USER MOD reduce.3.24.130724 H: found=0, std=0, add=762, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 763 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 13 GLN :FLIP amide:sc= -0.323 F(o=-2.7!,f=-0.94) USER MOD Set 1.2: A 16 GLN : amide:sc= -0.617 K(o=-0.94,f=-2) USER MOD Single : A 9 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 15 MET CE :methyl 156:sc= 0 (180deg=-0.803) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 GLN :FLIP amide:sc= 0.0424 F(o=-1.2!,f=0.042) USER MOD Single : A 28 LYS NZ :NH3+ -164:sc=-0.00967 (180deg=-0.303) USER MOD Single : A 34 MET CE :methyl -155:sc= 0 (180deg=-0.0494) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 137:sc= 1.3 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 171:sc= -0.581 (180deg=-0.831) USER MOD Single : A 44 SER OG : rot 180:sc=-0.00664 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.11) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -1.51 K(o=-1.5,f=-5.1!) USER MOD Single : A 60 LYS NZ :NH3+ 162:sc= -1.52! (180deg=-2.11) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot 96:sc= 0.358 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 MET CE :methyl -165:sc= -1.31 (180deg=-1.84) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot 180:sc= -1.76 USER MOD ----------------------------------------------------------------- ATOM 15 N GLN A 9 -10.109 133.580 121.122 1.00 0.00 N ATOM 16 CA GLN A 9 -11.054 134.072 122.117 1.00 0.00 C ATOM 17 C GLN A 9 -12.388 134.433 121.468 1.00 0.00 C ATOM 18 O GLN A 9 -13.449 134.215 122.052 1.00 0.00 O ATOM 19 CB GLN A 9 -10.478 135.303 122.819 1.00 0.00 C ATOM 20 CG GLN A 9 -9.231 134.902 123.610 1.00 0.00 C ATOM 21 CD GLN A 9 -8.615 136.130 124.272 1.00 0.00 C ATOM 22 OE1 GLN A 9 -8.926 137.260 123.895 1.00 0.00 O ATOM 23 NE2 GLN A 9 -7.756 135.976 125.241 1.00 0.00 N ATOM 0 HA GLN A 9 -11.224 133.280 122.847 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -10.226 136.069 122.085 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -11.222 135.735 123.488 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -9.493 134.163 124.368 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -8.504 134.434 122.946 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -7.500 135.039 125.551 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -7.340 136.793 125.688 1.00 0.00 H new ATOM 32 N ARG A 10 -12.328 134.985 120.260 1.00 0.00 N ATOM 33 CA ARG A 10 -13.544 135.367 119.553 1.00 0.00 C ATOM 34 C ARG A 10 -14.422 134.147 119.314 1.00 0.00 C ATOM 35 O ARG A 10 -15.642 134.210 119.455 1.00 0.00 O ATOM 36 CB ARG A 10 -13.189 136.007 118.211 1.00 0.00 C ATOM 37 CG ARG A 10 -12.398 137.292 118.455 1.00 0.00 C ATOM 38 CD ARG A 10 -12.170 138.013 117.125 1.00 0.00 C ATOM 39 NE ARG A 10 -11.503 137.127 116.177 1.00 0.00 N ATOM 40 CZ ARG A 10 -11.525 137.378 114.873 1.00 0.00 C ATOM 41 NH1 ARG A 10 -10.925 136.570 114.042 1.00 0.00 N1+ ATOM 42 NH2 ARG A 10 -12.147 138.433 114.421 1.00 0.00 N ATOM 0 H ARG A 10 -11.462 135.176 119.756 1.00 0.00 H new ATOM 0 HA ARG A 10 -14.089 136.085 120.165 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -12.601 135.314 117.609 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -14.097 136.227 117.649 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -12.940 137.940 119.143 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -11.441 137.059 118.923 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -13.124 138.344 116.715 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -11.566 138.906 117.286 1.00 0.00 H new ATOM 0 HE ARG A 10 -11.012 136.302 116.521 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -10.439 135.745 114.394 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -10.942 136.763 113.041 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -12.616 139.065 115.069 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -12.164 138.625 113.419 1.00 0.00 H new ATOM 56 N VAL A 11 -13.788 133.036 118.962 1.00 0.00 N ATOM 57 CA VAL A 11 -14.516 131.800 118.715 1.00 0.00 C ATOM 58 C VAL A 11 -15.246 131.369 119.978 1.00 0.00 C ATOM 59 O VAL A 11 -16.390 130.920 119.926 1.00 0.00 O ATOM 60 CB VAL A 11 -13.546 130.700 118.268 1.00 0.00 C ATOM 61 CG1 VAL A 11 -14.285 129.362 118.164 1.00 0.00 C ATOM 62 CG2 VAL A 11 -12.961 131.063 116.902 1.00 0.00 C ATOM 0 H VAL A 11 -12.778 132.966 118.842 1.00 0.00 H new ATOM 0 HA VAL A 11 -15.246 131.969 117.923 1.00 0.00 H new ATOM 0 HB VAL A 11 -12.744 130.611 119.001 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -13.589 128.586 117.846 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -14.701 129.100 119.137 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -15.091 129.447 117.435 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -12.271 130.282 116.583 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -13.767 131.155 116.174 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -12.428 132.011 116.975 1.00 0.00 H new ATOM 72 N ALA A 12 -14.576 131.519 121.111 1.00 0.00 N ATOM 73 CA ALA A 12 -15.170 131.151 122.384 1.00 0.00 C ATOM 74 C ALA A 12 -16.409 131.993 122.640 1.00 0.00 C ATOM 75 O ALA A 12 -17.402 131.507 123.175 1.00 0.00 O ATOM 76 CB ALA A 12 -14.158 131.356 123.511 1.00 0.00 C ATOM 0 H ALA A 12 -13.628 131.890 121.174 1.00 0.00 H new ATOM 0 HA ALA A 12 -15.456 130.100 122.351 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -14.612 131.078 124.462 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.282 130.733 123.331 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.858 132.403 123.545 1.00 0.00 H new ATOM 82 N GLN A 13 -16.341 133.256 122.241 1.00 0.00 N ATOM 83 CA GLN A 13 -17.468 134.167 122.413 1.00 0.00 C ATOM 84 C GLN A 13 -18.647 133.703 121.582 1.00 0.00 C ATOM 85 O GLN A 13 -19.789 133.718 122.039 1.00 0.00 O ATOM 86 CB GLN A 13 -17.062 135.570 121.968 1.00 0.00 C ATOM 87 CG GLN A 13 -18.127 136.586 122.393 1.00 0.00 C ATOM 88 CD GLN A 13 -18.057 136.826 123.898 1.00 0.00 C ATOM 89 OE1 GLN A 13 -17.142 136.222 124.607 1.00 0.00 O flip ATOM 90 NE2 GLN A 13 -18.857 137.586 124.444 1.00 0.00 N flip ATOM 0 H GLN A 13 -15.522 133.673 121.798 1.00 0.00 H new ATOM 0 HA GLN A 13 -17.754 134.180 123.465 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -16.100 135.835 122.407 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -16.936 135.594 120.886 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -17.977 137.525 121.860 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -19.117 136.220 122.122 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -19.572 138.058 123.890 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -18.805 137.744 125.450 1.00 0.00 H new ATOM 99 N GLU A 14 -18.361 133.276 120.358 1.00 0.00 N ATOM 100 CA GLU A 14 -19.414 132.798 119.489 1.00 0.00 C ATOM 101 C GLU A 14 -20.047 131.593 120.143 1.00 0.00 C ATOM 102 O GLU A 14 -21.262 131.418 120.122 1.00 0.00 O ATOM 103 CB GLU A 14 -18.837 132.410 118.126 1.00 0.00 C ATOM 104 CG GLU A 14 -18.301 133.659 117.426 1.00 0.00 C ATOM 105 CD GLU A 14 -17.775 133.295 116.041 1.00 0.00 C ATOM 106 OE1 GLU A 14 -17.690 132.113 115.753 1.00 0.00 O ATOM 107 OE2 GLU A 14 -17.466 134.205 115.289 1.00 0.00 O1- ATOM 0 H GLU A 14 -17.424 133.253 119.955 1.00 0.00 H new ATOM 0 HA GLU A 14 -20.158 133.580 119.334 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -18.038 131.679 118.252 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -19.606 131.939 117.514 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -19.091 134.405 117.340 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -17.504 134.106 118.021 1.00 0.00 H new ATOM 114 N MET A 15 -19.202 130.786 120.761 1.00 0.00 N ATOM 115 CA MET A 15 -19.673 129.608 121.469 1.00 0.00 C ATOM 116 C MET A 15 -20.404 130.021 122.734 1.00 0.00 C ATOM 117 O MET A 15 -21.418 129.437 123.096 1.00 0.00 O ATOM 118 CB MET A 15 -18.500 128.687 121.816 1.00 0.00 C ATOM 119 CG MET A 15 -17.942 128.068 120.532 1.00 0.00 C ATOM 120 SD MET A 15 -16.670 126.849 120.951 1.00 0.00 S ATOM 121 CE MET A 15 -16.181 126.421 119.260 1.00 0.00 C ATOM 0 H MET A 15 -18.192 130.923 120.787 1.00 0.00 H new ATOM 0 HA MET A 15 -20.361 129.064 120.822 1.00 0.00 H new ATOM 0 HB2 MET A 15 -17.721 129.250 122.330 1.00 0.00 H new ATOM 0 HB3 MET A 15 -18.829 127.903 122.498 1.00 0.00 H new ATOM 0 HG2 MET A 15 -18.744 127.593 119.967 1.00 0.00 H new ATOM 0 HG3 MET A 15 -17.520 128.845 119.895 1.00 0.00 H new ATOM 0 HE1 MET A 15 -15.164 126.030 119.263 1.00 0.00 H new ATOM 0 HE2 MET A 15 -16.859 125.664 118.866 1.00 0.00 H new ATOM 0 HE3 MET A 15 -16.226 127.311 118.632 1.00 0.00 H new ATOM 131 N GLN A 16 -19.886 131.046 123.395 1.00 0.00 N ATOM 132 CA GLN A 16 -20.503 131.537 124.618 1.00 0.00 C ATOM 133 C GLN A 16 -21.957 131.864 124.352 1.00 0.00 C ATOM 134 O GLN A 16 -22.844 131.506 125.127 1.00 0.00 O ATOM 135 CB GLN A 16 -19.770 132.792 125.102 1.00 0.00 C ATOM 136 CG GLN A 16 -20.315 133.221 126.466 1.00 0.00 C ATOM 137 CD GLN A 16 -19.640 134.513 126.913 1.00 0.00 C ATOM 138 OE1 GLN A 16 -19.764 135.541 126.247 1.00 0.00 O ATOM 139 NE2 GLN A 16 -18.930 134.523 128.008 1.00 0.00 N ATOM 0 H GLN A 16 -19.047 131.550 123.108 1.00 0.00 H new ATOM 0 HA GLN A 16 -20.439 130.769 125.389 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -18.701 132.594 125.174 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -19.897 133.599 124.380 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -21.394 133.366 126.407 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -20.139 132.436 127.201 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -18.829 133.670 128.558 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -18.476 135.384 128.314 1.00 0.00 H new ATOM 148 N LYS A 17 -22.191 132.530 123.237 1.00 0.00 N ATOM 149 CA LYS A 17 -23.540 132.887 122.849 1.00 0.00 C ATOM 150 C LYS A 17 -24.363 131.640 122.578 1.00 0.00 C ATOM 151 O LYS A 17 -25.507 131.529 123.015 1.00 0.00 O ATOM 152 CB LYS A 17 -23.504 133.772 121.599 1.00 0.00 C ATOM 153 CG LYS A 17 -24.935 134.057 121.133 1.00 0.00 C ATOM 154 CD LYS A 17 -24.934 135.135 120.036 1.00 0.00 C ATOM 155 CE LYS A 17 -24.515 136.507 120.605 1.00 0.00 C ATOM 156 NZ LYS A 17 -25.141 137.585 119.788 1.00 0.00 N1+ ATOM 0 H LYS A 17 -21.466 132.833 122.587 1.00 0.00 H new ATOM 0 HA LYS A 17 -24.005 133.438 123.666 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -22.988 134.707 121.817 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -22.944 133.277 120.806 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -25.390 133.142 120.753 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -25.541 134.388 121.977 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -24.251 134.845 119.238 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -25.928 135.209 119.594 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -24.828 136.594 121.646 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -23.430 136.605 120.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -24.863 138.513 120.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -24.822 137.503 118.