USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 967 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 109 MET CE :methyl 180:sc=-0.00155 (180deg=-0.00155) USER MOD Set 1.2: A 144 MET CE :methyl -122:sc= -0.262 (180deg=-1) USER MOD Set 2.1: A 26 THR OG1 : rot -42:sc= 1.03 USER MOD Set 2.2: A 60 ASN : amide:sc= 0.186 K(o=1.4,f=-0.29) USER MOD Set 2.3: A 62 THR OG1 : rot -3:sc= 0.166 USER MOD Set 3.1: A 5 THR OG1 : rot -54:sc= 0.0792 USER MOD Set 3.2: A 8 GLN : amide:sc= 0.0917 X(o=0.17,f=0.65) USER MOD Single : A 13 LYS NZ :NH3+ -174:sc= -0.0159 (180deg=-0.103) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -75:sc= 0.764 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 168:sc= -0.0421 (180deg=-0.293) USER MOD Single : A 34 THR OG1 : rot 55:sc= 0.136 USER MOD Single : A 36 MET CE :methyl -170:sc= 0 (180deg=-0.181) USER MOD Single : A 38 SER OG : rot 94:sc= 1.29 USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 ASN : amide:sc= -0.298 X(o=-0.3,f=-0.31) USER MOD Single : A 44 THR OG1 : rot -69:sc= 0.343 USER MOD Single : A 49 GLN : amide:sc= -0.453 K(o=-0.45,f=-2.5!) USER MOD Single : A 51 MET CE :methyl 174:sc= 0 (180deg=-0.0812) USER MOD Single : A 53 ASN : amide:sc= -0.0566 K(o=-0.057,f=-2!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl -145:sc= -0.0714 (180deg=-1.1) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0.342 K(o=0.34,f=-3.2!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -65:sc= 0.672 USER MOD Single : A 107 HIS : no HD1:sc= -0.214 X(o=-0.21,f=-0.0057) USER MOD Single : A 110 THR OG1 : rot 68:sc= 0.736 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -170:sc= 0.0336 USER MOD Single : A 124 MET CE :methyl -173:sc= -0.135 (180deg=-0.334) USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 137 ASN : amide:sc= -0.0437 K(o=-0.044,f=-7.7!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 MET CE :methyl -115:sc= -0.0213 (180deg=-0.32) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -11.180 14.427 0.898 1.00 0.00 N ATOM 59 CA THR A 5 -11.732 15.716 0.620 1.00 0.00 C ATOM 60 C THR A 5 -13.134 15.681 0.116 1.00 0.00 C ATOM 61 O THR A 5 -13.618 14.681 -0.411 1.00 0.00 O ATOM 62 CB THR A 5 -10.946 16.603 -0.300 1.00 0.00 C ATOM 63 OG1 THR A 5 -10.690 15.994 -1.557 1.00 0.00 O ATOM 64 CG2 THR A 5 -9.535 16.898 0.236 1.00 0.00 C ATOM 0 HA THR A 5 -11.692 16.156 1.617 1.00 0.00 H new ATOM 0 HB THR A 5 -11.565 17.496 -0.383 1.00 0.00 H new ATOM 0 HG1 THR A 5 -10.255 15.127 -1.418 1.00 0.00 H new ATOM 0 HG21 THR A 5 -9.007 17.544 -0.466 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.610 17.397 1.202 1.00 0.00 H new ATOM 0 HG23 THR A 5 -8.987 15.963 0.352 1.00 0.00 H new ATOM 72 N GLU A 6 -13.828 16.832 0.180 1.00 0.00 N ATOM 73 CA GLU A 6 -15.190 16.932 -0.245 1.00 0.00 C ATOM 74 C GLU A 6 -15.537 16.518 -1.634 1.00 0.00 C ATOM 75 O GLU A 6 -16.517 15.818 -1.883 1.00 0.00 O ATOM 76 CB GLU A 6 -15.637 18.376 0.040 1.00 0.00 C ATOM 77 CG GLU A 6 -17.112 18.661 -0.248 1.00 0.00 C ATOM 78 CD GLU A 6 -17.478 19.973 0.432 1.00 0.00 C ATOM 79 OE1 GLU A 6 -17.567 19.964 1.689 1.00 0.00 O ATOM 80 OE2 GLU A 6 -17.758 21.028 -0.197 1.00 0.00 O ATOM 0 H GLU A 6 -13.438 17.706 0.532 1.00 0.00 H new ATOM 0 HA GLU A 6 -15.735 16.181 0.326 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -15.435 18.604 1.087 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -15.027 19.054 -0.557 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -17.285 18.727 -1.322 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -17.737 17.850 0.126 1.00 0.00 H new ATOM 87 N GLU A 7 -14.627 16.763 -2.593 1.00 0.00 N ATOM 88 CA GLU A 7 -14.542 16.263 -3.930 1.00 0.00 C ATOM 89 C GLU A 7 -14.458 14.786 -4.108 1.00 0.00 C ATOM 90 O GLU A 7 -15.196 14.225 -4.916 1.00 0.00 O ATOM 91 CB GLU A 7 -13.368 16.927 -4.670 1.00 0.00 C ATOM 92 CG GLU A 7 -13.528 18.430 -4.903 1.00 0.00 C ATOM 93 CD GLU A 7 -13.066 19.224 -3.689 1.00 0.00 C ATOM 94 OE1 GLU A 7 -11.854 19.558 -3.606 1.00 0.00 O ATOM 95 OE2 GLU A 7 -13.891 19.611 -2.819 1.00 0.00 O ATOM 0 H GLU A 7 -13.851 17.396 -2.400 1.00 0.00 H new ATOM 0 HA GLU A 7 -15.509 16.530 -4.356 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -12.454 16.757 -4.101 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -13.239 16.435 -5.634 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -12.951 18.729 -5.778 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -14.572 18.659 -5.116 1.00 0.00 H new ATOM 102 N GLN A 8 -13.664 14.167 -3.216 1.00 0.00 N ATOM 103 CA GLN A 8 -13.491 12.750 -3.125 1.00 0.00 C ATOM 104 C GLN A 8 -14.726 12.081 -2.627 1.00 0.00 C ATOM 105 O GLN A 8 -15.110 11.003 -3.078 1.00 0.00 O ATOM 106 CB GLN A 8 -12.213 12.376 -2.357 1.00 0.00 C ATOM 107 CG GLN A 8 -10.919 12.903 -2.980 1.00 0.00 C ATOM 108 CD GLN A 8 -9.708 12.531 -2.136 1.00 0.00 C ATOM 109 OE1 GLN A 8 -9.366 13.106 -1.104 1.00 0.00 O ATOM 110 NE2 GLN A 8 -8.929 11.542 -2.649 1.00 0.00 N ATOM 0 H GLN A 8 -13.116 14.680 -2.525 1.00 0.00 H new ATOM 0 HA GLN A 8 -13.336 12.360 -4.131 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -12.292 12.757 -1.339 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.151 11.290 -2.287 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -10.804 12.496 -3.984 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -10.976 13.987 -3.080 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -9.210 11.063 -3.505 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.063 11.279 -2.178 1.00 0.00 H new ATOM 119 N ILE A 9 -15.298 12.602 -1.526 1.00 0.00 N ATOM 120 CA ILE A 9 -16.548 12.283 -0.910 1.00 0.00 C ATOM 121 C ILE A 9 -17.705 12.381 -1.843 1.00 0.00 C ATOM 122 O ILE A 9 -18.617 11.555 -1.848 1.00 0.00 O ATOM 123 CB ILE A 9 -16.670 12.983 0.411 1.00 0.00 C ATOM 124 CG1 ILE A 9 -15.504 12.539 1.311 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.066 12.746 1.011 1.00 0.00 C ATOM 126 CD1 ILE A 9 -15.460 13.024 2.759 1.00 0.00 C ATOM 0 H ILE A 9 -14.820 13.338 -1.007 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.571 11.222 -0.662 1.00 0.00 H new ATOM 0 HB ILE A 9 -16.589 14.064 0.299 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.498 11.449 1.329 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -14.578 12.855 0.830 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -18.142 13.259 1.970 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -18.825 13.133 0.331 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.222 11.677 1.158 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -14.576 12.620 3.251 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -15.419 14.113 2.777 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -16.354 12.686 3.283 1.00 0.00 H new ATOM 138 N ALA A 10 -17.684 13.422 -2.694 1.00 0.00 N ATOM 139 CA ALA A 10 -18.694 13.637 -3.683 1.00 0.00 C ATOM 140 C ALA A 10 -18.576 12.769 -4.888 1.00 0.00 C ATOM 141 O ALA A 10 -19.560 12.330 -5.481 1.00 0.00 O ATOM 142 CB ALA A 10 -18.732 15.150 -3.960 1.00 0.00 C ATOM 0 H ALA A 10 -16.949 14.130 -2.695 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.665 13.318 -3.304 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -19.492 15.363 -4.712 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -18.973 15.682 -3.040 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -17.758 15.478 -4.325 1.00 0.00 H new ATOM 148 N GLU A 11 -17.336 12.338 -5.183 1.00 0.00 N ATOM 149 CA GLU A 11 -17.156 11.269 -6.115 1.00 0.00 C ATOM 150 C GLU A 11 -17.553 9.961 -5.523 1.00 0.00 C ATOM 151 O GLU A 11 -18.281 9.218 -6.180 1.00 0.00 O ATOM 152 CB GLU A 11 -15.730 11.186 -6.684 1.00 0.00 C ATOM 153 CG GLU A 11 -15.653 10.308 -7.935 1.00 0.00 C ATOM 154 CD GLU A 11 -14.255 10.238 -8.534 1.00 0.00 C ATOM 155 OE1 GLU A 11 -13.357 9.540 -7.993 1.00 0.00 O ATOM 156 OE2 GLU A 11 -13.979 10.970 -9.522 1.00 0.00 O ATOM 0 H GLU A 11 -16.477 12.719 -4.787 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.816 11.496 -6.952 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -15.379 12.189 -6.925 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -15.060 10.788 -5.922 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -15.985 9.300 -7.685 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -16.344 10.694 -8.685 1.00 0.00 H new ATOM 163 N PHE A 12 -17.163 9.518 -4.314 1.00 0.00 N ATOM 164 CA PHE A 12 -17.374 8.211 -3.773 1.00 0.00 C ATOM 165 C PHE A 12 -18.803 7.979 -3.420 1.00 0.00 C ATOM 166 O PHE A 12 -19.228 6.830 -3.315 1.00 0.00 O ATOM 167 CB PHE A 12 -16.527 7.863 -2.537 1.00 0.00 C ATOM 168 CG PHE A 12 -15.057 7.921 -2.776 1.00 0.00 C ATOM 169 CD1 PHE A 12 -14.363 7.775 -3.954 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.349 8.359 -1.682 1.00 0.00 C ATOM 171 CE1 PHE A 12 -13.035 8.105 -4.085 1.00 0.00 C ATOM 172 CE2 PHE A 12 -13.011 8.655 -1.793 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.329 8.520 -2.980 1.00 0.00 C ATOM 0 H PHE A 12 -16.660 10.123 -3.665 1.00 0.00 H new ATOM 0 HA PHE A 12 -17.054 7.558 -4.585 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.781 8.550 -1.730 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.791 6.861 -2.198 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.885 7.384 -4.815 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -14.847 8.471 -0.730 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.550 8.039 -5.048 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.479 9.005 -0.921 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.272 8.733 -3.042 1.00 0.00 H new ATOM 183 N LYS A 13 -19.650 9.014 -3.275 1.00 0.00 N ATOM 184 CA LYS A 13 -21.051 8.849 -3.040 1.00 0.00 C ATOM 185 C LYS A 13 -21.734 8.551 -4.330 1.00 0.00 C ATOM 186 O LYS A 13 -22.517 7.603 -4.371 1.00 0.00 O ATOM 187 CB LYS A 13 -21.518 10.163 -2.391 1.00 0.00 C ATOM 188 CG LYS A 13 -22.958 9.899 -1.946 1.00 0.00 C ATOM 189 CD LYS A 13 -23.623 11.022 -1.148 1.00 0.00 C ATOM 190 CE LYS A 13 -25.034 10.756 -0.620 1.00 0.00 C ATOM 191 NZ LYS A 13 -25.887 10.185 -1.686 1.00 0.00 N ATOM 0 H LYS A 13 -19.354 9.989 -3.322 1.00 0.00 H new ATOM 0 HA LYS A 13 -21.287 8.014 -2.380 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -20.886 10.430 -1.544 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.470 10.991 -3.098 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.562 9.701 -2.832 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -22.971 8.992 -1.342 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -22.982 11.259 -0.299 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -23.659 11.910 -1.778 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -24.989 10.069 0.225 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -25.472 11.684 -0.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -26.865 10.105 -1.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -25.863 10.806 -2.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -25.533 9.242 -1.946 1.00 0.00 H new ATOM 205 N GLU A 14 -21.422 9.222 -5.453 1.00 0.00 N ATOM 206 CA GLU A 14 -21.968 8.907 -6.736 1.00 0.00 C ATOM 207 C GLU A 14 -21.654 7.552 -7.272 1.00 0.00 C ATOM 208 O GLU A 14 -22.463 6.895 -7.925 1.00 0.00 O ATOM 209 CB GLU A 14 -21.717 10.028 -7.758 1.00 0.00 C ATOM 210 CG GLU A 14 -22.521 11.284 -7.413 1.00 0.00 C ATOM 211 CD GLU A 14 -24.026 11.126 -7.576 1.00 0.00 C ATOM 212 OE1 GLU A 14 -24.373 11.223 -8.783 1.00 0.00 O ATOM 213 OE2 GLU A 14 -24.894 11.082 -6.663 1.00 0.00 O ATOM 0 H GLU A 14 -20.771 10.007 -5.469 1.00 0.00 H new ATOM 0 HA GLU A 14 -23.042 8.850 -6.556 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -20.654 10.269 -7.783 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -21.989 9.682 -8.755 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -22.306 11.568 -6.383 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -22.182 12.104 -8.046 1.00 0.00 H new ATOM 220 N ALA A 15 -20.401 7.149 -6.996 1.00 0.00 N ATOM 221 CA ALA A 15 -19.870 5.835 -7.196 1.00 0.00 C ATOM 222 C ALA A 15 -20.445 4.733 -6.374 1.00 0.00 C ATOM 223 O ALA A 15 -20.581 3.614 -6.866 1.00 0.00 O ATOM 224 CB ALA A 15 -18.338 5.837 -7.069 1.00 0.00 C ATOM 0 H ALA A 15 -19.709 7.788 -6.605 1.00 0.00 H new ATOM 0 HA ALA A 15 -20.185 5.599 -8.212 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -17.959 4.827 -7.225 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -17.912 6.505 -7.818 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -18.056 6.181 -6.074 1.00 0.00 H new ATOM 230 N PHE A 16 -20.947 4.959 -5.146 1.00 0.00 N ATOM 231 CA PHE A 16 -21.621 4.066 -4.257 1.00 0.00 C ATOM 232 C PHE A 16 -22.781 3.374 -4.887 1.00 0.00 C ATOM 233 O PHE A 16 -23.047 2.181 -4.744 1.00 0.00 O ATOM 234 CB PHE A 16 -22.073 4.804 -2.985 1.00 0.00 C ATOM 235 CG PHE A 16 -22.683 3.941 -1.935 1.00 0.00 C ATOM 236 CD1 PHE A 16 -21.849 3.303 -1.047 1.00 0.00 C ATOM 237 CD2 PHE A 16 -24.041 3.916 -1.720 1.00 0.00 C ATOM 238 CE1 PHE A 16 -22.346 2.701 0.085 1.00 0.00 C ATOM 239 CE2 PHE A 16 -24.525 3.132 -0.699 1.00 0.00 C ATOM 240 CZ PHE A 16 -23.704 2.645 0.291 1.00 0.00 C ATOM 0 H PHE A 16 -20.867 5.887 -4.729 1.00 0.00 H new ATOM 0 HA PHE A 16 -20.897 3.294 -3.994 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -21.212 5.317 -2.556 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -22.794 5.572 -3.266 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -20.787 3.274 -1.242 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -24.710 4.497 -2.337 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -21.671 2.273 0.811 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -25.578 2.892 -0.674 1.00 0.00 H new ATOM 0 HZ PHE A 16 -24.113 2.232 1.201 1.00 0.00 H new ATOM 250 N SER A 17 -23.531 4.204 -5.633 1.00 0.00 N ATOM 251 CA SER A 17 -24.781 3.887 -6.251 1.00 0.00 C ATOM 252 C SER A 17 -24.587 3.038 -7.460 1.00 0.00 C ATOM 253 O SER A 17 -25.396 2.187 -7.826 1.00 0.00 O ATOM 254 CB SER A 17 -25.386 5.209 -6.753 1.00 0.00 C ATOM 255 OG SER A 17 -26.751 5.164 -7.145 1.00 0.00 O ATOM 0 H SER A 17 -23.242 5.165 -5.817 1.00 0.00 H new ATOM 0 HA SER A 17 -25.407 3.363 -5.528 1.00 0.00 H new ATOM 0 HB2 SER A 17 -25.280 5.955 -5.966 1.00 0.00 H new ATOM 0 HB3 SER A 17 -24.797 5.555 -7.602 1.00 0.00 H new ATOM 0 HG SER A 17 -27.035 6.053 -7.445 1.00 0.00 H new ATOM 261 N LEU A 18 -23.395 3.124 -8.077 1.00 0.00 N ATOM 262 CA LEU A 18 -23.057 2.288 -9.187 1.00 0.00 C ATOM 263 C LEU A 18 -22.595 0.945 -8.737 1.00 0.00 C ATOM 264 O LEU A 18 -22.776 -0.014 -9.485 1.00 0.00 O ATOM 265 CB LEU A 18 -22.070 3.001 -10.127 1.00 0.00 C ATOM 266 CG LEU A 18 -22.705 4.225 -10.809 1.00 0.00 C ATOM 267 CD1 LEU A 18 -21.613 4.971 -11.594 1.00 0.00 C ATOM 268 CD2 LEU A 18 -23.935 3.887 -11.668 1.00 0.00 C ATOM 0 H LEU A 18 -22.661 3.777 -7.805 1.00 0.00 H new ATOM 0 HA LEU A 18 -23.957 2.104 -9.774 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -21.193 3.316 -9.561 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -21.724 2.301 -10.888 1.00 0.00 H new ATOM 0 HG LEU A 18 -23.104 4.881 -10.035 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -22.048 