USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 920 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 20 SER OG : rot 180:sc= 0.0271 USER MOD Set 1.2: A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 172:sc= 0.601 (180deg=0.566) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -0.333 X(o=-0.33,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 161:sc= 2.39 (180deg=2.19) USER MOD Single : A 28 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0411) USER MOD Single : A 29 LYS NZ :NH3+ 160:sc= 1 (180deg=0.483) USER MOD Single : A 36 SER OG : rot 180:sc= -0.0634 USER MOD Single : A 42 ASN : amide:sc=-0.00235 K(o=-0.0023,f=-0.62) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 MET CE :methyl 161:sc= -0.0646 (180deg=-0.12) USER MOD Single : A 50 CYS SG : rot 170:sc= -0.924 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -152:sc= 1.27! (180deg=0.68!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= -0.394 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 161:sc= 0.278 USER MOD Single : A 65 GLN : amide:sc= -0.17 X(o=-0.17,f=0) USER MOD Single : A 70 LYS NZ :NH3+ 174:sc= 1.2 (180deg=1.17) USER MOD Single : A 77 SER OG : rot 150:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 ASN : amide:sc= -0.467 K(o=-0.47,f=-2!) USER MOD Single : B 70 LYS NZ :NH3+ 165:sc= -0.0583 (180deg=-0.32) USER MOD Single : B 75 THR OG1 : rot -62:sc= 0.837 USER MOD ----------------------------------------------------------------- ATOM 18 N ALA A 2 9.282 12.344 -4.141 1.00 0.00 N ATOM 19 CA ALA A 2 8.552 12.265 -5.415 1.00 0.00 C ATOM 20 C ALA A 2 8.710 10.898 -6.019 1.00 0.00 C ATOM 21 O ALA A 2 9.683 10.609 -6.717 1.00 0.00 O ATOM 22 CB ALA A 2 8.955 13.357 -6.385 1.00 0.00 C ATOM 0 HA ALA A 2 7.496 12.430 -5.201 1.00 0.00 H new ATOM 0 HB1 ALA A 2 8.386 13.252 -7.309 1.00 0.00 H new ATOM 0 HB2 ALA A 2 8.750 14.331 -5.942 1.00 0.00 H new ATOM 0 HB3 ALA A 2 10.020 13.275 -6.604 1.00 0.00 H new ATOM 28 N TYR A 3 7.775 10.050 -5.720 1.00 0.00 N ATOM 29 CA TYR A 3 7.863 8.675 -6.106 1.00 0.00 C ATOM 30 C TYR A 3 6.857 8.339 -7.153 1.00 0.00 C ATOM 31 O TYR A 3 5.782 8.943 -7.221 1.00 0.00 O ATOM 32 CB TYR A 3 7.695 7.757 -4.887 1.00 0.00 C ATOM 33 CG TYR A 3 8.796 7.899 -3.864 1.00 0.00 C ATOM 34 CD1 TYR A 3 8.834 8.991 -3.020 1.00 0.00 C ATOM 35 CD2 TYR A 3 9.804 6.957 -3.760 1.00 0.00 C ATOM 36 CE1 TYR A 3 9.832 9.151 -2.106 1.00 0.00 C ATOM 37 CE2 TYR A 3 10.818 7.105 -2.841 1.00 0.00 C ATOM 38 CZ TYR A 3 10.829 8.205 -2.018 1.00 0.00 C ATOM 39 OH TYR A 3 11.832 8.356 -1.093 1.00 0.00 O ATOM 0 H TYR A 3 6.930 10.291 -5.202 1.00 0.00 H new ATOM 0 HA TYR A 3 8.854 8.514 -6.529 1.00 0.00 H new ATOM 0 HB2 TYR A 3 6.739 7.972 -4.411 1.00 0.00 H new ATOM 0 HB3 TYR A 3 7.657 6.722 -5.226 1.00 0.00 H new ATOM 0 HD1 TYR A 3 8.055 9.736 -3.086 1.00 0.00 H new ATOM 0 HD2 TYR A 3 9.795 6.094 -4.409 1.00 0.00 H new ATOM 0 HE1 TYR A 3 9.841 10.013 -1.456 1.00 0.00 H new ATOM 0 HE2 