6.961 -1.437 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -1.977 -4.101 -0.554 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.181 -4.475 -2.101 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -2.710 -3.564 -2.084 1.00 0.00 H new ATOM 1138 N ARG A 83 -3.441 -8.294 -4.026 1.00 0.00 N ATOM 1139 CA ARG A 83 -4.075 -9.600 -4.165 1.00 0.00 C ATOM 1140 C ARG A 83 -3.273 -10.674 -3.437 1.00 0.00 C ATOM 1141 O ARG A 83 -2.082 -10.504 -3.174 1.00 0.00 O ATOM 1142 CB ARG A 83 -4.215 -9.968 -5.644 1.00 0.00 C ATOM 1143 CG ARG A 83 -5.015 -8.957 -6.450 1.00 0.00 C ATOM 1144 CD ARG A 83 -4.940 -9.249 -7.940 1.00 0.00 C ATOM 1145 NE ARG A 83 -5.069 -8.035 -8.742 1.00 0.00 N ATOM 1146 CZ ARG A 83 -4.619 -7.926 -9.988 1.00 0.00 C ATOM 1147 NH1 ARG A 83 -4.015 -8.952 -10.570 1.00 0.00 N ATOM 1148 NH2 ARG A 83 -4.774 -6.789 -10.653 1.00 0.00 N ATOM 0 H ARG A 83 -2.612 -8.164 -4.606 1.00 0.00 H new ATOM 0 HA ARG A 83 -5.067 -9.544 -3.716 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.221 -10.064 -6.081 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -4.694 -10.944 -5.723 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -6.056 -8.974 -6.127 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -4.637 -7.953 -6.255 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.991 -9.735 -8.167 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.730 -9.949 -8.213 1.00 0.00 H new ATOM 0 HE ARG A 83 -5.529 -7.227 -8.323 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.894 -9.828 -10.062 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -3.671 -8.866 -11.526 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -5.239 -5.997 -10.208 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -4.428 -6.706 -11.609 1.00 0.00 H new ATOM 1162 N PHE A 84 -3.933 -11.781 -3.112 1.00 0.00 N ATOM 1163 CA PHE A 84 -3.283 -12.882 -2.413 1.00 0.00 C ATOM 1164 C PHE A 84 -3.786 -14.227 -2.928 1.00 0.00 C ATOM 1165 O PHE A 84 -4.904 -14.643 -2.622 1.00 0.00 O ATOM 1166 CB PHE A 84 -3.531 -12.775 -0.907 1.00 0.00 C ATOM 1167 CG PHE A 84 -2.850 -13.851 -0.109 1.00 0.00 C ATOM 1168 CD1 PHE A 84 -1.472 -13.856 0.038 1.00 0.00 C ATOM 1169 CD2 PHE A 84 -3.588 -14.857 0.493 1.00 0.00 C ATOM 1170 CE1 PHE A 84 -0.843 -14.844 0.772 1.00 0.00 C ATOM 1171 CE2 PHE A 84 -2.964 -15.848 1.228 1.00 0.00 C ATOM 1172 CZ PHE A 84 -1.590 -15.842 1.366 1.00 0.00 C ATOM 0 H PHE A 84 -4.919 -11.939 -3.322 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.212 -12.818 -2.604 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.186 -11.802 -0.558 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.604 -12.819 -0.720 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -0.883 -13.079 -0.426 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -4.663 -14.867 0.387 1.00 0.00 H new ATOM 0 HE1 PHE A 84 0.231 -14.835 0.881 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -3.551 -16.626 1.694 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.100 -16.617 1.938 1.00 0.00 H new ATOM 1182 N ASP A 85 -2.954 -14.903 -3.713 1.00 0.00 N ATOM 1183 CA ASP A 85 -3.313 -16.201 -4.271 1.00 0.00 C ATOM 