5.842 -12.084 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -20.829 5.293 -10.909 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -21.187 4.307 -12.346 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -24.328 4.800 -12.116 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -23.648 3.190 -12.456 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -24.702 3.431 -11.042 1.00 0.00 H new ATOM 280 N PHE A 19 -22.159 0.746 -7.480 1.00 0.00 N ATOM 281 CA PHE A 19 -21.925 -0.568 -6.964 1.00 0.00 C ATOM 282 C PHE A 19 -23.163 -1.200 -6.428 1.00 0.00 C ATOM 283 O PHE A 19 -23.428 -2.367 -6.711 1.00 0.00 O ATOM 284 CB PHE A 19 -20.735 -0.569 -5.991 1.00 0.00 C ATOM 285 CG PHE A 19 -19.469 0.037 -6.491 1.00 0.00 C ATOM 286 CD1 PHE A 19 -19.066 -0.312 -7.759 1.00 0.00 C ATOM 287 CD2 PHE A 19 -18.852 1.066 -5.818 1.00 0.00 C ATOM 288 CE1 PHE A 19 -18.037 0.422 -8.301 1.00 0.00 C ATOM 289 CE2 PHE A 19 -17.706 1.671 -6.276 1.00 0.00 C ATOM 290 CZ PHE A 19 -17.307 1.304 -7.540 1.00 0.00 C ATOM 0 H PHE A 19 -21.968 1.498 -6.818 1.00 0.00 H new ATOM 0 HA PHE A 19 -21.636 -1.215 -7.793 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -21.033 -0.039 -5.086 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -20.530 -1.600 -5.704 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -19.534 -1.121 -8.301 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -19.286 1.413 -4.892 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.797 0.303 -9.347 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -17.156 2.387 -5.683 1.00 0.00 H new ATOM 0 HZ PHE A 19 -16.396 1.720 -7.945 1.00 0.00 H new ATOM 300 N ASP A 20 -24.023 -0.470 -5.695 1.00 0.00 N ATOM 301 CA ASP A 20 -25.212 -0.973 -5.079 1.00 0.00 C ATOM 302 C ASP A 20 -26.190 -1.543 -6.048 1.00 0.00 C ATOM 303 O ASP A 20 -26.924 -0.840 -6.740 1.00 0.00 O ATOM 304 CB ASP A 20 -25.908 0.131 -4.266 1.00 0.00 C ATOM 305 CG ASP A 20 -26.938 -0.473 -3.322 1.00 0.00 C ATOM 306 OD1 ASP A 20 -27.226 -1.690 -3.479 1.00 0.00 O ATOM 307 OD2 ASP A 20 -27.533 0.286 -2.512 1.00 0.00 O ATOM 0 H ASP A 20 -23.881 0.525 -5.523 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.884 -1.783 -4.428 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -25.168 0.692 -3.696 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -26.393 0.837 -4.940 1.00 0.00 H new ATOM 312 N LYS A 21 -26.417 -2.869 -6.048 1.00 0.00 N ATOM 313 CA LYS A 21 -27.179 -3.597 -7.014 1.00 0.00 C ATOM 314 C LYS A 21 -28.649 -3.438 -6.829 1.00 0.00 C ATOM 315 O LYS A 21 -29.354 -3.088 -7.774 1.00 0.00 O ATOM 316 CB LYS A 21 -26.811 -5.090 -6.991 1.00 0.00 C ATOM 317 CG LYS A 21 -27.250 -5.859 -8.238 1.00 0.00 C ATOM 318 CD LYS A 21 -27.453 -7.363 -8.046 1.00 0.00 C ATOM 319 CE LYS A 21 -28.113 -8.050 -9.243 1.00 0.00 C ATOM 320 NZ LYS A 21 -27.907 -9.504 -9.062 1.00 0.00 N ATOM 0 H LYS A 21 -26.040 -3.475 -5.319 1.00 0.00 H new ATOM 0 HA LYS A 21 -26.924 -3.174 -7.986 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -25.731 -5.186 -6.879 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -27.264 -5.552 -6.114 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -28.183 -5.427 -8.600 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -26.504 -5.707 -9.019 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -26.487 -7.830 -7.857 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -28.066 -7.528 -7.160 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -29.176 -7.812 -9.289 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -27.669 -7.709 -10.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -28.341 -10.018 -9.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -26.888 -9.709 -9.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -28.348 -9.809 -8.171 1.00 0.00 H new ATOM 334 N ASP A 22 -29.164 -3.803 -5.642 1.00 0.00 N ATOM 335 CA ASP A 22 -30.501 -3.750 -5.137 1.00 0.00 C ATOM 336 C ASP A 22 -31.008 -2.366 -4.920 1.00 0.00 C ATOM 337 O ASP A 22 -32.185 -2.043 -5.074 1.00 0.00 O ATOM 338 CB ASP A 22 -30.915 -4.655 -3.964 1.00 0.00 C ATOM 339 CG ASP A 22 -29.683 -5.374 -3.432 1.00 0.00 C ATOM 340 OD1 ASP A 22 -28.611 -4.755 -3.196 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.796 -6.609 -3.209 1.00 0.00 O ATOM 0 H ASP A 22 -28.543 -4.194 -4.934 1.00 0.00 H new ATOM 0 HA ASP A 22 -31.000 -4.215 -5.987 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.374 -4.061 -3.174 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -31.661 -5.379 -4.292 1.00 0.00 H new ATOM 346 N GLY A 23 -30.117 -1.414 -4.590 1.00 0.00 N ATOM 347 CA GLY A 23 -30.293 -0.025 -4.299 1.00 0.00 C ATOM 348 C GLY A 23 -31.006 0.086 -2.995 1.00 0.00 C ATOM 349 O GLY A 23 -31.899 0.911 -2.803 1.00 0.00 O ATOM 0 H GLY A 23 -29.130 -1.662 -4.519 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -29.328 0.479 -4.250 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -30.866 0.460 -5.089 1.00 0.00 H new ATOM 353 N ASP A 24 -30.537 -0.675 -1.990 1.00 0.00 N ATOM 354 CA ASP A 24 -31.077 -0.550 -0.672 1.00 0.00 C ATOM 355 C ASP A 24 -30.332 0.465 0.126 1.00 0.00 C ATOM 356 O ASP A 24 -30.695 0.876 1.227 1.00 0.00 O ATOM 357 CB ASP A 24 -31.005 -1.948 -0.035 1.00 0.00 C ATOM 358 CG ASP A 24 -29.575 -2.409 0.209 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.822 -2.657 -0.770 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.162 -2.512 1.395 1.00 0.00 O ATOM 0 H ASP A 24 -29.794 -1.368 -2.087 1.00 0.00 H new ATOM 0 HA ASP A 24 -32.108 -0.198 -0.703 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -31.546 -1.940 0.911 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.508 -2.665 -0.684 1.00 0.00 H new ATOM 365 N GLY A 25 -29.198 0.949 -0.412 1.00 0.00 N ATOM 366 CA GLY A 25 -28.386 1.887 0.299 1.00 0.00 C ATOM 367 C GLY A 25 -27.241 1.283 1.037 1.00 0.00 C ATOM 368 O GLY A 25 -26.597 1.999 1.802 1.00 0.00 O ATOM 0 H GLY A 25 -28.845 0.693 -1.334 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -27.999 2.621 -0.408 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -29.014 2.427 1.008 1.00 0.00 H new ATOM 372 N THR A 26 -26.978 -0.024 0.858 1.00 0.00 N ATOM 373 CA THR A 26 -25.811 -0.536 1.506 1.00 0.00 C ATOM 374 C THR A 26 -25.110 -1.420 0.532 1.00 0.00 C ATOM 375 O THR A 26 -25.656 -1.789 -0.506 1.00 0.00 O ATOM 376 CB THR A 26 -25.968 -1.187 2.848 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.789 -2.346 2.820 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.672 -0.217 3.811 1.00 0.00 C ATOM 0 H THR A 26 -27.527 -0.685 0.308 1.00 0.00 H new ATOM 0 HA THR A 26 -25.222 0.338 1.783 1.00 0.00 H new ATOM 0 HB THR A 26 -24.959 -1.457 3.160 1.00 0.00 H new ATOM 0 HG1 THR A 26 -27.573 -2.178 2.257 1.00 0.00 H new ATOM 0 HG21 THR A 26 -26.786 -0.691 4.786 1.00 0.00 H new ATOM 0 HG22 THR A 26 -26.075 0.689 3.915 1.00 0.00 H new ATOM 0 HG23 THR A 26 -27.655 0.039 3.415 1.00 0.00 H new ATOM 386 N ILE A 27 -23.903 -1.909 0.867 1.00 0.00 N ATOM 387 CA ILE A 27 -23.087 -2.770 0.068 1.00 0.00 C ATOM 388 C ILE A 27 -22.784 -3.988 0.871 1.00 0.00 C ATOM 389 O ILE A 27 -22.232 -3.883 1.965 1.00 0.00 O ATOM 390 CB ILE A 27 -21.820 -2.129 -0.414 1.00 0.00 C ATOM 391 CG1 ILE A 27 -22.020 -0.674 -0.870 1.00 0.00 C ATOM 392 CG2 ILE A 27 -21.272 -2.929 -1.608 1.00 0.00 C ATOM 393 CD1 ILE A 27 -20.887 0.020 -1.623 1.00 0.00 C ATOM 0 H ILE A 27 -23.467 -1.686 1.761 1.00 0.00 H new ATOM 0 HA ILE A 27 -23.644 -3.017 -0.836 1.00 0.00 H new ATOM 0 HB ILE A 27 -21.127 -2.127 0.427 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -22.905 -0.645 -1.505 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -22.243 -0.078 0.015 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -20.350 -2.468 -1.963 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -21.068 -3.954 -1.297 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -22.008 -2.934 -2.412 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -21.186 1.038 -1.873 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.996 0.047 -0.996 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -20.669 -0.529 -2.539 1.00 0.00 H new ATOM 405 N THR A 28 -23.084 -5.188 0.342 1.00 0.00 N ATOM 406 CA THR A 28 -22.811 -6.457 0.941 1.00 0.00 C ATOM 407 C THR A 28 -21.415 -6.952 0.778 1.00 0.00 C ATOM 408 O THR A 28 -20.600 -6.291 0.136 1.00 0.00 O ATOM 409 CB THR A 28 -23.824 -7.495 0.559 1.00 0.00 C ATOM 410 OG1 THR A 28 -23.895 -7.578 -0.857 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.191 -7.130 1.163 1.00 0.00 C ATOM 0 H THR A 28 -23.547 -5.276 -0.563 1.00 0.00 H new ATOM 0 HA THR A 28 -22.907 -6.270 2.011 1.00 0.00 H new ATOM 0 HB THR A 28 -23.530 -8.469 0.950 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.384 -6.804 -1.206 1.00 0.00 H new ATOM 0 HG21 THR A 28 -25.925 -7.886 0.884 1.00 0.00 H new ATOM 0 HG22 THR A 28 -25.109 -7.087 2.249 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.508 -6.158 0.784 1.00 0.00 H new ATOM 419 N THR A 29 -21.108 -8.176 1.241 1.00 0.00 N ATOM 420 CA THR A 29 -19.901 -8.935 1.133 1.00 0.00 C ATOM 421 C THR A 29 -19.765 -9.440 -0.262 1.00 0.00 C ATOM 422 O THR A 29 -18.647 -9.515 -0.769 1.00 0.00 O ATOM 423 CB THR A 29 -19.889 -10.180 1.970 1.00 0.00 C ATOM 424 OG1 THR A 29 -21.076 -10.958 2.002 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.606 -9.635 3.380 1.00 0.00 C ATOM 0 H THR A 29 -21.808 -8.702 1.764 1.00 0.00 H new ATOM 0 HA THR A 29 -19.110 -8.257 1.455 1.00 0.00 H new ATOM 0 HB THR A 29 -19.164 -10.878 1.551 1.00 0.00 H new ATOM 0 HG1 THR A 29 -20.940 -11.739 2.578 1.00 0.00 H new ATOM 0 HG21 THR A 29 -19.573 -10.462 4.090 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.648 -9.115 3.384 1.00 0.00 H new ATOM 0 HG23 THR A 29 -20.396 -8.941 3.667 1.00 0.00 H new ATOM 433 N LYS A 30 -20.909 -9.708 -0.915 1.00 0.00 N ATOM 434 CA LYS A 30 -20.923 -10.194 -2.260 1.00 0.00 C ATOM 435 C LYS A 30 -20.750 -9.101 -3.258 1.00 0.00 C ATOM 436 O LYS A 30 -20.071 -9.187 -4.280 1.00 0.00 O ATOM 437 CB LYS A 30 -22.241 -10.952 -2.490 1.00 0.00 C ATOM 438 CG LYS A 30 -22.500 -12.149 -1.572 1.00 0.00 C ATOM 439 CD LYS A 30 -24.001 -12.407 -1.429 1.00 0.00 C ATOM 440 CE LYS A 30 -24.373 -13.592 -0.536 1.00 0.00 C ATOM 441 NZ LYS A 30 -23.692 -13.445 0.770 1.00 0.00 N ATOM 0 H LYS A 30 -21.835 -9.586 -0.506 1.00 0.00 H new ATOM 0 HA LYS A 30 -20.076 -10.866 -2.400 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -23.066 -10.248 -2.376 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -22.260 -11.301 -3.522 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -22.011 -13.035 -1.975 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -22.063 -11.962 -0.591 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -24.472 -11.509 -1.029 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -24.422 -12.573 -2.421 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -25.453 -13.632 -0.395 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -24.079 -14.528 -1.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -24.091 -14.125 1.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -22.675 -13.628 0.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -23.831 -12.478 1.127 1.00 0.00 H new ATOM 455 N GLU A 31 -21.263 -7.914 -2.888 1.00 0.00 N ATOM 456 CA GLU A 31 -21.186 -6.693 -3.628 1.00 0.00 C ATOM 457 C GLU A 31 -19.825 -6.112 -3.449 1.00 0.00 C ATOM 458 O GLU A 31 -19.203 -5.701 -4.427 1.00 0.00 O ATOM 459 CB GLU A 31 -22.225 -5.624 -3.249 1.00 0.00 C ATOM 460 CG GLU A 31 -23.630 -5.970 -3.745 1.00 0.00 C ATOM 461 CD GLU A 31 -24.742 -5.104 -3.171 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.928 -5.161 -1.926 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.508 -4.404 -3.886 1.00 0.00 O ATOM 0 H GLU A 31 -21.767 -7.801 -2.009 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.401 -6.963 -4.662 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.244 -5.509 -2.165 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -21.922 -4.664 -3.666 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -23.647 -5.885 -4.832 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -23.839 -7.012 -3.503 1.00 0.00 H new ATOM 470 N LEU A 32 -19.160 -6.123 -2.280 1.00 0.00 N ATOM 471 CA LEU A 32 -17.782 -5.750 -2.190 1.00 0.00 C ATOM 472 C LEU A 32 -16.875 -6.748 -2.823 1.00 0.00 C ATOM 473 O LEU A 32 -15.766 -6.466 -3.274 1.00 0.00 O ATOM 474 CB LEU A 32 -17.265 -5.369 -0.792 1.00 0.00 C ATOM 475 CG LEU A 32 -16.032 -4.450 -0.790 1.00 0.00 C ATOM 476 CD1 LEU A 32 -16.451 -3.018 -1.161 1.00 0.00 C ATOM 477 CD2 LEU A 32 -15.383 -4.433 0.605 1.00 0.00 C ATOM 0 H LEU A 32 -19.580 -6.392 -1.391 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.757 -4.822 -2.762 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -18.069 -4.877 -0.244 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.021 -6.282 -0.249 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.316 -4.829 -1.519 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.574 -2.370 -1.158 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.901 -3.016 -2.154 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -17.176 -2.651 -0.434 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.511 -3.779 0.593 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.102 -4.065 1.337 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.075 -5.443 0.875 1.00 0.00 H new ATOM 489 N GLY A 33 -17.335 -7.996 -3.023 1.00 0.00 N ATOM 490 CA GLY A 33 -16.813 -8.939 -3.962 1.00 0.00 C ATOM 491 C GLY A 33 -16.750 -8.434 -5.362 1.00 0.00 C ATOM 492 O GLY A 33 -15.788 -8.642 -6.100 1.00 0.00 O ATOM 0 H GLY A 33 -18.123 -8.370 -2.494 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.811 -9.232 -3.648 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.430 -9.838 -3.939 1.00 0.00 H new ATOM 496 N THR A 34 -17.828 -7.742 -5.771 1.00 0.00 N ATOM 497 CA THR A 34 -18.063 -7.398 -7.139 1.00 0.00 C ATOM 498 C THR A 34 -17.216 -6.233 -7.523 1.00 0.00 C ATOM 499 O THR A 34 -16.702 -6.151 -8.637 1.00 0.00 O ATOM 500 CB THR A 34 -19.478 -7.200 -7.596 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.235 -8.377 -7.353 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.626 -6.832 -9.082 1.00 0.00 C ATOM 0 H THR A 34 -18.555 -7.413 -5.135 1.00 0.00 H new ATOM 0 HA THR A 34 -17.779 -8.306 -7.671 1.00 0.00 H new ATOM 0 HB THR A 34 -19.847 -6.352 -7.019 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.161 -8.624 -6.408 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.682 -6.708 -9.323 1.00 0.00 H new ATOM 0 HG22 THR A 34 -19.097 -5.900 -9.280 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.204 -7.627 -9.697 1.00 0.00 H new ATOM 510 N VAL A 35 -17.013 -5.297 -6.578 1.00 0.00 N ATOM 511 CA VAL A 35 -16.021 -4.276 -6.710 1.00 0.00 C ATOM 512 C VAL A 35 -14.628 -4.764 -6.916 1.00 0.00 C ATOM 513 O VAL A 35 -13.951 -4.480 -7.903 1.00 0.00 O ATOM 514 CB VAL A 35 -16.048 -3.400 -5.493 1.00 0.00 C ATOM 515 CG1 VAL A 35 -14.861 -2.469 -5.190 1.00 0.00 C ATOM 516 CG2 VAL A 35 -17.398 -2.666 -5.439 1.00 0.00 C ATOM 0 H VAL A 35 -17.546 -5.249 -5.709 1.00 0.00 H new ATOM 