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -26.176 137.492 119.825 1.00 0.00 H new ATOM 170 N GLU A 18 -23.777 130.717 121.837 1.00 0.00 N ATOM 171 CA GLU A 18 -24.475 129.481 121.490 1.00 0.00 C ATOM 172 C GLU A 18 -24.783 128.683 122.736 1.00 0.00 C ATOM 173 O GLU A 18 -25.820 128.027 122.836 1.00 0.00 O ATOM 174 CB GLU A 18 -23.624 128.642 120.537 1.00 0.00 C ATOM 175 CG GLU A 18 -23.524 129.348 119.185 1.00 0.00 C ATOM 176 CD GLU A 18 -24.879 129.342 118.483 1.00 0.00 C ATOM 177 OE1 GLU A 18 -25.730 128.566 118.888 1.00 0.00 O ATOM 178 OE2 GLU A 18 -25.045 130.112 117.552 1.00 0.00 O1- ATOM 0 H GLU A 18 -22.830 130.793 121.465 1.00 0.00 H new ATOM 0 HA GLU A 18 -25.411 129.741 120.996 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -22.629 128.494 120.956 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -24.067 127.654 120.411 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -23.185 130.374 119.327 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -22.781 128.850 118.561 1.00 0.00 H new ATOM 185 N ILE A 19 -23.885 128.769 123.692 1.00 0.00 N ATOM 186 CA ILE A 19 -24.080 128.070 124.958 1.00 0.00 C ATOM 187 C ILE A 19 -25.212 128.738 125.714 1.00 0.00 C ATOM 188 O ILE A 19 -26.090 128.078 126.265 1.00 0.00 O ATOM 189 CB ILE A 19 -22.786 128.072 125.794 1.00 0.00 C ATOM 190 CG1 ILE A 19 -21.752 127.151 125.133 1.00 0.00 C ATOM 191 CG2 ILE A 19 -23.071 127.569 127.216 1.00 0.00 C ATOM 192 CD1 ILE A 19 -20.367 127.415 125.730 1.00 0.00 C ATOM 0 H ILE A 19 -23.021 129.307 123.626 1.00 0.00 H new ATOM 0 HA ILE A 19 -24.337 127.029 124.762 1.00 0.00 H new ATOM 0 HB ILE A 19 -22.401 129.090 125.846 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -22.031 126.108 125.284 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -21.733 127.323 124.057 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -22.148 127.575 127.796 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -23.804 128.221 127.692 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -23.464 126.553 127.171 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -19.636 126.759 125.258 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -20.088 128.454 125.556 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -20.390 127.220 126.802 1.00 0.00 H new ATOM 204 N ALA A 20 -25.193 130.058 125.694 1.00 0.00 N ATOM 205 CA ALA A 20 -26.226 130.839 126.340 1.00 0.00 C ATOM 206 C ALA A 20 -27.541 130.584 125.638 1.00 0.00 C ATOM 207 O ALA A 20 -28.604 130.540 126.256 1.00 0.00 O ATOM 208 CB ALA A 20 -25.882 132.328 126.276 1.00 0.00 C ATOM 0 H ALA A 20 -24.470 130.611 125.235 1.00 0.00 H new ATOM 0 HA ALA A 20 -26.302 130.547 127.387 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -26.667 132.904 126.765 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -24.933 132.504 126.783 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -25.800 132.638 125.234 1.00 0.00 H new ATOM 214 N LEU A 21 -27.445 130.433 124.324 1.00 0.00 N ATOM 215 CA LEU A 21 -28.615 130.200 123.505 1.00 0.00 C ATOM 216 C LEU A 21 -29.290 128.887 123.876 1.00 0.00 C ATOM 217 O LEU A 21 -30.488 128.856 124.158 1.00 0.00 O ATOM 218 CB LEU A 21 -28.194 130.166 122.030 1.00 0.00 C ATOM 219 CG LEU A 21 -29.417 130.040 121.099 1.00 0.00 C ATOM 220 CD1 LEU A 21 -30.268 131.327 121.140 1.00 0.00 C ATOM 221 CD2 LEU A 21 -28.911 129.794 119.672 1.00 0.00 C ATOM 0 H LEU A 21 -26.566 130.469 123.807 1.00 0.00 H new ATOM 0 HA LEU A 21 -29.328 131.007 123.674 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -27.641 131.074 121.787 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -27.519 129.327 121.862 1.00 0.00 H new ATOM 0 HG LEU A 21 -30.044 129.211 121.428 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -31.126 131.217 120.476 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -30.617 131.500 122.158 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -29.663 132.174 120.815 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -29.761 129.702 118.996 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -28.287 130.630 119.358 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -28.326 128.875 119.647 1.00 0.00 H new ATOM 233 N ILE A 22 -28.523 127.807 123.882 1.00 0.00 N ATOM 234 CA ILE A 22 -29.082 126.510 124.231 1.00 0.00 C ATOM 235 C ILE A 22 -29.432 126.455 125.706 1.00 0.00 C ATOM 236 O ILE A 22 -30.400 125.808 126.105 1.00 0.00 O ATOM 237 CB ILE A 22 -28.102 125.387 123.896 1.00 0.00 C ATOM 238 CG1 ILE A 22 -27.806 125.415 122.391 1.00 0.00 C ATOM 239 CG2 ILE A 22 -28.740 124.047 124.274 1.00 0.00 C ATOM 240 CD1 ILE A 22 -26.708 124.402 122.042 1.00 0.00 C ATOM 0 H ILE A 22 -27.529 127.801 123.653 1.00 0.00 H new ATOM 0 HA ILE A 22 -29.990 126.373 123.645 1.00 0.00 H new ATOM 0 HB ILE A 22 -27.172 125.518 124.449 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -28.713 125.185 121.831 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -27.493 126.416 122.094 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -28.050 123.236 124.040 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -28.962 124.038 125.341 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -29.663 123.912 123.711 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -26.510 124.435 120.971 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -25.797 124.650 122.587 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -27.035 123.400 122.320 1.00 0.00 H new ATOM 252 N LEU A 23 -28.623 127.121 126.514 1.00 0.00 N ATOM 253 CA LEU A 23 -28.844 127.122 127.953 1.00 0.00 C ATOM 254 C LEU A 23 -30.219 127.679 128.300 1.00 0.00 C ATOM 255 O LEU A 23 -30.912 127.135 129.153 1.00 0.00 O ATOM 256 CB LEU A 23 -27.750 127.944 128.652 1.00 0.00 C ATOM 257 CG LEU A 23 -27.957 127.970 130.179 1.00 0.00 C ATOM 258 CD1 LEU A 23 -27.930 126.539 130.754 1.00 0.00 C ATOM 259 CD2 LEU A 23 -26.830 128.804 130.805 1.00 0.00 C ATOM 0 H LEU A 23 -27.816 127.662 126.204 1.00 0.00 H new ATOM 0 HA LEU A 23 -28.800 126.091 128.303 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -26.772 127.521 128.423 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -27.755 128.963 128.265 1.00 0.00 H new ATOM 0 HG LEU A 23 -28.927 128.410 130.409 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -28.078 126.578 131.833 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -28.726 125.949 130.300 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -26.967 126.077 130.536 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -26.958 128.835 131.887 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -25.867 128.352 130.566 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -26.863 129.818 130.407 1.00 0.00 H new ATOM 271 N GLN A 24 -30.595 128.769 127.643 1.00 0.00 N ATOM 272 CA GLN A 24 -31.886 129.410 127.889 1.00 0.00 C ATOM 273 C GLN A 24 -33.008 128.738 127.103 1.00 0.00 C ATOM 274 O GLN A 24 -34.132 128.597 127.585 1.00 0.00 O ATOM 275 CB GLN A 24 -31.805 130.888 127.493 1.00 0.00 C ATOM 276 CG GLN A 24 -33.071 131.618 127.950 1.00 0.00 C ATOM 277 CD GLN A 24 -33.023 133.074 127.500 1.00 0.00 C ATOM 278 OE1 GLN A 24 -31.942 133.538 126.934 1.00 0.00 O flip ATOM 279 NE2 GLN A 24 -33.996 133.810 127.669 1.00 0.00 N flip ATOM 0 H GLN A 24 -30.025 129.230 126.934 1.00 0.00 H new ATOM 0 HA GLN A 24 -32.112 129.313 128.951 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -30.926 131.347 127.945 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -31.692 130.979 126.413 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -33.953 131.129 127.535 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -33.159 131.567 129.035 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -34.840 133.446 128.111 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -33.958 134.783 127.367 1.00 0.00 H new ATOM 288 N ARG A 25 -32.697 128.385 125.867 1.00 0.00 N ATOM 289 CA ARG A 25 -33.675 127.787 124.962 1.00 0.00 C ATOM 290 C ARG A 25 -34.088 126.372 125.346 1.00 0.00 C ATOM 291 O ARG A 25 -35.261 126.013 125.241 1.00 0.00 O ATOM 292 CB ARG A 25 -33.087 127.755 123.559 1.00 0.00 C ATOM 293 CG ARG A 25 -34.161 127.346 122.544 1.00 0.00 C ATOM 294 CD ARG A 25 -33.555 127.334 121.140 1.00 0.00 C ATOM 295 NE ARG A 25 -34.584 127.049 120.147 1.00 0.00 N ATOM 296 CZ ARG A 25 -35.110 125.834 120.031 1.00 0.00 C ATOM 297 NH1 ARG A 25 -36.029 125.604 119.134 1.00 0.00 N1+ ATOM 298 NH2 ARG A 25 -34.708 124.872 120.815 1.00 0.00 N ATOM 0 H ARG A 25 -31.768 128.502 125.461 1.00 0.00 H new ATOM 0 HA ARG A 25 -34.571 128.404 125.019 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -32.688 128.736 123.302 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -32.255 127.052 123.522 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -34.554 126.360 122.791 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -34.999 128.042 122.584 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -33.092 128.298 120.928 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -32.767 126.583 121.083 1.00 0.00 H new ATOM 0 HE ARG A 25 -34.906 127.795 119.531 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -36.344 126.357 118.522 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -36.433 124.672 119.045 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -33.990 125.052 121.517 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -35.112 123.939 120.726 1.00 0.00 H new ATOM 312 N GLU A 26 -33.129 125.562 125.749 1.00 0.00 N ATOM 313 CA GLU A 26 -33.427 124.178 126.094 1.00 0.00 C ATOM 314 C GLU A 26 -34.167 124.109 127.419 1.00 0.00 C ATOM 315 O GLU A 26 -34.777 123.095 127.755 1.00 0.00 O ATOM 316 CB GLU A 26 -32.128 123.367 126.154 1.00 0.00 C ATOM 317 CG GLU A 26 -32.445 121.881 126.343 1.00 0.00 C ATOM 318 CD GLU A 26 -31.159 121.069 126.318 1.00 0.00 C ATOM 319 OE1 GLU A 26 -30.177 121.569 125.798 1.00 0.00 O ATOM 320 OE2 GLU A 26 -31.173 119.962 126.824 1.00 0.00 O1- ATOM 0 H GLU A 26 -32.149 125.829 125.846 1.00 0.00 H new ATOM 0 HA GLU A 26 -34.071 123.750 125.325 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -31.557 123.511 125.237 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -31.506 123.722 126.976 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -32.963 121.728 127.290 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -33.116 121.540 125.554 1.00 0.00 H new ATOM 327 N ILE A 27 -34.129 125.209 128.169 1.00 0.00 N ATOM 328 CA ILE A 27 -34.818 125.282 129.480 1.00 0.00 C ATOM 329 C ILE A 27 -35.937 126.319 129.440 1.00 0.00 C ATOM 330 O ILE A 27 -35.793 127.379 128.831 1.00 0.00 O ATOM 331 CB ILE A 27 -33.809 125.659 130.579 1.00 0.00 C ATOM 332 CG1 ILE A 27 -34.455 125.466 131.960 1.00 0.00 C ATOM 333 CG2 ILE A 27 -33.371 127.126 130.418 1.00 0.00 C ATOM 334 CD1 ILE A 27 -33.396 125.655 133.049 1.00 0.00 C ATOM 0 H ILE A 27 -33.636 126.062 127.904 1.00 0.00 H new ATOM 0 HA ILE A 27 -35.250 124.305 129.699 1.00 0.00 H new ATOM 0 HB ILE A 27 -32.934 125.015 130.491 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -35.265 126.182 132.098 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -34.893 124.471 132.033 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -32.657 127.381 131.201 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -32.903 127.261 129.443 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -34.242 127.776 130.496 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -33.853 125.518 134.029 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -32.601 124.922 132.914 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -32.979 126.660 132.980 1.00 0.00 H new ATOM 346 N LYS A 28 -37.046 126.011 130.106 1.00 0.00 N ATOM 347 CA LYS A 28 -38.179 126.929 130.155 1.00 0.00 C ATOM 348 C LYS A 28 -37.950 127.956 131.260 1.00 0.00 C ATOM 349 O LYS A 28 -37.910 127.611 132.441 1.00 0.00 O ATOM 350 CB LYS A 28 -39.462 126.137 130.428 1.00 0.00 C ATOM 351 CG LYS A 28 -39.734 125.194 129.254 1.00 0.00 C ATOM 352 CD LYS A 28 -41.078 124.492 129.460 1.00 0.00 C ATOM 353 CE LYS A 28 -41.295 123.467 128.346 1.00 0.00 C ATOM 354 NZ LYS A 28 -41.439 124.174 127.042 1.00 0.00 N1+ ATOM 0 H LYS A 28 -37.184 125.139 130.616 1.00 0.00 H new ATOM 0 HA LYS A 28 -38.277 127.448 129.202 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -39.361 125.567 131.352 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -40.302 126.819 130.564 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -39.745 125.754 128.319 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -38.935 124.456 129.174 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -41.097 123.998 130.432 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -41.886 125.223 129.458 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -40.454 122.774 128.306 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -42.187 122.874 128.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -41.849 123.526 126.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -42.064 124.997 127.