TYR A 3 11.599 6.362 -2.767 1.00 0.00 H new ATOM 0 HH TYR A 3 12.455 7.602 -1.160 1.00 0.00 H new ATOM 49 N PHE A 4 7.215 7.407 -7.979 1.00 0.00 N ATOM 50 CA PHE A 4 6.321 6.906 -8.993 1.00 0.00 C ATOM 51 C PHE A 4 5.471 5.824 -8.344 1.00 0.00 C ATOM 52 O PHE A 4 5.705 5.473 -7.185 1.00 0.00 O ATOM 53 CB PHE A 4 7.108 6.360 -10.191 1.00 0.00 C ATOM 54 CG PHE A 4 8.155 7.315 -10.685 1.00 0.00 C ATOM 55 CD1 PHE A 4 7.802 8.514 -11.276 1.00 0.00 C ATOM 56 CD2 PHE A 4 9.499 7.015 -10.532 1.00 0.00 C ATOM 57 CE1 PHE A 4 8.771 9.398 -11.701 1.00 0.00 C ATOM 58 CE2 PHE A 4 10.471 7.889 -10.956 1.00 0.00 C ATOM 59 CZ PHE A 4 10.106 9.084 -11.540 1.00 0.00 C ATOM 0 H PHE A 4 8.135 6.967 -7.975 1.00 0.00 H new ATOM 0 HA PHE A 4 5.685 7.703 -9.379 1.00 0.00 H new ATOM 0 HB2 PHE A 4 7.584 5.421 -9.909 1.00 0.00 H new ATOM 0 HB3 PHE A 4 6.416 6.136 -11.003 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.758 8.760 -11.406 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.787 6.081 -10.073 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.487 10.334 -12.159 1.00 0.00 H new ATOM 0 HE2 PHE A 4 11.515 7.642 -10.833 1.00 0.00 H new ATOM 0 HZ PHE A 4 10.866 9.776 -11.872 1.00 0.00 H new ATOM 69 N LEU A 5 4.517 5.287 -9.039 1.00 0.00 N ATOM 70 CA LEU A 5 3.620 4.364 -8.414 1.00 0.00 C ATOM 71 C LEU A 5 3.614 3.018 -9.125 1.00 0.00 C ATOM 72 O LEU A 5 3.599 2.950 -10.352 1.00 0.00 O ATOM 73 CB LEU A 5 2.227 5.001 -8.382 1.00 0.00 C ATOM 74 CG LEU A 5 1.086 4.199 -7.787 1.00 0.00 C ATOM 75 CD1 LEU A 5 1.341 3.885 -6.316 1.00 0.00 C ATOM 76 CD2 LEU A 5 -0.202 4.968 -7.948 1.00 0.00 C ATOM 0 H LEU A 5 4.340 5.468 -10.027 1.00 0.00 H new ATOM 0 HA LEU A 5 3.950 4.160 -7.395 1.00 0.00 H new ATOM 0 HB2 LEU A 5 2.301 5.936 -7.827 1.00 0.00 H new ATOM 0 HB3 LEU A 5 1.955 5.258 -9.406 1.00 0.00 H new ATOM 0 HG LEU A 5 1.011 3.250 -8.317 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.506 3.309 -5.917 1.00 0.00 H new ATOM 0 HD12 LEU A 5 2.259 3.306 -6.222 1.00 0.00 H new ATOM 0 HD13 LEU A 5 1.440 4.816 -5.757 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.024 4.394 -7.521 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.121 5.925 -7.432 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.392 5.142 -9.007 1.00 0.00 H new ATOM 88 N ASP A 6 3.659 1.970 -8.353 1.00 0.00 N ATOM 89 CA ASP A 6 3.571 0.607 -8.867 1.00 0.00 C ATOM 90 C ASP A 6 2.520 -0.134 -8.112 1.00 0.00 C ATOM 91 O ASP A 6 2.297 0.123 -6.928 1.00 0.00 O ATOM 92 CB ASP A 6 4.898 -0.199 -8.784 1.00 0.00 C ATOM 93 CG ASP A 6 5.881 0.041 -9.917 1.00 0.00 C ATOM 94 OD1 ASP A 6 5.475 0.061 -11.095 1.00 0.00 O ATOM 95 OD2 ASP A 6 7.086 0.137 -9.665 1.00 0.00 O ATOM 0 H ASP A 6 3.758 2.024 -7.339 1.00 0.00 H new ATOM 0 HA ASP A 6 3.328 0.701 -9.925 1.00 0.00 H new ATOM 0 HB2 ASP A 6 5.391 0.042 -7.842 1.00 0.00 H new ATOM 0 HB3 ASP A 6 4.656 -1.261 -8.755 1.00 0.00 H new ATOM 100 N PHE A 7 1.861 -1.022 -8.776 1.00 0.00 N ATOM 