1184 C ASP A 85 -4.467 -16.066 -5.260 1.00 0.00 C ATOM 1185 O ASP A 85 -5.380 -16.892 -5.280 1.00 0.00 O ATOM 1186 CB ASP A 85 -3.694 -17.173 -3.154 1.00 0.00 C ATOM 1187 CG ASP A 85 -3.569 -18.623 -3.579 1.00 0.00 C ATOM 1188 OD1 ASP A 85 -2.455 -19.179 -3.473 1.00 0.00 O ATOM 1189 OD2 ASP A 85 -4.584 -19.201 -4.019 1.00 0.00 O ATOM 0 H ASP A 85 -2.026 -14.573 -3.977 1.00 0.00 H new ATOM 0 HA ASP A 85 -2.446 -16.593 -4.802 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -3.056 -16.995 -2.288 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -4.719 -16.977 -2.840 1.00 0.00 H new ATOM 1194 N ASP A 86 -4.419 -15.021 -6.078 1.00 0.00 N ATOM 1195 CA ASP A 86 -5.460 -14.778 -7.070 1.00 0.00 C ATOM 1196 C ASP A 86 -6.777 -14.405 -6.396 1.00 0.00 C ATOM 1197 O ASP A 86 -7.847 -14.855 -6.807 1.00 0.00 O ATOM 1198 CB ASP A 86 -5.655 -16.014 -7.950 1.00 0.00 C ATOM 1199 CG ASP A 86 -6.204 -15.669 -9.320 1.00 0.00 C ATOM 1200 OD1 ASP A 86 -6.875 -14.622 -9.445 1.00 0.00 O ATOM 1201 OD2 ASP A 86 -5.963 -16.445 -10.268 1.00 0.00 O ATOM 0 H ASP A 86 -3.670 -14.328 -6.074 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.143 -13.943 -7.695 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -4.701 -16.530 -8.063 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -6.335 -16.706 -7.453 1.00 0.00 H new ATOM 1206 N LYS A 87 -6.691 -13.582 -5.357 1.00 0.00 N ATOM 1207 CA LYS A 87 -7.875 -13.148 -4.624 1.00 0.00 C ATOM 1208 C LYS A 87 -7.660 -11.767 -4.012 1.00 0.00 C ATOM 1209 O LYS A 87 -6.666 -11.530 -3.325 1.00 0.00 O ATOM 1210 CB LYS A 87 -8.219 -14.157 -3.526 1.00 0.00 C ATOM 1211 CG LYS A 87 -8.518 -15.550 -4.052 1.00 0.00 C ATOM 1212 CD LYS A 87 -8.681 -16.550 -2.920 1.00 0.00 C ATOM 1213 CE LYS A 87 -9.084 -17.921 -3.441 1.00 0.00 C ATOM 1214 NZ LYS A 87 -7.903 -18.719 -3.874 1.00 0.00 N ATOM 0 H LYS A 87 -5.813 -13.202 -5.003 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.706 -13.089 -5.327 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -7.388 -14.214 -2.823 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.083 -13.795 -2.969 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.428 -15.526 -4.651 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.711 -15.872 -4.710 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -7.745 -16.631 -2.367 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.435 -16.189 -2.220 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -9.622 -18.462 -2.662 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -9.770 -17.804 -4.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -8.193 -19.398 -4.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -7.177 -18.083 -4.