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -40.505 124.493 126.715 1.00 0.00 H new ATOM 368 N ASP A 29 -37.780 129.217 130.869 1.00 0.00 N ATOM 369 CA ASP A 29 -37.531 130.279 131.841 1.00 0.00 C ATOM 370 C ASP A 29 -38.758 130.542 132.724 1.00 0.00 C ATOM 371 O ASP A 29 -38.613 130.800 133.919 1.00 0.00 O ATOM 372 CB ASP A 29 -37.086 131.576 131.123 1.00 0.00 C ATOM 373 CG ASP A 29 -36.346 131.228 129.835 1.00 0.00 C ATOM 374 OD1 ASP A 29 -35.704 130.191 129.805 1.00 0.00 O ATOM 375 OD2 ASP A 29 -36.433 132.003 128.897 1.00 0.00 O1- ATOM 0 H ASP A 29 -37.810 129.526 129.897 1.00 0.00 H new ATOM 0 HA ASP A 29 -36.725 129.945 132.495 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -37.955 132.194 130.898 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -36.440 132.161 131.777 1.00 0.00 H new ATOM 380 N PRO A 30 -39.950 130.495 132.176 1.00 0.00 N ATOM 381 CA PRO A 30 -41.194 130.751 132.967 1.00 0.00 C ATOM 382 C PRO A 30 -41.280 129.883 134.228 1.00 0.00 C ATOM 383 O PRO A 30 -41.844 130.304 135.238 1.00 0.00 O ATOM 384 CB PRO A 30 -42.328 130.422 131.972 1.00 0.00 C ATOM 385 CG PRO A 30 -41.717 130.644 130.624 1.00 0.00 C ATOM 386 CD PRO A 30 -40.260 130.202 130.762 1.00 0.00 C ATOM 0 HA PRO A 30 -41.238 131.773 133.344 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -42.672 129.394 132.088 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -43.193 131.067 132.127 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -42.233 130.064 129.858 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -41.784 131.691 130.330 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -40.137 129.143 130.534 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -39.607 130.752 130.084 1.00 0.00 H new ATOM 394 N ARG A 31 -40.726 128.673 134.166 1.00 0.00 N ATOM 395 CA ARG A 31 -40.767 127.779 135.319 1.00 0.00 C ATOM 396 C ARG A 31 -40.058 128.404 136.518 1.00 0.00 C ATOM 397 O ARG A 31 -40.501 128.256 137.656 1.00 0.00 O ATOM 398 CB ARG A 31 -40.103 126.444 134.974 1.00 0.00 C ATOM 399 CG ARG A 31 -40.909 125.739 133.882 1.00 0.00 C ATOM 400 CD ARG A 31 -40.309 124.357 133.618 1.00 0.00 C ATOM 401 NE ARG A 31 -40.539 123.481 134.762 1.00 0.00 N ATOM 402 CZ ARG A 31 -40.085 122.232 134.773 1.00 0.00 C ATOM 403 NH1 ARG A 31 -40.306 121.467 135.807 1.00 0.00 N1+ ATOM 404 NH2 ARG A 31 -39.419 121.770 133.750 1.00 0.00 N ATOM 0 H ARG A 31 -40.252 128.295 133.345 1.00 0.00 H new ATOM 0 HA ARG A 31 -41.812 127.610 135.579 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -39.081 126.611 134.635 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -40.046 125.814 135.862 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -41.951 125.643 134.189 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -40.899 126.332 132.968 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -40.756 123.924 132.723 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -39.239 124.447 133.429 1.00 0.00 H new ATOM 0 HE ARG A 31 -41.057 123.833 135.567 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -40.827 121.828 136.606 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -39.958 120.508 135.816 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -39.247 122.368 132.942 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -39.071 120.811 133.759 1.00 0.00 H new ATOM 418 N LEU A 32 -38.964 129.117 136.255 1.00 0.00 N ATOM 419 CA LEU A 32 -38.218 129.775 137.325 1.00 0.00 C ATOM 420 C LEU A 32 -38.911 131.077 137.715 1.00 0.00 C ATOM 421 O LEU A 32 -38.700 131.606 138.806 1.00 0.00 O ATOM 422 CB LEU A 32 -36.781 130.064 136.875 1.00 0.00 C ATOM 423 CG LEU A 32 -36.088 128.769 136.417 1.00 0.00 C ATOM 424 CD1 LEU A 32 -34.647 129.098 136.005 1.00 0.00 C ATOM 425 CD2 LEU A 32 -36.079 127.726 137.560 1.00 0.00 C ATOM 0 H LEU A 32 -38.578 129.253 135.321 1.00 0.00 H new ATOM 0 HA LEU A 32 -38.187 129.111 138.189 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -36.788 130.788 136.060 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -36.220 130.513 137.695 1.00 0.00 H new ATOM 0 HG LEU A 32 -36.632 128.348 135.572 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -34.145 128.187 135.678 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -34.658 129.820 135.188 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -34.113 129.521 136.856 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -35.585 126.816 137.219 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -35.542 128.131 138.418 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -37.104 127.495 137.850 1.00 0.00 H new ATOM 437 N GLY A 33 -39.747 131.582 136.809 1.00 0.00 N ATOM 438 CA GLY A 33 -40.486 132.821 137.047 1.00 0.00 C ATOM 439 C GLY A 33 -39.661 134.041 136.647 1.00 0.00 C ATOM 440 O GLY A 33 -40.077 135.179 136.866 1.00 0.00 O ATOM 0 H GLY A 33 -39.930 131.152 135.902 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -41.417 132.807 136.481 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -40.755 132.890 138.101 1.00 0.00 H new ATOM 444 N MET A 34 -38.493 133.801 136.060 1.00 0.00 N ATOM 445 CA MET A 34 -37.627 134.897 135.636 1.00 0.00 C ATOM 446 C MET A 34 -36.519 134.384 134.719 1.00 0.00 C ATOM 447 O MET A 34 -36.137 133.216 134.785 1.00 0.00 O ATOM 448 CB MET A 34 -37.016 135.580 136.864 1.00 0.00 C ATOM 449 CG MET A 34 -36.332 136.886 136.447 1.00 0.00 C ATOM 450 SD MET A 34 -35.652 137.707 137.907 1.00 0.00 S ATOM 451 CE MET A 34 -35.023 139.182 137.067 1.00 0.00 C ATOM 0 H MET A 34 -38.127 132.869 135.868 1.00 0.00 H new ATOM 0 HA MET A 34 -38.226 135.620 135.082 1.00 0.00 H new ATOM 0 HB2 MET A 34 -37.792 135.785 137.601 1.00 0.00 H new ATOM 0 HB3 MET A 34 -36.293 134.916 137.339 1.00 0.00 H new ATOM 0 HG2 MET A 34 -35.537 136.679 135.730 1.00 0.00 H new ATOM 0 HG3 MET A 34 -37.048 137.540 135.949 1.00 0.00 H new ATOM 0 HE1 MET A 34 -34.204 139.609 137.646 1.00 0.00 H new ATOM 0 HE2 MET A 34 -34.663 138.910 136.075 1.00 0.00 H new ATOM 0 HE3 MET A 34 -35.823 139.916 136.974 1.00 0.00 H new ATOM 461 N MET A 35 -36.000 135.269 133.870 1.00 0.00 N ATOM 462 CA MET A 35 -34.928 134.900 132.952 1.00 0.00 C ATOM 463 C MET A 35 -33.587 134.918 133.680 1.00 0.00 C ATOM 464 O MET A 35 -33.352 135.763 134.544 1.00 0.00 O ATOM 465 CB MET A 35 -34.888 135.877 131.776 1.00 0.00 C ATOM 466 CG MET A 35 -36.171 135.740 130.954 1.00 0.00 C ATOM 467 SD MET A 35 -36.067 136.801 129.491 1.00 0.00 S ATOM 468 CE MET A 35 -37.736 136.488 128.865 1.00 0.00 C ATOM 0 H MET A 35 -36.303 136.240 133.800 1.00 0.00 H new ATOM 0 HA MET A 35 -35.117 133.894 132.576 1.00 0.00 H new ATOM 0 HB2 MET A 35 -34.785 136.899 132.142 1.00 0.00 H new ATOM 0 HB3 MET A 35 -34.019 135.674 131.150 1.00 0.00 H new ATOM 0 HG2 MET A 35 -36.314 134.702 130.654 1.00 0.00 H new ATOM 0 HG3 MET A 35 -37.034 136.019 131.558 1.00 0.00 H new ATOM 0 HE1 MET A 35 -37.892 137.054 127.947 1.00 0.00 H new ATOM 0 HE2 MET A 35 -37.854 135.424 128.659 1.00 0.00 H new ATOM 0 HE3 MET A 35 -38.468 136.797 129.611 1.00 0.00 H new ATOM 478 N THR A 36 -32.714 133.970 133.334 1.00 0.00 N ATOM 479 CA THR A 36 -31.390 133.859 133.964 1.00 0.00 C ATOM 480 C THR A 36 -30.319 134.517 133.100 1.00 0.00 C ATOM 481 O THR A 36 -30.492 134.674 131.891 1.00 0.00 O ATOM 482 CB THR A 36 -31.049 132.380 134.167 1.00 0.00 C ATOM 483 OG1 THR A 36 -29.873 132.269 134.956 1.00 0.00 O ATOM 484 CG2 THR A 36 -30.825 131.703 132.811 1.00 0.00 C ATOM 0 H THR A 36 -32.897 133.265 132.620 1.00 0.00 H new ATOM 0 HA THR A 36 -31.417 134.371 134.926 1.00 0.00 H new ATOM 0 HB THR A 36 -31.878 131.888 134.677 1.00 0.00 H new ATOM 0 HG1 THR A 36 -29.994 131.565 135.627 1.00 0.00 H new ATOM 0 HG21 THR A 36 -30.583 130.651 132.965 1.00 0.00 H new ATOM 0 HG22 THR A 36 -31.731 131.783 132.210 1.00 0.00 H new ATOM 0 HG23 THR A 36 -30.001 132.193 132.292 1.00 0.00 H new ATOM 492 N THR A 37 -29.205 134.904 133.735 1.00 0.00 N ATOM 493 CA THR A 37 -28.082 135.557 133.034 1.00 0.00 C ATOM 494 C THR A 37 -26.807 134.741 133.207 1.00 0.00 C ATOM 495 O THR A 37 -26.570 134.167 134.270 1.00 0.00 O ATOM 496 CB THR A 37 -27.864 136.959 133.606 1.00 0.00 C ATOM 497 OG1 THR A 37 -29.076 137.697 133.522 1.00 0.00 O ATOM 498 CG2 THR A 37 -26.772 137.673 132.808 1.00 0.00 C ATOM 0 H THR A 37 -29.053 134.777 134.736 1.00 0.00 H new ATOM 0 HA THR A 37 -28.323 135.625 131.973 1.00 0.00 H new ATOM 0 HB THR A 37 -27.557 136.883 134.649 1.00 0.00 H new ATOM 0 HG1 THR A 37 -28.938 138.595 133.890 1.00 0.00 H new ATOM 0 HG21 THR A 37 -26.617 138.672 133.216 1.00 0.00 H new ATOM 0 HG22 THR A 37 -25.843 137.106 132.874 1.00 0.00 H new ATOM 0 HG23 THR A 37 -27.076 137.751 131.764 1.00 0.00 H new ATOM 506 N VAL A 38 -25.980 134.693 132.157 1.00 0.00 N ATOM 507 CA VAL A 38 -24.719 133.942 132.208 1.00 0.00 C ATOM 508 C VAL A 38 -23.569 134.872 132.578 1.00 0.00 C ATOM 509 O VAL A 38 -23.268 135.823 131.856 1.00 0.00 O ATOM 510 CB VAL A 38 -24.445 133.308 130.839 1.00 0.00 C ATOM 511 CG1 VAL A 38 -23.202 132.418 130.922 1.00 0.00 C ATOM 512 CG2 VAL A 38 -25.648 132.458 130.425 1.00 0.00 C ATOM 0 H VAL A 38 -26.158 135.161 131.268 1.00 0.00 H new ATOM 0 HA VAL A 38 -24.801 133.161 132.964 1.00 0.00 H new ATOM 0 HB VAL A 38 -24.279 134.095 130.103 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -23.010 131.969 129.947 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -22.343 133.019 131.220 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -23.367 131.631 131.658 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -25.456 132.006 129.452 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -25.811 131.673 131.164 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -26.535 133.088 130.364 1.00 0.00 H new ATOM 522 N SER A 39 -22.934 134.590 133.712 1.00 0.00 N ATOM 523 CA SER A 39 -21.819 135.405 134.180 1.00 0.00 C ATOM 524 C SER A 39 -20.644 135.349 133.207 1.00 0.00 C ATOM 525 O SER A 39 -19.941 136.341 133.015 1.00 0.00 O ATOM 526 CB SER A 39 -21.366 134.923 135.557 1.00 0.00 C ATOM 527 OG SER A 39 -20.384 135.816 136.067 1.00 0.00 O ATOM 0 H SER A 39 -23.171 133.807 134.321 1.00 0.00 H new ATOM 0 HA SER A 39 -22.161 136.438 134.245 1.00 0.00 H new ATOM 0 HB2 SER A 39 -22.217 134.874 136.236 1.00 0.00 H new ATOM 0 HB3 SER A 39 -20.956 133.915 135.486 1.00 0.00 H new ATOM 0 HG SER A 39 -20.092 135.511 136.951 1.00 0.00 H new ATOM 533 N GLY A 40 -20.425 134.181 132.601 1.00 0.00 N ATOM 534 CA GLY A 40 -19.325 134.006 131.658 1.00 0.00 C ATOM 535 C GLY A 40 -18.900 132.547 131.626 1.00 0.00 C ATOM 536 O GLY A 40 -19.215 131.781 132.534 1.00 0.00 O ATOM 0 H GLY A 40 -20.993 133.347 132.747 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -19.633 134.326 130.663 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -18.482 134.633 131.948 1.00 0.00 H new ATOM 540 N VAL A 41 -18.189 132.159 130.566 1.00 0.00 N ATOM 541 CA VAL A 41 -17.720 130.774 130.404 1.00 0.00 C ATOM 542 C VAL A 41 -16.220 130.738 130.133 1.00 0.00 C ATOM 543 O VAL A 41 -15.658 131.678 129.570 1.00 0.00 O ATOM 544 CB VAL A 41 -18.494 130.140 129.252 1.00 0.00 C ATOM 545 CG1 VAL A 41 -19.988 130.396 129.475 1.00 0.00 C ATOM 546 CG2 VAL A 41 -18.061 130.772 127.926 1.00 0.00 C ATOM 0 H VAL A 41 -17.923 132.782 129.804 1.00 0.00 H new ATOM 0 HA VAL A 41 -17.896 130.213 131.322 1.00 0.00 H new ATOM 0 HB VAL A 41 -18.295 129.069 129.215 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -20.559 129.950 128.661 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -20.296 129.951 130.421 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -20.173 131.470 129.502 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -18.617 130.316 127.107 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -18.264 131.843 127.950 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -16.994 130.608 127.776 1.00 0.00 H new ATOM 556 N GLU A 42 -15.572 129.640 130.541 1.00 0.00 N ATOM 557 CA GLU A 42 -14.122 129.464 130.349 1.00 0.00 C ATOM 558 C GLU A 42 -13.812 128.084 129.790 1.00 0.00 C ATOM 559 O GLU A 42 -14.441 127.094 130.160 1.00 0.00 O ATOM 560 CB GLU A 42 -13.393 129.645 131.679 1.00 0.00 C ATOM 561 CG GLU A 42 -13.581 131.079 132.167 1.00 0.00 C ATOM 562 CD GLU A 42 -12.801 131.296 133.460 1.00 0.00 C ATOM 563 OE1 GLU A 42 -12.303 130.321 133.998 1.00 0.00 O ATOM 564 OE2 GLU A 42 -12.713 132.433 133.892 1.00 0.00 O1- ATOM 0 H GLU A 42 -16.028 128.856 