0 HA VAL A 35 -16.285 -3.734 -7.618 1.00 0.00 H new ATOM 0 HB VAL A 35 -15.923 -4.106 -4.672 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -15.058 -1.914 -4.273 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -13.955 -3.063 -5.067 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.727 -1.769 -6.015 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.429 -2.026 -4.557 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -17.517 -2.056 -6.335 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.207 -3.395 -5.386 1.00 0.00 H new ATOM 526 N MET A 36 -14.125 -5.561 -5.956 1.00 0.00 N ATOM 527 CA MET A 36 -12.847 -6.202 -5.956 1.00 0.00 C ATOM 528 C MET A 36 -12.532 -6.986 -7.184 1.00 0.00 C ATOM 529 O MET A 36 -11.537 -6.702 -7.848 1.00 0.00 O ATOM 530 CB MET A 36 -12.796 -7.144 -4.742 1.00 0.00 C ATOM 531 CG MET A 36 -12.649 -6.478 -3.372 1.00 0.00 C ATOM 532 SD MET A 36 -10.978 -6.088 -2.772 1.00 0.00 S ATOM 533 CE MET A 36 -11.647 -6.006 -1.086 1.00 0.00 C ATOM 0 H MET A 36 -14.657 -5.773 -5.112 1.00 0.00 H new ATOM 0 HA MET A 36 -12.101 -5.409 -5.917 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.707 -7.743 -4.735 1.00 0.00 H new ATOM 0 HB3 MET A 36 -11.963 -7.833 -4.879 1.00 0.00 H new ATOM 0 HG2 MET A 36 -13.219 -5.549 -3.392 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.123 -7.127 -2.635 1.00 0.00 H new ATOM 0 HE1 MET A 36 -10.892 -5.597 -0.414 1.00 0.00 H new ATOM 0 HE2 MET A 36 -12.528 -5.364 -1.075 1.00 0.00 H new ATOM 0 HE3 MET A 36 -11.923 -7.007 -0.755 1.00 0.00 H new ATOM 543 N ARG A 37 -13.473 -7.867 -7.567 1.00 0.00 N ATOM 544 CA ARG A 37 -13.302 -8.695 -8.720 1.00 0.00 C ATOM 545 C ARG A 37 -13.214 -7.857 -9.949 1.00 0.00 C ATOM 546 O ARG A 37 -12.245 -7.998 -10.693 1.00 0.00 O ATOM 547 CB ARG A 37 -14.464 -9.701 -8.772 1.00 0.00 C ATOM 548 CG ARG A 37 -14.259 -10.776 -9.841 1.00 0.00 C ATOM 549 CD ARG A 37 -15.504 -11.661 -9.920 1.00 0.00 C ATOM 550 NE ARG A 37 -16.665 -10.885 -10.440 1.00 0.00 N ATOM 551 CZ ARG A 37 -18.002 -11.030 -10.206 1.00 0.00 C ATOM 552 NH1 ARG A 37 -18.464 -11.851 -9.219 1.00 0.00 N ATOM 553 NH2 ARG A 37 -18.876 -10.218 -10.870 1.00 0.00 N ATOM 0 H ARG A 37 -14.356 -8.006 -7.076 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.368 -9.253 -8.660 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -14.572 -10.178 -7.798 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -15.394 -9.168 -8.971 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -14.069 -10.311 -10.808 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -13.385 -11.381 -9.601 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -15.310 -12.515 -10.569 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -15.738 -12.058 -8.932 1.00 0.00 H new ATOM 0 HE ARG A 37 -16.421 -10.123 -11.073 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -17.806 -12.371 -8.639 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -19.467 -11.944 -9.061 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -18.526 -9.520 -11.526 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -19.879 -10.309 -10.710 1.00 0.00 H new ATOM 567 N SER A 38 -14.135 -6.885 -10.072 1.00 0.00 N ATOM 568 CA SER A 38 -14.136 -5.920 -11.127 1.00 0.00 C ATOM 569 C SER A 38 -13.013 -4.942 -11.164 1.00 0.00 C ATOM 570 O SER A 38 -12.766 -4.512 -12.290 1.00 0.00 O ATOM 571 CB SER A 38 -15.407 -5.109 -11.432 1.00 0.00 C ATOM 572 OG SER A 38 -16.580 -5.880 -11.218 1.00 0.00 O ATOM 0 H SER A 38 -14.906 -6.767 -9.414 1.00 0.00 H new ATOM 0 HA SER A 38 -14.029 -6.683 -11.898 1.00 0.00 H new ATOM 0 HB2 SER A 38 -15.434 -4.221 -10.800 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.381 -4.764 -12.466 1.00 0.00 H new ATOM 0 HG SER A 38 -16.917 -5.719 -10.312 1.00 0.00 H new ATOM 578 N LEU A 39 -12.195 -4.652 -10.136 1.00 0.00 N ATOM 579 CA LEU A 39 -10.954 -3.953 -10.267 1.00 0.00 C ATOM 580 C LEU A 39 -9.833 -4.889 -10.562 1.00 0.00 C ATOM 581 O LEU A 39 -8.741 -4.487 -10.959 1.00 0.00 O ATOM 582 CB LEU A 39 -10.610 -3.184 -8.980 1.00 0.00 C ATOM 583 CG LEU A 39 -11.580 -2.046 -8.620 1.00 0.00 C ATOM 584 CD1 LEU A 39 -11.347 -1.455 -7.219 1.00 0.00 C ATOM 585 CD2 LEU A 39 -11.526 -0.969 -9.717 1.00 0.00 C ATOM 0 H LEU A 39 -12.407 -4.916 -9.174 1.00 0.00 H new ATOM 0 HA LEU A 39 -11.077 -3.254 -11.094 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.580 -3.890 -8.150 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.608 -2.768 -9.081 1.00 0.00 H new ATOM 0 HG LEU A 39 -12.584 -2.469 -8.575 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -12.068 -0.658 -7.036 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.471 -2.236 -6.469 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.336 -1.051 -7.158 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -12.212 -0.160 -9.467 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -10.512 -0.575 -9.791 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -11.815 -1.408 -10.672 1.00 0.00 H new ATOM 597 N GLY A 40 -10.033 -6.188 -10.274 1.00 0.00 N ATOM 598 CA GLY A 40 -9.081 -7.206 -10.592 1.00 0.00 C ATOM 599 C GLY A 40 -8.291 -7.724 -9.440 1.00 0.00 C ATOM 600 O GLY A 40 -7.223 -8.283 -9.687 1.00 0.00 O ATOM 0 H GLY A 40 -10.872 -6.537 -9.811 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -9.608 -8.041 -11.054 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -8.390 -6.813 -11.338 1.00 0.00 H new ATOM 604 N GLN A 41 -8.808 -7.504 -8.218 1.00 0.00 N ATOM 605 CA GLN A 41 -8.374 -7.962 -6.934 1.00 0.00 C ATOM 606 C GLN A 41 -9.006 -9.278 -6.636 1.00 0.00 C ATOM 607 O GLN A 41 -9.986 -9.624 -7.293 1.00 0.00 O ATOM 608 CB GLN A 41 -8.617 -6.935 -5.815 1.00 0.00 C ATOM 609 CG GLN A 41 -7.848 -5.638 -6.075 1.00 0.00 C ATOM 610 CD GLN A 41 -8.176 -4.639 -4.975 1.00 0.00 C ATOM 611 OE1 GLN A 41 -9.131 -3.863 -4.975 1.00 0.00 O ATOM 612 NE2 GLN A 41 -7.307 -4.620 -3.929 1.00 0.00 N ATOM 0 H GLN A 41 -9.643 -6.926 -8.123 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.292 -8.090 -6.971 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.683 -6.720 -5.741 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.310 -7.357 -4.858 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -6.776 -5.834 -6.098 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.118 -5.229 -7.048 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.511 -5.258 -3.916 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -7.451 -3.968 -3.158 1.00 0.00 H new ATOM 621 N ASN A 42 -8.423 -9.993 -5.657 1.00 0.00 N ATOM 622 CA ASN A 42 -8.857 -11.327 -5.379 1.00 0.00 C ATOM 623 C ASN A 42 -8.759 -11.548 -3.909 1.00 0.00 C ATOM 624 O ASN A 42 -7.813 -12.229 -3.516 1.00 0.00 O ATOM 625 CB ASN A 42 -7.911 -12.374 -5.990 1.00 0.00 C ATOM 626 CG ASN A 42 -8.068 -12.177 -7.491 1.00 0.00 C ATOM 627 OD1 ASN A 42 -9.127 -12.429 -8.064 1.00 0.00 O ATOM 628 ND2 ASN A 42 -6.957 -11.731 -8.136 1.00 0.00 N ATOM 0 H ASN A 42 -7.663 -9.655 -5.066 1.00 0.00 H new ATOM 0 HA ASN A 42 -9.864 -11.433 -5.783 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -6.881 -12.215 -5.672 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -8.186 -13.385 -5.689 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -6.976 -11.590 -9.146 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -6.105 -11.538 -7.610 1.00 0.00 H new ATOM 635 N PRO A 43 -9.649 -11.065 -3.093 1.00 0.00 N ATOM 636 CA PRO A 43 -9.703 -11.556 -1.747 1.00 0.00 C ATOM 637 C PRO A 43 -10.368 -12.889 -1.751 1.00 0.00 C ATOM 638 O PRO A 43 -11.179 -13.232 -2.610 1.00 0.00 O ATOM 639 CB PRO A 43 -10.523 -10.458 -1.072 1.00 0.00 C ATOM 640 CG PRO A 43 -11.467 -9.969 -2.182 1.00 0.00 C ATOM 641 CD PRO A 43 -10.411 -9.842 -3.292 1.00 0.00 C ATOM 0 HA PRO A 43 -8.751 -11.724 -1.244 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -11.078 -10.842 -0.216 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -9.887 -9.653 -0.704 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -12.255 -10.683 -2.420 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -11.955 -9.024 -1.944 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -10.860 -9.793 -4.284 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -9.796 -8.950 -3.176 1.00 0.00 H new ATOM 649 N THR A 44 -10.116 -13.664 -0.682 1.00 0.00 N ATOM 650 CA THR A 44 -10.893 -14.791 -0.267 1.00 0.00 C ATOM 651 C THR A 44 -12.059 -14.362 0.556 1.00 0.00 C ATOM 652 O THR A 44 -12.181 -13.205 0.956 1.00 0.00 O ATOM 653 CB THR A 44 -10.138 -15.770 0.582 1.00 0.00 C ATOM 654 OG1 THR A 44 -9.636 -15.231 1.796 1.00 0.00 O ATOM 655 CG2 THR A 44 -8.898 -16.138 -0.249 1.00 0.00 C ATOM 0 H THR A 44 -9.319 -13.493 -0.069 1.00 0.00 H new ATOM 0 HA THR A 44 -11.191 -15.268 -1.201 1.00 0.00 H new ATOM 0 HB THR A 44 -10.813 -16.586 0.841 1.00 0.00 H new ATOM 0 HG1 THR A 44 -8.913 -14.600 1.599 1.00 0.00 H new ATOM 0 HG21 THR A 44 -8.289 -16.854 0.303 1.00 0.00 H new ATOM 0 HG22 THR A 44 -9.212 -16.582 -1.194 1.00 0.00 H new ATOM 0 HG23 THR A 44 -8.313 -15.240 -0.446 1.00 0.00 H new ATOM 663 N GLU A 45 -13.068 -15.238 0.710 1.00 0.00 N ATOM 664 CA GLU A 45 -14.250 -15.011 1.483 1.00 0.00 C ATOM 665 C GLU A 45 -13.947 -14.732 2.915 1.00 0.00 C ATOM 666 O GLU A 45 -14.600 -13.941 3.593 1.00 0.00 O ATOM 667 CB GLU A 45 -15.129 -16.273 1.469 1.00 0.00 C ATOM 668 CG GLU A 45 -15.463 -16.833 0.085 1.00 0.00 C ATOM 669 CD GLU A 45 -14.599 -17.998 -0.377 1.00 0.00 C ATOM 670 OE1 GLU A 45 -13.360 -17.890 -0.175 1.00 0.00 O ATOM 671 OE2 GLU A 45 -15.125 -18.982 -0.963 1.00 0.00 O ATOM 0 H GLU A 45 -13.058 -16.158 0.269 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.748 -14.151 1.036 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -14.626 -17.051 2.044 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -16.063 -16.049 1.985 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.505 -17.153 0.084 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.376 -16.028 -0.644 1.00 0.00 H new ATOM 678 N ALA A 46 -12.891 -15.380 3.437 1.00 0.00 N ATOM 679 CA ALA A 46 -12.416 -15.067 4.749 1.00 0.00 C ATOM 680 C ALA A 46 -11.801 -13.735 5.008 1.00 0.00 C ATOM 681 O ALA A 46 -12.250 -13.070 5.940 1.00 0.00 O ATOM 682 CB ALA A 46 -11.483 -16.171 5.273 1.00 0.00 C ATOM 0 H ALA A 46 -12.370 -16.114 2.957 1.00 0.00 H new ATOM 0 HA ALA A 46 -13.355 -15.008 5.299 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -11.135 -15.909 6.272 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -12.024 -17.116 5.313 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -10.627 -16.271 4.606 1.00 0.00 H new ATOM 688 N GLU A 47 -10.998 -13.259 4.038 1.00 0.00 N ATOM 689 CA GLU A 47 -10.482 -11.939 3.850 1.00 0.00 C ATOM 690 C GLU A 47 -11.521 -10.878 3.729 1.00 0.00 C ATOM 691 O GLU A 47 -11.358 -9.814 4.324 1.00 0.00 O ATOM 692 CB GLU A 47 -9.499 -11.840 2.671 1.00 0.00 C ATOM 693 CG GLU A 47 -8.083 -12.332 2.976 1.00 0.00 C ATOM 694 CD GLU A 47 -7.330 -12.354 1.654 1.00 0.00 C ATOM 695 OE1 GLU A 47 -7.461 -13.286 0.817 1.00 0.00 O ATOM 696 OE2 GLU A 47 -6.490 -11.439 1.440 1.00 0.00 O ATOM 0 H GLU A 47 -10.674 -13.880 3.297 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.940 -11.749 4.776 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.897 -12.415 1.835 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -9.446 -10.801 2.346 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -7.590 -11.672 3.690 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -8.107 -13.326 3.424 1.00 0.00 H new ATOM 703 N LEU A 48 -12.651 -11.094 3.033 1.00 0.00 N ATOM 704 CA LEU A 48 -13.734 -10.167 2.924 1.00 0.00 C ATOM 705 C LEU A 48 -14.509 -9.967 4.181 1.00 0.00 C ATOM 706 O LEU A 48 -14.665 -8.869 4.713 1.00 0.00 O ATOM 707 CB LEU A 48 -14.759 -10.491 1.824 1.00 0.00 C ATOM 708 CG LEU A 48 -14.362 -9.897 0.462 1.00 0.00 C ATOM 709 CD1 LEU A 48 -15.074 -10.659 -0.668 1.00 0.00 C ATOM 710 CD2 LEU A 48 -14.532 -8.371 0.381 1.00 0.00 C ATOM 0 H LEU A 48 -12.817 -11.960 2.520 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.194 -9.255 2.667 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -14.859 -11.572 1.731 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -15.736 -10.105 2.115 1.00 0.00 H new ATOM 0 HG LEU A 48 -13.289 -10.040 0.336 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -14.789 -10.233 -1.630 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -14.786 -11.710 -0.636 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -16.153 -10.575 -0.540 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -14.233 -8.024 -0.608 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -15.576 -8.111 0.556 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -13.908 -7.895 1.137 1.00 0.00 H new ATOM 722 N GLN A 49 -15.045 -11.087 4.697 1.00 0.00 N ATOM 723 CA GLN A 49 -15.847 -11.189 5.877 1.00 0.00 C ATOM 724 C GLN A 49 -15.299 -10.516 7.088 1.00 0.00 C ATOM 725 O GLN A 49 -15.927 -9.799 7.866 1.00 0.00 O ATOM 726 CB GLN A 49 -16.266 -12.632 6.206 1.00 0.00 C ATOM 727 CG GLN A 49 -17.571 -12.631 7.005 1.00 0.00 C ATOM 728 CD GLN A 49 -18.757 -12.284 6.116 1.00 0.00 C ATOM 729 OE1 GLN A 49 -18.755 -12.552 4.916 1.00 0.00 O ATOM 730 NE2 GLN A 49 -19.876 -11.736 6.661 1.00 0.00 N ATOM 0 H GLN A 49 -14.905 -11.994 4.252 1.00 0.00 H new ATOM 0 HA GLN A 49 -16.739 -10.625 5.603 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -16.395 -13.201 5.285 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -15.480 -13.126 6.778 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -17.725 -13.611 7.457 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -17.501 -11.912 7.821 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -19.899 -11.506 7.654 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -20.692 -11.555 6.076 1.00 0.00 H new ATOM 739 N ASP A 50 -13.967 -10.654 7.206 1.00 0.00 N ATOM 740 CA ASP A 50 -13.059 -10.089 8.155 1.00 0.00 C ATOM 741 C ASP A 50 -12.995 -8.602 8.099 1.00 0.00 C ATOM 742 O ASP A 50 -13.186 -7.942 9.120 1.00 0.00 O ATOM 743 CB ASP A 50 -11.652 -10.685 7.981 1.00 0.00 C ATOM 744 CG ASP A 50 -10.786 -10.605 9.231 1.00 0.00 C ATOM 745 OD1 ASP A 50 -11.211 -11.016 10.343 1.00 0.00 O ATOM 746 OD2 ASP A 50 -9.603 -10.192 9.099 1.00 0.00 O ATOM 0 H ASP A 50 -13.463 -11.243 6.543 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.449 -10.350 9.139 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -11.745 -11.729 7.682 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.146 -10.165 7.167 1.00 0.00 H new ATOM 751 N MET A 51 -12.819 -7.986 6.917 1.00 0.00 N ATOM 752 CA MET A 51 -12.769 -6.561 6.806 1.00 0.00 C ATOM 753 C MET A 51 -14.091 -5.878 6.886 1.00 0.00 C ATOM 754 O MET A 51 -14.219 -4.866 7.574 1.00 0.00 O ATOM 755 CB MET A 51 -11.917 -6.235 5.568 1.00 0.00 C ATOM 756 CG MET A 51 -12.532 -6.594 4.214 1.00 0.00 C ATOM 757 SD MET A 51 -11.773 -5.744 2.798 1.00 0.00 S ATOM 758 CE MET A 51 -10.199 -6.648 2.844 1.00 0.00 C ATOM 0 H MET A 51 -12.710 -8.479 6.031 1.00 0.00 H new ATOM 0 HA MET A 51 -12.288 -6.135 7.686 1.00 0.00 H new ATOM 0 HB2 MET A 51 -11.699 -5.167 5.573 1.00 0.00 H new ATOM 0 HB3 