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.514 -19.234 -3.058 1.00 0.00 H new ATOM 1228 N HIS A 88 -8.599 -10.861 -4.264 1.00 0.00 N ATOM 1229 CA HIS A 88 -8.513 -9.504 -3.736 1.00 0.00 C ATOM 1230 C HIS A 88 -8.787 -9.487 -2.235 1.00 0.00 C ATOM 1231 O HIS A 88 -9.748 -10.096 -1.764 1.00 0.00 O ATOM 1232 CB HIS A 88 -9.502 -8.589 -4.457 1.00 0.00 C ATOM 1233 CG HIS A 88 -8.896 -7.832 -5.599 1.00 0.00 C ATOM 1234 ND1 HIS A 88 -8.643 -6.477 -5.554 1.00 0.00 N ATOM 1235 CD2 HIS A 88 -8.489 -8.249 -6.821 1.00 0.00 C ATOM 1236 CE1 HIS A 88 -8.109 -6.093 -6.700 1.00 0.00 C ATOM 1237 NE2 HIS A 88 -8.005 -7.149 -7.486 1.00 0.00 N ATOM 0 H HIS A 88 -9.428 -11.042 -4.830 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.501 -9.138 -3.907 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -10.333 -9.188 -4.829 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -9.916 -7.879 -3.741 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -8.536 -9.258 -7.202 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -7.809 -5.086 -6.951 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -7.627 -7.148 -8.433 1.00 0.00 H new ATOM 1246 N ILE A 89 -7.938 -8.787 -1.491 1.00 0.00 N ATOM 1247 CA ILE A 89 -8.090 -8.692 -0.044 1.00 0.00 C ATOM 1248 C ILE A 89 -9.246 -7.768 0.327 1.00 0.00 C ATOM 1249 O ILE A 89 -9.604 -6.853 -0.414 1.00 0.00 O ATOM 1250 CB ILE A 89 -6.802 -8.177 0.625 1.00 0.00 C ATOM 1251 CG1 ILE A 89 -6.498 -6.750 0.166 1.00 0.00 C ATOM 1252 CG2 ILE A 89 -5.635 -9.101 0.307 1.00 0.00 C ATOM 1253 CD1 ILE A 89 -5.430 -6.065 0.991 1.00 0.00 C ATOM 0 H ILE A 89 -7.138 -8.277 -1.866 1.00 0.00 H new ATOM 0 HA ILE A 89 -8.300 -9.698 0.318 1.00 0.00 H new ATOM 0 HB ILE A 89 -6.950 -8.167 1.705 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -6.182 -6.772 -0.877 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -7.414 -6.160 0.209 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -4.732 -8.724 0.787 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -5.852 -10.103 0.678 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -5.484 -9.139 -0.772 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -5.266 -5.057 0.609 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -5.752 -6.011 2.031 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.502 -6.632 0.928 1.00 0.00 H new ATOM 1265 N PRO A 90 -9.843 -8.011 1.503 1.00 0.00 N ATOM 1266 CA PRO A 90 -10.965 -7.211 2.002 1.00 0.00 C ATOM 1267 C PRO A 90 -10.541 -5.801 2.397 1.00 0.00 C ATOM 1268 O PRO A 90 -10.256 -5.532 3.563 1.00 0.00 O ATOM 1269 CB PRO A 90 -11.440 -7.992 3.230 1.00 0.00 C ATOM 1270 CG PRO A 90 -10.240 -8.750 3.683 1.00 0.00 C ATOM 1271 CD PRO A 90 -9.468 -9.086 2.437 1.00 0.00 C ATOM 0 HA PRO A 90 -11.736 -7.073 1.244 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.803 -7.322 4.010 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.261 -8.663 2.979 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -9.637 -8.153 4.367 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -10.529 -9.654 4.219 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -8.394 -9.101 2.622 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -9.739 -10.068 2.049 1.00 0.00 H new ATOM 1279 N GLY A 91 -10.503 -4.902 1.418 1.00 0.00 N ATOM 1280 CA GLY A 91 -10.113 -3.530 1.685 1.00 0.00 C ATOM 1281 C GLY A 91 -9.367 -2.903 0.524 1.00 0.00 C ATOM 1282 O GLY A 91 -9.129 -1.695 0.509 1.00 0.00 O ATOM 0 H GLY A 91 -10.735 -5.100 0.445 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -11.002 -2.939 1.903 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -9.484 -3.501 2.575 1.00 0.00 H new ATOM 1286 N SER A 92 -8.995 -3.726 -0.452 1.00 0.00 N ATOM 1287 CA SER A 92 -8.267 -3.245 -1.621 1.00 0.00 C ATOM 1288 C SER A 92 -9.137 -3.318 -2.871 1.00 0.00 C ATOM 1289 O SER A 92 -10.070 -4.117 -2.964 1.00 0.00 O ATOM 1290 CB SER A 92 -6.991 -4.065 -1.825 1.00 0.00 C ATOM 1291 OG SER A 92 -6.683 -4.193 -3.202 1.00 0.00 O ATOM 0 H SER A 92 -9.186 -4.728 -0.456 1.00 0.00 H new ATOM 0 HA SER A 92 -7.998 -2.203 -1.448 1.00 0.00 H new ATOM 0 HB2 SER A 92 -6.160 -3.586 -1.306 1.00 0.00 H new ATOM 0 HB3 SER A 92 -7.116 -5.054 -1.383 1.00 0.00 H new ATOM 0 HG SER A 92 -6.828 -5.120 -3.485 1.00 0.00 H new ATOM 1297 N PRO A 93 -8.827 -2.464 -3.858 1.00 0.00 N ATOM 1298 CA PRO A 93 -7.720 -1.508 -3.758 1.00 0.00 C ATOM 1299 C PRO A 93 -8.002 -0.397 -2.752 1.00 0.00 C ATOM 1300 O PRO A 93 -9.099 0.160 -2.718 1.00 0.00 O ATOM 1301 CB PRO A 93 -7.619 -0.934 -5.174 1.00 0.00 C ATOM 1302 CG PRO A 93 -8.982 -1.102 -5.749 1.00 0.00 C ATOM 1303 CD PRO A 93 -9.534 -2.364 -5.146 1.00 0.00 C ATOM 0 HA PRO A 93 -6.803 -1.982 -3.408 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -7.324 0.115 -5.156 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -6.872 -1.465 -5.764 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -9.614 -0.247 -5.510 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -8.941 -1.175 -6.836 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.614 -2.305 -5.008 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -9.340 -3.230 -5.779 1.00 0.00 H new ATOM 1311 N PHE A 94 -7.004 -0.079 -1.934 1.00 0.00 N ATOM 1312 CA PHE A 94 -7.145 0.965 -0.926 1.00 0.00 C ATOM 1313 C PHE A 94 -6.927 2.345 -1.539 1.00 0.00 C ATOM 1314 O PHE A 94 -5.793 2.753 -1.794 1.00 0.00 O ATOM 1315 CB PHE A 94 -6.152 0.739 0.216 1.00 0.00 C ATOM 1316 CG PHE A 94 -6.514 -0.415 1.106 1.00 0.00 C ATOM 1317 CD1 PHE A 94 -6.078 -1.697 0.812 1.00 0.00 C ATOM 1318 CD2 PHE A 94 -7.290 -0.218 2.236 1.00 0.00 C ATOM 1319 CE1 PHE A 94 -6.410 -2.762 1.629 1.00 0.00 C ATOM 1320 CE2 PHE A 94 -7.624 -1.279 3.057 1.00 0.00 C ATOM 1321 CZ PHE A 94 -7.184 -2.552 2.753 1.00 0.00 C ATOM 0 H PHE A 94 -6.089 -0.529 -1.950 1.00 0.00 H new ATOM 0 HA PHE A 94 -8.159 0.918 -0.530 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -5.161 0.567 -0.204 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -6.090 1.646 0.818 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -5.472 -1.866 -0.066 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -7.638 0.775 2.478 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -6.064 -3.757 1.388 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -8.229 -1.112 3.936 1.00 0.00 H new ATOM 0 HZ PHE A 94 -7.445 -3.382 3.393 1.00 0.00 H new ATOM 1331 N THR A 95 -8.022 3.062 -1.774 1.00 0.00 N ATOM 1332 CA THR A 95 -7.953 4.395 -2.359 1.00 0.00 C ATOM 1333 C THR A 95 -7.285 5.379 -1.405 1.00 0.00 C ATOM 1334 O THR A 95 -7.913 5.876 -0.471 1.00 0.00 O ATOM 1335 CB THR A 95 -9.354 4.922 -2.724 1.00 0.00 C ATOM 1336 OG1 THR A 95 -9.998 4.015 -3.625 1.00 0.00 O ATOM 1337 CG2 THR A 95 -9.264 6.300 -3.361 1.00 0.00 