101 CA PHE A 7 0.853 -1.844 -8.157 1.00 0.00 C ATOM 102 C PHE A 7 1.017 -3.285 -8.530 1.00 0.00 C ATOM 103 O PHE A 7 1.246 -3.605 -9.691 1.00 0.00 O ATOM 104 CB PHE A 7 -0.562 -1.389 -8.532 1.00 0.00 C ATOM 105 CG PHE A 7 -1.233 -0.494 -7.530 1.00 0.00 C ATOM 106 CD1 PHE A 7 -1.074 0.875 -7.564 1.00 0.00 C ATOM 107 CD2 PHE A 7 -2.047 -1.041 -6.557 1.00 0.00 C ATOM 108 CE1 PHE A 7 -1.714 1.680 -6.640 1.00 0.00 C ATOM 109 CE2 PHE A 7 -2.688 -0.244 -5.637 1.00 0.00 C ATOM 110 CZ PHE A 7 -2.523 1.119 -5.678 1.00 0.00 C ATOM 0 H PHE A 7 2.000 -1.206 -9.769 1.00 0.00 H new ATOM 0 HA PHE A 7 0.986 -1.734 -7.081 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -0.517 -0.868 -9.488 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -1.183 -2.272 -8.679 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -0.444 1.322 -8.319 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -2.182 -2.112 -6.518 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -1.579 2.751 -6.673 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -3.320 -0.690 -4.883 1.00 0.00 H new ATOM 0 HZ PHE A 7 -3.026 1.748 -4.958 1.00 0.00 H new ATOM 120 N ASP A 8 0.961 -4.128 -7.534 1.00 0.00 N ATOM 121 CA ASP A 8 0.885 -5.570 -7.703 1.00 0.00 C ATOM 122 C ASP A 8 -0.374 -5.909 -8.498 1.00 0.00 C ATOM 123 O ASP A 8 -1.428 -5.275 -8.304 1.00 0.00 O ATOM 124 CB ASP A 8 0.874 -6.245 -6.307 1.00 0.00 C ATOM 125 CG ASP A 8 0.218 -7.616 -6.266 1.00 0.00 C ATOM 126 OD1 ASP A 8 0.801 -8.596 -6.735 1.00 0.00 O ATOM 127 OD2 ASP A 8 -0.908 -7.709 -5.739 1.00 0.00 O ATOM 0 H ASP A 8 0.967 -3.833 -6.557 1.00 0.00 H new ATOM 0 HA ASP A 8 1.750 -5.941 -8.253 1.00 0.00 H new ATOM 0 HB2 ASP A 8 1.902 -6.339 -5.957 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.357 -5.589 -5.606 1.00 0.00 H new ATOM 132 N GLU A 9 -0.249 -6.850 -9.411 1.00 0.00 N ATOM 133 CA GLU A 9 -1.322 -7.274 -10.290 1.00 0.00 C ATOM 134 C GLU A 9 -2.590 -7.660 -9.495 1.00 0.00 C ATOM 135 O GLU A 9 -3.711 -7.390 -9.929 1.00 0.00 O ATOM 136 CB GLU A 9 -0.817 -8.447 -11.109 1.00 0.00 C ATOM 137 CG GLU A 9 -1.250 -8.470 -12.561 1.00 0.00 C ATOM 138 CD GLU A 9 -2.682 -8.867 -12.757 1.00 0.00 C ATOM 139 OE1 GLU A 9 -3.067 -9.966 -12.306 1.00 0.00 O ATOM 140 OE2 GLU A 9 -3.449 -8.114 -13.385 1.00 0.00 O ATOM 0 H GLU A 9 0.624 -7.355 -9.567 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.606 -6.450 -10.945 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.272 -8.449 -11.074 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.153 -9.369 -10.634 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.094 -7.482 -12.993 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.612 -9.162 -13.110 1.00 0.00 H new ATOM 147 N ARG A 10 -2.415 -8.243 -8.321 1.00 0.00 N ATOM 148 CA ARG A 10 -3.557 -8.611 -7.500 1.00 0.00 C ATOM 149 C ARG A 10 -4.127 -7.363 -6.825 1.00 0.00 C ATOM 150 O ARG A 10 -5.339 -7.182 -6.759 1.00 0.00 O ATOM 151 CB ARG A 10 -3.185 -9.664 -6.450 1.00 