MET A 51 -10.964 -6.756 5.661 1.00 0.00 H new ATOM 0 HG2 MET A 51 -12.448 -7.670 4.064 1.00 0.00 H new ATOM 0 HG3 MET A 51 -13.596 -6.357 4.237 1.00 0.00 H new ATOM 0 HE1 MET A 51 -9.592 -6.366 1.983 1.00 0.00 H new ATOM 0 HE2 MET A 51 -9.664 -6.401 3.761 1.00 0.00 H new ATOM 0 HE3 MET A 51 -10.394 -7.720 2.815 1.00 0.00 H new ATOM 768 N ILE A 52 -15.178 -6.570 6.500 1.00 0.00 N ATOM 769 CA ILE A 52 -16.571 -6.316 6.700 1.00 0.00 C ATOM 770 C ILE A 52 -16.898 -6.266 8.153 1.00 0.00 C ATOM 771 O ILE A 52 -17.556 -5.351 8.647 1.00 0.00 O ATOM 772 CB ILE A 52 -17.406 -7.235 5.860 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.895 -6.633 4.532 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.632 -7.750 6.633 1.00 0.00 C ATOM 775 CD1 ILE A 52 -16.979 -6.919 3.343 1.00 0.00 C ATOM 0 H ILE A 52 -15.054 -7.433 5.970 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.831 -5.321 6.339 1.00 0.00 H new ATOM 0 HB ILE A 52 -16.726 -8.051 5.617 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -18.889 -7.023 4.313 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -17.994 -5.554 4.649 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.214 -8.413 5.993 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.302 -8.296 7.517 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -19.250 -6.906 6.938 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -17.394 -6.461 2.445 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -15.990 -6.505 3.538 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -16.899 -7.996 3.196 1.00 0.00 H new ATOM 787 N ASN A 53 -16.365 -7.187 8.976 1.00 0.00 N ATOM 788 CA ASN A 53 -16.462 -7.217 10.402 1.00 0.00 C ATOM 789 C ASN A 53 -15.655 -6.142 11.045 1.00 0.00 C ATOM 790 O ASN A 53 -15.970 -5.572 12.089 1.00 0.00 O ATOM 791 CB ASN A 53 -15.955 -8.597 10.855 1.00 0.00 C ATOM 792 CG ASN A 53 -17.069 -9.625 10.721 1.00 0.00 C ATOM 793 OD1 ASN A 53 -18.257 -9.306 10.722 1.00 0.00 O ATOM 794 ND2 ASN A 53 -16.715 -10.936 10.791 1.00 0.00 N ATOM 0 H ASN A 53 -15.824 -7.972 8.614 1.00 0.00 H new ATOM 0 HA ASN A 53 -17.496 -7.047 10.701 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -15.098 -8.896 10.252 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.615 -8.548 11.890 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.435 -11.657 10.844 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -15.729 -11.199 10.790 1.00 0.00 H new ATOM 801 N GLU A 54 -14.579 -5.727 10.354 1.00 0.00 N ATOM 802 CA GLU A 54 -13.742 -4.724 10.935 1.00 0.00 C ATOM 803 C GLU A 54 -14.221 -3.314 10.870 1.00 0.00 C ATOM 804 O GLU A 54 -14.159 -2.581 11.855 1.00 0.00 O ATOM 805 CB GLU A 54 -12.338 -4.679 10.308 1.00 0.00 C ATOM 806 CG GLU A 54 -11.344 -3.598 10.738 1.00 0.00 C ATOM 807 CD GLU A 54 -9.867 -3.965 10.706 1.00 0.00 C ATOM 808 OE1 GLU A 54 -9.407 -4.631 11.673 1.00 0.00 O ATOM 809 OE2 GLU A 54 -9.195 -3.539 9.730 1.00 0.00 O ATOM 0 H GLU A 54 -14.296 -6.067 9.435 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.749 -5.055 11.973 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.868 -5.645 10.495 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -12.467 -4.591 9.229 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.491 -2.729 10.097 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -11.595 -3.292 11.754 1.00 0.00 H new ATOM 816 N VAL A 55 -14.764 -2.889 9.715 1.00 0.00 N ATOM 817 CA VAL A 55 -15.006 -1.516 9.396 1.00 0.00 C ATOM 818 C VAL A 55 -16.400 -1.086 9.697 1.00 0.00 C ATOM 819 O VAL A 55 -16.765 0.081 9.558 1.00 0.00 O ATOM 820 CB VAL A 55 -14.489 -1.031 8.074 1.00 0.00 C ATOM 821 CG1 VAL A 55 -12.980 -1.294 7.936 1.00 0.00 C ATOM 822 CG2 VAL A 55 -15.291 -1.571 6.879 1.00 0.00 C ATOM 0 H VAL A 55 -15.046 -3.529 8.972 1.00 0.00 H new ATOM 0 HA VAL A 55 -14.360 -0.983 10.094 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.636 0.049 8.056 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.635 -0.932 6.968 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.446 -0.773 8.730 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.789 -2.364 8.012 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.868 -1.184 5.952 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.245 -2.660 6.872 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.330 -1.252 6.964 1.00 0.00 H new ATOM 832 N ASP A 56 -17.167 -2.059 10.220 1.00 0.00 N ATOM 833 CA ASP A 56 -18.565 -1.995 10.516 1.00 0.00 C ATOM 834 C ASP A 56 -18.766 -1.374 11.855 1.00 0.00 C ATOM 835 O ASP A 56 -18.474 -1.861 12.946 1.00 0.00 O ATOM 836 CB ASP A 56 -19.240 -3.376 10.452 1.00 0.00 C ATOM 837 CG ASP A 56 -20.752 -3.357 10.278 1.00 0.00 C ATOM 838 OD1 ASP A 56 -21.353 -2.348 9.823 1.00 0.00 O ATOM 839 OD2 ASP A 56 -21.334 -4.452 10.503 1.00 0.00 O ATOM 0 H ASP A 56 -16.773 -2.970 10.456 1.00 0.00 H new ATOM 0 HA ASP A 56 -19.039 -1.378 9.752 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.803 -3.937 9.626 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -19.003 -3.920 11.367 1.00 0.00 H new ATOM 844 N ALA A 57 -19.160 -0.088 11.876 1.00 0.00 N ATOM 845 CA ALA A 57 -19.239 0.890 12.916 1.00 0.00 C ATOM 846 C ALA A 57 -20.552 0.835 13.618 1.00 0.00 C ATOM 847 O ALA A 57 -20.616 1.176 14.798 1.00 0.00 O ATOM 848 CB ALA A 57 -18.932 2.297 12.377 1.00 0.00 C ATOM 0 H ALA A 57 -19.478 0.331 11.002 1.00 0.00 H new ATOM 0 HA ALA A 57 -18.475 0.653 13.656 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.999 3.021 13.189 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -17.926 2.315 11.958 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.653 2.555 11.601 1.00 0.00 H new ATOM 854 N ASP A 58 -21.661 0.475 12.947 1.00 0.00 N ATOM 855 CA ASP A 58 -22.989 0.332 13.459 1.00 0.00 C ATOM 856 C ASP A 58 -23.292 -1.031 13.978 1.00 0.00 C ATOM 857 O ASP A 58 -23.912 -1.225 15.023 1.00 0.00 O ATOM 858 CB ASP A 58 -23.982 0.907 12.435 1.00 0.00 C ATOM 859 CG ASP A 58 -23.743 0.388 11.024 1.00 0.00 C ATOM 860 OD1 ASP A 58 -23.525 -0.846 10.888 1.00 0.00 O ATOM 861 OD2 ASP A 58 -23.671 1.137 10.014 1.00 0.00 O ATOM 0 H ASP A 58 -21.621 0.264 11.950 1.00 0.00 H new ATOM 0 HA ASP A 58 -23.096 0.925 14.367 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -24.998 0.658 12.742 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -23.907 1.994 12.435 1.00 0.00 H new ATOM 866 N GLY A 59 -22.953 -2.083 13.213 1.00 0.00 N ATOM 867 CA GLY A 59 -23.060 -3.483 13.485 1.00 0.00 C ATOM 868 C GLY A 59 -23.965 -4.194 12.539 1.00 0.00 C ATOM 869 O GLY A 59 -24.235 -5.378 12.733 1.00 0.00 O ATOM 0 H GLY A 59 -22.554 -1.928 12.287 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -22.068 -3.933 13.438 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -23.425 -3.623 14.502 1.00 0.00 H new ATOM 873 N ASN A 60 -24.455 -3.568 11.453 1.00 0.00 N ATOM 874 CA ASN A 60 -25.561 -4.064 10.694 1.00 0.00 C ATOM 875 C ASN A 60 -25.207 -5.127 9.711 1.00 0.00 C ATOM 876 O ASN A 60 -26.114 -5.791 9.211 1.00 0.00 O ATOM 877 CB ASN A 60 -26.467 -3.004 10.047 1.00 0.00 C ATOM 878 CG ASN A 60 -25.862 -2.118 8.967 1.00 0.00 C ATOM 879 OD1 ASN A 60 -24.756 -2.346 8.479 1.00 0.00 O ATOM 880 ND2 ASN A 60 -26.591 -1.063 8.516 1.00 0.00 N ATOM 0 H ASN A 60 -24.072 -2.694 11.094 1.00 0.00 H new ATOM 0 HA ASN A 60 -26.162 -4.525 11.478 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -27.328 -3.516 9.617 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.844 -2.357 10.839 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -26.220 -0.466 7.777 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -27.509 -0.869 8.917 1.00 0.00 H new ATOM 887 N GLY A 61 -23.921 -5.445 9.483 1.00 0.00 N ATOM 888 CA GLY A 61 -23.540 -6.511 8.608 1.00 0.00 C ATOM 889 C GLY A 61 -23.152 -5.904 7.304 1.00 0.00 C ATOM 890 O GLY A 61 -22.168 -6.405 6.761 1.00 0.00 O ATOM 0 H GLY A 61 -23.134 -4.957 9.911 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -22.709 -7.075 9.031 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -24.365 -7.211 8.475 1.00 0.00 H new ATOM 894 N THR A 62 -23.868 -4.864 6.842 1.00 0.00 N ATOM 895 CA THR A 62 -23.725 -4.281 5.544 1.00 0.00 C ATOM 896 C THR A 62 -22.869 -3.062 5.597 1.00 0.00 C ATOM 897 O THR A 62 -22.772 -2.301 6.559 1.00 0.00 O ATOM 898 CB THR A 62 -25.056 -4.014 4.906 1.00 0.00 C ATOM 899 OG1 THR A 62 -25.835 -3.099 5.662 1.00 0.00 O ATOM 900 CG2 THR A 62 -25.850 -5.330 4.852 1.00 0.00 C ATOM 0 H THR A 62 -24.585 -4.405 7.404 1.00 0.00 H new ATOM 0 HA THR A 62 -23.217 -5.005 4.907 1.00 0.00 H new ATOM 0 HB THR A 62 -24.866 -3.597 3.917 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.357 -2.864 6.484 1.00 0.00 H new ATOM 0 HG21 THR A 62 -26.821 -5.151 4.390 1.00 0.00 H new ATOM 0 HG22 THR A 62 -25.299 -6.064 4.264 1.00 0.00 H new ATOM 0 HG23 THR A 62 -25.994 -5.710 5.863 1.00 0.00 H new ATOM 908 N ILE A 63 -22.188 -2.724 4.488 1.00 0.00 N ATOM 909 CA ILE A 63 -21.306 -1.605 4.366 1.00 0.00 C ATOM 910 C ILE A 63 -22.085 -0.421 3.908 1.00 0.00 C ATOM 911 O ILE A 63 -22.450 -0.267 2.743 1.00 0.00 O ATOM 912 CB ILE A 63 -20.097 -1.847 3.512 1.00 0.00 C ATOM 913 CG1 ILE A 63 -19.483 -3.247 3.680 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.989 -0.827 3.822 1.00 0.00 C ATOM 915 CD1 ILE A 63 -18.356 -3.527 2.688 1.00 0.00 C ATOM 0 H ILE A 63 -22.258 -3.264 3.626 1.00 0.00 H new ATOM 0 HA ILE A 63 -20.889 -1.419 5.356 1.00 0.00 H new ATOM 0 HB ILE A 63 -20.461 -1.748 2.490 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -19.100 -3.350 4.695 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -20.264 -3.997 3.556 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -18.124 -1.025 3.189 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.357 0.180 3.628 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.699 -0.912 4.869 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -17.964 -4.530 2.857 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -18.740 -3.454 1.671 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -17.559 -2.797 2.828 1.00 0.00 H new ATOM 927 N ASP A 64 -22.452 0.491 4.826 1.00 0.00 N ATOM 928 CA ASP A 64 -22.994 1.759 4.449 1.00 0.00 C ATOM 929 C ASP A 64 -21.962 2.683 3.899 1.00 0.00 C ATOM 930 O ASP A 64 -20.778 2.361 3.813 1.00 0.00 O ATOM 931 CB ASP A 64 -23.659 2.425 5.665 1.00 0.00 C ATOM 932 CG ASP A 64 -24.580 1.521 6.471 1.00 0.00 C ATOM 933 OD1 ASP A 64 -24.092 0.638 7.227 1.00 0.00 O ATOM 934 OD2 ASP A 64 -25.787 1.880 6.484 1.00 0.00 O ATOM 0 H ASP A 64 -22.373 0.349 5.833 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.726 1.569 3.664 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -22.878 2.804 6.325 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -24.231 3.287 5.321 1.00 0.00 H new ATOM 939 N PHE A 65 -22.352 3.916 3.532 1.00 0.00 N ATOM 940 CA PHE A 65 -21.463 4.935 3.065 1.00 0.00 C ATOM 941 C PHE A 65 -20.289 5.292 3.911 1.00 0.00 C ATOM 942 O PHE A 65 -19.220 5.199 3.310 1.00 0.00 O ATOM 943 CB PHE A 65 -22.289 6.071 2.440 1.00 0.00 C ATOM 944 CG PHE A 65 -21.484 7.112 1.741 1.00 0.00 C ATOM 945 CD1 PHE A 65 -20.562 6.807 0.768 1.00 0.00 C ATOM 946 CD2 PHE A 65 -21.705 8.426 2.079 1.00 0.00 C ATOM 947 CE1 PHE A 65 -19.894 7.831 0.138 1.00 0.00 C ATOM 948 CE2 PHE A 65 -20.979 9.426 1.475 1.00 0.00 C ATOM 949 CZ PHE A 65 -20.034 9.145 0.518 1.00 0.00 C ATOM 0 H PHE A 65 -23.326 4.216 3.562 1.00 0.00 H new ATOM 0 HA PHE A 65 -20.858 4.501 2.269 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -22.996 5.641 1.731 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -22.875 6.550 3.224 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.365 5.779 0.502 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.450 8.674 2.820 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.236 7.594 -0.685 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.155 10.453 1.759 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.426 9.924 0.082 1.00 0.00 H new ATOM 959 N PRO A 66 -20.297 5.656 5.159 1.00 0.00 N ATOM 960 CA PRO A 66 -19.127 6.127 5.842 1.00 0.00 C ATOM 961 C PRO A 66 -18.115 5.046 6.008 1.00 0.00 C ATOM 962 O PRO A 66 -16.962 5.447 6.155 1.00 0.00 O ATOM 963 CB PRO A 66 -19.633 6.658 7.181 1.00 0.00 C ATOM 964 CG PRO A 66 -21.025 6.015 7.292 1.00 0.00 C ATOM 965 CD PRO A 66 -21.533 6.005 5.842 1.00 0.00 C ATOM 0 HA PRO A 66 -18.612 6.904 5.278 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -18.984 6.364 8.005 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -19.687 7.747 7.191 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -20.970 5.008 7.705 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -21.682 6.591 7.943 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.323 5.272 5.680 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -21.926 6.972 5.529 1.00 0.00 H new ATOM 973 N GLU A 67 -18.579 3.784 6.038 1.00 0.00 N ATOM 974 CA GLU A 67 -17.862 2.547 6.032 1.00 0.00 C ATOM 975 C GLU A 67 -17.298 2.217 4.693 1.00 0.00 C ATOM 976 O GLU A 67 -16.313 1.487 4.600 1.00 0.00 O ATOM 977 CB GLU A 67 -18.704 1.397 6.611 1.00 0.00 C ATOM 978 CG GLU A 67 -19.453 1.798 7.884 1.00 0.00 C ATOM 979 CD GLU A 67 -20.467 0.706 8.193 1.00 0.00 C ATOM 980 OE1 GLU A 67 -21.033 0.004 7.313 1.00 0.00 O ATOM 981 OE2 GLU A 67 -20.835 0.484 9.378 1.00 0.00 O ATOM 0 H GLU A 67 -19.584 3.615 6.071 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.006 2.680 6.694 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -19.422 1.064 5.861 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -18.054 0.549 6.828 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -18.757 1.919 8.714 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -19.954 2.756 7.746 1.00 0.00 H new ATOM 988 N PHE A 68 -17.936 2.563 3.560 1.00 0.00 N ATOM 989 CA PHE A 68 -17.349 2.406 2.265 1.00 0.00 C ATOM 990 C PHE A 68 -16.259 3.400 2.056 1.00 0.00 C ATOM 991 O PHE A 68 -15.234 3.005 1.503 1.00 0.00 O ATOM 992 CB PHE A 68 -18.466 2.470 1.210 1.00 0.00 C ATOM 993 CG PHE A 68 -18.014 2.151 -0.173 1.00 0.00 C ATOM 994 CD1 PHE A 68 -17.398 0.970 -0.513 1.00 0.00 C ATOM 995 CD2 PHE A 68 -18.147 3.085 -1.174 1.00 0.00 C ATOM 996 CE1 PHE A 68 -16.828 0.764 -1.748 1.00 0.00 C ATOM 997 CE2 PHE A 68 -17.743 2.813 -2.460 1.00 0.00 C ATOM 998 CZ PHE A 68 -17.040 1.670 -2.760 1.00 0.00 C ATOM 0 H PHE A 68 -18.876 2.959 3.543 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.867 1.433 2.171 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -19.257 1.775 1.492 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.901 3.469 1.217 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.360 0.174 0.216 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -18.576 4.049 -0.946 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.215 -0.108 -1.922 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -17.982 3.510 -3.249 1.00 0.00 H new ATOM 0 HZ PHE A 68 -16.667 1.490 -3.757 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.432 4.661 2.492 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.372 5.612 2.624 1.00 0.00 C ATOM 1010 C LEU A 69 -14.164 5.186 3.386 1.00 