C ATOM 0 H THR A 95 -8.968 2.741 -1.568 1.00 0.00 H new ATOM 0 HA THR A 95 -7.357 4.311 -3.268 1.00 0.00 H new ATOM 0 HB THR A 95 -9.940 5.001 -1.808 1.00 0.00 H new ATOM 0 HG1 THR A 95 -10.889 4.356 -3.851 1.00 0.00 H new ATOM 0 HG21 THR A 95 -10.265 6.652 -3.610 1.00 0.00 H new ATOM 0 HG22 THR A 95 -8.799 6.995 -2.661 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.663 6.243 -4.269 1.00 0.00 H new ATOM 1345 N ALA A 96 -6.008 5.656 -1.648 1.00 0.00 N ATOM 1346 CA ALA A 96 -5.256 6.584 -0.812 1.00 0.00 C ATOM 1347 C ALA A 96 -5.266 7.989 -1.404 1.00 0.00 C ATOM 1348 O ALA A 96 -4.973 8.179 -2.585 1.00 0.00 O ATOM 1349 CB ALA A 96 -3.826 6.094 -0.635 1.00 0.00 C ATOM 0 H ALA A 96 -5.473 5.251 -2.416 1.00 0.00 H new ATOM 0 HA ALA A 96 -5.738 6.627 0.165 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.276 6.796 -0.009 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -3.834 5.113 -0.160 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.343 6.021 -1.609 1.00 0.00 H new ATOM 1355 N LYS A 97 -5.606 8.972 -0.577 1.00 0.00 N ATOM 1356 CA LYS A 97 -5.655 10.361 -1.018 1.00 0.00 C ATOM 1357 C LYS A 97 -4.304 11.041 -0.823 1.00 0.00 C ATOM 1358 O LYS A 97 -3.743 11.025 0.273 1.00 0.00 O ATOM 1359 CB LYS A 97 -6.737 11.123 -0.251 1.00 0.00 C ATOM 1360 CG LYS A 97 -8.100 11.085 -0.921 1.00 0.00 C ATOM 1361 CD LYS A 97 -9.192 11.594 0.005 1.00 0.00 C ATOM 1362 CE LYS A 97 -9.733 10.483 0.891 1.00 0.00 C ATOM 1363 NZ LYS A 97 -10.382 11.020 2.120 1.00 0.00 N ATOM 0 H LYS A 97 -5.852 8.832 0.403 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.897 10.371 -2.081 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.823 10.704 0.752 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -6.426 12.162 -0.137 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -8.078 11.691 -1.827 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.328 10.064 -1.226 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -8.798 12.398 0.627 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -10.004 12.017 -0.586 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -10.454 9.889 0.329 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -8.920 9.814 1.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -10.738 10.232 2.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -9.688 11.566 2.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -11.174 11.638 1.852 1.00 0.00 H new ATOM 1377 N ILE A 98 -3.787 11.639 -1.891 1.00 0.00 N ATOM 1378 CA ILE A 98 -2.504 12.327 -1.836 1.00 0.00 C ATOM 1379 C ILE A 98 -2.658 13.807 -2.168 1.00 0.00 C ATOM 1380 O ILE A 98 -3.084 14.168 -3.266 1.00 0.00 O ATOM 1381 CB ILE A 98 -1.486 11.698 -2.805 1.00 0.00 C ATOM 1382 CG1 ILE A 98 -1.279 10.219 -2.474 1.00 0.00 C ATOM 1383 CG2 ILE A 98 -0.164 12.449 -2.746 1.00 0.00 C ATOM 1384 CD1 ILE A 98 -0.645 9.985 -1.121 1.00 0.00 C ATOM 0 H ILE A 98 -4.238 11.661 -2.806 1.00 0.00 H new ATOM 0 HA ILE A 98 -2.134 12.223 -0.816 1.00 0.00 H new ATOM 0 HB ILE A 98 -1.879 11.772 -3.819 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -2.242 9.709 -2.508 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -0.652 