0.00 C ATOM 152 CG ARG A 10 -2.668 -11.001 -6.986 1.00 0.00 C ATOM 153 CD ARG A 10 -3.716 -11.762 -7.795 1.00 0.00 C ATOM 154 NE ARG A 10 -3.964 -11.185 -9.129 1.00 0.00 N ATOM 155 CZ ARG A 10 -5.134 -11.228 -9.776 1.00 0.00 C ATOM 156 NH1 ARG A 10 -6.256 -11.543 -9.133 1.00 0.00 N ATOM 157 NH2 ARG A 10 -5.191 -10.886 -11.050 1.00 0.00 N ATOM 0 H ARG A 10 -1.506 -8.470 -7.918 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.314 -9.052 -8.149 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -2.424 -9.240 -5.795 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -4.063 -9.859 -5.834 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -1.793 -10.822 -7.611 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -2.342 -11.620 -6.150 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -3.393 -12.797 -7.910 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -4.652 -11.780 -7.236 1.00 0.00 H new ATOM 0 HE ARG A 10 -3.185 -10.718 -9.593 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -6.230 -11.755 -8.136 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -7.142 -11.572 -9.638 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -4.345 -10.590 -11.537 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -6.081 -10.917 -11.547 1.00 0.00 H new ATOM 171 N ALA A 11 -3.233 -6.490 -6.357 1.00 0.00 N ATOM 172 CA ALA A 11 -3.585 -5.213 -5.711 1.00 0.00 C ATOM 173 C ALA A 11 -4.448 -4.335 -6.619 1.00 0.00 C ATOM 174 O ALA A 11 -5.263 -3.544 -6.139 1.00 0.00 O ATOM 175 CB ALA A 11 -2.335 -4.468 -5.261 1.00 0.00 C ATOM 0 H ALA A 11 -2.227 -6.648 -6.415 1.00 0.00 H new ATOM 0 HA ALA A 11 -4.179 -5.449 -4.828 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -2.622 -3.529 -4.787 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -1.783 -5.080 -4.548 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.704 -4.261 -6.125 1.00 0.00 H new ATOM 181 N LEU A 12 -4.264 -4.487 -7.921 1.00 0.00 N ATOM 182 CA LEU A 12 -5.091 -3.812 -8.917 1.00 0.00 C ATOM 183 C LEU A 12 -6.568 -4.180 -8.702 1.00 0.00 C ATOM 184 O LEU A 12 -7.457 -3.319 -8.601 1.00 0.00 O ATOM 185 CB LEU A 12 -4.679 -4.256 -10.334 1.00 0.00 C ATOM 186 CG LEU A 12 -3.242 -3.981 -10.790 1.00 0.00 C ATOM 187 CD1 LEU A 12 -3.012 -4.591 -12.160 1.00 0.00 C ATOM 188 CD2 LEU A 12 -2.959 -2.497 -10.846 1.00 0.00 C ATOM 0 H LEU A 12 -3.538 -5.081 -8.320 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.953 -2.736 -8.811 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.853 -5.329 -10.410 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -5.351 -3.773 -11.043 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.566 -4.433 -10.064 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.989 -4.393 -12.480 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.174 -5.668 -12.111 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.707 -4.152 -12.875 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -1.932 -2.335 -11.173 