0.00 C ATOM 1011 O LEU A 69 -13.039 5.579 3.082 1.00 0.00 O ATOM 1012 CB LEU A 69 -15.871 6.938 3.221 1.00 0.00 C ATOM 1013 CG LEU A 69 -17.011 7.672 2.494 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -17.606 8.843 3.293 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -16.446 8.321 1.219 1.00 0.00 C ATOM 0 H LEU A 69 -17.343 5.032 2.762 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.045 5.725 1.590 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -16.197 6.743 4.243 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.021 7.618 3.282 1.00 0.00 H new ATOM 0 HG LEU A 69 -17.780 6.919 2.320 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -18.403 9.310 2.715 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.010 8.473 4.235 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -16.827 9.578 3.496 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.244 8.845 0.693 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -15.662 9.029 1.488 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.031 7.549 0.571 1.00 0.00 H new ATOM 1027 N THR A 70 -14.245 4.277 4.374 1.00 0.00 N ATOM 1028 CA THR A 70 -13.155 3.623 5.029 1.00 0.00 C ATOM 1029 C THR A 70 -12.434 2.683 4.124 1.00 0.00 C ATOM 1030 O THR A 70 -11.206 2.623 4.132 1.00 0.00 O ATOM 1031 CB THR A 70 -13.578 2.890 6.267 1.00 0.00 C ATOM 1032 OG1 THR A 70 -14.110 3.888 7.126 1.00 0.00 O ATOM 1033 CG2 THR A 70 -12.474 2.155 7.046 1.00 0.00 C ATOM 0 H THR A 70 -15.147 3.976 4.743 1.00 0.00 H new ATOM 0 HA THR A 70 -12.476 4.425 5.319 1.00 0.00 H new ATOM 0 HB THR A 70 -14.266 2.105 5.953 1.00 0.00 H new ATOM 0 HG1 THR A 70 -14.410 3.474 7.962 1.00 0.00 H new ATOM 0 HG21 THR A 70 -12.908 1.666 7.918 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.012 1.406 6.403 1.00 0.00 H new ATOM 0 HG23 THR A 70 -11.719 2.871 7.370 1.00 0.00 H new ATOM 1041 N MET A 71 -13.194 1.993 3.255 1.00 0.00 N ATOM 1042 CA MET A 71 -12.559 1.203 2.247 1.00 0.00 C ATOM 1043 C MET A 71 -11.914 1.993 1.161 1.00 0.00 C ATOM 1044 O MET A 71 -10.791 1.672 0.773 1.00 0.00 O ATOM 1045 CB MET A 71 -13.473 0.214 1.504 1.00 0.00 C ATOM 1046 CG MET A 71 -14.185 -0.719 2.485 1.00 0.00 C ATOM 1047 SD MET A 71 -12.993 -1.794 3.339 1.00 0.00 S ATOM 1048 CE MET A 71 -14.102 -3.160 3.788 1.00 0.00 C ATOM 0 H MET A 71 -14.214 1.980 3.247 1.00 0.00 H new ATOM 0 HA MET A 71 -11.829 0.673 2.858 1.00 0.00 H new ATOM 0 HB2 MET A 71 -14.211 0.764 0.919 1.00 0.00 H new ATOM 0 HB3 MET A 71 -12.883 -0.374 0.801 1.00 0.00 H new ATOM 0 HG2 MET A 71 -14.739 -0.130 3.216 1.00 0.00 H new ATOM 0 HG3 MET A 71 -14.913 -1.329 1.950 1.00 0.00 H new ATOM 0 HE1 MET A 71 -13.805 -3.567 4.755 1.00 0.00 H new ATOM 0 HE2 MET A 71 -15.126 -2.792 3.848 1.00 0.00 H new ATOM 0 HE3 MET A 71 -14.041 -3.942 3.031 1.00 0.00 H new ATOM 1058 N MET A 72 -12.536 3.039 0.587 1.00 0.00 N ATOM 1059 CA MET A 72 -11.964 3.907 -0.395 1.00 0.00 C ATOM 1060 C MET A 72 -10.764 4.677 0.036 1.00 0.00 C ATOM 1061 O MET A 72 -9.819 4.762 -0.747 1.00 0.00 O ATOM 1062 CB MET A 72 -13.114 4.821 -0.849 1.00 0.00 C ATOM 1063 CG MET A 72 -14.252 4.070 -1.544 1.00 0.00 C ATOM 1064 SD MET A 72 -13.637 2.987 -2.868 1.00 0.00 S ATOM 1065 CE MET A 72 -13.768 4.144 -4.261 1.00 0.00 C ATOM 0 H MET A 72 -13.495 3.293 0.823 1.00 0.00 H new ATOM 0 HA MET A 72 -11.556 3.305 -1.207 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.513 5.348 0.018 1.00 0.00 H new ATOM 0 HB3 MET A 72 -12.720 5.577 -1.528 1.00 0.00 H new ATOM 0 HG2 MET A 72 -14.796 3.475 -0.811 1.00 0.00 H new ATOM 0 HG3 MET A 72 -14.960 4.787 -1.960 1.00 0.00 H new ATOM 0 HE1 MET A 72 -13.431 3.654 -5.174 1.00 0.00 H new ATOM 0 HE2 MET A 72 -14.806 4.456 -4.379 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.146 5.018 -4.068 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.733 5.145 1.297 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.603 5.608 2.041 1.00 0.00 C ATOM 1077 C ALA A 73 -8.435 4.683 2.060 1.00 0.00 C ATOM 1078 O ALA A 73 -7.306 5.169 2.004 1.00 0.00 O ATOM 1079 CB ALA A 73 -9.953 5.918 3.506 1.00 0.00 C ATOM 0 H ALA A 73 -11.589 5.204 1.849 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.319 6.511 1.500 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.061 6.266 4.027 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.719 6.693 3.541 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.327 5.016 3.989 1.00 0.00 H new ATOM 1234 N GLU A 83 6.283 5.416 3.836 1.00 0.00 N ATOM 1235 CA GLU A 83 6.681 6.499 4.682 1.00 0.00 C ATOM 1236 C GLU A 83 6.032 6.471 6.023 1.00 0.00 C ATOM 1237 O GLU A 83 6.551 7.006 7.001 1.00 0.00 O ATOM 1238 CB GLU A 83 6.510 7.893 4.057 1.00 0.00 C ATOM 1239 CG GLU A 83 7.609 8.233 3.048 1.00 0.00 C ATOM 1240 CD GLU A 83 7.368 9.567 2.356 1.00 0.00 C ATOM 1241 OE1 GLU A 83 6.488 9.691 1.462 1.00 0.00 O ATOM 1242 OE2 GLU A 83 8.188 10.456 2.708 1.00 0.00 O ATOM 0 HA GLU A 83 7.750 6.329 4.809 1.00 0.00 H new ATOM 0 HB2 GLU A 83 5.540 7.947 3.562 1.00 0.00 H new ATOM 0 HB3 GLU A 83 6.506 8.642 4.849 1.00 0.00 H new ATOM 0 HG2 GLU A 83 8.572 8.260 3.559 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.668 7.443 2.299 1.00 0.00 H new ATOM 1249 N GLU A 84 4.777 5.995 6.107 1.00 0.00 N ATOM 1250 CA GLU A 84 3.923 5.805 7.238 1.00 0.00 C ATOM 1251 C GLU A 84 4.678 4.989 8.230 1.00 0.00 C ATOM 1252 O GLU A 84 4.798 5.251 9.426 1.00 0.00 O ATOM 1253 CB GLU A 84 2.469 5.392 6.953 1.00 0.00 C ATOM 1254 CG GLU A 84 1.716 5.137 8.260 1.00 0.00 C ATOM 1255 CD GLU A 84 0.218 4.905 8.125 1.00 0.00 C ATOM 1256 OE1 GLU A 84 -0.493 5.943 8.053 1.00 0.00 O ATOM 1257 OE2 GLU A 84 -0.251 3.740 8.233 1.00 0.00 O ATOM 0 H GLU A 84 4.298 5.703 5.255 1.00 0.00 H new ATOM 0 HA GLU A 84 3.698 6.776 7.679 1.00 0.00 H new ATOM 0 HB2 GLU A 84 1.967 6.175 6.385 1.00 0.00 H new ATOM 0 HB3 GLU A 84 2.455 4.493 6.337 1.00 0.00 H new ATOM 0 HG2 GLU A 84 2.157 4.268 8.748 1.00 0.00 H new ATOM 0 HG3 GLU A 84 1.875 5.989 8.921 1.00 0.00 H new ATOM 1264 N ILE A 85 5.200 3.833 7.785 1.00 0.00 N ATOM 1265 CA ILE A 85 5.811 2.877 8.655 1.00 0.00 C ATOM 1266 C ILE A 85 7.231 3.187 8.983 1.00 0.00 C ATOM 1267 O ILE A 85 7.614 3.123 10.150 1.00 0.00 O ATOM 1268 CB ILE A 85 5.692 1.489 8.097 1.00 0.00 C ATOM 1269 CG1 ILE A 85 6.541 1.093 6.877 1.00 0.00 C ATOM 1270 CG2 ILE A 85 4.220 1.212 7.746 1.00 0.00 C ATOM 1271 CD1 ILE A 85 6.446 -0.379 6.477 1.00 0.00 C ATOM 0 H ILE A 85 5.198 3.557 6.803 1.00 0.00 H new ATOM 0 HA ILE A 85 5.260 2.937 9.594 1.00 0.00 H new ATOM 0 HB ILE A 85 6.098 0.882 8.906 1.00 0.00 H new ATOM 0 HG12 ILE A 85 6.238 1.705 6.028 1.00 0.00 H new ATOM 0 HG13 ILE A 85 7.584 1.331 7.086 1.00 0.00 H new ATOM 0 HG21 ILE A 85 4.126 0.205 7.340 1.00 0.00 H new ATOM 0 HG22 ILE A 85 3.609 1.299 8.644 1.00 0.00 H new ATOM 0 HG23 ILE A 85 3.880 1.935 7.005 1.00 0.00 H new ATOM 0 HD11 ILE A 85 7.078 -0.561 5.608 1.00 0.00 H new ATOM 0 HD12 ILE A 85 6.779 -1.004 7.306 1.00 0.00 H new ATOM 0 HD13 ILE A 85 5.413 -0.623 6.231 1.00 0.00 H new ATOM 1283 N ARG A 86 7.873 3.885 8.029 1.00 0.00 N ATOM 1284 CA ARG A 86 9.056 4.653 8.259 1.00 0.00 C ATOM 1285 C ARG A 86 8.909 5.641 9.365 1.00 0.00 C ATOM 1286 O ARG A 86 9.800 5.719 10.210 1.00 0.00 O ATOM 1287 CB ARG A 86 9.574 5.323 6.975 1.00 0.00 C ATOM 1288 CG ARG A 86 11.080 5.312 6.706 1.00 0.00 C ATOM 1289 CD ARG A 86 11.693 6.279 5.691 1.00 0.00 C ATOM 1290 NE ARG A 86 13.153 5.993 5.771 1.00 0.00 N ATOM 1291 CZ ARG A 86 13.795 5.059 5.012 1.00 0.00 C ATOM 1292 NH1 ARG A 86 13.086 4.307 4.120 1.00 0.00 N ATOM 1293 NH2 ARG A 86 15.133 4.854 5.190 1.00 0.00 N ATOM 0 H ARG A 86 7.555 3.915 7.060 1.00 0.00 H new ATOM 0 HA ARG A 86 9.810 3.936 8.583 1.00 0.00 H new ATOM 0 HB2 ARG A 86 9.082 4.844 6.129 1.00 0.00 H new ATOM 0 HB3 ARG A 86 9.246 6.363 6.987 1.00 0.00 H new ATOM 0 HG2 ARG A 86 11.579 5.487 7.659 1.00 0.00 H new ATOM 0 HG3 ARG A 86 11.343 4.303 6.389 1.00 0.00 H new ATOM 0 HD2 ARG A 86 11.305 6.106 4.687 1.00 0.00 H new ATOM 0 HD3 ARG A 86 11.473 7.317 5.943 1.00 0.00 H new ATOM 0 HE ARG A 86 13.709 6.531 6.437 1.00 0.00 H new ATOM 0 HH11 ARG A 86 12.080 4.445 4.023 1.00 0.00 H new ATOM 0 HH12 ARG A 86 13.562 3.608 3.551 1.00 0.00 H new ATOM 0 HH21 ARG A 86 15.644 5.397 5.886 1.00 0.00 H new ATOM 0 HH22 ARG A 86 15.622 4.158 4.627 1.00 0.00 H new ATOM 1307 N GLU A 87 7.849 6.468 9.407 1.00 0.00 N ATOM 1308 CA GLU A 87 7.611 7.323 10.529 1.00 0.00 C ATOM 1309 C GLU A 87 7.184 6.563 11.738 1.00 0.00 C ATOM 1310 O GLU A 87 7.735 6.783 12.815 1.00 0.00 O ATOM 1311 CB GLU A 87 6.604 8.438 10.201 1.00 0.00 C ATOM 1312 CG GLU A 87 6.578 9.533 11.269 1.00 0.00 C ATOM 1313 CD GLU A 87 5.545 10.594 10.918 1.00 0.00 C ATOM 1314 OE1 GLU A 87 5.089 10.540 9.744 1.00 0.00 O ATOM 1315 OE2 GLU A 87 5.286 11.513 11.740 1.00 0.00 O ATOM 0 H GLU A 87 7.156 6.545 8.663 1.00 0.00 H new ATOM 0 HA GLU A 87 8.566 7.795 10.759 1.00 0.00 H new ATOM 0 HB2 GLU A 87 6.857 8.880 9.237 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.608 8.007 10.102 1.00 0.00 H new ATOM 0 HG2 GLU A 87 6.345 9.097 12.240 1.00 0.00 H new ATOM 0 HG3 GLU A 87 7.564 9.990 11.354 1.00 0.00 H new ATOM 1322 N ALA A 88 6.293 5.555 11.716 1.00 0.00 N ATOM 1323 CA ALA A 88 5.805 4.848 12.859 1.00 0.00 C ATOM 1324 C ALA A 88 6.777 3.959 13.555 1.00 0.00 C ATOM 1325 O ALA A 88 6.696 3.766 14.767 1.00 0.00 O ATOM 1326 CB ALA A 88 4.662 3.917 12.420 1.00 0.00 C ATOM 0 H ALA A 88 5.889 5.213 10.844 1.00 0.00 H new ATOM 0 HA ALA A 88 5.524 5.641 13.552 1.00 0.00 H new ATOM 0 HB1 ALA A 88 4.283 3.373 13.285 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.858 4.509 11.983 1.00 0.00 H new ATOM 0 HB3 ALA A 88 5.034 3.208 11.680 1.00 0.00 H new ATOM 1332 N PHE A 89 7.812 3.652 12.753 1.00 0.00 N ATOM 1333 CA PHE A 89 8.985 3.076 13.333 1.00 0.00 C ATOM 1334 C PHE A 89 9.710 4.034 14.214 1.00 0.00 C ATOM 1335 O PHE A 89 9.957 3.806 15.397 1.00 0.00 O ATOM 1336 CB PHE A 89 9.946 2.602 12.230 1.00 0.00 C ATOM 1337 CG PHE A 89 11.076 1.770 12.732 1.00 0.00 C ATOM 1338 CD1 PHE A 89 10.833 0.479 13.139 1.00 0.00 C ATOM 1339 CD2 PHE A 89 12.336 2.319 12.721 1.00 0.00 C ATOM 1340 CE1 PHE A 89 11.850 -0.155 13.814 1.00 0.00 C ATOM 1341 CE2 PHE A 89 13.334 1.632 13.371 1.00 0.00 C ATOM 1342 CZ PHE A 89 13.106 0.395 13.924 1.00 0.00 C ATOM 0 H PHE A 89 7.841 3.795 11.743 1.00 0.00 H new ATOM 0 HA PHE A 89 8.653 2.234 13.940 1.00 0.00 H new ATOM 0 HB2 PHE A 89 9.384 2.028 11.494 1.00 0.00 H new ATOM 0 HB3 PHE A 89 10.350 3.473 11.714 1.00 0.00 H new ATOM 0 HD1 PHE A 89 9.892 -0.012 12.939 1.00 0.00 H new ATOM 0 HD2 PHE A 89 12.535 3.255 12.220 1.00 0.00 H new ATOM 0 HE1 PHE A 89 11.656 -1.114 14.272 1.00 0.00 H new ATOM 0 HE2 PHE A 89 14.317 2.073 13.448 1.00 0.00 H new ATOM 0 HZ PHE A 89 13.897 -0.135 14.435 1.00 0.00 H new ATOM 1352 N ARG A 90 10.010 5.267 13.769 1.00 0.00 N ATOM 1353 CA ARG A 90 10.693 6.262 14.536 1.00 0.00 C ATOM 1354 C ARG A 90 9.874 6.840 15.638 1.00 0.00 C ATOM 1355 O ARG A 90 10.366 7.462 16.579 1.00 0.00 O ATOM 1356 CB ARG A 90 11.351 7.283 13.593 1.00 0.00 C ATOM 1357 CG ARG A 90 10.540 8.527 13.222 1.00 0.00 C ATOM 1358 CD ARG A 90 11.329 9.425 12.267 1.00 0.00 C ATOM 1359 NE ARG A 90 11.543 8.931 10.878 1.00 0.00 N ATOM 1360 CZ ARG A 90 10.849 9.413 9.806 1.00 0.00 C ATOM 1361 NH1 ARG A 90 9.860 10.344 9.939 1.00 0.00 N ATOM 1362 NH2 ARG A 90 11.108 8.804 8.612 1.00 0.00 N ATOM 0 H ARG A 90 9.765 5.585 12.831 1.00 0.00 H new ATOM 0 HA ARG A 90 11.501 5.782 15.088 1.00 0.00 H new ATOM 0 HB2 ARG A 90 12.283 7.613 14.052 1.00 0.00 H new ATOM 0 HB3 ARG A 90 11.616 6.767 12.670 1.00 0.00 H new ATOM 0 HG2 ARG A 90 9.601 8.229 12.756 1.00 0.00 H new ATOM 0 HG3 ARG A 90 10.285 9.083 14.124 1.00 0.00 H new ATOM 0 HD2 ARG A 90 10.816 10.385 12.207 1.00 0.00 H new ATOM 0 HD3 ARG A 90 12.306 9.612 12.712 1.00 0.00 H new ATOM 0 HE ARG A 90 12.238 8.201 10.721 1.00 0.00 H new ATOM 0 HH11 ARG A 90 9.618 10.703 10.863 1.00 0.00 H new ATOM 0 HH12 ARG A 90 9.363 10.681 9.115 1.00 0.00 H new ATOM 0 HH21 ARG A 90 11.783 8.041 8.565 1.00 0.00 H new ATOM 0 HH22 ARG A 90 10.626 9.112 7.767 1.00 0.00 H new ATOM 1376 N VAL A 91 8.547 6.620 15.626 1.00 0.00 N ATOM 1377 CA VAL A 91 7.546 6.831 16.625 1.00 0.00 C ATOM 1378 C VAL A 91 7.681 5.788 17.681 1.00 0.00 C ATOM 1379 O VAL A 91 7.724 6.130 18.862 1.00 0.00 O ATOM 1380 CB VAL A 91 6.123 7.006 16.186 1.00 0.00 C ATOM 1381 CG1 VAL A 91 5.092 7.304 17.287 1.00 0.00 C ATOM 1382 CG2 VAL A 91 5.990 8.193 15.217 1.00 0.00 C ATOM 0 H VAL A 91 8.118 6.236 14.784 1.00 0.00 H new ATOM 0 HA VAL A 91 7.762 7.827 17.011 1.00 0.00 H new ATOM 0 HB VAL A 91 5.903 6.031 15.751 1.00 0.00 H new ATOM 0 HG11 VAL A 91 4.103 7.409 16.841 1.00 0.00 H new ATOM 0 HG12 VAL A 91 5.081 6.485 18.006 1.00 0.00 H new ATOM 0 HG13 VAL A 91 5.360 8.230 17.796 1.00 0.00 H new ATOM 0 HG21 VAL A 91 4.949 8.299 14.913 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.318 9.106 15.713 1.00 0.00 H new ATOM 0 HG23 VAL A 91 6.609 8.016 14.337 1.00 0.00 H new ATOM 1392 N PHE A 92 7.722 4.514 17.251 1.00 0.00 N ATOM 1393 CA PHE A 92 7.662 3.354 18.085 1.00 0.00 C ATOM 1394 C PHE A 92 8.918 3.133 18.856 1.00 0.00 C ATOM 1395 O PHE A 92 8.918 2.736 20.020 1.00 0.00 O ATOM 1396 CB PHE A 92 7.315 2.096 17.271 1.00 0.00 C ATOM 1397 CG PHE A 92 5.916 1.920 16.790 1.00 0.00 C ATOM 1398 CD1 PHE A 92 4.909 2.848 16.919 1.00 0.00 C ATOM 1399 CD2 PHE A 92 5.680 0.661 16.290 1.00 0.00 C ATOM 1400 CE1 PHE A 92 3.663 2.549 16.420 1.00 0.00 C ATOM 1401 CE2 PHE A 92 4.458 0.371 15.730 1.00 0.00 C ATOM 1402 CZ PHE A 92 3.477 1.331 15.812 1.00 0.00 C ATOM 0 H PHE A 92 7.802 4.281 16.261 1.00 0.00 H new ATOM 0 HA PHE A 92 6.865 3.541 18.805 1.00 0.00 H new ATOM 0 HB2 PHE A 92 7.969 2.075 16.400 1.00 0.00 H new ATOM 0 HB3 PHE A 92 7.567 1.228 17.880 1.00 0.00 H new ATOM 0 HD1 PHE A 92 5.094 3.795 17.404 1.00 0.00 H new ATOM 0 HD2 PHE A 92 6.450 -0.095 16.337 1.00 0.00 H new ATOM 0 HE1 PHE A 92 2.850 3.255 16.504 1.00 0.00 H new ATOM 0 HE2 PHE A 92 4.276 -0.576 15.244 1.00 0.00 H new ATOM 0 HZ PHE A 92 2.512 1.117 15.377 1.00 0.00 H new ATOM 1412 N ASP A 93 10.081 3.302 18.201 1.00 0.00 N ATOM 1413 CA ASP A 93 11.343 3.160 18.858 1.00 0.00 C ATOM 1414 C ASP A 93 11.521 4.349 19.739 1.00 0.00 C ATOM 1415 O ASP A 93 11.373 5.502 19.337 1.00 0.00 O ATOM 1416 CB ASP A 93 12.552 3.079 17.911 1.00 0.00 C ATOM 1417 CG ASP A 93 13.903 2.738 18.524 1.00 0.00 C ATOM 1418 OD1 ASP A 93 13.881 2.100 19.611 1.00 0.00 O ATOM 1419 OD2 ASP A 93 15.014 3.076 18.035 1.00 0.00 O ATOM 0 H ASP A 93 10.147 3.538 17.211 1.00 0.00 H new ATOM 0 HA ASP A 93 11.317 2.215 19.400 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.331 2.334 17.147 1.00 0.00 H new ATOM 0 HB3 ASP A 93 12.646 4.039 17.402 1.00 0.00 H new ATOM 1424 N LYS A 94 11.705 4.107 21.049 1.00 0.00 N ATOM 1425 CA LYS A 94 11.527 5.092 22.069 1.00 0.00 C ATOM 1426 C LYS A 94 12.635 6.082 22.184 1.00 0.00 C ATOM 1427 O LYS A 94 12.462 7.296 22.096 1.00 0.00 O ATOM 1428 CB LYS A 94 11.214 4.523 23.463 1.00 0.00 C ATOM 1429 CG LYS A 94 10.744 5.516 24.528 1.00 0.00 C ATOM 1430 CD LYS A 94 10.270 4.926 25.857 1.00 0.00 C ATOM 1431 CE LYS A 94 11.366 4.410 26.792 1.00 0.00 C ATOM 1432 NZ LYS A 94 10.771 3.929 28.059 1.00 0.00 N ATOM 0 H LYS A 94 11.987 3.196 21.410 1.00 0.00 H new ATOM 0 HA LYS A 94 10.642 5.618 21.710 1.00 0.00 H new ATOM 0 HB2 LYS A 94 10.447 3.757 23.352 1.00 0.00 H new ATOM 0 HB3 LYS A 94 12.110 4.026 23.835 1.00 0.00 H new ATOM 0 HG2 LYS A 94 11.562 6.206 24.735 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.929 6.105 24.108 1.00 0.00 H new ATOM 0 HD2 LYS A 94 9.698 5.688 26.386 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.586 4.105 25.644 1.00 0.00 H new ATOM 0 HE2 LYS A 94 11.915 3.601 26.309 1.00 0.00 H new ATOM 0 HE3 LYS A 94 12.083 5.205 26.