9.767 -3.243 1.00 0.00 H new ATOM 0 HG21 ILE A 98 0.545 11.992 -3.437 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -0.324 13.490 -3.026 1.00 0.00 H new ATOM 0 HG23 ILE A 98 0.236 12.403 -1.733 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -0.529 8.914 -0.954 1.00 0.00 H new ATOM 0 HD12 ILE A 98 0.333 10.465 -1.089 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -1.282 10.406 -0.343 1.00 0.00 H new ATOM 1396 N THR A 99 -2.308 14.662 -1.212 1.00 0.00 N ATOM 1397 CA THR A 99 -2.407 16.104 -1.402 1.00 0.00 C ATOM 1398 C THR A 99 -1.049 16.708 -1.739 1.00 0.00 C ATOM 1399 O THR A 99 -0.007 16.144 -1.407 1.00 0.00 O ATOM 1400 CB THR A 99 -2.969 16.799 -0.148 1.00 0.00 C ATOM 1401 OG1 THR A 99 -2.225 16.399 1.008 1.00 0.00 O ATOM 1402 CG2 THR A 99 -4.439 16.460 0.046 1.00 0.00 C ATOM 0 H THR A 99 -1.953 14.381 -0.298 1.00 0.00 H new ATOM 0 HA THR A 99 -3.091 16.267 -2.235 1.00 0.00 H new ATOM 0 HB THR A 99 -2.876 17.876 -0.284 1.00 0.00 H new ATOM 0 HG1 THR A 99 -2.587 16.846 1.801 1.00 0.00 H new ATOM 0 HG21 THR A 99 -4.814 16.962 0.938 1.00 0.00 H new ATOM 0 HG22 THR A 99 -5.007 16.792 -0.823 1.00 0.00 H new ATOM 0 HG23 THR A 99 -4.552 15.382 0.162 1.00 0.00 H new ATOM 1410 N GLY A 100 -1.067 17.861 -2.401 1.00 0.00 N ATOM 1411 CA GLY A 100 0.170 18.524 -2.771 1.00 0.00 C ATOM 1412 C GLY A 100 -0.053 19.673 -3.734 1.00 0.00 C ATOM 1413 O GLY A 100 -1.018 19.673 -4.498 1.00 0.00 O ATOM 0 H GLY A 100 -1.916 18.348 -2.688 1.00 0.00 H new ATOM 0 HA2 GLY A 100 0.661 18.897 -1.872 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.845 17.799 -3.226 1.00 0.00 H new ATOM 1417 N ASP A 101 0.840 20.656 -3.697 1.00 0.00 N ATOM 1418 CA ASP A 101 0.736 21.817 -4.573 1.00 0.00 C ATOM 1419 C ASP A 101 0.919 21.415 -6.033 1.00 0.00 C ATOM 1420 O ASP A 101 1.919 20.796 -6.396 1.00 0.00 O ATOM 1421 CB ASP A 101 1.777 22.869 -4.186 1.00 0.00 C ATOM 1422 CG ASP A 101 1.351 24.273 -4.568 1.00 0.00 C ATOM 1423 OD1 ASP A 101 0.472 24.833 -3.881 1.00 0.00 O ATOM 1424 OD2 ASP A 101 1.896 24.811 -5.554 1.00 0.00 O ATOM 0 H ASP A 101 1.644 20.672 -3.070 1.00 0.00 H new ATOM 0 HA ASP A 101 -0.261 22.242 -4.455 1.00 0.00 H new ATOM 0 HB2 ASP A 101 1.951 22.825 -3.111 1.00 0.00 H new ATOM 0 HB3 ASP A 101 2.724 22.635 -4.672 1.00 0.00 H new ATOM 1429 N ASP A 102 -0.054 21.770 -6.865 1.00 0.00 N ATOM 1430 CA ASP A 102 -0.001 21.446 -8.286 1.00 0.00 C ATOM 1431 C ASP A 102 1.376 21.757 -8.863 1.00 0.00 C ATOM 1432 O ASP A 102 2.026 20.891 -9.448 1.00 0.00 O ATOM 1433 CB ASP A 102 -1.075 22.224 -9.048 1.00 0.00 C ATOM 1434 CG ASP A 102 -2.459 22.026 -8.463 1.00 0.00 C ATOM 1435 OD1 ASP A 102 -2.608 22.172 -7.232 1.00 0.00 O ATOM 1436 OD2 ASP A 102 -3.393 21.723 -9.235 1.00 0.00 O ATOM 0 H ASP A 102 -0.889 22.282 -6.580 1.00 0.00 H new ATOM 0 HA ASP A 102 -0.189 20.378 -8.398 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -0.827 23.285 -9.036 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -1.076 21.908 -10.091 1.00 0.00 H new ATOM 1441 N SER A 103 1.816 23.001 -8.695 1.00 0.00 N ATOM 1442 CA SER A 103 3.114 23.428 -9.203 1.00 0.00 C ATOM 1443 C SER