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -3.643 -2.022 -11.550 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.098 -2.063 -9.856 1.00 0.00 H new ATOM 200 N LYS A 13 -6.796 -5.462 -8.540 1.00 0.00 N ATOM 201 CA LYS A 13 -8.139 -6.014 -8.441 1.00 0.00 C ATOM 202 C LYS A 13 -8.710 -5.680 -7.072 1.00 0.00 C ATOM 203 O LYS A 13 -9.917 -5.522 -6.904 1.00 0.00 O ATOM 204 CB LYS A 13 -8.095 -7.540 -8.625 1.00 0.00 C ATOM 205 CG LYS A 13 -7.084 -8.028 -9.669 1.00 0.00 C ATOM 206 CD LYS A 13 -7.304 -7.450 -11.062 1.00 0.00 C ATOM 207 CE LYS A 13 -6.086 -7.756 -11.905 1.00 0.00 C ATOM 208 NZ LYS A 13 -6.187 -7.318 -13.307 1.00 0.00 N ATOM 0 H LYS A 13 -6.056 -6.160 -8.472 1.00 0.00 H new ATOM 0 HA LYS A 13 -8.768 -5.584 -9.220 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -7.859 -8.002 -7.666 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -9.088 -7.887 -8.910 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -6.079 -7.771 -9.335 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -7.132 -9.115 -9.726 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -8.197 -7.882 -11.515 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -7.465 -6.373 -11.005 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -5.217 -7.280 -11.451 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -5.907 -8.831 -11.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -5.267 -7.442 -13.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -6.906 -7.888 -13.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -6.460 -6.315 -13.339 1.00 0.00 H new ATOM 222 N GLU A 14 -7.810 -5.534 -6.119 1.00 0.00 N ATOM 223 CA GLU A 14 -8.138 -5.224 -4.745 1.00 0.00 C ATOM 224 C GLU A 14 -8.888 -3.902 -4.610 1.00 0.00 C ATOM 225 O GLU A 14 -9.882 -3.833 -3.892 1.00 0.00 O ATOM 226 CB GLU A 14 -6.878 -5.179 -3.904 1.00 0.00 C ATOM 227 CG GLU A 14 -6.152 -6.511 -3.742 1.00 0.00 C ATOM 228 CD GLU A 14 -6.859 -7.499 -2.851 1.00 0.00 C ATOM 229 OE1 GLU A 14 -7.956 -7.976 -3.191 1.00 0.00 O ATOM 230 OE2 GLU A 14 -6.278 -7.872 -1.812 1.00 0.00 O ATOM 0 H GLU A 14 -6.808 -5.630 -6.285 1.00 0.00 H new ATOM 0 HA GLU A 14 -8.796 -6.016 -4.389 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.189 -4.461 -4.350 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -7.135 -4.802 -2.914 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -6.017 -6.959 -4.726 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -5.157 -6.322 -3.338 1.00 0.00 H new ATOM 237 N TRP A 15 -8.457 -2.850 -5.321 1.00 0.00 N ATOM 238 CA TRP A 15 -9.147 -1.574 -5.158 1.00 0.00 C ATOM 239 C TRP A 15 -10.465 -1.631 -5.884 1.00 0.00 C ATOM 240 O TRP A 15 -11.437 -0.968 -5.524 1.00 0.00 O ATOM 241 CB TRP A 15 -8.313 -0.319 -5.606 1.00 0.00 C ATOM 242 CG TRP A 15 -8.196 -0.041 -7.108 1.00 0.00 C ATOM 243 CD1 TRP A 15 -9.201 0.349 -7.965 1.00 0.00 C ATOM 244 CD2 TRP A 15 -7.005 -0.042 -7.896 1.00 0.00 C ATOM 245 NE1 TRP A 15 -8.716 0.533 -9.223 