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 11.524 3.581 28.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 10.267 4.710 28.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 10.104 3.157 27.858 1.00 0.00 H new ATOM 1446 N ASP A 95 13.816 5.601 22.614 1.00 0.00 N ATOM 1447 CA ASP A 95 15.087 6.254 22.550 1.00 0.00 C ATOM 1448 C ASP A 95 15.597 6.650 21.207 1.00 0.00 C ATOM 1449 O ASP A 95 16.084 7.756 20.979 1.00 0.00 O ATOM 1450 CB ASP A 95 16.142 5.460 23.338 1.00 0.00 C ATOM 1451 CG ASP A 95 16.439 4.051 22.845 1.00 0.00 C ATOM 1452 OD1 ASP A 95 15.710 3.423 22.032 1.00 0.00 O ATOM 1453 OD2 ASP A 95 17.480 3.594 23.389 1.00 0.00 O ATOM 0 H ASP A 95 13.885 4.678 23.042 1.00 0.00 H new ATOM 0 HA ASP A 95 14.896 7.219 23.020 1.00 0.00 H new ATOM 0 HB2 ASP A 95 17.073 6.028 23.330 1.00 0.00 H new ATOM 0 HB3 ASP A 95 15.816 5.397 24.376 1.00 0.00 H new ATOM 1458 N GLY A 96 15.386 5.785 20.200 1.00 0.00 N ATOM 1459 CA GLY A 96 15.565 5.962 18.792 1.00 0.00 C ATOM 1460 C GLY A 96 16.978 5.596 18.492 1.00 0.00 C ATOM 1461 O GLY A 96 17.712 6.239 17.742 1.00 0.00 O ATOM 0 H GLY A 96 15.047 4.844 20.403 1.00 0.00 H new ATOM 0 HA2 GLY A 96 14.874 5.332 18.232 1.00 0.00 H new ATOM 0 HA3 GLY A 96 15.362 6.993 18.502 1.00 0.00 H new ATOM 1465 N ASN A 97 17.404 4.447 19.046 1.00 0.00 N ATOM 1466 CA ASN A 97 18.719 3.918 18.855 1.00 0.00 C ATOM 1467 C ASN A 97 18.834 3.209 17.550 1.00 0.00 C ATOM 1468 O ASN A 97 19.949 3.033 17.061 1.00 0.00 O ATOM 1469 CB ASN A 97 19.055 2.984 20.030 1.00 0.00 C ATOM 1470 CG ASN A 97 18.087 1.832 20.257 1.00 0.00 C ATOM 1471 OD1 ASN A 97 17.001 1.708 19.693 1.00 0.00 O ATOM 1472 ND2 ASN A 97 18.563 0.882 21.105 1.00 0.00 N ATOM 0 H ASN A 97 16.816 3.868 19.645 1.00 0.00 H new ATOM 0 HA ASN A 97 19.436 4.738 18.830 1.00 0.00 H new ATOM 0 HB2 ASN A 97 20.051 2.571 19.868 1.00 0.00 H new ATOM 0 HB3 ASN A 97 19.102 3.580 20.942 1.00 0.00 H new ATOM 0 HD21 ASN A 97 18.016 0.041 21.287 1.00 0.00 H new ATOM 0 HD22 ASN A 97 19.467 1.011 21.559 1.00 0.00 H new ATOM 1479 N GLY A 98 17.743 2.772 16.896 1.00 0.00 N ATOM 1480 CA GLY A 98 17.611 2.030 15.681 1.00 0.00 C ATOM 1481 C GLY A 98 16.738 0.827 15.786 1.00 0.00 C ATOM 1482 O GLY A 98 16.210 0.286 14.815 1.00 0.00 O ATOM 0 H GLY A 98 16.820 2.972 17.282 1.00 0.00 H new ATOM 0 HA2 GLY A 98 17.211 2.688 14.909 1.00 0.00 H new ATOM 0 HA3 GLY A 98 18.602 1.717 15.351 1.00 0.00 H new ATOM 1486 N TYR A 99 16.592 0.282 17.006 1.00 0.00 N ATOM 1487 CA TYR A 99 16.021 -1.017 17.186 1.00 0.00 C ATOM 1488 C TYR A 99 14.906 -0.847 18.159 1.00 0.00 C ATOM 1489 O TYR A 99 15.081 -0.295 19.244 1.00 0.00 O ATOM 1490 CB TYR A 99 17.098 -1.981 17.712 1.00 0.00 C ATOM 1491 CG TYR A 99 18.315 -2.051 16.855 1.00 0.00 C ATOM 1492 CD1 TYR A 99 18.219 -2.861 15.749 1.00 0.00 C ATOM 1493 CD2 TYR A 99 19.494 -1.386 17.097 1.00 0.00 C ATOM 1494 CE1 TYR A 99 19.275 -3.016 14.882 1.00 0.00 C ATOM 1495 CE2 TYR A 99 20.572 -1.591 16.268 1.00 0.00 C ATOM 1496 CZ TYR A 99 20.473 -2.402 15.162 1.00 0.00 C ATOM 1497 OH TYR A 99 21.504 -2.494 14.204 1.00 0.00 O ATOM 0 H TYR A 99 16.871 0.743 17.872 1.00 0.00 H new ATOM 0 HA TYR A 99 15.645 -1.441 16.255 1.00 0.00 H new ATOM 0 HB2 TYR A 99 17.390 -1.672 18.716 1.00 0.00 H new ATOM 0 HB3 TYR A 99 16.668 -2.979 17.798 1.00 0.00 H new ATOM 0 HD1 TYR A 99 17.295 -3.387 15.557 1.00 0.00 H new ATOM 0 HD2 TYR A 99 19.573 -0.707 17.933 1.00 0.00 H new ATOM 0 HE1 TYR A 99 19.164 -3.614 13.990 1.00 0.00 H new ATOM 0 HE2 TYR A 99 21.512 -1.107 16.489 1.00 0.00 H new ATOM 0 HH TYR A 99 22.295 -2.015 14.528 1.00 0.00 H new ATOM 1507 N ILE A 100 13.724 -1.446 17.926 1.00 0.00 N ATOM 1508 CA ILE A 100 12.627 -1.460 18.843 1.00 0.00 C ATOM 1509 C ILE A 100 12.903 -2.733 19.566 1.00 0.00 C ATOM 1510 O ILE A 100 12.903 -3.850 19.050 1.00 0.00 O ATOM 1511 CB ILE A 100 11.223 -1.393 18.320 1.00 0.00 C ATOM 1512 CG1 ILE A 100 11.100 -0.628 16.991 1.00 0.00 C ATOM 1513 CG2 ILE A 100 10.587 -0.846 19.609 1.00 0.00 C ATOM 1514 CD1 ILE A 100 9.711 -0.706 16.358 1.00 0.00 C ATOM 0 H ILE A 100 13.524 -1.943 17.058 1.00 0.00 H new ATOM 0 HA ILE A 100 12.608 -0.538 19.425 1.00 0.00 H new ATOM 0 HB ILE A 100 10.729 -2.295 17.959 1.00 0.00 H new ATOM 0 HG12 ILE A 100 11.353 0.419 17.161 1.00 0.00 H new ATOM 0 HG13 ILE A 100 11.832 -1.023 16.287 1.00 0.00 H new ATOM 0 HG21 ILE A 100 9.516 -0.711 19.457 1.00 0.00 H new ATOM 0 HG22 ILE A 100 10.752 -1.551 20.424 1.00 0.00 H new ATOM 0 HG23 ILE A 100 11.041 0.112 19.861 1.00 0.00 H new ATOM 0 HD11 ILE A 100 9.704 -0.142 15.425 1.00 0.00 H new ATOM 0 HD12 ILE A 100 9.462 -1.747 16.155 1.00 0.00 H new ATOM 0 HD13 ILE A 100 8.975 -0.284 17.042 1.00 0.00 H new ATOM 1526 N SER A 101 13.234 -2.600 20.863 1.00 0.00 N ATOM 1527 CA SER A 101 13.466 -3.679 21.773 1.00 0.00 C ATOM 1528 C SER A 101 12.150 -4.321 22.048 1.00 0.00 C ATOM 1529 O SER A 101 11.106 -3.671 22.022 1.00 0.00 O ATOM 1530 CB SER A 101 14.310 -3.401 23.028 1.00 0.00 C ATOM 1531 OG SER A 101 13.575 -2.631 23.968 1.00 0.00 O ATOM 0 H SER A 101 13.346 -1.686 21.301 1.00 0.00 H new ATOM 0 HA SER A 101 14.146 -4.369 21.274 1.00 0.00 H new ATOM 0 HB2 SER A 101 14.616 -4.343 23.482 1.00 0.00 H new ATOM 0 HB3 SER A 101 15.221 -2.871 22.749 1.00 0.00 H new ATOM 0 HG SER A 101 13.388 -1.746 23.591 1.00 0.00 H new ATOM 1537 N ALA A 102 12.169 -5.638 22.321 1.00 0.00 N ATOM 1538 CA ALA A 102 10.990 -6.361 22.687 1.00 0.00 C ATOM 1539 C ALA A 102 10.178 -5.725 23.762 1.00 0.00 C ATOM 1540 O ALA A 102 8.954 -5.629 23.698 1.00 0.00 O ATOM 1541 CB ALA A 102 11.212 -7.836 23.058 1.00 0.00 C ATOM 0 H ALA A 102 13.014 -6.209 22.287 1.00 0.00 H new ATOM 0 HA ALA A 102 10.430 -6.325 21.752 1.00 0.00 H new ATOM 0 HB1 ALA A 102 10.258 -8.293 23.319 1.00 0.00 H new ATOM 0 HB2 ALA A 102 11.646 -8.363 22.209 1.00 0.00 H new ATOM 0 HB3 ALA A 102 11.890 -7.899 23.909 1.00 0.00 H new ATOM 1547 N ALA A 103 10.872 -5.230 24.803 1.00 0.00 N ATOM 1548 CA ALA A 103 10.146 -4.488 25.787 1.00 0.00 C ATOM 1549 C ALA A 103 9.481 -3.236 25.328 1.00 0.00 C ATOM 1550 O ALA A 103 8.320 -2.946 25.613 1.00 0.00 O ATOM 1551 CB ALA A 103 11.114 -4.174 26.940 1.00 0.00 C ATOM 0 H ALA A 103 11.874 -5.333 24.961 1.00 0.00 H new ATOM 0 HA ALA A 103 9.312 -5.123 26.084 1.00 0.00 H new ATOM 0 HB1 ALA A 103 10.591 -3.607 27.710 1.00 0.00 H new ATOM 0 HB2 ALA A 103 11.487 -5.105 27.366 1.00 0.00 H new ATOM 0 HB3 ALA A 103 11.951 -3.587 26.563 1.00 0.00 H new ATOM 1557 N GLU A 104 10.092 -2.444 24.430 1.00 0.00 N ATOM 1558 CA GLU A 104 9.445 -1.312 23.843 1.00 0.00 C ATOM 1559 C GLU A 104 8.379 -1.736 22.892 1.00 0.00 C ATOM 1560 O GLU A 104 7.212 -1.400 23.092 1.00 0.00 O ATOM 1561 CB GLU A 104 10.434 -0.487 23.003 1.00 0.00 C ATOM 1562 CG GLU A 104 11.490 0.328 23.753 1.00 0.00 C ATOM 1563 CD GLU A 104 12.694 0.616 22.868 1.00 0.00 C ATOM 1564 OE1 GLU A 104 13.331 -0.306 22.293 1.00 0.00 O ATOM 1565 OE2 GLU A 104 13.045 1.818 22.725 1.00 0.00 O ATOM 0 H GLU A 104 11.048 -2.591 24.107 1.00 0.00 H new ATOM 0 HA GLU A 104 9.038 -0.734 24.672 1.00 0.00 H new ATOM 0 HB2 GLU A 104 10.952 -1.168 22.328 1.00 0.00 H new ATOM 0 HB3 GLU A 104 9.858 0.199 22.383 1.00 0.00 H new ATOM 0 HG2 GLU A 104 11.054 1.267 24.095 1.00 0.00 H new ATOM 0 HG3 GLU A 104 11.810 -0.217 24.641 1.00 0.00 H new ATOM 1572 N LEU A 105 8.614 -2.660 21.944 1.00 0.00 N ATOM 1573 CA LEU A 105 7.661 -3.135 20.990 1.00 0.00 C ATOM 1574 C LEU A 105 6.465 -3.810 21.568 1.00 0.00 C ATOM 1575 O LEU A 105 5.360 -3.602 21.070 1.00 0.00 O ATOM 1576 CB LEU A 105 8.261 -3.959 19.839 1.00 0.00 C ATOM 1577 CG LEU A 105 7.269 -4.275 18.707 1.00 0.00 C ATOM 1578 CD1 LEU A 105 7.489 -3.484 17.407 1.00 0.00 C ATOM 1579 CD2 LEU A 105 7.249 -5.766 18.330 1.00 0.00 C ATOM 0 H LEU A 105 9.527 -3.103 21.838 1.00 0.00 H new ATOM 0 HA LEU A 105 7.300 -2.203 20.555 1.00 0.00 H new ATOM 0 HB2 LEU A 105 9.110 -3.416 19.422 1.00 0.00 H new ATOM 0 HB3 LEU A 105 8.647 -4.896 20.240 1.00 0.00 H new ATOM 0 HG LEU A 105 6.318 -3.969 19.142 1.00 0.00 H new ATOM 0 HD11 LEU A 105 6.740 -3.778 16.671 1.00 0.00 H new ATOM 0 HD12 LEU A 105 7.399 -2.417 17.611 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.484 -3.696 17.016 1.00 0.00 H new ATOM 0 HD21 LEU A 105 6.531 -5.928 17.526 1.00 0.00 H new ATOM 0 HD22 LEU A 105 8.241 -6.070 17.997 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.961 -6.357 19.199 1.00 0.00 H new ATOM 1591 N ARG A 106 6.566 -4.541 22.692 1.00 0.00 N ATOM 1592 CA ARG A 106 5.424 -5.259 23.166 1.00 0.00 C ATOM 1593 C ARG A 106 4.472 -4.401 23.925 1.00 0.00 C ATOM 1594 O ARG A 106 3.270 -4.494 23.682 1.00 0.00 O ATOM 1595 CB ARG A 106 5.933 -6.453 23.991 1.00 0.00 C ATOM 1596 CG ARG A 106 6.499 -6.251 25.398 1.00 0.00 C ATOM 1597 CD ARG A 106 6.911 -7.517 26.152 1.00 0.00 C ATOM 1598 NE ARG A 106 5.742 -8.435 26.249 1.00 0.00 N ATOM 1599 CZ ARG A 106 5.721 -9.724 25.799 1.00 0.00 C ATOM 1600 NH1 ARG A 106 6.902 -10.178 25.287 1.00 0.00 N ATOM 1601 NH2 ARG A 106 4.582 -10.477 25.809 1.00 0.00 N ATOM 0 H ARG A 106 7.410 -4.635 23.258 1.00 0.00 H new ATOM 0 HA ARG A 106 4.841 -5.618 22.317 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.106 -7.158 24.077 1.00 0.00 H new ATOM 0 HB3 ARG A 106 6.709 -6.942 23.401 1.00 0.00 H new ATOM 0 HG2 ARG A 106 7.368 -5.598 25.326 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.753 -5.725 25.994 1.00 0.00 H new ATOM 0 HD2 ARG A 106 7.734 -8.011 25.635 1.00 0.00 H new ATOM 0 HD3 ARG A 106 7.270 -7.260 27.149 1.00 0.00 H new ATOM 0 HE ARG A 106 4.893 -8.074 26.684 1.00 0.00 H new ATOM 0 HH11 ARG A 106 7.716 -9.564 25.262 1.00 0.00 H new ATOM 0 HH12 ARG A 106 6.970 -11.131 24.929 1.00 0.00 H new ATOM 0 HH21 ARG A 106 3.711 -10.079 26.160 1.00 0.00 H new ATOM 0 HH22 ARG A 106 4.602 -11.437 25.465 1.00 0.00 H new ATOM 1615 N HIS A 107 4.998 -3.378 24.621 1.00 0.00 N ATOM 1616 CA HIS A 107 4.195 -2.353 25.212 1.00 0.00 C ATOM 1617 C HIS A 107 3.551 -1.515 24.162 1.00 0.00 C ATOM 1618 O HIS A 107 2.406 -1.091 24.309 1.00 0.00 O ATOM 1619 CB HIS A 107 5.025 -1.416 26.105 1.00 0.00 C ATOM 1620 CG HIS A 107 4.523 -0.055 26.487 1.00 0.00 C ATOM 1621 ND1 HIS A 107 3.847 0.165 27.670 1.00 0.00 N ATOM 1622 CD2 HIS A 107 4.497 1.094 25.761 1.00 0.00 C ATOM 1623 CE1 HIS A 107 3.457 1.468 27.643 1.00 0.00 C ATOM 1624 NE2 HIS A 107 3.868 2.050 26.532 1.00 0.00 N ATOM 0 H HIS A 107 5.999 -3.260 24.776 1.00 0.00 H new ATOM 0 HA HIS A 107 3.444 -2.864 25.815 1.00 0.00 H new ATOM 0 HB2 HIS A 107 5.222 -1.954 27.032 1.00 0.00 H new ATOM 0 HB3 HIS A 107 5.985 -1.273 25.609 1.00 0.00 H new ATOM 0 HD2 HIS A 107 4.894 1.233 24.766 1.00 0.00 H new ATOM 0 HE1 HIS A 107 2.891 1.958 28.421 1.00 0.00 H new ATOM 0 HE2 HIS A 107 3.743 3.032 26.287 1.00 0.00 H new ATOM 1632 N VAL A 108 4.182 -1.208 23.014 1.00 0.00 N ATOM 1633 CA VAL A 108 3.622 -0.582 21.857 1.00 0.00 C ATOM 1634 C VAL A 108 2.505 -1.425 21.346 1.00 0.00 C ATOM 1635 O VAL A 108 1.413 -0.923 21.085 1.00 0.00 O ATOM 1636 CB VAL A 108 4.672 -0.293 20.825 1.00 0.00 C ATOM 1637 CG1 VAL A 108 4.120 0.334 19.534 1.00 0.00 C ATOM 1638 CG2 VAL A 108 5.630 0.765 21.398 1.00 0.00 C ATOM 0 H VAL A 108 5.172 -1.418 22.887 1.00 0.00 H new ATOM 0 HA VAL A 108 3.212 0.392 22.123 1.00 0.00 H new ATOM 0 HB VAL A 108 5.135 -1.252 20.591 1.00 0.00 H new ATOM 0 HG11 VAL A 108 4.939 0.513 18.838 1.00 0.00 H new ATOM 0 HG12 VAL A 108 3.399 -0.345 19.079 1.00 0.00 H new ATOM 0 HG13 VAL A 108 3.630 1.279 19.769 1.00 0.00 H new ATOM 0 HG21 VAL A 108 6.403 0.991 20.664 1.00 0.00 H new ATOM 0 HG22 VAL A 108 5.073 1.673 21.630 1.00 0.00 H new ATOM 0 HG23 VAL A 108 6.094 0.382 22.307 1.00 0.00 H new ATOM 1648 N MET A 109 2.701 -2.756 21.312 1.00 0.00 N ATOM 1649 CA MET A 109 1.717 -3.556 20.651 1.00 0.00 C ATOM 1650 C MET A 109 0.543 -3.918 21.494 1.00 0.00 C ATOM 1651 O MET A 109 -0.543 -4.218 21.001 1.00 0.00 O ATOM 1652 CB MET A 109 2.436 -4.680 19.885 1.00 0.00 C ATOM 1653 CG MET A 109 3.351 -4.191 18.761 1.00 0.00 C ATOM 1654 SD MET A 109 2.280 -3.704 17.375 1.00 0.00 S ATOM 1655 CE MET A 109 3.712 -3.045 16.473 1.00 0.00 C ATOM 0 H MET A 109 3.493 -3.256 21.717 1.00 0.00 H new ATOM 0 HA MET A 109 1.194 -2.967 19.897 1.00 0.00 H new ATOM 0 HB2 MET A 109 3.027 -5.264 20.591 1.00 0.00 H new ATOM 0 HB3 MET A 109 1.689 -5.352 19.463 1.00 0.00 H new ATOM 0 HG2 MET A 109 3.956 -3.348 19.096 1.00 0.00 H new ATOM 0 HG3 MET A 109 4.042 -4.977 18.457 1.00 0.00 H new ATOM 0 HE1 MET A 109 3.384 -2.642 15.515 1.00 0.00 H new ATOM 0 HE2 MET A 109 4.178 -2.253 17.059 1.00 0.00 H new ATOM 0 HE3 MET A 109 4.434 -3.844 16.303 1.00 0.00 H new ATOM 1665 N THR A 110 0.694 -3.750 22.820 1.00 0.00 N ATOM 1666 CA THR A 110 -0.392 -3.761 23.749 1.00 0.00 C ATOM 1667 C THR A 110 -1.165 -2.488 23.693 1.00 0.00 C ATOM 1668 O THR A 110 -2.384 -2.575 23.550 1.00 0.00 O ATOM 1669 CB THR A 110 0.080 -3.917 25.165 1.00 0.00 C ATOM 1670 OG1 THR A 110 0.920 -5.056 25.288 1.00 0.00 O ATOM 1671 CG2 THR A 110 -1.091 -4.189 26.124 1.00 0.00 C ATOM 0 H THR A 110 1.602 -3.602 23.260 1.00 0.00 H new ATOM 0 HA THR A 110 -1.014 -4.609 23.463 1.00 0.00 H new ATOM 0 HB THR A 110 0.594 -2.989 25.413 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.755 -4.901 24.799 1.00 0.00 H new ATOM 0 HG21 THR A 110 -0.712 -4.296 27.140 1.00 0.00 H new ATOM 0 HG22 THR A 110 -1.794 -3.357 26.085 1.00 0.00 H new ATOM 0 HG23 THR A 110 -1.599 -5.107 25.827 1.00 0.00 H new ATOM 1679 N ASN A 111 -0.554 -1.298 23.832 1.00 0.00 N ATOM 1680 CA ASN A 111 -1.301 -0.091 24.004 1.00 0.00 C ATOM 1681 C ASN A 111 -1.535 0.735 22.786 1.00 0.00 C ATOM 1682 O ASN A 111 -1.442 1.960 22.828 1.00 0.00 O ATOM 1683 CB ASN A 111 -0.660 0.739 25.129 1.00 0.00 C ATOM 1684 CG ASN A 111 -0.608 -0.028 26.442 1.00 0.00 C ATOM 1685 OD1 ASN A 111 -1.679 -0.349 26.955 1.00 0.00 O ATOM 1686 ND2 ASN A 111 0.619 -0.349 26.934 1.00 0.00 N ATOM 0 H ASN A 111 0.458 -1.172 23.825 1.00 0.00 H new ATOM 0 HA ASN A 111 -2.308 -0.413 24.269 1.00 0.00 H new ATOM 0 HB2 ASN A 111 0.350 1.027 24.837 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -1.227 1.660 25.269 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.698 -0.896 27.791 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.460 -0.042 26.446 1.00 0.00 H new ATOM 1693 N LEU A 112 -1.901 0.169 21.622 1.00 0.00 N ATOM 1694 CA LEU A 112 -2.151 0.803 20.365 1.00 0.00 C ATOM 1695 C LEU A 112 -3.593 1.032 20.066 