131.008 1.00 0.00 H new ATOM 0 HA GLU A 42 -13.781 130.216 129.637 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -13.781 128.944 132.418 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.332 129.426 131.558 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -13.239 131.779 131.405 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -14.639 131.280 132.333 1.00 0.00 H new ATOM 571 N MET A 43 -12.822 128.028 128.900 1.00 0.00 N ATOM 572 CA MET A 43 -12.394 126.767 128.277 1.00 0.00 C ATOM 573 C MET A 43 -11.110 126.269 128.935 1.00 0.00 C ATOM 574 O MET A 43 -10.236 127.064 129.281 1.00 0.00 O ATOM 575 CB MET A 43 -12.138 126.988 126.786 1.00 0.00 C ATOM 576 CG MET A 43 -13.449 127.334 126.077 1.00 0.00 C ATOM 577 SD MET A 43 -13.166 127.391 124.291 1.00 0.00 S ATOM 578 CE MET A 43 -14.859 127.802 123.806 1.00 0.00 C ATOM 0 H MET A 43 -12.296 128.845 128.590 1.00 0.00 H new ATOM 0 HA MET A 43 -13.182 126.025 128.409 1.00 0.00 H new ATOM 0 HB2 MET A 43 -11.416 127.793 126.648 1.00 0.00 H new ATOM 0 HB3 MET A 43 -11.703 126.091 126.346 1.00 0.00 H new ATOM 0 HG2 MET A 43 -14.210 126.590 126.313 1.00 0.00 H new ATOM 0 HG3 MET A 43 -13.823 128.296 126.428 1.00 0.00 H new ATOM 0 HE1 MET A 43 -14.884 128.044 122.744 1.00 0.00 H new ATOM 0 HE2 MET A 43 -15.510 126.949 124.000 1.00 0.00 H new ATOM 0 HE3 MET A 43 -15.204 128.660 124.382 1.00 0.00 H new ATOM 588 N SER A 44 -10.995 124.954 129.107 1.00 0.00 N ATOM 589 CA SER A 44 -9.799 124.388 129.726 1.00 0.00 C ATOM 590 C SER A 44 -8.622 124.436 128.760 1.00 0.00 C ATOM 591 O SER A 44 -8.798 124.414 127.543 1.00 0.00 O ATOM 592 CB SER A 44 -10.044 122.942 130.157 1.00 0.00 C ATOM 593 OG SER A 44 -8.868 122.435 130.776 1.00 0.00 O ATOM 0 H SER A 44 -11.701 124.271 128.832 1.00 0.00 H new ATOM 0 HA SER A 44 -9.565 124.986 130.607 1.00 0.00 H new ATOM 0 HB2 SER A 44 -10.884 122.893 130.850 1.00 0.00 H new ATOM 0 HB3 SER A 44 -10.307 122.332 129.293 1.00 0.00 H new ATOM 0 HG SER A 44 -9.019 121.508 131.056 1.00 0.00 H new ATOM 599 N ARG A 45 -7.424 124.508 129.321 1.00 0.00 N ATOM 600 CA ARG A 45 -6.204 124.568 128.525 1.00 0.00 C ATOM 601 C ARG A 45 -6.115 123.378 127.568 1.00 0.00 C ATOM 602 O ARG A 45 -5.543 123.490 126.484 1.00 0.00 O ATOM 603 CB ARG A 45 -4.992 124.572 129.468 1.00 0.00 C ATOM 604 CG ARG A 45 -3.677 124.843 128.701 1.00 0.00 C ATOM 605 CD ARG A 45 -3.468 126.351 128.489 1.00 0.00 C ATOM 606 NE ARG A 45 -2.203 126.588 127.803 1.00 0.00 N ATOM 607 CZ ARG A 45 -1.042 126.439 128.432 1.00 0.00 C ATOM 608 NH1 ARG A 45 0.077 126.656 127.796 1.00 0.00 N1+ ATOM 609 NH2 ARG A 45 -1.020 126.077 129.685 1.00 0.00 N ATOM 0 H ARG A 45 -7.269 124.526 130.329 1.00 0.00 H new ATOM 0 HA ARG A 45 -6.216 125.480 127.928 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -5.130 125.333 130.236 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -4.925 123.612 129.979 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -2.835 124.429 129.256 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -3.702 124.336 127.736 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -4.291 126.762 127.904 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -3.472 126.866 129.450 1.00 0.00 H new ATOM 0 HE ARG A 45 -2.210 126.873 126.824 1.00 0.00 H new ATOM 0 HH11 ARG A 45 0.060 126.940 126.816 1.00 0.00 H new ATOM 0 HH12 ARG A 45 0.968 126.542 128.279 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -1.894 125.908 130.182 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -0.129 125.963 130.167 1.00 0.00 H new ATOM 623 N ASP A 46 -6.662 122.235 127.979 1.00 0.00 N ATOM 624 CA ASP A 46 -6.610 121.031 127.147 1.00 0.00 C ATOM 625 C ASP A 46 -7.720 121.032 126.099 1.00 0.00 C ATOM 626 O ASP A 46 -7.793 120.131 125.265 1.00 0.00 O ATOM 627 CB ASP A 46 -6.751 119.789 128.030 1.00 0.00 C ATOM 628 CG ASP A 46 -5.536 119.658 128.941 1.00 0.00 C ATOM 629 OD1 ASP A 46 -4.561 120.350 128.699 1.00 0.00 O ATOM 630 OD2 ASP A 46 -5.598 118.866 129.868 1.00 0.00 O1- ATOM 0 H ASP A 46 -7.141 122.116 128.872 1.00 0.00 H new ATOM 0 HA ASP A 46 -5.650 121.018 126.632 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -7.659 119.859 128.629 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.847 118.899 127.408 1.00 0.00 H new ATOM 635 N LEU A 47 -8.583 122.042 126.148 1.00 0.00 N ATOM 636 CA LEU A 47 -9.682 122.140 125.199 1.00 0.00 C ATOM 637 C LEU A 47 -10.543 120.900 125.311 1.00 0.00 C ATOM 638 O LEU A 47 -11.291 120.557 124.396 1.00 0.00 O ATOM 639 CB LEU A 47 -9.148 122.266 123.767 1.00 0.00 C ATOM 640 CG LEU A 47 -8.077 123.362 123.695 1.00 0.00 C ATOM 641 CD1 LEU A 47 -7.569 123.470 122.254 1.00 0.00 C ATOM 642 CD2 LEU A 47 -8.675 124.711 124.133 1.00 0.00 C ATOM 0 H LEU A 47 -8.542 122.799 126.831 1.00 0.00 H new ATOM 0 HA LEU A 47 -10.272 123.027 125.428 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -8.727 121.314 123.443 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -9.966 122.501 123.086 1.00 0.00 H new ATOM 0 HG LEU A 47 -7.252 123.108 124.361 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -6.807 124.247 122.194 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -7.139 122.516 121.947 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -8.398 123.723 121.594 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -7.908 125.484 124.079 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -9.502 124.974 123.473 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -9.039 124.632 125.157 1.00 0.00 H new ATOM 654 N ALA A 48 -10.413 120.223 126.454 1.00 0.00 N ATOM 655 CA ALA A 48 -11.163 118.998 126.732 1.00 0.00 C ATOM 656 C ALA A 48 -12.336 119.277 127.666 1.00 0.00 C ATOM 657 O ALA A 48 -13.429 118.743 127.481 1.00 0.00 O ATOM 658 CB ALA A 48 -10.238 117.968 127.382 1.00 0.00 C ATOM 0 H ALA A 48 -9.788 120.507 127.209 1.00 0.00 H new ATOM 0 HA ALA A 48 -11.551 118.612 125.789 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.798 117.056 127.589 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -9.413 117.742 126.706 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.843 118.371 128.315 1.00 0.00 H new ATOM 664 N TYR A 49 -12.098 120.113 128.683 1.00 0.00 N ATOM 665 CA TYR A 49 -13.131 120.467 129.674 1.00 0.00 C ATOM 666 C TYR A 49 -13.465 121.953 129.595 1.00 0.00 C ATOM 667 O TYR A 49 -12.604 122.777 129.297 1.00 0.00 O ATOM 668 CB TYR A 49 -12.612 120.151 131.079 1.00 0.00 C ATOM 669 CG TYR A 49 -12.183 118.704 131.150 1.00 0.00 C ATOM 670 CD1 TYR A 49 -13.108 117.713 131.498 1.00 0.00 C ATOM 671 CD2 TYR A 49 -10.857 118.355 130.866 1.00 0.00 C ATOM 672 CE1 TYR A 49 -12.707 116.373 131.563 1.00 0.00 C ATOM 673 CE2 TYR A 49 -10.456 117.016 130.930 1.00 0.00 C ATOM 674 CZ TYR A 49 -11.381 116.025 131.279 1.00 0.00 C ATOM 675 OH TYR A 49 -10.986 114.704 131.342 1.00 0.00 O ATOM 0 H TYR A 49 -11.196 120.561 128.845 1.00 0.00 H new ATOM 0 HA TYR A 49 -14.030 119.889 129.461 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -11.772 120.802 131.322 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -13.390 120.346 131.817 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -14.131 117.982 131.716 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -10.143 119.120 130.597 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -13.420 115.608 131.832 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -9.433 116.747 130.710 1.00 0.00 H new ATOM 0 HH TYR A 49 -10.035 114.636 131.115 1.00 0.00 H new ATOM 685 N ALA A 50 -14.727 122.298 129.871 1.00 0.00 N ATOM 686 CA ALA A 50 -15.178 123.702 129.843 1.00 0.00 C ATOM 687 C ALA A 50 -15.972 124.033 131.104 1.00 0.00 C ATOM 688 O ALA A 50 -16.754 123.217 131.592 1.00 0.00 O ATOM 689 CB ALA A 50 -16.050 123.939 128.610 1.00 0.00 C ATOM 0 H ALA A 50 -15.457 121.629 130.116 1.00 0.00 H new ATOM 0 HA ALA A 50 -14.302 124.349 129.800 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -16.381 124.977 128.593 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -15.473 123.727 127.710 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -16.919 123.282 128.647 1.00 0.00 H new ATOM 695 N LYS A 51 -15.766 125.250 131.624 1.00 0.00 N ATOM 696 CA LYS A 51 -16.461 125.721 132.832 1.00 0.00 C ATOM 697 C LYS A 51 -17.481 126.793 132.471 1.00 0.00 C ATOM 698 O LYS A 51 -17.153 127.780 131.814 1.00 0.00 O ATOM 699 CB LYS A 51 -15.443 126.305 133.814 1.00 0.00 C ATOM 700 CG LYS A 51 -14.489 125.202 134.277 1.00 0.00 C ATOM 701 CD LYS A 51 -13.546 125.757 135.346 1.00 0.00 C ATOM 702 CE LYS A 51 -12.515 124.691 135.721 1.00 0.00 C ATOM 703 NZ LYS A 51 -13.180 123.611 136.503 1.00 0.00 N1+ ATOM 0 H LYS A 51 -15.120 125.931 131.225 1.00 0.00 H new ATOM 0 HA LYS A 51 -16.977 124.878 133.291 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -14.882 127.109 133.337 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -15.957 126.739 134.671 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -15.055 124.361 134.678 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -13.915 124.825 133.431 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -13.043 126.650 134.974 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -14.114 126.055 136.228 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -12.061 124.276 134.821 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -11.711 125.137 136.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -12.458 122.986 136.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -13.749 124.033 137.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -13.798 123.058 135.875 1.00 0.00 H new ATOM 717 N VAL A 52 -18.727 126.596 132.916 1.00 0.00 N ATOM 718 CA VAL A 52 -19.821 127.553 132.653 1.00 0.00 C ATOM 719 C VAL A 52 -20.352 128.123 133.964 1.00 0.00 C ATOM 720 O VAL A 52 -20.620 127.383 134.909 1.00 0.00 O ATOM 721 CB VAL A 52 -20.959 126.841 131.905 1.00 0.00 C ATOM 722 CG1 VAL A 52 -22.169 127.775 131.766 1.00 0.00 C ATOM 723 CG2 VAL A 52 -20.464 126.431 130.514 1.00 0.00 C ATOM 0 H VAL A 52 -19.009 125.782 133.462 1.00 0.00 H new ATOM 0 HA VAL A 52 -19.435 128.370 132.043 1.00 0.00 H new ATOM 0 HB VAL A 52 -21.261 125.957 132.467 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -22.968 127.258 131.234 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -22.520 128.065 132.756 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -21.879 128.666 131.209 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -21.266 125.925 129.977 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -20.160 127.319 129.960 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -19.613 125.757 130.615 1.00 0.00 H new ATOM 733 N TYR A 53 -20.518 129.451 134.009 1.00 0.00 N ATOM 734 CA TYR A 53 -21.040 130.136 135.203 1.00 0.00 C ATOM 735 C TYR A 53 -22.411 130.722 134.888 1.00 0.00 C ATOM 736 O TYR A 53 -22.584 131.395 133.872 1.00 0.00 O ATOM 737 CB TYR A 53 -20.086 131.263 135.609 1.00 0.00 C ATOM 738 CG TYR A 53 -18.754 130.675 136.024 1.00 0.00 C ATOM 739 CD1 TYR A 53 -17.849 130.236 135.049 1.00 0.00 C ATOM 740 CD2 TYR A 53 -18.421 130.574 137.381 1.00 0.00 C ATOM 741 CE1 TYR A 53 -16.616 129.695 135.431 1.00 0.00 C ATOM 742 CE2 TYR A 53 -17.187 130.034 137.762 1.00 0.00 C ATOM 743 CZ TYR A 53 -16.285 129.594 136.787 1.00 0.00 C ATOM 744 OH TYR A 53 -15.069 129.061 137.163 1.00 0.00 O ATOM 0 H TYR A 53 -20.299 130.075 133.232 1.00 0.00 H new ATOM 0 HA TYR A 53 -21.125 129.422 136.023 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -19.947 131.953 134.777 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -20.514 131.837 136.431 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -18.103 130.315 134.002 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -19.117 130.913 138.134 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -15.919 129.355 134.679 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -16.931 129.957 138.808 1.00 0.00 H new ATOM 0 HH TYR A 53 -14.998 129.065 138.140 1.00 0.00 H new ATOM 754 N VAL A 54 -23.393 130.458 135.758 1.00 0.00 N ATOM 755 CA VAL A 54 -24.767 130.957 135.561 1.00 0.00 C ATOM 756 C VAL A 54 -25.287 131.618 136.830 1.00 0.00 C ATOM 757 O VAL A 54 -24.933 131.221 137.940 