1.00 0.00 N ATOM 246 CE2 TRP A 15 -7.372 0.310 -9.215 1.00 0.00 C ATOM 247 CE3 TRP A 15 -5.670 -0.322 -7.627 1.00 0.00 C ATOM 248 CZ2 TRP A 15 -6.453 0.390 -10.247 1.00 0.00 C ATOM 249 CZ3 TRP A 15 -4.759 -0.235 -8.656 1.00 0.00 C ATOM 250 CH2 TRP A 15 -5.153 0.118 -9.950 1.00 0.00 C ATOM 0 H TRP A 15 -7.677 -2.856 -5.978 1.00 0.00 H new ATOM 0 HA TRP A 15 -9.303 -1.436 -4.088 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -8.752 0.561 -5.135 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -7.305 -0.426 -5.205 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -10.233 0.490 -7.678 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.269 0.795 -10.039 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.354 -0.602 -6.633 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.756 0.658 -11.249 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.718 -0.444 -8.459 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.409 0.176 -10.731 1.00 0.00 H new ATOM 261 N ARG A 16 -10.495 -2.452 -6.897 1.00 0.00 N ATOM 262 CA ARG A 16 -11.656 -2.581 -7.740 1.00 0.00 C ATOM 263 C ARG A 16 -12.808 -3.292 -7.025 1.00 0.00 C ATOM 264 O ARG A 16 -13.978 -3.057 -7.341 1.00 0.00 O ATOM 265 CB ARG A 16 -11.276 -3.293 -9.035 1.00 0.00 C ATOM 266 CG ARG A 16 -10.192 -2.554 -9.788 1.00 0.00 C ATOM 267 CD ARG A 16 -9.761 -3.259 -11.063 1.00 0.00 C ATOM 268 NE ARG A 16 -10.874 -3.556 -11.980 1.00 0.00 N ATOM 269 CZ ARG A 16 -10.774 -4.318 -13.088 1.00 0.00 C ATOM 270 NH1 ARG A 16 -9.592 -4.762 -13.497 1.00 0.00 N ATOM 271 NH2 ARG A 16 -11.850 -4.600 -13.802 1.00 0.00 N ATOM 0 H ARG A 16 -9.715 -3.053 -7.164 1.00 0.00 H new ATOM 0 HA ARG A 16 -12.016 -1.581 -7.982 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -10.936 -4.303 -8.807 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -12.158 -3.389 -9.669 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -10.548 -1.554 -10.036 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -9.326 -2.432 -9.138 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -9.030 -2.638 -11.582 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -9.259 -4.191 -10.801 1.00 0.00 H new ATOM 0 HE ARG A 16 -11.787 -3.156 -11.761 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -8.750 -4.527 -12.972 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -9.526 -5.338 -14.336 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -12.761 -4.241 -13.516 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -11.770 -5.177 -14.639 1.00 0.00 H new ATOM 285 N LYS A 17 -12.486 -4.127 -6.046 1.00 0.00 N ATOM 286 CA LYS A 17 -13.512 -4.861 -5.323 1.00 0.00 C ATOM 287 C LYS A 17 -14.047 -4.095 -4.110 1.00 0.00 C ATOM 288 O LYS A 17 -15.007 -4.532 -3.472 1.00 0.00 O ATOM 289 CB LYS A 17 -13.024 -6.292 -4.955 1.00 0.00 C ATOM 290 CG LYS A 17 -11.751 -6.387 -4.083 1.00 0.00 C ATOM 291 CD LYS A 17 -11.979 -6.060 -2.595 1.00 0.00 C ATOM 292 CE LYS A 17 -12.896 -7.078 -1.925 1.00 