A 103 4.041 23.827 -8.059 1.00 0.00 C ATOM 1444 O SER A 103 3.647 23.815 -6.893 1.00 0.00 O ATOM 1445 CB SER A 103 2.946 24.601 -10.171 1.00 0.00 C ATOM 1446 OG SER A 103 2.702 25.808 -9.471 1.00 0.00 O ATOM 0 H SER A 103 1.292 23.730 -8.211 1.00 0.00 H new ATOM 0 HA SER A 103 3.562 22.589 -9.735 1.00 0.00 H new ATOM 0 HB2 SER A 103 3.844 24.705 -10.780 1.00 0.00 H new ATOM 0 HB3 SER A 103 2.120 24.399 -10.853 1.00 0.00 H new ATOM 0 HG SER A 103 2.600 26.543 -10.111 1.00 0.00 H new ATOM 1452 N MET A 104 5.275 24.181 -8.402 1.00 0.00 N ATOM 1453 CA MET A 104 6.259 24.585 -7.404 1.00 0.00 C ATOM 1454 C MET A 104 6.978 25.860 -7.834 1.00 0.00 C ATOM 1455 O MET A 104 6.911 26.258 -8.997 1.00 0.00 O ATOM 1456 CB MET A 104 7.275 23.465 -7.175 1.00 0.00 C ATOM 1457 CG MET A 104 6.645 22.152 -6.740 1.00 0.00 C ATOM 1458 SD MET A 104 6.052 21.171 -8.132 1.00 0.00 S ATOM 1459 CE MET A 104 5.371 19.751 -7.279 1.00 0.00 C ATOM 0 H MET A 104 5.617 24.196 -9.363 1.00 0.00 H new ATOM 0 HA MET A 104 5.732 24.783 -6.471 1.00 0.00 H new ATOM 0 HB2 MET A 104 7.837 23.302 -8.095 1.00 0.00 H new ATOM 0 HB3 MET A 104 7.990 23.784 -6.417 1.00 0.00 H new ATOM 0 HG2 MET A 104 7.376 21.572 -6.177 1.00 0.00 H new ATOM 0 HG3 MET A 104 5.814 22.358 -6.066 1.00 0.00 H new ATOM 0 HE1 MET A 104 4.964 19.050 -8.007 1.00 0.00 H new ATOM 0 HE2 MET A 104 6.156 19.261 -6.704 1.00 0.00 H new ATOM 0 HE3 MET A 104 4.578 20.077 -6.606 1.00 0.00 H new ATOM 1469 N ARG A 105 7.663 26.495 -6.889 1.00 0.00 N ATOM 1470 CA ARG A 105 8.393 27.726 -7.172 1.00 0.00 C ATOM 1471 C ARG A 105 9.885 27.449 -7.331 1.00 0.00 C ATOM 1472 O ARG A 105 10.600 27.263 -6.347 1.00 0.00 O ATOM 1473 CB ARG A 105 8.169 28.744 -6.053 1.00 0.00 C ATOM 1474 CG ARG A 105 9.059 29.972 -6.159 1.00 0.00 C ATOM 1475 CD ARG A 105 8.600 31.076 -5.219 1.00 0.00 C ATOM 1476 NE ARG A 105 9.699 31.958 -4.834 1.00 0.00 N ATOM 1477 CZ ARG A 105 10.282 32.812 -5.666 1.00 0.00 C ATOM 1478 NH1 ARG A 105 9.874 32.900 -6.925 1.00 0.00 N ATOM 1479 NH2 ARG A 105 11.276 33.582 -5.241 1.00 0.00 N ATOM 0 H ARG A 105 7.728 26.178 -5.922 1.00 0.00 H new ATOM 0 HA ARG A 105 8.016 28.136 -8.109 1.00 0.00 H new ATOM 0 HB2 ARG A 105 7.126 29.060 -6.064 1.00 0.00 H new ATOM 0 HB3 ARG A 105 8.345 28.260 -5.092 1.00 0.00 H new ATOM 0 HG2 ARG A 105 10.088 29.698 -5.925 1.00 0.00 H new ATOM 0 HG3 ARG A 105 9.052 30.340 -7.185 1.00 0.00 H new ATOM 0 HD2 ARG A 105 7.817 31.661 -5.702 1.00 0.00 H new ATOM 0 HD3 ARG A 105 8.161 30.632 -4.325 1.00 0.00 H new ATOM 0 HE ARG A 105 10.037 31.915 -3.873 1.00 0.00 H new ATOM 0 HH11 ARG A 105 9.110 32.310 -7.256 1.00 0.00 H new ATOM 0 HH12 ARG A 105 10.324 33.557 -7.562 1.00 0.00 H new ATOM 0 HH21 ARG A 105 11.593 33.518 -4.274 1.00 0.00 H new ATOM 0 HH22 ARG A 105 11.723 34.238 -5.882 1.00 0.00 H new ATOM 1493 N SER A 106 10.347 27.423 -8.577 1.00 0.00 N ATOM 1494 CA SER A 106 11.753 27.164 -8.865 1.00 0.00 C ATOM 1495 C SER A 106 12.655 27.976 -7.941 1.00 0.00 C ATOM 1496 O SER A 106 12.462 29.178 -7.765 1.00 0.00 O ATOM 1497 CB SER A 106 12.065 27.499 -10.325 1.00 0.00 C ATOM 1498 OG SER A 106 11.298 26.698 -11.207 