1.00 0.00 O ATOM 758 CB VAL A 54 -25.687 129.799 135.181 1.00 0.00 C ATOM 759 CG1 VAL A 54 -27.040 130.355 134.735 1.00 0.00 C ATOM 760 CG2 VAL A 54 -25.060 129.004 134.034 1.00 0.00 C ATOM 0 H VAL A 54 -23.266 129.903 136.605 1.00 0.00 H new ATOM 0 HA VAL A 54 -24.753 131.696 134.760 1.00 0.00 H new ATOM 0 HB VAL A 54 -25.826 129.145 136.042 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -27.700 129.531 134.463 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -27.487 130.923 135.551 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -26.899 131.007 133.873 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -25.717 128.177 133.763 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -24.923 129.656 133.172 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -24.093 128.611 134.349 1.00 0.00 H new ATOM 770 N THR A 55 -26.135 132.640 136.655 1.00 0.00 N ATOM 771 CA THR A 55 -26.720 133.378 137.786 1.00 0.00 C ATOM 772 C THR A 55 -28.245 133.415 137.682 1.00 0.00 C ATOM 773 O THR A 55 -28.802 133.850 136.674 1.00 0.00 O ATOM 774 CB THR A 55 -26.176 134.809 137.777 1.00 0.00 C ATOM 775 OG1 THR A 55 -24.756 134.772 137.747 1.00 0.00 O ATOM 776 CG2 THR A 55 -26.639 135.542 139.033 1.00 0.00 C ATOM 0 H THR A 55 -26.433 132.976 135.739 1.00 0.00 H new ATOM 0 HA THR A 55 -26.451 132.874 138.714 1.00 0.00 H new ATOM 0 HB THR A 55 -26.548 135.333 136.896 1.00 0.00 H new ATOM 0 HG1 THR A 55 -24.405 135.687 137.739 1.00 0.00 H new ATOM 0 HG21 THR A 55 -26.250 136.560 139.024 1.00 0.00 H new ATOM 0 HG22 THR A 55 -27.728 135.570 139.057 1.00 0.00 H new ATOM 0 HG23 THR A 55 -26.269 135.020 139.916 1.00 0.00 H new ATOM 784 N PHE A 56 -28.914 132.968 138.755 1.00 0.00 N ATOM 785 CA PHE A 56 -30.387 132.954 138.828 1.00 0.00 C ATOM 786 C PHE A 56 -30.863 133.815 139.999 1.00 0.00 C ATOM 787 O PHE A 56 -30.375 133.669 141.119 1.00 0.00 O ATOM 788 CB PHE A 56 -30.890 131.522 139.049 1.00 0.00 C ATOM 789 CG PHE A 56 -30.531 130.640 137.876 1.00 0.00 C ATOM 790 CD1 PHE A 56 -29.302 129.970 137.854 1.00 0.00 C ATOM 791 CD2 PHE A 56 -31.437 130.473 136.823 1.00 0.00 C ATOM 792 CE1 PHE A 56 -28.980 129.134 136.778 1.00 0.00 C ATOM 793 CE2 PHE A 56 -31.113 129.640 135.745 1.00 0.00 C ATOM 794 CZ PHE A 56 -29.885 128.970 135.724 1.00 0.00 C ATOM 0 H PHE A 56 -28.456 132.608 139.592 1.00 0.00 H new ATOM 0 HA PHE A 56 -30.779 133.348 137.890 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -30.455 131.116 139.962 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -31.971 131.529 139.187 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -28.602 130.098 138.667 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -32.387 130.987 136.842 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -28.033 128.616 136.762 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -31.811 129.515 134.930 1.00 0.00 H new ATOM 0 HZ PHE A 56 -29.636 128.326 134.894 1.00 0.00 H new ATOM 804 N LEU A 57 -31.830 134.691 139.750 1.00 0.00 N ATOM 805 CA LEU A 57 -32.366 135.533 140.818 1.00 0.00 C ATOM 806 C LEU A 57 -33.188 134.676 141.776 1.00 0.00 C ATOM 807 O LEU A 57 -33.341 134.997 142.958 1.00 0.00 O ATOM 808 CB LEU A 57 -33.236 136.657 140.236 1.00 0.00 C ATOM 809 CG LEU A 57 -33.661 137.644 141.346 1.00 0.00 C ATOM 810 CD1 LEU A 57 -32.448 138.459 141.854 1.00 0.00 C ATOM 811 CD2 LEU A 57 -34.728 138.592 140.779 1.00 0.00 C ATOM 0 H LEU A 57 -32.255 134.837 138.834 1.00 0.00 H new ATOM 0 HA LEU A 57 -31.537 135.989 141.359 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -32.683 137.188 139.461 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -34.120 136.232 139.762 1.00 0.00 H new ATOM 0 HG LEU A 57 -34.065 137.083 142.189 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -32.773 139.147 142.635 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -31.697 137.780 142.258 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -32.018 139.025 141.028 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -35.038 139.295 141.552 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -34.314 139.142 139.934 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -35.590 138.013 140.448 1.00 0.00 H new ATOM 823 N ASN A 58 -33.712 133.573 141.254 1.00 0.00 N ATOM 824 CA ASN A 58 -34.524 132.673 142.054 1.00 0.00 C ATOM 825 C ASN A 58 -33.612 131.779 142.863 1.00 0.00 C ATOM 826 O ASN A 58 -34.069 130.932 143.631 1.00 0.00 O ATOM 827 CB ASN A 58 -35.416 131.824 141.149 1.00 0.00 C ATOM 828 CG ASN A 58 -36.261 132.725 140.256 1.00 0.00 C ATOM 829 OD1 ASN A 58 -36.382 132.475 139.056 1.00 0.00 O ATOM 830 ND2 ASN A 58 -36.857 133.765 140.771 1.00 0.00 N ATOM 0 H ASN A 58 -33.588 133.284 140.284 1.00 0.00 H new ATOM 0 HA ASN A 58 -35.160 133.253 142.723 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -34.803 131.163 140.536 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -36.062 131.189 141.754 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -37.424 134.372 140.180 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -36.756 133.971 141.765 1.00 0.00 H new ATOM 837 N ASP A 59 -32.313 132.020 142.730 1.00 0.00 N ATOM 838 CA ASP A 59 -31.347 131.276 143.506 1.00 0.00 C ATOM 839 C ASP A 59 -31.651 131.559 144.959 1.00 0.00 C ATOM 840 O ASP A 59 -31.216 130.847 145.863 1.00 0.00 O ATOM 841 CB ASP A 59 -29.919 131.721 143.179 1.00 0.00 C ATOM 842 CG ASP A 59 -28.918 130.848 143.926 1.00 0.00 C ATOM 843 OD1 ASP A 59 -29.344 129.883 144.540 1.00 0.00 O ATOM 844 OD2 ASP A 59 -27.739 131.157 143.874 1.00 0.00 O1- ATOM 0 H ASP A 59 -31.915 132.716 142.100 1.00 0.00 H new ATOM 0 HA ASP A 59 -31.415 130.212 143.280 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -29.744 131.652 142.105 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -29.782 132.766 143.458 1.00 0.00 H new ATOM 849 N LYS A 60 -32.423 132.627 145.159 1.00 0.00 N ATOM 850 CA LYS A 60 -32.816 133.036 146.495 1.00 0.00 C ATOM 851 C LYS A 60 -33.783 132.020 147.092 1.00 0.00 C ATOM 852 O LYS A 60 -33.756 131.749 148.293 1.00 0.00 O ATOM 853 CB LYS A 60 -33.490 134.405 146.440 1.00 0.00 C ATOM 854 CG LYS A 60 -32.493 135.437 145.918 1.00 0.00 C ATOM 855 CD LYS A 60 -33.188 136.793 145.738 1.00 0.00 C ATOM 856 CE LYS A 60 -33.781 137.274 147.072 1.00 0.00 C ATOM 857 NZ LYS A 60 -32.879 136.893 148.196 1.00 0.00 N1+ ATOM 0 H LYS A 60 -32.785 133.219 144.411 1.00 0.00 H new ATOM 0 HA LYS A 60 -31.925 133.093 147.120 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -34.365 134.367 145.791 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -33.841 134.691 147.432 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -31.660 135.535 146.615 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -32.076 135.104 144.968 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -32.475 137.527 145.364 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -33.978 136.708 144.992 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -33.914 138.356 147.052 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -34.767 136.834 147.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -33.109 137.464 149.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -33.007 135.885 148.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -31.891 137.064 147.921 1.00 0.00 H new ATOM 871 N ASP A 61 -34.634 131.457 146.237 1.00 0.00 N ATOM 872 CA ASP A 61 -35.618 130.456 146.668 1.00 0.00 C ATOM 873 C ASP A 61 -35.024 129.051 146.574 1.00 0.00 C ATOM 874 O ASP A 61 -34.629 128.601 145.498 1.00 0.00 O ATOM 875 CB ASP A 61 -36.867 130.547 145.791 1.00 0.00 C ATOM 876 CG ASP A 61 -37.932 129.581 146.299 1.00 0.00 C ATOM 877 OD1 ASP A 61 -37.712 128.982 147.339 1.00 0.00 O ATOM 878 OD2 ASP A 61 -38.952 129.455 145.642 1.00 0.00 O1- ATOM 0 H ASP A 61 -34.665 131.674 145.241 1.00 0.00 H new ATOM 0 HA ASP A 61 -35.888 130.655 147.705 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -37.254 131.566 145.800 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -36.614 130.311 144.757 1.00 0.00 H new ATOM 883 N GLU A 62 -34.955 128.373 147.715 1.00 0.00 N ATOM 884 CA GLU A 62 -34.397 127.025 147.773 1.00 0.00 C ATOM 885 C GLU A 62 -35.167 126.055 146.880 1.00 0.00 C ATOM 886 O GLU A 62 -34.599 125.110 146.337 1.00 0.00 O ATOM 887 CB GLU A 62 -34.427 126.517 149.216 1.00 0.00 C ATOM 888 CG GLU A 62 -33.519 127.389 150.085 1.00 0.00 C ATOM 889 CD GLU A 62 -33.490 126.852 151.511 1.00 0.00 C ATOM 890 OE1 GLU A 62 -34.276 125.967 151.806 1.00 0.00 O ATOM 891 OE2 GLU A 62 -32.681 127.333 152.288 1.00 0.00 O1- ATOM 0 H GLU A 62 -35.278 128.734 148.612 1.00 0.00 H new ATOM 0 HA GLU A 62 -33.370 127.075 147.412 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -35.447 126.541 149.600 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -34.096 125.479 149.254 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -32.510 127.402 149.672 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -33.878 128.418 150.082 1.00 0.00 H new ATOM 898 N ASP A 63 -36.462 126.282 146.741 1.00 0.00 N ATOM 899 CA ASP A 63 -37.286 125.415 145.915 1.00 0.00 C ATOM 900 C ASP A 63 -36.941 125.597 144.448 1.00 0.00 C ATOM 901 O ASP A 63 -36.904 124.639 143.676 1.00 0.00 O ATOM 902 CB ASP A 63 -38.766 125.730 146.138 1.00 0.00 C ATOM 903 CG ASP A 63 -39.164 125.380 147.568 1.00 0.00 C ATOM 904 OD1 ASP A 63 -38.396 124.699 148.226 1.00 0.00 O ATOM 905 OD2 ASP A 63 -40.232 125.799 147.984 1.00 0.00 O1- ATOM 0 H ASP A 63 -36.962 127.052 147.185 1.00 0.00 H new ATOM 0 HA ASP A 63 -37.091 124.381 146.198 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -38.954 126.787 145.948 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -39.377 125.166 145.433 1.00 0.00 H new ATOM 910 N ALA A 64 -36.715 126.847 144.075 1.00 0.00 N ATOM 911 CA ALA A 64 -36.401 127.181 142.696 1.00 0.00 C ATOM 912 C ALA A 64 -35.032 126.668 142.256 1.00 0.00 C ATOM 913 O ALA A 64 -34.891 126.140 141.153 1.00 0.00 O ATOM 914 CB ALA A 64 -36.447 128.695 142.500 1.00 0.00 C ATOM 0 H ALA A 64 -36.743 127.646 144.708 1.00 0.00 H new ATOM 0 HA ALA A 64 -37.154 126.689 142.080 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -36.210 128.935 141.463 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -37.445 129.063 142.739 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -35.719 129.169 143.158 1.00 0.00 H new ATOM 920 N VAL A 65 -34.020 126.836 143.102 1.00 0.00 N ATOM 921 CA VAL A 65 -32.681 126.392 142.743 1.00 0.00 C ATOM 922 C VAL A 65 -32.625 124.876 142.696 1.00 0.00 C ATOM 923 O VAL A 65 -31.919 124.293 141.878 1.00 0.00 O ATOM 924 CB VAL A 65 -31.639 126.950 143.731 1.00 0.00 C ATOM 925 CG1 VAL A 65 -31.699 126.198 145.061 1.00 0.00 C ATOM 926 CG2 VAL A 65 -30.238 126.803 143.134 1.00 0.00 C ATOM 0 H VAL A 65 -34.100 127.268 144.023 1.00 0.00 H new ATOM 0 HA VAL A 65 -32.442 126.776 141.751 1.00 0.00 H new ATOM 0 HB VAL A 65 -31.861 128.002 143.910 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -30.955 126.608 145.744 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -32.692 126.308 145.497 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -31.493 125.141 144.891 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -29.501 127.198 143.833 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -30.031 125.749 142.946 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -30.182 127.357 142.197 1.00 0.00 H new ATOM 936 N LYS A 66 -33.383 124.242 143.574 1.00 0.00 N ATOM 937 CA LYS A 66 -33.413 122.801 143.613 1.00 0.00 C ATOM 938 C LYS A 66 -34.001 122.268 142.320 1.00 0.00 C ATOM 939 O LYS A 66 -33.503 121.307 141.738 1.00 0.00 O ATOM 940 CB LYS A 66 -34.255 122.326 144.801 1.00 0.00 C ATOM 941 CG LYS A 66 -34.068 120.818 144.997 1.00 0.00 C ATOM 942 CD LYS A 66 -35.129 120.288 145.968 1.00 0.00 C ATOM 943 CE LYS A 66 -34.894 120.866 147.367 1.00 0.00 C ATOM 944 NZ LYS A 66 -35.650 120.061 148.368 1.00 0.00 N1+ ATOM 0 H LYS A 66 -33.979 124.703 144.262 1.00 0.00 H new ATOM 0 HA LYS A 66 -32.396 122.426 143.728 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -33.960 122.859 145.705 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -35.307 122.552 144.627 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -34.149 120.304 144.039 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -33.071 120.613 145.386 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -36.124 120.559 145.616 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -35.090 119.199 146.004 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -33.830 120.854 147.603 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -35.217 121.906 147.