1.00 0.00 C ATOM 1696 O LEU A 112 -4.068 2.165 20.023 1.00 0.00 O ATOM 1697 CB LEU A 112 -1.534 0.004 19.205 1.00 0.00 C ATOM 1698 CG LEU A 112 -0.309 0.609 18.499 1.00 0.00 C ATOM 1699 CD1 LEU A 112 0.259 -0.265 17.368 1.00 0.00 C ATOM 1700 CD2 LEU A 112 -0.589 1.931 17.763 1.00 0.00 C ATOM 0 H LEU A 112 -2.035 -0.840 21.558 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.678 1.781 20.457 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -1.252 -0.978 19.585 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -2.310 -0.155 18.456 1.00 0.00 H new ATOM 0 HG LEU A 112 0.372 0.724 19.342 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.120 0.232 16.922 1.00 0.00 H new ATOM 0 HD12 LEU A 112 0.566 -1.229 17.773 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.506 -0.418 16.607 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.328 2.287 17.294 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -1.348 1.768 16.998 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -0.945 2.675 18.475 1.00 0.00 H new ATOM 1712 N GLY A 113 -4.425 0.006 19.814 1.00 0.00 N ATOM 1713 CA GLY A 113 -5.765 0.091 19.320 1.00 0.00 C ATOM 1714 C GLY A 113 -6.421 -1.218 19.045 1.00 0.00 C ATOM 1715 O GLY A 113 -7.474 -1.452 19.636 1.00 0.00 O ATOM 0 H GLY A 113 -4.136 -0.960 19.968 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -6.369 0.637 20.044 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -5.761 0.678 18.401 1.00 0.00 H new ATOM 1719 N GLU A 114 -5.824 -2.192 18.334 1.00 0.00 N ATOM 1720 CA GLU A 114 -6.372 -3.509 18.231 1.00 0.00 C ATOM 1721 C GLU A 114 -6.349 -4.415 19.414 1.00 0.00 C ATOM 1722 O GLU A 114 -5.450 -4.340 20.250 1.00 0.00 O ATOM 1723 CB GLU A 114 -5.944 -4.266 16.963 1.00 0.00 C ATOM 1724 CG GLU A 114 -6.208 -3.497 15.667 1.00 0.00 C ATOM 1725 CD GLU A 114 -7.661 -3.439 15.219 1.00 0.00 C ATOM 1726 OE1 GLU A 114 -8.340 -4.500 15.172 1.00 0.00 O ATOM 1727 OE2 GLU A 114 -8.164 -2.316 14.950 1.00 0.00 O ATOM 0 H GLU A 114 -4.950 -2.064 17.824 1.00 0.00 H new ATOM 0 HA GLU A 114 -7.424 -3.230 18.167 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -4.880 -4.494 17.029 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -6.473 -5.218 16.924 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -5.844 -2.477 15.791 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -5.619 -3.951 14.870 1.00 0.00 H new ATOM 1734 N LYS A 115 -7.211 -5.445 19.475 1.00 0.00 N ATOM 1735 CA LYS A 115 -7.246 -6.378 20.558 1.00 0.00 C ATOM 1736 C LYS A 115 -6.289 -7.506 20.380 1.00 0.00 C ATOM 1737 O LYS A 115 -6.045 -8.028 19.293 1.00 0.00 O ATOM 1738 CB LYS A 115 -8.640 -7.022 20.645 1.00 0.00 C ATOM 1739 CG LYS A 115 -9.691 -6.069 21.217 1.00 0.00 C ATOM 1740 CD LYS A 115 -11.116 -6.604 21.056 1.00 0.00 C ATOM 1741 CE LYS A 115 -11.421 -7.949 21.718 1.00 0.00 C ATOM 1742 NZ LYS A 115 -12.756 -8.318 21.196 1.00 0.00 N ATOM 0 H LYS A 115 -7.904 -5.635 18.751 1.00 0.00 H new ATOM 0 HA LYS A 115 -6.985 -5.809 21.450 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -8.950 -7.345 19.651 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -8.586 -7.915 21.268 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -9.487 -5.900 22.274 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -9.610 -5.103 20.719 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -11.806 -5.862 21.458 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -11.328 -6.693 19.991 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -10.672 -8.698 21.461 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -11.428 -7.865 22.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -13.046 -9.232 21.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -13.447 -7.587 21.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -12.715 -8.394 20.160 1.00 0.00 H new ATOM 1756 N LEU A 116 -5.470 -7.699 21.429 1.00 0.00 N ATOM 1757 CA LEU A 116 -4.219 -8.388 21.352 1.00 0.00 C ATOM 1758 C LEU A 116 -3.835 -8.993 22.659 1.00 0.00 C ATOM 1759 O LEU A 116 -4.302 -8.532 23.700 1.00 0.00 O ATOM 1760 CB LEU A 116 -3.151 -7.504 20.686 1.00 0.00 C ATOM 1761 CG LEU A 116 -2.219 -8.234 19.704 1.00 0.00 C ATOM 1762 CD1 LEU A 116 -2.949 -8.905 18.529 1.00 0.00 C ATOM 1763 CD2 LEU A 116 -1.180 -7.293 19.070 1.00 0.00 C ATOM 0 H LEU A 116 -5.687 -7.362 22.367 1.00 0.00 H new ATOM 0 HA LEU A 116 -4.321 -9.250 20.693 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -3.652 -6.695 20.154 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -2.544 -7.045 21.466 1.00 0.00 H new ATOM 0 HG LEU A 116 -1.747 -8.991 20.330 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -2.222 -9.398 17.883 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -3.653 -9.643 18.912 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -3.489 -8.150 17.958 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -0.547 -7.858 18.385 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -1.692 -6.502 18.522 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -0.563 -6.851 19.853 1.00 0.00 H new ATOM 1775 N THR A 117 -2.999 -10.046 22.666 1.00 0.00 N ATOM 1776 CA THR A 117 -2.556 -10.764 23.821 1.00 0.00 C ATOM 1777 C THR A 117 -1.073 -10.621 23.837 1.00 0.00 C ATOM 1778 O THR A 117 -0.559 -10.139 22.829 1.00 0.00 O ATOM 1779 CB THR A 117 -2.893 -12.225 23.868 1.00 0.00 C ATOM 1780 OG1 THR A 117 -2.262 -13.003 22.862 1.00 0.00 O ATOM 1781 CG2 THR A 117 -4.390 -12.301 23.522 1.00 0.00 C ATOM 0 H THR A 117 -2.605 -10.422 21.803 1.00 0.00 H new ATOM 0 HA THR A 117 -3.074 -10.341 24.682 1.00 0.00 H new ATOM 0 HB THR A 117 -2.586 -12.605 24.842 1.00 0.00 H new ATOM 0 HG1 THR A 117 -2.647 -13.904 22.856 1.00 0.00 H new ATOM 0 HG21 THR A 117 -4.714 -13.342 23.536 1.00 0.00 H new ATOM 0 HG22 THR A 117 -4.962 -11.733 24.255 1.00 0.00 H new ATOM 0 HG23 THR A 117 -4.556 -11.882 22.529 1.00 0.00 H new ATOM 1789 N ASP A 118 -0.383 -10.937 24.948 1.00 0.00 N ATOM 1790 CA ASP A 118 1.034 -11.129 24.909 1.00 0.00 C ATOM 1791 C ASP A 118 1.536 -12.280 24.107 1.00 0.00 C ATOM 1792 O ASP A 118 2.619 -12.174 23.532 1.00 0.00 O ATOM 1793 CB ASP A 118 1.473 -11.377 26.361 1.00 0.00 C ATOM 1794 CG ASP A 118 1.485 -10.170 27.289 1.00 0.00 C ATOM 1795 OD1 ASP A 118 2.438 -9.359 27.143 1.00 0.00 O ATOM 1796 OD2 ASP A 118 0.553 -10.035 28.125 1.00 0.00 O ATOM 0 H ASP A 118 -0.804 -11.059 25.869 1.00 0.00 H new ATOM 0 HA ASP A 118 1.443 -10.241 24.427 1.00 0.00 H new ATOM 0 HB2 ASP A 118 0.813 -12.130 26.792 1.00 0.00 H new ATOM 0 HB3 ASP A 118 2.476 -11.803 26.345 1.00 0.00 H new ATOM 1801 N GLU A 119 0.738 -13.333 23.857 1.00 0.00 N ATOM 1802 CA GLU A 119 1.093 -14.514 23.134 1.00 0.00 C ATOM 1803 C GLU A 119 1.314 -14.247 21.685 1.00 0.00 C ATOM 1804 O GLU A 119 2.132 -14.912 21.050 1.00 0.00 O ATOM 1805 CB GLU A 119 0.038 -15.616 23.321 1.00 0.00 C ATOM 1806 CG GLU A 119 -0.070 -16.177 24.741 1.00 0.00 C ATOM 1807 CD GLU A 119 -1.006 -17.376 24.692 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -2.223 -17.128 24.480 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -0.567 -18.554 24.603 1.00 0.00 O ATOM 0 H GLU A 119 -0.227 -13.359 24.185 1.00 0.00 H new ATOM 0 HA GLU A 119 2.039 -14.861 23.549 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -0.934 -15.220 23.029 1.00 0.00 H new ATOM 0 HB3 GLU A 119 0.266 -16.436 22.640 1.00 0.00 H new ATOM 0 HG2 GLU A 119 0.912 -16.472 25.112 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -0.454 -15.419 25.424 1.00 0.00 H new ATOM 1816 N GLU A 120 0.453 -13.335 21.200 1.00 0.00 N ATOM 1817 CA GLU A 120 0.398 -12.926 19.831 1.00 0.00 C ATOM 1818 C GLU A 120 1.492 -11.950 19.565 1.00 0.00 C ATOM 1819 O GLU A 120 2.125 -11.891 18.512 1.00 0.00 O ATOM 1820 CB GLU A 120 -0.952 -12.309 19.431 1.00 0.00 C ATOM 1821 CG GLU A 120 -1.128 -12.164 17.918 1.00 0.00 C ATOM 1822 CD GLU A 120 -2.588 -12.427 17.578 1.00 0.00 C ATOM 1823 OE1 GLU A 120 -3.084 -13.575 17.734 1.00 0.00 O ATOM 1824 OE2 GLU A 120 -3.218 -11.417 17.166 1.00 0.00 O ATOM 0 H GLU A 120 -0.234 -12.862 21.787 1.00 0.00 H new ATOM 0 HA GLU A 120 0.521 -13.824 19.226 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -1.758 -12.928 19.826 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -1.047 -11.328 19.896 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -0.838 -11.164 17.596 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -0.483 -12.868 17.392 1.00 0.00 H new ATOM 1831 N VAL A 121 1.888 -11.143 20.565 1.00 0.00 N ATOM 1832 CA VAL A 121 3.024 -10.274 20.586 1.00 0.00 C ATOM 1833 C VAL A 121 4.341 -10.967 20.662 1.00 0.00 C ATOM 1834 O VAL A 121 5.202 -10.617 19.856 1.00 0.00 O ATOM 1835 CB VAL A 121 2.955 -9.322 21.743 1.00 0.00 C ATOM 1836 CG1 VAL A 121 4.247 -8.488 21.786 1.00 0.00 C ATOM 1837 CG2 VAL A 121 1.794 -8.335 21.534 1.00 0.00 C ATOM 0 H VAL A 121 1.363 -11.096 21.439 1.00 0.00 H new ATOM 0 HA VAL A 121 2.972 -9.755 19.629 1.00 0.00 H new ATOM 0 HB VAL A 121 2.818 -9.895 22.660 1.00 0.00 H new ATOM 0 HG11 VAL A 121 4.204 -7.793 22.625 1.00 0.00 H new ATOM 0 HG12 VAL A 121 5.104 -9.151 21.907 1.00 0.00 H new ATOM 0 HG13 VAL A 121 4.350 -7.928 20.856 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.747 -7.645 22.376 1.00 0.00 H new ATOM 0 HG22 VAL A 121 1.955 -7.774 20.614 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.856 -8.886 21.464 1.00 0.00 H new ATOM 1847 N ASP A 122 4.422 -11.983 21.539 1.00 0.00 N ATOM 1848 CA ASP A 122 5.581 -12.818 21.457 1.00 0.00 C ATOM 1849 C ASP A 122 5.664 -13.634 20.213 1.00 0.00 C ATOM 1850 O ASP A 122 6.805 -13.903 19.840 1.00 0.00 O ATOM 1851 CB ASP A 122 5.604 -13.808 22.633 1.00 0.00 C ATOM 1852 CG ASP A 122 5.950 -13.079 23.923 1.00 0.00 C ATOM 1853 OD1 ASP A 122 7.131 -12.649 24.024 1.00 0.00 O ATOM 1854 OD2 ASP A 122 5.164 -12.948 24.899 1.00 0.00 O ATOM 0 H ASP A 122 3.738 -12.218 22.258 1.00 0.00 H new ATOM 0 HA ASP A 122 6.423 -12.126 21.471 1.00 0.00 H new ATOM 0 HB2 ASP A 122 4.633 -14.293 22.729 1.00 0.00 H new ATOM 0 HB3 ASP A 122 6.335 -14.594 22.443 1.00 0.00 H new ATOM 1859 N GLU A 123 4.545 -14.107 19.636 1.00 0.00 N ATOM 1860 CA GLU A 123 4.540 -14.669 18.321 1.00 0.00 C ATOM 1861 C GLU A 123 5.059 -13.804 17.224 1.00 0.00 C ATOM 1862 O GLU A 123 5.967 -14.142 16.467 1.00 0.00 O ATOM 1863 CB GLU A 123 3.149 -15.252 18.020 1.00 0.00 C ATOM 1864 CG GLU A 123 3.277 -16.102 16.754 1.00 0.00 C ATOM 1865 CD GLU A 123 1.903 -16.646 16.393 1.00 0.00 C ATOM 1866 OE1 GLU A 123 1.451 -17.653 17.002 1.00 0.00 O ATOM 1867 OE2 GLU A 123 1.322 -16.193 15.371 1.00 0.00 O ATOM 0 H GLU A 123 3.631 -14.099 20.088 1.00 0.00 H new ATOM 0 HA GLU A 123 5.282 -15.467 18.337 1.00 0.00 H new ATOM 0 HB2 GLU A 123 2.797 -15.857 18.855 1.00 0.00 H new ATOM 0 HB3 GLU A 123 2.421 -14.454 17.875 1.00 0.00 H new ATOM 0 HG2 GLU A 123 3.674 -15.503 15.935 1.00 0.00 H new ATOM 0 HG3 GLU A 123 3.977 -16.921 16.918 1.00 0.00 H new ATOM 1874 N MET A 124 4.643 -12.526 17.157 1.00 0.00 N ATOM 1875 CA MET A 124 5.069 -11.458 16.306 1.00 0.00 C ATOM 1876 C MET A 124 6.538 -11.214 16.339 1.00 0.00 C ATOM 1877 O MET A 124 7.154 -11.137 15.277 1.00 0.00 O ATOM 1878 CB MET A 124 4.169 -10.252 16.625 1.00 0.00 C ATOM 1879 CG MET A 124 4.587 -8.884 16.083 1.00 0.00 C ATOM 1880 SD MET A 124 3.635 -7.393 16.505 1.00 0.00 S ATOM 1881 CE MET A 124 1.996 -8.148 16.710 1.00 0.00 C ATOM 0 H MET A 124 3.908 -12.204 17.787 1.00 0.00 H new ATOM 0 HA MET A 124 4.937 -11.715 15.255 1.00 0.00 H new ATOM 0 HB2 MET A 124 3.170 -10.471 16.247 1.00 0.00 H new ATOM 0 HB3 MET A 124 4.089 -10.172 17.709 1.00 0.00 H new ATOM 0 HG2 MET A 124 5.614 -8.711 16.404 1.00 0.00 H new ATOM 0 HG3 MET A 124 4.601 -8.960 14.996 1.00 0.00 H new ATOM 0 HE1 MET A 124 1.250 -7.366 16.851 1.00 0.00 H new ATOM 0 HE2 MET A 124 1.749 -8.729 15.821 1.00 0.00 H new ATOM 0 HE3 MET A 124 2.004 -8.803 17.581 1.00 0.00 H new ATOM 1891 N ILE A 125 7.087 -11.049 17.556 1.00 0.00 N ATOM 1892 CA ILE A 125 8.471 -10.848 17.853 1.00 0.00 C ATOM 1893 C ILE A 125 9.297 -12.004 17.406 1.00 0.00 C ATOM 1894 O ILE A 125 10.393 -11.909 16.855 1.00 0.00 O ATOM 1895 CB ILE A 125 8.677 -10.547 19.308 1.00 0.00 C ATOM 1896 CG1 ILE A 125 8.170 -9.122 19.588 1.00 0.00 C ATOM 1897 CG2 ILE A 125 10.116 -10.626 19.847 1.00 0.00 C ATOM 1898 CD1 ILE A 125 7.859 -8.809 21.051 1.00 0.00 C ATOM 0 H ILE A 125 6.514 -11.057 18.400 1.00 0.00 H new ATOM 0 HA ILE A 125 8.807 -9.977 17.291 1.00 0.00 H new ATOM 0 HB ILE A 125 8.128 -11.337 19.821 1.00 0.00 H new ATOM 0 HG12 ILE A 125 8.918 -8.413 19.234 1.00 0.00 H new ATOM 0 HG13 ILE A 125 7.268 -8.954 18.999 1.00 0.00 H new ATOM 0 HG21 ILE A 125 10.120 -10.386 20.910 1.00 0.00 H new ATOM 0 HG22 ILE A 125 10.504 -11.634 19.701 1.00 0.00 H new ATOM 0 HG23 ILE A 125 10.745 -9.914 19.312 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.510 -7.780 21.137 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.085 -9.486 21.411 1.00 0.00 H new ATOM 0 HD13 ILE A 125 8.761 -8.937 21.650 1.00 0.00 H new ATOM 1910 N ARG A 126 8.777 -13.205 17.717 1.00 0.00 N ATOM 1911 CA ARG A 126 9.323 -14.461 17.307 1.00 0.00 C ATOM 1912 C ARG A 126 9.507 -14.668 15.843 1.00 0.00 C ATOM 1913 O ARG A 126 10.568 -15.086 15.381 1.00 0.00 O ATOM 1914 CB ARG A 126 8.482 -15.664 17.763 1.00 0.00 C ATOM 1915 CG ARG A 126 8.960 -17.065 17.374 1.00 0.00 C ATOM 1916 CD ARG A 126 7.991 -18.189 17.744 1.00 0.00 C ATOM 1917 NE ARG A 126 7.274 -18.632 16.516 1.00 0.00 N ATOM 1918 CZ ARG A 126 6.013 -19.154 16.465 1.00 0.00 C ATOM 1919 NH1 ARG A 126 5.272 -19.557 17.538 1.00 0.00 N ATOM 1920 NH2 ARG A 126 5.543 -19.571 15.254 1.00 0.00 N ATOM 0 H ARG A 126 7.934 -13.304 18.282 1.00 0.00 H new ATOM 0 HA ARG A 126 10.299 -14.409 17.790 1.00 0.00 H new ATOM 0 HB2 ARG A 126 8.408 -15.627 18.850 1.00 0.00 H new ATOM 0 HB3 ARG A 126 7.474 -15.534 17.370 1.00 0.00 H new ATOM 0 HG2 ARG A 126 9.133 -17.091 16.298 1.00 0.00 H new ATOM 0 HG3 ARG A 126 9.919 -17.255 17.856 1.00 0.00 H new ATOM 0 HD2 ARG A 126 8.534 -19.025 18.185 1.00 0.00 H new ATOM 0 HD3 ARG A 126 7.278 -17.841 18.492 1.00 0.00 H new ATOM 0 HE ARG A 126 7.771 -18.537 15.630 1.00 0.00 H new ATOM 0 HH11 ARG A 126 5.655 -19.479 18.480 1.00 0.00 H new ATOM 0 HH12 ARG A 126 4.335 -19.936 17.398 1.00 0.00 H new ATOM 0 HH21 ARG A 126 6.129 -19.488 14.423 1.00 0.00 H new ATOM 0 HH22 ARG A 126 4.606 -19.966 15.179 1.00 0.00 H new ATOM 1934 N GLU A 127 8.472 -14.350 15.045 1.00 0.00 N ATOM 1935 CA GLU A 127 8.416 -14.574 13.634 1.00 0.00 C ATOM 1936 C GLU A 127 9.219 -13.571 12.879 1.00 0.00 C ATOM 1937 O GLU A 127 9.749 -13.753 11.784 1.00 0.00 O ATOM 1938 CB GLU A 127 7.058 -14.856 12.970 1.00 0.00 C ATOM 1939 CG GLU A 127 6.311 -16.127 13.377 1.00 0.00 C ATOM 1940 CD GLU A 127 6.902 -17.434 12.868 1.00 0.00 C ATOM 1941 OE1 GLU A 127 6.817 -17.674 11.634 1.00 0.00 O ATOM 1942 OE2 GLU A 127 7.423 -18.185 13.735 1.00 0.00 O ATOM 0 H GLU A 127 7.625 -13.911 15.407 1.00 0.00 H new ATOM 0 HA GLU A 127 8.880 -15.557 13.560 1.00 0.00 H new ATOM 0 HB2 GLU A 127 6.405 -14.006 13.170 1.00 0.00 H new ATOM 0 HB3 GLU A 127 7.214 -14.891 11.892 1.00 0.00 H new ATOM 0 HG2 