0.00 C ATOM 293 NZ LYS A 17 -13.098 -6.804 -0.483 1.00 0.00 N ATOM 0 H LYS A 17 -11.531 -4.311 -5.737 1.00 0.00 H new ATOM 0 HA LYS A 17 -14.362 -4.969 -5.997 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -13.833 -6.804 -4.434 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -12.844 -6.839 -5.880 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -11.343 -7.395 -4.164 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -10.999 -5.706 -4.482 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -11.020 -6.038 -2.077 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -12.413 -5.064 -2.504 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -13.862 -7.078 -2.429 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -12.474 -8.076 -2.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -13.728 -7.525 -0.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -12.181 -6.831 0.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -13.526 -5.864 -0.365 1.00 0.00 H new ATOM 307 N LEU A 18 -13.433 -2.971 -3.790 1.00 0.00 N ATOM 308 CA LEU A 18 -13.853 -2.179 -2.640 1.00 0.00 C ATOM 309 C LEU A 18 -14.558 -0.887 -3.065 1.00 0.00 C ATOM 310 O LEU A 18 -14.712 -0.637 -4.258 1.00 0.00 O ATOM 311 CB LEU A 18 -12.681 -1.961 -1.648 1.00 0.00 C ATOM 312 CG LEU A 18 -11.358 -1.395 -2.200 1.00 0.00 C ATOM 313 CD1 LEU A 18 -11.437 0.088 -2.509 1.00 0.00 C ATOM 314 CD2 LEU A 18 -10.213 -1.686 -1.258 1.00 0.00 C ATOM 0 H LEU A 18 -12.643 -2.583 -4.306 1.00 0.00 H new ATOM 0 HA LEU A 18 -14.604 -2.747 -2.091 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -13.029 -1.290 -0.863 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -12.462 -2.918 -1.175 1.00 0.00 H new ATOM 0 HG LEU A 18 -11.172 -1.903 -3.146 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.477 0.431 -2.894 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -12.211 0.263 -3.256 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -11.680 0.637 -1.599 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.290 -1.277 -1.669 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -10.413 -1.228 -0.290 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -10.108 -2.764 -1.135 1.00 0.00 H new ATOM 326 N GLY A 19 -14.986 -0.090 -2.095 1.00 0.00 N ATOM 327 CA GLY A 19 -15.754 1.121 -2.369 1.00 0.00 C ATOM 328 C GLY A 19 -15.005 2.194 -3.158 1.00 0.00 C ATOM 329 O GLY A 19 -13.772 2.169 -3.270 1.00 0.00 O ATOM 0 H GLY A 19 -14.814 -0.261 -1.104 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -16.653 0.846 -2.921 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -16.080 1.549 -1.421 1.00 0.00 H new ATOM 333 N SER A 20 -15.748 3.140 -3.686 1.00 0.00 N ATOM 334 CA SER A 20 -15.206 4.214 -4.491 1.00 0.00 C ATOM 335 C SER A 20 -14.443 5.219 -3.619 1.00 0.00 C ATOM 336 O SER A 20 -13.249 5.451 -3.816 1.00 0.00 O ATOM 337 CB SER A 20 -16.347 4.882 -5.263 1.00 0.00 C ATOM 338 OG SER A 20 -17.431 5.190 -4.387 1.00 0.00 O ATOM 0 H