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -35.492 120.452 149.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -36.665 120.094 148.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -35.321 119.075 148.340 1.00 0.00 H new ATOM 958 N ALA A 67 -35.068 122.916 141.877 1.00 0.00 N ATOM 959 CA ALA A 67 -35.729 122.523 140.655 1.00 0.00 C ATOM 960 C ALA A 67 -34.859 122.847 139.458 1.00 0.00 C ATOM 961 O ALA A 67 -34.785 122.084 138.495 1.00 0.00 O ATOM 962 CB ALA A 67 -37.071 123.248 140.529 1.00 0.00 C ATOM 0 H ALA A 67 -35.490 123.715 142.350 1.00 0.00 H new ATOM 0 HA ALA A 67 -35.903 121.447 140.684 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -37.563 122.946 139.604 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -37.705 122.991 141.378 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -36.903 124.325 140.515 1.00 0.00 H new ATOM 968 N GLY A 68 -34.213 123.998 139.529 1.00 0.00 N ATOM 969 CA GLY A 68 -33.355 124.446 138.449 1.00 0.00 C ATOM 970 C GLY A 68 -32.132 123.549 138.281 1.00 0.00 C ATOM 971 O GLY A 68 -31.830 123.101 137.176 1.00 0.00 O ATOM 0 H GLY A 68 -34.267 124.637 140.322 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -33.922 124.463 137.519 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -33.031 125.468 138.644 1.00 0.00 H new ATOM 975 N ILE A 69 -31.431 123.294 139.379 1.00 0.00 N ATOM 976 CA ILE A 69 -30.231 122.458 139.331 1.00 0.00 C ATOM 977 C ILE A 69 -30.549 121.076 138.773 1.00 0.00 C ATOM 978 O ILE A 69 -29.802 120.543 137.955 1.00 0.00 O ATOM 979 CB ILE A 69 -29.630 122.322 140.747 1.00 0.00 C ATOM 980 CG1 ILE A 69 -29.120 123.702 141.255 1.00 0.00 C ATOM 981 CG2 ILE A 69 -28.490 121.283 140.751 1.00 0.00 C ATOM 982 CD1 ILE A 69 -27.698 124.017 140.751 1.00 0.00 C ATOM 0 H ILE A 69 -31.667 123.648 140.306 1.00 0.00 H new ATOM 0 HA ILE A 69 -29.508 122.937 138.671 1.00 0.00 H new ATOM 0 HB ILE A 69 -30.410 121.975 141.424 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -29.803 124.484 140.924 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -29.128 123.712 142.345 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -28.077 121.199 141.756 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -28.879 120.315 140.437 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -27.707 121.600 140.063 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -27.384 124.989 141.131 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -27.009 123.250 141.104 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -27.694 124.035 139.661 1.00 0.00 H new ATOM 994 N LYS A 70 -31.656 120.505 139.210 1.00 0.00 N ATOM 995 CA LYS A 70 -32.052 119.192 138.736 1.00 0.00 C ATOM 996 C LYS A 70 -32.414 119.252 137.271 1.00 0.00 C ATOM 997 O LYS A 70 -32.152 118.317 136.515 1.00 0.00 O ATOM 998 CB LYS A 70 -33.232 118.661 139.551 1.00 0.00 C ATOM 999 CG LYS A 70 -32.762 118.331 140.970 1.00 0.00 C ATOM 1000 CD LYS A 70 -33.920 117.720 141.762 1.00 0.00 C ATOM 1001 CE LYS A 70 -33.481 117.484 143.208 1.00 0.00 C ATOM 1002 NZ LYS A 70 -34.679 117.221 144.054 1.00 0.00 N1+ ATOM 0 H LYS A 70 -32.293 120.926 139.887 1.00 0.00 H new ATOM 0 HA LYS A 70 -31.210 118.511 138.862 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -34.029 119.404 139.584 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -33.645 117.771 139.076 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -31.924 117.634 140.934 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -32.405 119.234 141.465 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -34.783 118.386 141.737 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -34.230 116.779 141.307 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -32.795 116.639 143.258 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -32.942 118.354 143.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -34.381 117.060 145.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -35.318 118.041 144.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -35.175 116.378 143.701 1.00 0.00 H new ATOM 1016 N ALA A 71 -33.016 120.359 136.873 1.00 0.00 N ATOM 1017 CA ALA A 71 -33.402 120.522 135.492 1.00 0.00 C ATOM 1018 C ALA A 71 -32.167 120.668 134.618 1.00 0.00 C ATOM 1019 O ALA A 71 -32.059 120.052 133.561 1.00 0.00 O ATOM 1020 CB ALA A 71 -34.292 121.756 135.336 1.00 0.00 C ATOM 0 H ALA A 71 -33.244 121.146 137.481 1.00 0.00 H new ATOM 0 HA ALA A 71 -33.959 119.639 135.179 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -34.577 121.869 134.290 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -35.188 121.638 135.946 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -33.746 122.642 135.661 1.00 0.00 H new ATOM 1026 N LEU A 72 -31.243 121.493 135.083 1.00 0.00 N ATOM 1027 CA LEU A 72 -30.001 121.740 134.361 1.00 0.00 C ATOM 1028 C LEU A 72 -29.081 120.525 134.404 1.00 0.00 C ATOM 1029 O LEU A 72 -28.373 120.236 133.439 1.00 0.00 O ATOM 1030 CB LEU A 72 -29.289 122.963 134.962 1.00 0.00 C ATOM 1031 CG LEU A 72 -27.999 123.297 134.184 1.00 0.00 C ATOM 1032 CD1 LEU A 72 -28.327 123.678 132.724 1.00 0.00 C ATOM 1033 CD2 LEU A 72 -27.301 124.472 134.884 1.00 0.00 C ATOM 0 H LEU A 72 -31.328 122.006 135.961 1.00 0.00 H new ATOM 0 HA LEU A 72 -30.246 121.935 133.317 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -29.960 123.822 134.945 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -29.047 122.769 136.007 1.00 0.00 H new ATOM 0 HG LEU A 72 -27.347 122.424 134.168 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -27.404 123.910 132.192 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -28.828 122.843 132.234 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -28.981 124.550 132.714 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -26.386 124.723 134.348 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -27.965 125.336 134.893 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -27.056 124.192 135.908 1.00 0.00 H new ATOM 1045 N GLN A 73 -29.078 119.833 135.536 1.00 0.00 N ATOM 1046 CA GLN A 73 -28.221 118.671 135.700 1.00 0.00 C ATOM 1047 C GLN A 73 -28.692 117.546 134.808 1.00 0.00 C ATOM 1048 O GLN A 73 -27.899 116.902 134.121 1.00 0.00 O ATOM 1049 CB GLN A 73 -28.223 118.214 137.162 1.00 0.00 C ATOM 1050 CG GLN A 73 -27.180 117.110 137.362 1.00 0.00 C ATOM 1051 CD GLN A 73 -27.227 116.603 138.799 1.00 0.00 C ATOM 1052 OE1 GLN A 73 -28.244 116.065 139.236 1.00 0.00 O ATOM 1053 NE2 GLN A 73 -26.180 116.744 139.565 1.00 0.00 N ATOM 0 H GLN A 73 -29.655 120.055 136.347 1.00 0.00 H new ATOM 0 HA GLN A 73 -27.205 118.945 135.417 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -28.003 119.057 137.817 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -29.212 117.847 137.436 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -27.371 116.289 136.671 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -26.185 117.493 137.135 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -25.338 117.190 139.201 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -26.204 116.408 140.528 1.00 0.00 H new ATOM 1062 N GLU A 74 -29.991 117.325 134.815 1.00 0.00 N ATOM 1063 CA GLU A 74 -30.568 116.283 133.994 1.00 0.00 C ATOM 1064 C GLU A 74 -30.495 116.676 132.531 1.00 0.00 C ATOM 1065 O GLU A 74 -30.263 115.845 131.653 1.00 0.00 O ATOM 1066 CB GLU A 74 -32.023 116.070 134.388 1.00 0.00 C ATOM 1067 CG GLU A 74 -32.588 114.847 133.658 1.00 0.00 C ATOM 1068 CD GLU A 74 -34.067 114.682 133.989 1.00 0.00 C ATOM 1069 OE1 GLU A 74 -34.586 115.507 134.721 1.00 0.00 O ATOM 1070 OE2 GLU A 74 -34.659 113.732 133.504 1.00 0.00 O1- ATOM 0 H GLU A 74 -30.662 117.849 135.376 1.00 0.00 H new ATOM 0 HA GLU A 74 -30.009 115.360 134.146 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -32.100 115.928 135.466 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -32.609 116.955 134.140 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -32.458 114.963 132.582 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -32.039 113.952 133.951 1.00 0.00 H new ATOM 1077 N ALA A 75 -30.693 117.958 132.292 1.00 0.00 N ATOM 1078 CA ALA A 75 -30.654 118.501 130.948 1.00 0.00 C ATOM 1079 C ALA A 75 -29.216 118.707 130.505 1.00 0.00 C ATOM 1080 O ALA A 75 -28.955 119.046 129.354 1.00 0.00 O ATOM 1081 CB ALA A 75 -31.386 119.841 130.921 1.00 0.00 C ATOM 0 H ALA A 75 -30.884 118.648 133.018 1.00 0.00 H new ATOM 0 HA ALA A 75 -31.138 117.799 130.269 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -31.358 120.251 129.911 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -32.423 119.695 131.225 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -30.901 120.535 131.608 1.00 0.00 H new ATOM 1087 N SER A 76 -28.288 118.537 131.436 1.00 0.00 N ATOM 1088 CA SER A 76 -26.877 118.759 131.124 1.00 0.00 C ATOM 1089 C SER A 76 -26.407 117.916 129.939 1.00 0.00 C ATOM 1090 O SER A 76 -25.823 118.442 128.991 1.00 0.00 O ATOM 1091 CB SER A 76 -26.024 118.427 132.348 1.00 0.00 C ATOM 1092 OG SER A 76 -24.684 118.841 132.112 1.00 0.00 O ATOM 0 H SER A 76 -28.477 118.252 132.397 1.00 0.00 H new ATOM 0 HA SER A 76 -26.764 119.808 130.852 1.00 0.00 H new ATOM 0 HB2 SER A 76 -26.422 118.929 133.230 1.00 0.00 H new ATOM 0 HB3 SER A 76 -26.056 117.356 132.549 1.00 0.00 H new ATOM 0 HG SER A 76 -24.544 119.732 132.496 1.00 0.00 H new ATOM 1098 N GLY A 77 -26.671 116.616 129.987 1.00 0.00 N ATOM 1099 CA GLY A 77 -26.253 115.733 128.904 1.00 0.00 C ATOM 1100 C GLY A 77 -26.876 116.160 127.585 1.00 0.00 C ATOM 1101 O GLY A 77 -26.240 116.094 126.532 1.00 0.00 O ATOM 0 H GLY A 77 -27.165 116.155 130.751 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -25.166 115.745 128.818 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -26.543 114.708 129.133 1.00 0.00 H new ATOM 1105 N PHE A 78 -28.122 116.594 127.653 1.00 0.00 N ATOM 1106 CA PHE A 78 -28.840 117.030 126.466 1.00 0.00 C ATOM 1107 C PHE A 78 -28.226 118.290 125.862 1.00 0.00 C ATOM 1108 O PHE A 78 -28.115 118.403 124.642 1.00 0.00 O ATOM 1109 CB PHE A 78 -30.290 117.305 126.836 1.00 0.00 C ATOM 1110 CG PHE A 78 -30.988 116.002 127.154 1.00 0.00 C ATOM 1111 CD1 PHE A 78 -30.872 115.437 128.430 1.00 0.00 C ATOM 1112 CD2 PHE A 78 -31.754 115.362 126.173 1.00 0.00 C ATOM 1113 CE1 PHE A 78 -31.521 114.232 128.724 1.00 0.00 C ATOM 1114 CE2 PHE A 78 -32.403 114.156 126.467 1.00 0.00 C ATOM 1115 CZ PHE A 78 -32.286 113.592 127.742 1.00 0.00 C ATOM 0 H PHE A 78 -28.659 116.654 128.518 1.00 0.00 H new ATOM 0 HA PHE A 78 -28.776 116.237 125.721 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -30.336 117.973 127.696 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -30.797 117.809 126.013 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -30.282 115.931 129.188 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -31.845 115.798 125.189 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -31.431 113.796 129.708 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -32.993 113.662 125.710 1.00 0.00 H new ATOM 0 HZ PHE A 78 -32.786 112.662 127.969 1.00 0.00 H new ATOM 1125 N ILE A 79 -27.832 119.239 126.709 1.00 0.00 N ATOM 1126 CA ILE A 79 -27.239 120.474 126.205 1.00 0.00 C ATOM 1127 C ILE A 79 -25.944 120.168 125.480 1.00 0.00 C ATOM 1128 O ILE A 79 -25.649 120.736 124.434 1.00 0.00 O ATOM 1129 CB ILE A 79 -26.959 121.446 127.361 1.00 0.00 C ATOM 1130 CG1 ILE A 79 -28.283 121.892 127.995 1.00 0.00 C ATOM 1131 CG2 ILE A 79 -26.207 122.679 126.840 1.00 0.00 C ATOM 1132 CD1 ILE A 79 -28.009 122.528 129.360 1.00 0.00 C ATOM 0 H ILE A 79 -27.910 119.180 127.724 1.00 0.00 H new ATOM 0 HA ILE A 79 -27.943 120.937 125.514 1.00 0.00 H new ATOM 0 HB ILE A 79 -26.348 120.939 128.108 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -28.787 122.606 