GLU A 127 6.269 -16.169 14.465 1.00 0.00 H new ATOM 0 HG3 GLU A 127 5.283 -16.052 13.021 1.00 0.00 H new ATOM 1949 N ALA A 128 9.299 -12.328 13.385 1.00 0.00 N ATOM 1950 CA ALA A 128 9.910 -11.194 12.764 1.00 0.00 C ATOM 1951 C ALA A 128 11.358 -11.056 13.089 1.00 0.00 C ATOM 1952 O ALA A 128 12.169 -10.493 12.356 1.00 0.00 O ATOM 1953 CB ALA A 128 9.089 -9.953 13.154 1.00 0.00 C ATOM 0 H ALA A 128 8.906 -12.099 14.298 1.00 0.00 H new ATOM 0 HA ALA A 128 9.897 -11.321 11.682 1.00 0.00 H new ATOM 0 HB1 ALA A 128 9.529 -9.067 12.696 1.00 0.00 H new ATOM 0 HB2 ALA A 128 8.063 -10.071 12.805 1.00 0.00 H new ATOM 0 HB3 ALA A 128 9.092 -9.840 14.238 1.00 0.00 H new ATOM 1959 N ASP A 129 11.818 -11.455 14.288 1.00 0.00 N ATOM 1960 CA ASP A 129 13.176 -11.325 14.717 1.00 0.00 C ATOM 1961 C ASP A 129 14.011 -12.382 14.078 1.00 0.00 C ATOM 1962 O ASP A 129 14.008 -13.560 14.431 1.00 0.00 O ATOM 1963 CB ASP A 129 13.377 -11.446 16.237 1.00 0.00 C ATOM 1964 CG ASP A 129 14.816 -11.140 16.628 1.00 0.00 C ATOM 1965 OD1 ASP A 129 15.485 -10.422 15.838 1.00 0.00 O ATOM 1966 OD2 ASP A 129 15.312 -11.722 17.630 1.00 0.00 O ATOM 0 H ASP A 129 11.217 -11.887 14.989 1.00 0.00 H new ATOM 0 HA ASP A 129 13.472 -10.319 14.420 1.00 0.00 H new ATOM 0 HB2 ASP A 129 12.704 -10.760 16.751 1.00 0.00 H new ATOM 0 HB3 ASP A 129 13.115 -12.453 16.562 1.00 0.00 H new ATOM 1971 N ILE A 130 14.749 -12.038 13.008 1.00 0.00 N ATOM 1972 CA ILE A 130 15.646 -12.848 12.243 1.00 0.00 C ATOM 1973 C ILE A 130 16.854 -13.175 13.051 1.00 0.00 C ATOM 1974 O ILE A 130 17.364 -14.286 13.189 1.00 0.00 O ATOM 1975 CB ILE A 130 15.980 -12.197 10.933 1.00 0.00 C ATOM 1976 CG1 ILE A 130 14.683 -11.868 10.174 1.00 0.00 C ATOM 1977 CG2 ILE A 130 16.919 -13.056 10.070 1.00 0.00 C ATOM 1978 CD1 ILE A 130 13.781 -12.985 9.652 1.00 0.00 C ATOM 0 H ILE A 130 14.711 -11.087 12.641 1.00 0.00 H new ATOM 0 HA ILE A 130 15.156 -13.790 11.997 1.00 0.00 H new ATOM 0 HB ILE A 130 16.519 -11.274 11.148 1.00 0.00 H new ATOM 0 HG12 ILE A 130 14.076 -11.246 10.831 1.00 0.00 H new ATOM 0 HG13 ILE A 130 14.959 -11.252 9.318 1.00 0.00 H new ATOM 0 HG21 ILE A 130 17.128 -12.538 9.134 1.00 0.00 H new ATOM 0 HG22 ILE A 130 17.852 -13.227 10.607 1.00 0.00 H new ATOM 0 HG23 ILE A 130 16.443 -14.013 9.857 1.00 0.00 H new ATOM 0 HD11 ILE A 130 12.919 -12.550 9.147 1.00 0.00 H new ATOM 0 HD12 ILE A 130 14.339 -13.605 8.950 1.00 0.00 H new ATOM 0 HD13 ILE A 130 13.441 -13.598 10.487 1.00 0.00 H new ATOM 1990 N ASP A 131 17.305 -12.187 13.845 1.00 0.00 N ATOM 1991 CA ASP A 131 18.585 -12.236 14.479 1.00 0.00 C ATOM 1992 C ASP A 131 18.525 -13.209 15.606 1.00 0.00 C ATOM 1993 O ASP A 131 19.363 -14.107 15.658 1.00 0.00 O ATOM 1994 CB ASP A 131 18.937 -10.942 15.232 1.00 0.00 C ATOM 1995 CG ASP A 131 19.035 -9.722 14.328 1.00 0.00 C ATOM 1996 OD1 ASP A 131 17.950 -9.317 13.831 1.00 0.00 O ATOM 1997 OD2 ASP A 131 20.122 -9.087 14.289 1.00 0.00 O ATOM 0 H ASP A 131 16.773 -11.341 14.050 1.00 0.00 H new ATOM 0 HA ASP A 131 19.290 -12.458 13.678 1.00 0.00 H new ATOM 0 HB2 ASP A 131 18.182 -10.759 15.996 1.00 0.00 H new ATOM 0 HB3 ASP A 131 19.887 -11.079 15.749 1.00 0.00 H new ATOM 2002 N GLY A 132 17.549 -13.074 16.522 1.00 0.00 N ATOM 2003 CA GLY A 132 17.540 -13.714 17.800 1.00 0.00 C ATOM 2004 C GLY A 132 17.998 -12.846 18.921 1.00 0.00 C ATOM 2005 O GLY A 132 18.214 -13.391 20.002 1.00 0.00 O ATOM 0 H GLY A 132 16.727 -12.491 16.363 1.00 0.00 H new ATOM 0 HA2 GLY A 132 16.529 -14.060 18.013 1.00 0.00 H new ATOM 0 HA3 GLY A 132 18.177 -14.598 17.756 1.00 0.00 H new ATOM 2009 N ASP A 133 18.169 -11.537 18.663 1.00 0.00 N ATOM 2010 CA ASP A 133 18.502 -10.511 19.603 1.00 0.00 C ATOM 2011 C ASP A 133 17.363 -10.224 20.519 1.00 0.00 C ATOM 2012 O ASP A 133 17.547 -10.019 21.718 1.00 0.00 O ATOM 2013 CB ASP A 133 19.000 -9.200 18.970 1.00 0.00 C ATOM 2014 CG ASP A 133 18.283 -8.413 17.883 1.00 0.00 C ATOM 2015 OD1 ASP A 133 17.209 -8.876 17.415 1.00 0.00 O ATOM 2016 OD2 ASP A 133 18.741 -7.339 17.409 1.00 0.00 O ATOM 0 H ASP A 133 18.065 -11.167 17.718 1.00 0.00 H new ATOM 0 HA ASP A 133 19.341 -10.919 20.167 1.00 0.00 H new ATOM 0 HB2 ASP A 133 19.137 -8.504 19.798 1.00 0.00 H new ATOM 0 HB3 ASP A 133 19.990 -9.421 18.572 1.00 0.00 H new ATOM 2021 N GLY A 134 16.145 -10.164 19.951 1.00 0.00 N ATOM 2022 CA GLY A 134 14.851 -9.931 20.514 1.00 0.00 C ATOM 2023 C GLY A 134 14.501 -8.498 20.309 1.00 0.00 C ATOM 2024 O GLY A 134 13.647 -7.918 20.978 1.00 0.00 O ATOM 0 H GLY A 134 16.063 -10.301 18.943 1.00 0.00 H new ATOM 0 HA2 GLY A 134 14.110 -10.574 20.040 1.00 0.00 H new ATOM 0 HA3 GLY A 134 14.850 -10.173 21.577 1.00 0.00 H new ATOM 2028 N GLN A 135 15.204 -7.851 19.363 1.00 0.00 N ATOM 2029 CA GLN A 135 14.996 -6.520 18.881 1.00 0.00 C ATOM 2030 C GLN A 135 14.423 -6.564 17.506 1.00 0.00 C ATOM 2031 O GLN A 135 14.645 -7.501 16.741 1.00 0.00 O ATOM 2032 CB GLN A 135 16.145 -5.502 18.984 1.00 0.00 C ATOM 2033 CG GLN A 135 16.970 -5.712 20.254 1.00 0.00 C ATOM 2034 CD GLN A 135 17.821 -4.494 20.585 1.00 0.00 C ATOM 2035 OE1 GLN A 135 17.257 -3.435 20.855 1.00 0.00 O ATOM 2036 NE2 GLN A 135 19.157 -4.564 20.338 1.00 0.00 N ATOM 0 H GLN A 135 15.989 -8.302 18.894 1.00 0.00 H new ATOM 0 HA GLN A 135 14.291 -6.106 19.602 1.00 0.00 H new ATOM 0 HB2 GLN A 135 16.791 -5.592 18.111 1.00 0.00 H new ATOM 0 HB3 GLN A 135 15.738 -4.491 18.977 1.00 0.00 H new ATOM 0 HG2 GLN A 135 16.303 -5.927 21.089 1.00 0.00 H new ATOM 0 HG3 GLN A 135 17.614 -6.582 20.129 1.00 0.00 H new ATOM 0 HE21 GLN A 135 19.589 -5.462 20.117 1.00 0.00 H new ATOM 0 HE22 GLN A 135 19.727 -3.719 20.373 1.00 0.00 H new ATOM 2045 N VAL A 136 13.646 -5.531 17.133 1.00 0.00 N ATOM 2046 CA VAL A 136 12.968 -5.479 15.875 1.00 0.00 C ATOM 2047 C VAL A 136 13.551 -4.258 15.250 1.00 0.00 C ATOM 2048 O VAL A 136 13.553 -3.150 15.784 1.00 0.00 O ATOM 2049 CB VAL A 136 11.474 -5.375 15.952 1.00 0.00 C ATOM 2050 CG1 VAL A 136 10.805 -4.741 14.720 1.00 0.00 C ATOM 2051 CG2 VAL A 136 11.050 -6.842 16.133 1.00 0.00 C ATOM 0 H VAL A 136 13.485 -4.712 17.720 1.00 0.00 H new ATOM 0 HA VAL A 136 13.110 -6.405 15.319 1.00 0.00 H new ATOM 0 HB VAL A 136 11.162 -4.707 16.755 1.00 0.00 H new ATOM 0 HG11 VAL A 136 9.726 -4.709 14.868 1.00 0.00 H new ATOM 0 HG12 VAL A 136 11.183 -3.728 14.582 1.00 0.00 H new ATOM 0 HG13 VAL A 136 11.032 -5.337 13.836 1.00 0.00 H new ATOM 0 HG21 VAL A 136 9.964 -6.901 16.203 1.00 0.00 H new ATOM 0 HG22 VAL A 136 11.391 -7.427 15.279 1.00 0.00 H new ATOM 0 HG23 VAL A 136 11.495 -7.239 17.045 1.00 0.00 H new ATOM 2061 N ASN A 137 14.260 -4.394 14.116 1.00 0.00 N ATOM 2062 CA ASN A 137 14.826 -3.307 13.379 1.00 0.00 C ATOM 2063 C ASN A 137 13.929 -2.853 12.280 1.00 0.00 C ATOM 2064 O ASN A 137 12.849 -3.423 12.137 1.00 0.00 O ATOM 2065 CB ASN A 137 16.183 -3.802 12.850 1.00 0.00 C ATOM 2066 CG ASN A 137 16.326 -4.769 11.683 1.00 0.00 C ATOM 2067 OD1 ASN A 137 15.795 -4.448 10.621 1.00 0.00 O ATOM 2068 ND2 ASN A 137 17.184 -5.814 11.830 1.00 0.00 N ATOM 0 H ASN A 137 14.447 -5.303 13.693 1.00 0.00 H new ATOM 0 HA ASN A 137 14.956 -2.432 14.016 1.00 0.00 H new ATOM 0 HB2 ASN A 137 16.752 -2.911 12.583 1.00 0.00 H new ATOM 0 HB3 ASN A 137 16.693 -4.264 13.696 1.00 0.00 H new ATOM 0 HD21 ASN A 137 17.426 -6.392 11.025 1.00 0.00 H new ATOM 0 HD22 ASN A 137 17.586 -6.019 12.745 1.00 0.00 H new ATOM 2075 N TYR A 138 14.291 -1.831 11.484 1.00 0.00 N ATOM 2076 CA TYR A 138 13.335 -1.287 10.570 1.00 0.00 C ATOM 2077 C TYR A 138 12.954 -2.177 9.438 1.00 0.00 C ATOM 2078 O TYR A 138 11.765 -2.226 9.126 1.00 0.00 O ATOM 2079 CB TYR A 138 13.788 0.107 10.103 1.00 0.00 C ATOM 2080 CG TYR A 138 12.855 0.745 9.132 1.00 0.00 C ATOM 2081 CD1 TYR A 138 11.518 0.970 9.364 1.00 0.00 C ATOM 2082 CD2 TYR A 138 13.269 1.063 7.860 1.00 0.00 C ATOM 2083 CE1 TYR A 138 10.674 1.449 8.391 1.00 0.00 C ATOM 2084 CE2 TYR A 138 12.471 1.450 6.809 1.00 0.00 C ATOM 2085 CZ TYR A 138 11.131 1.549 7.098 1.00 0.00 C ATOM 2086 OH TYR A 138 10.170 1.790 6.093 1.00 0.00 O ATOM 0 H TYR A 138 15.212 -1.393 11.470 1.00 0.00 H new ATOM 0 HA TYR A 138 12.404 -1.193 11.129 1.00 0.00 H new ATOM 0 HB2 TYR A 138 13.893 0.756 10.973 1.00 0.00 H new ATOM 0 HB3 TYR A 138 14.774 0.025 9.646 1.00 0.00 H new ATOM 0 HD1 TYR A 138 11.117 0.763 10.345 1.00 0.00 H new ATOM 0 HD2 TYR A 138 14.330 1.003 7.666 1.00 0.00 H new ATOM 0 HE1 TYR A 138 9.665 1.743 8.639 1.00 0.00 H new ATOM 0 HE2 TYR A 138 12.869 1.661 5.827 1.00 0.00 H new ATOM 0 HH TYR A 138 10.614 1.842 5.221 1.00 0.00 H new ATOM 2096 N GLU A 139 13.884 -3.032 8.975 1.00 0.00 N ATOM 2097 CA GLU A 139 13.623 -4.001 7.956 1.00 0.00 C ATOM 2098 C GLU A 139 12.723 -5.092 8.425 1.00 0.00 C ATOM 2099 O GLU A 139 12.019 -5.681 7.606 1.00 0.00 O ATOM 2100 CB GLU A 139 14.914 -4.613 7.387 1.00 0.00 C ATOM 2101 CG GLU A 139 15.717 -3.658 6.502 1.00 0.00 C ATOM 2102 CD GLU A 139 17.111 -4.184 6.192 1.00 0.00 C ATOM 2103 OE1 GLU A 139 18.040 -4.019 7.027 1.00 0.00 O ATOM 2104 OE2 GLU A 139 17.373 -4.571 5.022 1.00 0.00 O ATOM 0 H GLU A 139 14.844 -3.050 9.319 1.00 0.00 H new ATOM 0 HA GLU A 139 13.117 -3.453 7.161 1.00 0.00 H new ATOM 0 HB2 GLU A 139 15.543 -4.942 8.214 1.00 0.00 H new ATOM 0 HB3 GLU A 139 14.659 -5.501 6.808 1.00 0.00 H new ATOM 0 HG2 GLU A 139 15.178 -3.493 5.569 1.00 0.00 H new ATOM 0 HG3 GLU A 139 15.799 -2.691 6.998 1.00 0.00 H new ATOM 2111 N GLU A 140 12.824 -5.495 9.704 1.00 0.00 N ATOM 2112 CA GLU A 140 12.051 -6.501 10.364 1.00 0.00 C ATOM 2113 C GLU A 140 10.714 -5.862 10.528 1.00 0.00 C ATOM 2114 O GLU A 140 9.715 -6.575 10.448 1.00 0.00 O ATOM 2115 CB GLU A 140 12.649 -6.922 11.716 1.00 0.00 C ATOM 2116 CG GLU A 140 13.994 -7.611 11.478 1.00 0.00 C ATOM 2117 CD GLU A 140 14.675 -7.927 12.802 1.00 0.00 C ATOM 2118 OE1 GLU A 140 14.974 -6.956 13.548 1.00 0.00 O ATOM 2119 OE2 GLU A 140 14.942 -9.103 13.166 1.00 0.00 O ATOM 0 H GLU A 140 13.510 -5.077 10.332 1.00 0.00 H new ATOM 0 HA GLU A 140 12.016 -7.429 9.793 1.00 0.00 H new ATOM 0 HB2 GLU A 140 12.782 -6.050 12.356 1.00 0.00 H new ATOM 0 HB3 GLU A 140 11.968 -7.597 12.234 1.00 0.00 H new ATOM 0 HG2 GLU A 140 13.843 -8.530 10.912 1.00 0.00 H new ATOM 0 HG3 GLU A 140 14.637 -6.968 10.876 1.00 0.00 H new ATOM 2126 N PHE A 141 10.528 -4.562 10.818 1.00 0.00 N ATOM 2127 CA PHE A 141 9.289 -3.857 10.926 1.00 0.00 C ATOM 2128 C PHE A 141 8.631 -3.813 9.590 1.00 0.00 C ATOM 2129 O PHE A 141 7.488 -4.254 9.480 1.00 0.00 O ATOM 2130 CB PHE A 141 9.481 -2.459 11.537 1.00 0.00 C ATOM 2131 CG PHE A 141 8.226 -1.782 11.967 1.00 0.00 C ATOM 2132 CD1 PHE A 141 7.481 -2.253 13.023 1.00 0.00 C ATOM 2133 CD2 PHE A 141 7.770 -0.720 11.222 1.00 0.00 C ATOM 2134 CE1 PHE A 141 6.368 -1.541 13.403 1.00 0.00 C ATOM 2135 CE2 PHE A 141 6.561 -0.150 11.539 1.00 0.00 C ATOM 2136 CZ PHE A 141 5.826 -0.537 12.635 1.00 0.00 C ATOM 0 H PHE A 141 11.323 -3.948 10.993 1.00 0.00 H new ATOM 0 HA PHE A 141 8.632 -4.390 11.613 1.00 0.00 H new ATOM 0 HB2 PHE A 141 10.144 -2.543 12.398 1.00 0.00 H new ATOM 0 HB3 PHE A 141 9.986 -1.826 10.807 1.00 0.00 H new ATOM 0 HD1 PHE A 141 7.763 -3.158 13.540 1.00 0.00 H new ATOM 0 HD2 PHE A 141 8.355 -0.339 10.398 1.00 0.00 H new ATOM 0 HE1 PHE A 141 5.899 -1.781 14.346 1.00 0.00 H new ATOM 0 HE2 PHE A 141 6.173 0.632 10.903 1.00 0.00 H new ATOM 0 HZ PHE A 141 4.879 -0.079 12.878 1.00 0.00 H new ATOM 2146 N VAL A 142 9.284 -3.388 8.494 1.00 0.00 N ATOM 2147 CA VAL A 142 8.842 -3.488 7.137 1.00 0.00 C ATOM 2148 C VAL A 142 8.468 -4.889 6.795 1.00 0.00 C ATOM 2149 O VAL A 142 7.383 -5.140 6.272 1.00 0.00 O ATOM 2150 CB VAL A 142 9.905 -3.015 6.191 1.00 0.00 C ATOM 2151 CG1 VAL A 142 9.657 -3.272 4.695 1.00 0.00 C ATOM 2152 CG2 VAL A 142 10.129 -1.510 6.415 1.00 0.00 C ATOM 0 H VAL A 142 10.196 -2.937 8.564 1.00 0.00 H new ATOM 0 HA VAL A 142 7.963 -2.852 7.036 1.00 0.00 H new ATOM 0 HB VAL A 142 10.783 -3.616 6.429 1.00 0.00 H new ATOM 0 HG11 VAL A 142 10.495 -2.885 4.115 1.00 0.00 H new ATOM 0 HG12 VAL A 142 9.560 -4.344 4.521 1.00 0.00 H new ATOM 0 HG13 VAL A 142 8.740 -2.770 4.387 1.00 0.00 H new ATOM 0 HG21 VAL A 142 10.900 -1.152 5.733 1.00 0.00 H new ATOM 0 HG22 VAL A 142 9.200 -0.972 6.227 1.00 0.00 H new ATOM 0 HG23 VAL A 142 10.446 -1.338 7.444 1.00 0.00 H new ATOM 2162 N GLN A 143 9.249 -5.962 7.014 1.00 0.00 N ATOM 2163 CA GLN A 143 8.888 -7.321 6.753 1.00 0.00 C ATOM 2164 C GLN A 143 7.691 -7.804 7.496 1.00 0.00 C ATOM 2165 O GLN A 143 6.831 -8.539 7.013 1.00 0.00 O ATOM 2166 CB GLN A 143 10.142 -8.198 6.910 1.00 0.00 C ATOM 2167 CG GLN A 143 10.049 -9.478 6.077 1.00 0.00 C ATOM 2168 CD GLN A 143 11.303 -10.289 5.783 1.00 0.00 C ATOM 2169 OE1 GLN A 143 11.993 -10.012 4.803 1.00 0.00 O ATOM 2170 NE2 GLN A 143 11.532 -11.362 6.586 1.00 0.00 N ATOM 0 H GLN A 143 10.190 -5.874 7.397 1.00 0.00 H new ATOM 0 HA GLN A 143 8.541 -7.394 5.722 1.00 0.00 H new ATOM 0 HB2 GLN A 143 11.022 -7.631 6.607 1.00 0.00 H new ATOM 0 HB3 GLN A 143 10.275 -8.457 7.960 1.00 0.00 H new ATOM 0 HG2 GLN A 143 9.345 -10.141 6.580 1.00 0.00 H new ATOM 0 HG3 GLN A 143 9.605 -9.209 5.119 1.00 0.00 H new ATOM 0 HE21 GLN A 143 10.924 -11.540 7.385 1.00 0.00 H new ATOM 0 HE22 GLN A 143 12.312 -11.989 6.389 1.00 0.00 H new ATOM 2179 N MET A 144 7.411 -7.326 8.722 1.00 0.00 N ATOM 2180 CA MET A 144 6.292 -7.592 9.572 1.00 0.00 C ATOM 2181 C MET A 144 5.059 -6.901 9.102 1.00 0.00 C ATOM 2182 O MET A 144 4.009 -7.538 9.039 1.00 0.00 O ATOM 2183 CB MET A 144 6.664 -7.316 11.039 1.00 0.00 C ATOM 2184 CG MET A 144 5.725 -7.814 12.140 1.00 0.00 C ATOM 2185 SD MET A 144 4.280 -6.752 12.434 1.00 0.00 S ATOM 2186 CE MET A 144 5.274 -5.497 13.291 1.00 0.00 C ATOM 0 H MET A 144 8.053 -6.671 9.169 1.00 0.00 H new ATOM 0 HA MET A 144 6.041 -8.651 9.516 1.00 0.00 H new ATOM 0 HB2 MET A 144 7.646 -7.753 11.219 1.00 0.00 H new ATOM 0 HB3 MET A 144 6.769 -6.237 11.156 1.00 0.00 H new ATOM 0 HG2 MET A 144 5.378 -8.814 11.880 1.00 0.00 H new ATOM 0 HG3 MET A 144 6.289 -7.904 13.068 1.00 0.00 H new ATOM 0 HE1 MET A 144 4.883 -5.349 14.298 1.00 0.00 H new ATOM 0 HE2 MET A 144 6.310 -5.831 13.349 1.00 0.00 H new ATOM 0 HE3 MET A 144 5.226 -4.557 12.741 1.00 0.00 H new ATOM 2196 N MET A 145 5.172 -5.609 8.744 1.00 0.00 N ATOM 2197 CA MET A 145 4.045 -4.836 8.322 1.00 0.00 C ATOM 2198 C MET A 145 3.573 -5.183 6.952 1.00 0.00 C ATOM 2199 O MET A 145 2.369 -5.172 6.703 1.00 0.00 O ATOM 2200 CB MET A 145 4.349 -3.329 8.353 1.00 0.00 C ATOM 2201 CG MET A 145 4.424 -2.874 9.812 1.00 0.00 C ATOM 2202 SD MET A 145 2.800 -2.857 10.628 1.00 0.00 S ATOM 2203 CE MET A 145 2.215 -1.318 9.861 1.00 0.00 C ATOM 0 H MET A 145 6.053 -5.096 8.747 1.00 0.00 H new ATOM 0 HA MET A 145 3.257 -5.080 9.034 1.00 0.00 H new ATOM 0 HB2 MET A 145 5.291 -3.123 7.844 1.00 0.00 H new ATOM 0 HB3 MET A 145 3.573 -2.776 7.824 1.00 0.00 H new ATOM 0 HG2 MET A 145 5.094 -3.536 10.360 1.00 0.00 H new ATOM 0 HG3 MET A 145 4.858 -1.875 9.855 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.083 -0.556 10.629 1.00 0.00 H new ATOM 0 HE2 MET A 145 2.948 -0.974 9.131 1.00 0.00 H new ATOM 0 HE3 MET A 145 1.263 -1.499 9.362 1.00 0.00 H new