1.00 0.00 O ATOM 0 H SER A 106 9.769 27.578 -9.403 1.00 0.00 H new ATOM 0 HA SER A 106 11.945 26.105 -8.693 1.00 0.00 H new ATOM 0 HB2 SER A 106 11.857 28.553 -10.512 1.00 0.00 H new ATOM 0 HB3 SER A 106 13.127 27.344 -10.518 1.00 0.00 H new ATOM 0 HG SER A 106 11.514 26.932 -12.134 1.00 0.00 H new ATOM 1504 N GLY A 107 13.643 27.308 -7.353 1.00 0.00 N ATOM 1505 CA GLY A 107 14.561 27.982 -6.454 1.00 0.00 C ATOM 1506 C GLY A 107 14.847 27.174 -5.203 1.00 0.00 C ATOM 1507 O GLY A 107 14.425 27.525 -4.101 1.00 0.00 O ATOM 0 H GLY A 107 13.824 26.313 -7.483 1.00 0.00 H new ATOM 0 HA2 GLY A 107 15.497 28.180 -6.977 1.00 0.00 H new ATOM 0 HA3 GLY A 107 14.144 28.948 -6.171 1.00 0.00 H new ATOM 1511 N PRO A 108 15.579 26.062 -5.367 1.00 0.00 N ATOM 1512 CA PRO A 108 15.935 25.178 -4.254 1.00 0.00 C ATOM 1513 C PRO A 108 16.942 25.818 -3.305 1.00 0.00 C ATOM 1514 O PRO A 108 17.932 26.407 -3.740 1.00 0.00 O ATOM 1515 CB PRO A 108 16.554 23.963 -4.950 1.00 0.00 C ATOM 1516 CG PRO A 108 17.064 24.488 -6.248 1.00 0.00 C ATOM 1517 CD PRO A 108 16.115 25.582 -6.652 1.00 0.00 C ATOM 0 HA PRO A 108 15.072 24.937 -3.633 1.00 0.00 H new ATOM 0 HB2 PRO A 108 17.359 23.533 -4.354 1.00 0.00 H new ATOM 0 HB3 PRO A 108 15.815 23.176 -5.104 1.00 0.00 H new ATOM 0 HG2 PRO A 108 18.079 24.871 -6.143 1.00 0.00 H new ATOM 0 HG3 PRO A 108 17.097 23.701 -7.002 1.00 0.00 H new ATOM 0 HD2 PRO A 108 16.626 26.376 -7.196 1.00 0.00 H new ATOM 0 HD3 PRO A 108 15.324 25.208 -7.302 1.00 0.00 H new ATOM 1525 N SER A 109 16.684 25.698 -2.006 1.00 0.00 N ATOM 1526 CA SER A 109 17.566 26.269 -0.996 1.00 0.00 C ATOM 1527 C SER A 109 18.202 25.171 -0.148 1.00 0.00 C ATOM 1528 O SER A 109 17.883 23.992 -0.299 1.00 0.00 O ATOM 1529 CB SER A 109 16.792 27.237 -0.099 1.00 0.00 C ATOM 1530 OG SER A 109 16.416 28.402 -0.812 1.00 0.00 O ATOM 0 H SER A 109 15.871 25.210 -1.629 1.00 0.00 H new ATOM 0 HA SER A 109 18.358 26.815 -1.508 1.00 0.00 H new ATOM 0 HB2 SER A 109 15.902 26.743 0.292 1.00 0.00 H new ATOM 0 HB3 SER A 109 17.406 27.514 0.758 1.00 0.00 H new ATOM 0 HG SER A 109 15.921 29.004 -0.218 1.00 0.00 H new ATOM 1536 N SER A 110 19.103 25.569 0.745 1.00 0.00 N ATOM 1537 CA SER A 110 19.788 24.619 1.615 1.00 0.00 C ATOM 1538 C SER A 110 19.624 25.010 3.080 1.00 0.00 C ATOM 1539 O SER A 110 19.417 26.179 3.403 1.00 0.00 O ATOM 1540 CB SER A 110 21.274 24.547 1.257 1.00 0.00 C ATOM 1541 OG SER A 110 21.928 23.533 2.000 1.00 0.00 O ATOM 0 H SER A 110 19.376 26.542 0.885 1.00 0.00 H new ATOM 0 HA SER A 110 19.338 23.637 1.466 1.00 0.00 H new ATOM 0 HB2 SER A 110 21.385 24.350 0.191 1.00 0.00 H new ATOM 0 HB3 SER A 110 21.746 25.509 1.455 1.00 0.00 H new ATOM 0 HG SER A 110 22.876 23.506 1.752 1.00 0.00 H new ATOM 1547 N GLY A 111 19.718 24.022 3.964 1.00 0.00 N ATOM 1548 CA GLY A 111 19.578 24.281 5.385 1.00 0.00 C ATOM 1549 C GLY A 111 19.404 23.010 6.192 1.00 0.00 C ATOM 1550 O GLY A 111 18.576 22.162 5.857 1.00 0.00 O ATOM 0 H GLY A 111 19.889 23.046 3.721 1.00 0.00 H new ATOM 0 HA2 GLY A 111 20.458 24.817 5.742 1.00 0.00 H new ATOM 0 HA3 GLY A 111 18.720 24.932 5.550 1.00 0.00 H new TER 1554 GLY A 111