127.344 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -28.950 121.037 128.108 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -26.013 123.363 127.666 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -25.261 122.368 126.396 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -26.813 123.183 126.087 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -28.950 122.844 129.809 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -27.523 121.800 130.010 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -27.358 123.393 129.234 1.00 0.00 H new ATOM 1144 N ARG A 80 -25.179 119.271 126.061 1.00 0.00 N ATOM 1145 CA ARG A 80 -23.892 118.886 125.484 1.00 0.00 C ATOM 1146 C ARG A 80 -24.066 118.242 124.123 1.00 0.00 C ATOM 1147 O ARG A 80 -23.372 118.572 123.162 1.00 0.00 O ATOM 1148 CB ARG A 80 -23.189 117.903 126.420 1.00 0.00 C ATOM 1149 CG ARG A 80 -21.865 117.442 125.799 1.00 0.00 C ATOM 1150 CD ARG A 80 -21.053 116.667 126.837 1.00 0.00 C ATOM 1151 NE ARG A 80 -19.908 116.020 126.202 1.00 0.00 N ATOM 1152 CZ ARG A 80 -18.914 116.729 125.676 1.00 0.00 C ATOM 1153 NH1 ARG A 80 -17.920 116.120 125.089 1.00 0.00 N1+ ATOM 1154 NH2 ARG A 80 -18.923 118.031 125.755 1.00 0.00 N ATOM 0 H ARG A 80 -25.416 118.791 126.929 1.00 0.00 H new ATOM 0 HA ARG A 80 -23.292 119.788 125.362 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -23.003 118.376 127.384 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -23.832 117.043 126.606 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -22.059 116.813 124.931 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -21.297 118.304 125.448 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -20.710 117.344 127.620 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -21.683 115.918 127.317 1.00 0.00 H new ATOM 0 HE ARG A 80 -19.870 115.002 126.161 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -17.907 115.102 125.034 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -17.157 116.663 124.685 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -19.694 118.508 126.221 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -18.159 118.572 125.350 1.00 0.00 H new ATOM 1168 N SER A 81 -24.997 117.317 124.065 1.00 0.00 N ATOM 1169 CA SER A 81 -25.289 116.597 122.846 1.00 0.00 C ATOM 1170 C SER A 81 -25.970 117.497 121.845 1.00 0.00 C ATOM 1171 O SER A 81 -25.765 117.394 120.640 1.00 0.00 O ATOM 1172 CB SER A 81 -26.216 115.442 123.179 1.00 0.00 C ATOM 1173 OG SER A 81 -26.354 114.598 122.044 1.00 0.00 O ATOM 0 H SER A 81 -25.573 117.043 124.861 1.00 0.00 H new ATOM 0 HA SER A 81 -24.356 116.235 122.413 1.00 0.00 H new ATOM 0 HB2 SER A 81 -25.818 114.874 124.020 1.00 0.00 H new ATOM 0 HB3 SER A 81 -27.191 115.822 123.483 1.00 0.00 H new ATOM 0 HG SER A 81 -26.952 113.852 122.262 1.00 0.00 H new ATOM 1179 N LEU A 82 -26.805 118.364 122.367 1.00 0.00 N ATOM 1180 CA LEU A 82 -27.554 119.271 121.542 1.00 0.00 C ATOM 1181 C LEU A 82 -26.644 120.305 120.918 1.00 0.00 C ATOM 1182 O LEU A 82 -26.801 120.677 119.755 1.00 0.00 O ATOM 1183 CB LEU A 82 -28.631 119.944 122.397 1.00 0.00 C ATOM 1184 CG LEU A 82 -29.422 120.983 121.578 1.00 0.00 C ATOM 1185 CD1 LEU A 82 -30.022 120.331 120.316 1.00 0.00 C ATOM 1186 CD2 LEU A 82 -30.555 121.549 122.452 1.00 0.00 C ATOM 0 H LEU A 82 -26.981 118.458 123.367 1.00 0.00 H new ATOM 0 HA LEU A 82 -28.027 118.717 120.731 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -29.313 119.189 122.788 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -28.167 120.430 123.255 1.00 0.00 H new ATOM 0 HG LEU A 82 -28.750 121.784 121.270 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -30.577 121.078 119.749 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -29.219 119.929 119.698 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -30.694 119.524 120.608 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -31.121 122.285 121.882 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -31.218 120.739 122.758 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -30.130 122.024 123.336 1.00 0.00 H new ATOM 1198 N LEU A 83 -25.696 120.767 121.707 1.00 0.00 N ATOM 1199 CA LEU A 83 -24.760 121.766 121.235 1.00 0.00 C ATOM 1200 C LEU A 83 -23.813 121.162 120.216 1.00 0.00 C ATOM 1201 O LEU A 83 -23.604 121.710 119.134 1.00 0.00 O ATOM 1202 CB LEU A 83 -23.972 122.331 122.425 1.00 0.00 C ATOM 1203 CG LEU A 83 -23.268 123.675 122.074 1.00 0.00 C ATOM 1204 CD1 LEU A 83 -22.943 124.435 123.369 1.00 0.00 C ATOM 1205 CD2 LEU A 83 -21.954 123.432 121.295 1.00 0.00 C ATOM 0 H LEU A 83 -25.554 120.469 122.672 1.00 0.00 H new ATOM 0 HA LEU A 83 -25.311 122.574 120.753 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -24.647 122.485 123.267 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -23.226 121.603 122.744 1.00 0.00 H new ATOM 0 HG LEU A 83 -23.943 124.258 121.448 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -22.450 125.376 123.125 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -23.866 124.639 123.912 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -22.282 123.830 123.990 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -21.486 124.389 121.064 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -21.276 122.833 121.903 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -22.173 122.902 120.368 1.00 0.00 H new ATOM 1217 N GLY A 84 -23.243 120.022 120.577 1.00 0.00 N ATOM 1218 CA GLY A 84 -22.310 119.343 119.700 1.00 0.00 C ATOM 1219 C GLY A 84 -22.971 118.940 118.392 1.00 0.00 C ATOM 1220 O GLY A 84 -22.389 119.081 117.319 1.00 0.00 O ATOM 0 H GLY A 84 -23.411 119.552 121.467 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -21.461 119.995 119.495 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -21.918 118.457 120.199 1.00 0.00 H new ATOM 1224 N LYS A 85 -24.189 118.437 118.497 1.00 0.00 N ATOM 1225 CA LYS A 85 -24.940 118.008 117.314 1.00 0.00 C ATOM 1226 C LYS A 85 -25.342 119.195 116.452 1.00 0.00 C ATOM 1227 O LYS A 85 -25.298 119.132 115.224 1.00 0.00 O ATOM 1228 CB LYS A 85 -26.189 117.232 117.739 1.00 0.00 C ATOM 1229 CG LYS A 85 -25.779 115.859 118.272 1.00 0.00 C ATOM 1230 CD LYS A 85 -26.968 115.203 118.982 1.00 0.00 C ATOM 1231 CE LYS A 85 -28.084 114.908 117.973 1.00 0.00 C ATOM 1232 NZ LYS A 85 -29.035 113.923 118.562 1.00 0.00 N1+ ATOM 0 H LYS A 85 -24.683 118.313 119.381 1.00 0.00 H new ATOM 0 HA LYS A 85 -24.292 117.362 116.722 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -26.730 117.785 118.507 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -26.865 117.118 116.892 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -25.439 115.227 117.452 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -24.942 115.962 118.963 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -26.649 114.279 119.465 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -27.341 115.860 119.767 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -28.609 115.828 117.715 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -27.660 114.514 117.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -29.793 113.721 117.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -28.528 113.043 118.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -29.448 114.316 119.432 1.00 0.00 H new ATOM 1246 N ALA A 86 -25.737 120.271 117.108 1.00 0.00 N ATOM 1247 CA ALA A 86 -26.154 121.476 116.397 1.00 0.00 C ATOM 1248 C ALA A 86 -24.995 122.019 115.578 1.00 0.00 C ATOM 1249 O ALA A 86 -25.161 122.406 114.421 1.00 0.00 O ATOM 1250 CB ALA A 86 -26.623 122.538 117.394 1.00 0.00 C ATOM 0 H ALA A 86 -25.779 120.340 118.125 1.00 0.00 H new ATOM 0 HA ALA A 86 -26.979 121.225 115.730 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -26.932 123.433 116.854 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -27.465 122.152 117.968 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -25.806 122.787 118.071 1.00 0.00 H new ATOM 1256 N MET A 87 -23.812 122.015 116.183 1.00 0.00 N ATOM 1257 CA MET A 87 -22.601 122.478 115.512 1.00 0.00 C ATOM 1258 C MET A 87 -21.962 121.303 114.783 1.00 0.00 C ATOM 1259 O MET A 87 -21.075 121.477 113.948 1.00 0.00 O ATOM 1260 CB MET A 87 -21.619 123.046 116.539 1.00 0.00 C ATOM 1261 CG MET A 87 -22.271 124.211 117.284 1.00 0.00 C ATOM 1262 SD MET A 87 -21.061 124.958 118.403 1.00 0.00 S ATOM 1263 CE MET A 87 -22.161 126.188 119.144 1.00 0.00 C ATOM 0 H MET A 87 -23.665 121.695 117.140 1.00 0.00 H new ATOM 0 HA MET A 87 -22.854 123.262 114.799 1.00 0.00 H new ATOM 0 HB2 MET A 87 -21.326 122.269 117.245 1.00 0.00 H new ATOM 0 HB3 MET A 87 -20.710 123.383 116.040 1.00 0.00 H new ATOM 0 HG2 MET A 87 -22.634 124.954 116.574 1.00 0.00 H new ATOM 0 HG3 MET A 87 -23.135 123.859 117.847 1.00 0.00 H new ATOM 0 HE1 MET A 87 -21.568 126.936 119.670 1.00 0.00 H new ATOM 0 HE2 MET A 87 -22.745 126.672 118.361 1.00 0.00 H new ATOM 0 HE3 MET A 87 -22.834 125.698 119.848 1.00 0.00 H new ATOM 1273 N ARG A 88 -22.425 120.102 115.128 1.00 0.00 N ATOM 1274 CA ARG A 88 -21.909 118.877 114.529 1.00 0.00 C ATOM 1275 C ARG A 88 -20.402 118.781 114.736 1.00 0.00 C ATOM 1276 O ARG A 88 -19.671 118.297 113.871 1.00 0.00 O ATOM 1277 CB ARG A 88 -22.238 118.845 113.037 1.00 0.00 C ATOM 1278 CG ARG A 88 -23.755 118.796 112.849 1.00 0.00 C ATOM 1279 CD ARG A 88 -24.080 118.647 111.362 1.00 0.00 C ATOM 1280 NE ARG A 88 -25.514 118.794 111.141 1.00 0.00 N ATOM 1281 CZ ARG A 88 -26.358 117.810 111.432 1.00 0.00 C ATOM 1282 NH1 ARG A 88 -27.637 117.966 111.226 1.00 0.00 N1+ ATOM 1283 NH2 ARG A 88 -25.908 116.689 111.925 1.00 0.00 N ATOM 0 H ARG A 88 -23.158 119.954 115.821 1.00 0.00 H new ATOM 0 HA ARG A 88 -22.383 118.023 115.014 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -21.828 119.727 112.545 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -21.775 117.976 112.570 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -24.175 117.961 113.409 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -24.210 119.705 113.242 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -23.538 119.398 110.787 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -23.748 117.672 111.006 1.00 0.00 H new ATOM 0 HE ARG A 88 -25.875 119.667 110.757 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -27.988 118.843 110.842 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -28.285 117.211 111.449 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -24.908 116.568 112.087 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -26.556 115.934 112.148 1.00 0.00 H new ATOM 1297 N LEU A 89 -19.948 119.256 115.898 1.00 0.00 N ATOM 1298 CA LEU A 89 -18.522 119.245 116.254 1.00 0.00 C ATOM 1299 C LEU A 89 -18.187 118.108 117.211 1.00 0.00 C ATOM 1300 O LEU A 89 -18.945 117.808 118.132 1.00 0.00 O ATOM 1301 CB LEU A 89 -18.169 120.568 116.931 1.00 0.00 C ATOM 1302 CG LEU A 89 -18.308 121.732 115.938 1.00 0.00 C ATOM 1303 CD1 LEU A 89 -18.211 123.053 116.714 1.00 0.00 C ATOM 1304 CD2 LEU A 89 -17.193 121.672 114.860 1.00 0.00 C ATOM 0 H LEU A 89 -20.551 119.657 116.616 1.00 0.00 H new ATOM 0 HA LEU A 89 -17.948 119.104 115.338 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -18.824 120.732 117.787 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -17.149 120.527 117.313 1.00 0.00 H new ATOM 0 HG LEU A 89 -19.271 121.661 115.433 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -18.308 123.889 116.022 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -19.010 123.100 117.454 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -17.246 123.109 117.218 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -17.311 122.506 114.168 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -16.217 121.736 115.342 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -17.267 120.732 114.312 1.00 0.00 H new ATOM 1316 N ARG A 90 -17.016 117.500 116.996 1.00 0.00 N ATOM 1317 CA ARG A 90 -16.528 116.409 117.847 1.00 0.00 C ATOM 1318 C ARG A 90 -15.470 116.946 118.807 1.00 0.00 C ATOM 1319 O ARG A 90 -15.059 116.264 119.745 1.00 0.00 O ATOM 1320 CB ARG A 90 -15.915 115.309 116.978 1.00 0.00 C ATOM 1321 CG ARG A 90 -16.988 114.732 116.052 1.00 0.00 C ATOM 1322 CD ARG A 90 -16.392 113.588 115.231 1.00 0.00 C ATOM 1323 NE ARG A 90 -16.099 112.447 116.092 1.00 0.00 N ATOM 1324 CZ ARG A 90 -17.068 111.652 116.532 1.00 0.00 C ATOM 1325 NH1 ARG A 90 -16.780 110.637 117.301 1.00 0.00 N1+ ATOM 1326 NH2 ARG A 90 -18.307 111.884 116.196 1.00 0.00 N ATOM 0 H ARG A 90 -16.384 117.747 116.234 1.00 0.00 H new ATOM 0 HA ARG A 90 -17.362 115.997 118.415 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -15.091 115.713 116.390 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -15.501 114.521 117.608 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -17.833 114.371 116.638 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -17.368 115.510 115.389 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -17.089 113.292 114.448 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -15.480 113.923 114.736 1.00 0.00 H new ATOM 0 HE ARG A 90 -15.134 112.257 116.361 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -15.811 110.455 117.564 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -17.524 110.026 117.639 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -18.533 112.677 115.595 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -19.050 111.273 116.534 1.00 0.00 H new ATOM 1340 N ILE A 91 -15.032 118.184 118.554 1.00 0.00 N ATOM 1341 CA ILE A 91 -14.014 118.837 119.386 1.00 0.00 C ATOM 1342 C ILE A 91 -14.655 119.581 120.554 1.00 0.00 C ATOM 1343 O ILE A 91 -14.006 120.393 121.214 1.00 0.00 O ATOM 1344 CB ILE A 91 -13.182 119.806 118.529 1.00 0.00 C ATOM 1345 CG1 ILE A 91 -14.069 120.931 117.967 1.00 0.00 C ATOM 1346 CG2 ILE A 91 -12.549 119.038 117.367 1.00 0.00 C ATOM 1347 CD1 ILE A 91 -13.206 121.914 117.171 1.00 0.00 C ATOM 0 H ILE A 91 -15.367 118.755 117.778 1.00 0.00 H new ATOM 0 HA ILE A 91 -13.359 118.068 119.796 1.00 0.00 H new ATOM 0 HB ILE A 91 -12.406 120.248 119.155 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -14.845 120.511 117.327 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -14.574 121.451 118.781 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -11.959 119.722 116.757 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -11.904 118.252 117.759 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -13.333 118.592 116.755 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -13.835 122.711 116.773 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -12.447 122.343 117.825 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -12.722 121.389 116.348 1.00 0.00 H new ATOM 1359 N VAL A 92 -15.932 119.314 120.795 1.00 0.00 N ATOM 1360 CA VAL A 92 -16.644 119.975 121.867 1.00 0.00 C ATOM 1361 C VAL A 92 -16.175 119.417 123.227 1.00 0.00 C ATOM 1362 O VAL A 92 -16.274 118.212 123.455 1.00 0.00 O ATOM 1363 CB VAL A 92 -18.152 119.739 121.706 1.00 0.00 C ATOM 1364 CG1 VAL A 92 -18.461 118.233 121.691 1.00 0.00 C ATOM 1365 CG2 VAL A 92 -18.896 120.411 122.866 1.00 0.00 C ATOM 0 H VAL A 92 -16.489 118.646 120.262 1.00 0.00 H new ATOM 0 HA VAL A 92 -16.439 121.045 121.828 1.00 0.00 H new ATOM 0 HB VAL A 92 -18.481 120.169 120.760 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -19.535 118.083 121.576 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -17.938 117.762 120.859 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -18.130 117.784 122.628 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -19.968 120.246 122.755 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -18.559 119.984 123.811 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -18.691 121.482 122.858 1.00 0.00 H new ATOM 1375 N PRO A 93 -15.664 120.230 124.137 1.00 0.00 N ATOM 1376 CA PRO A 93 -15.197 119.728 125.465 1.00 0.00 C ATOM 1377 C PRO A 93 -16.365 119.477 126.409 1.00 0.00 C ATOM 1378 O PRO A 93 -17.476 119.931 126.156 1.00 0.00 O ATOM 1379 CB PRO A 93 -14.309 120.868 125.970 1.00 0.00 C ATOM 1380 CG PRO A 93 -14.951 122.093 125.410 1.00 0.00 C ATOM 1381 CD PRO A 93 -15.468 121.694 124.029 1.00 0.00 C ATOM 0 HA PRO A 93 -14.676 118.773 125.401 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -14.275 120.896 127.059 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -13.282 120.760 125.622 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -15.765 122.435 126.049 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -14.236 122.912 125.339 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -16.399 122.206 123.787 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -14.753 121.946 123.246 1.00 0.00 H new ATOM 1389 N GLU A 94 -16.107 118.769 127.502 1.00 0.00 N ATOM 1390 CA GLU A 94 -17.161 118.500 128.470 1.00 0.00 C ATOM 1391 C GLU A 94 -17.652 119.815 129.066 1.00 0.00 C ATOM 1392 O GLU A 94 -16.854 120.701 129.369 1.00 0.00 O ATOM 1393 CB GLU A 94 -16.638 117.593 129.585 1.00 0.00 C ATOM 1394 CG GLU A 94 -16.219 116.246 128.993 1.00 0.00 C ATOM 1395 CD GLU A 94 -15.786 115.301 130.108 1.00 0.00 C ATOM 1396 OE1 GLU A 94 -15.698 115.751 131.238 1.00 0.00 O ATOM 1397 OE2 GLU A 94 -15.549 114.141 129.816 1.00 0.00 O1- ATOM 0 H GLU A 94 -15.195 118.378 127.737 1.00 0.00 H new ATOM 0 HA GLU A 94 -17.986 117.997 127.965 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -15.790 118.063 130.083 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -17.410 117.446 130.341 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -17.049 115.810 128.436 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -15.401 116.388 128.287 1.00 0.00 H new ATOM 1404 N LEU A 95 -18.972 119.943 129.232 1.00 0.00 N ATOM 1405 CA LEU A 95 -19.568 121.165 129.794 1.00 0.00 C ATOM 1406 C LEU A 95 -19.845 120.989 131.284 1.00 0.00 C ATOM 1407 O LEU A 95 -20.506 120.038 131.699 1.00 0.00 O ATOM 1408 CB LEU A 95 -20.898 121.491 129.069 1.00 0.00 C ATOM 1409 CG LEU A 95 -20.669 122.086 127.657 1.00 0.00 C ATOM 1410 CD1 LEU A 95 -20.316 123.580 127.740 1.00 0.00 C ATOM 1411 CD2 LEU A 95 -19.544 121.347 126.928 1.00 0.00 C ATOM 0 H LEU A 95 -19.648 119.220 128.987 1.00 0.00 H new ATOM 0 HA LEU A 95 -18.862 121.983 129.653 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -21.495 120.583 128.985 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -21.473 122.197 129.669 1.00 0.00 H new ATOM 0 HG LEU A 95 -21.598 121.967 127.100 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -20.160 123.973 126.735 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -21.132 124.121 128.219 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -19.405 123.707 128.325 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -19.403 121.784 125.939 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -18.620 121.436 127.499 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -19.807 120.294 126.826 1.00 0.00 H new ATOM 1423 N THR A 96 -19.359 121.946 132.078 1.00 0.00 N ATOM 1424 CA THR A 96 -19.572 121.951 133.535 1.00 0.00 C ATOM 1425 C THR A 96 -20.344 123.209 133.909 1.00 0.00 C ATOM 1426 O THR A 96 -19.972 124.307 133.506 1.00 0.00 O ATOM 1427 CB THR A 96 -18.221 121.932 134.258 1.00 0.00 C ATOM 1428 OG1 THR A 96 -17.577 120.688 134.021 1.00 0.00 O ATOM 1429 CG2 THR A 96 -18.429 122.133 135.760 1.00 0.00 C ATOM 0 H THR A 96 -18.810 122.735 131.737 1.00 0.00 H new ATOM 0 HA THR A 96 -20.138 121.068 133.831 1.00 0.00 H new ATOM 0 HB THR A 96 -17.597 122.741 133.878 1.00 0.00 H new ATOM 0 HG1 THR A 96 -16.712 120.675 134.481 1.00 0.00 H new ATOM 0 HG21 THR A 96 -17.464 122.118 136.266 1.00 0.00 H new ATOM 0 HG22 THR A 96 -18.916 123.093 135.935 1.00 0.00 H new ATOM 0 HG23 THR A 96 -19.056 121.332 136.151 1.00 0.00 H new ATOM 1437 N PHE A 97 -21.433 123.046 134.671 1.00 0.00 N ATOM 1438 CA PHE A 97 -22.275 124.185 135.077 1.00 0.00 C ATOM 1439 C PHE A 97 -22.011 124.587 136.521 1.00 0.00 C ATOM 1440 O PHE A 97 -22.042 123.757 137.430 1.00 0.00 O ATOM 1441 CB PHE A 97 -23.748 123.802 134.925 1.00 0.00 C ATOM 1442 CG PHE A 97 -24.042 123.512 133.472 1.00 0.00 C ATOM 1443 CD1 PHE A 97 -23.896 122.212 132.974 1.00 0.00 C ATOM 1444 CD2 PHE A 97 -24.459 124.544 132.622 1.00 0.00 C ATOM 1445 CE1 PHE A 97 -24.165 121.943 131.627 1.00 0.00 C ATOM 1446 CE2 PHE A 97 -24.729 124.275 131.275 1.00 0.00 C ATOM 1447 CZ PHE A 97 -24.582 122.975 130.777 1.00 0.00 C ATOM 0 H PHE A 97 -21.753 122.142 135.019 1.00 0.00 H new ATOM 0 HA PHE A 97 -22.031 125.033 134.436 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -23.973 122.927 135.535 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -24.385 124.611 135.282 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -23.576 121.416 133.630 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -24.572 125.547 133.006 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -24.051 120.940 131.243 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -25.051 125.071 130.620 1.00 0.00 H new ATOM 0 HZ PHE A 97 -24.790 122.768 129.738 1.00 0.00 H new ATOM 1457 N PHE A 98 -21.766 125.887 136.721 1.00 0.00 N ATOM 1458 CA PHE A 98 -21.507 126.453 138.055 1.00 0.00 C ATOM 1459 C PHE A 98 -22.509 127.565 138.346 1.00 0.00 C ATOM 1460 O PHE A 98 -22.905 128.304 137.444 1.00 0.00 O ATOM 1461 CB PHE A 98 -20.091 127.028 138.112 1.00 0.00 C ATOM 1462 CG PHE A 98 -19.776 127.441 139.530 1.00 0.00 C ATOM 1463 CD1 PHE A 98 -19.190 126.525 140.412 1.00 0.00 C ATOM 1464 CD2 PHE A 98 -20.076 128.737 139.964 1.00 0.00 C ATOM 1465 CE1 PHE A 98 -18.902 126.907 141.727 1.00 0.00 C ATOM 1466 CE2 PHE A 98 -19.788 129.119 141.280 1.00 0.00 C ATOM 1467 CZ PHE A 98 -19.200 128.204 142.162 1.00 0.00 C ATOM 0 H PHE A 98 -21.741 126.575 135.969 1.00 0.00 H new ATOM 0 HA PHE A 98 -21.609 125.663 138.799 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -19.371 126.285 137.769 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -20.007 127.885 137.444 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -18.960 125.524 140.078 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -20.530 129.443 139.284 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -18.449 126.201 142.407 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -20.019 130.119 141.615 1.00 0.00 H new ATOM 0 HZ PHE A 98 -18.977 128.498 143.177 1.00 0.00 H new ATOM 1477 N TYR A 99 -22.917 127.687 139.613 1.00 0.00 N ATOM 1478 CA TYR A 99 -23.878 128.723 140.034 1.00 0.00 C ATOM 1479 C TYR A 99 -23.176 129.783 140.875 1.00 0.00 C ATOM 1480 O TYR A 99 -22.417 129.464 141.791 1.00 0.00 O ATOM 1481 CB TYR A 99 -25.003 128.077 140.850 1.00 0.00 C ATOM 1482 CG TYR A 99 -25.916 127.297 139.923 1.00 0.00 C ATOM 1483 CD1 TYR A 99 -25.441 126.145 139.284 1.00 0.00 C ATOM 1484 CD2 TYR A 99 -27.233 127.726 139.700 1.00 0.00 C ATOM 1485 CE1 TYR A 99 -26.279 125.424 138.424 1.00 0.00 C ATOM 1486 CE2 TYR A 99 -28.070 127.005 138.841 1.00 0.00 C ATOM 1487 CZ TYR A 99 -27.593 125.854 138.202 1.00 0.00 C ATOM 1488 OH TYR A 99 -28.419 125.143 137.356 1.00 0.00 O ATOM 0 H TYR A 99 -22.598 127.082 140.370 1.00 0.00 H new ATOM 0 HA TYR A 99 -24.298 129.199 139.148 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -24.583 127.414 141.607 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -25.571 128.844 141.377 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -24.428 125.812 139.454 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -27.601 128.614 140.192 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -25.911 124.536 137.932 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -29.084 127.336 138.671 1.00 0.00 H new ATOM 0 HH TYR A 99 -29.297 125.577 137.315 1.00 0.00 H new ATOM 1498 N ASP A 100 -23.430 131.048 140.548 1.00 0.00 N ATOM 1499 CA ASP A 100 -22.815 132.163 141.265 1.00 0.00 C ATOM 1500 C ASP A 100 -23.585 132.480 142.544 1.00 0.00 C ATOM 1501 O ASP A 100 -24.794 132.707 142.511 1.00 0.00 O ATOM 1502 CB ASP A 100 -22.787 133.402 140.369 1.00 0.00 C ATOM 1503 CG ASP A 100 -22.025 134.529 141.059 1.00 0.00 C ATOM 1504 OD1 ASP A 100 -21.473 134.281 142.118 1.00 0.00 O ATOM 1505 OD2 ASP A 100 -22.006 135.622 140.518 1.00 0.00 O1- ATOM 0 H ASP A 100 -24.056 131.327 139.793 1.00 0.00 H new ATOM 0 HA ASP A 100 -21.798 131.877 141.532 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -22.314 133.162 139.417 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -23.805 133.723 140.147 1.00 0.00 H new