SER A 20 -16.760 3.187 -3.567 1.00 0.00 H new ATOM 0 HA SER A 20 -14.489 3.811 -5.206 1.00 0.00 H new ATOM 0 HB2 SER A 20 -15.987 5.794 -5.739 1.00 0.00 H new ATOM 0 HB3 SER A 20 -16.691 4.221 -6.059 1.00 0.00 H new ATOM 0 HG SER A 20 -18.151 5.618 -4.896 1.00 0.00 H new ATOM 344 N THR A 21 -15.118 5.756 -2.612 1.00 0.00 N ATOM 345 CA THR A 21 -14.530 6.712 -1.693 1.00 0.00 C ATOM 346 C THR A 21 -13.376 6.051 -0.935 1.00 0.00 C ATOM 347 O THR A 21 -12.400 6.698 -0.570 1.00 0.00 O ATOM 348 CB THR A 21 -15.594 7.210 -0.698 1.00 0.00 C ATOM 349 OG1 THR A 21 -16.726 7.669 -1.433 1.00 0.00 O ATOM 350 CG2 THR A 21 -15.063 8.348 0.168 1.00 0.00 C ATOM 0 H THR A 21 -16.094 5.537 -2.411 1.00 0.00 H new ATOM 0 HA THR A 21 -14.150 7.564 -2.257 1.00 0.00 H new ATOM 0 HB THR A 21 -15.866 6.385 -0.040 1.00 0.00 H new ATOM 0 HG1 THR A 21 -17.413 7.988 -0.811 1.00 0.00 H new ATOM 0 HG21 THR A 21 -15.841 8.674 0.858 1.00 0.00 H new ATOM 0 HG22 THR A 21 -14.198 8.002 0.734 1.00 0.00 H new ATOM 0 HG23 THR A 21 -14.769 9.183 -0.468 1.00 0.00 H new ATOM 358 N VAL A 22 -13.486 4.752 -0.736 1.00 0.00 N ATOM 359 CA VAL A 22 -12.446 3.996 -0.079 1.00 0.00 C ATOM 360 C VAL A 22 -11.140 4.045 -0.894 1.00 0.00 C ATOM 361 O VAL A 22 -10.077 4.322 -0.343 1.00 0.00 O ATOM 362 CB VAL A 22 -12.873 2.524 0.189 1.00 0.00 C ATOM 363 CG1 VAL A 22 -11.740 1.735 0.818 1.00 0.00 C ATOM 364 CG2 VAL A 22 -14.092 2.484 1.099 1.00 0.00 C ATOM 0 H VAL A 22 -14.293 4.198 -1.024 1.00 0.00 H new ATOM 0 HA VAL A 22 -12.271 4.462 0.890 1.00 0.00 H new ATOM 0 HB VAL A 22 -13.124 2.068 -0.769 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -12.065 0.710 0.995 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -10.881 1.733 0.146 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -11.458 2.195 1.765 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.379 1.448 1.277 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -13.853 2.963 2.049 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -14.918 3.013 0.624 1.00 0.00 H new ATOM 374 N ARG A 23 -11.238 3.858 -2.214 1.00 0.00 N ATOM 375 CA ARG A 23 -10.035 3.856 -3.042 1.00 0.00 C ATOM 376 C ARG A 23 -9.482 5.282 -3.173 1.00 0.00 C ATOM 377 O ARG A 23 -8.277 5.476 -3.263 1.00 0.00 O ATOM 378 CB ARG A 23 -10.262 3.238 -4.447 1.00 0.00 C ATOM 379 CG ARG A 23 -10.978 4.143 -5.430 1.00 0.00 C ATOM 380 CD ARG A 23 -11.044 3.557 -6.817 1.00 0.00 C ATOM 381 NE ARG A 23 -11.364 4.602 -7.783 1.00 0.00 N ATOM 382 CZ ARG A 23 -10.657 4.870 -8.888 1.00 0.00 C ATOM 383 NH1 ARG A 23 -9.707 4.040 -9.304 1.00 0.00 N ATOM 384 NH2 ARG A 23 -10.933 5.941 -9.613 1.00 0.00 N ATOM 0 H ARG A 23 -12.112 3.710 -2.718 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.307 3.221 -2.536 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -9.295 2.961 -4.867 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -10.837 2.319 -4.336 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -11.990 4.334 -5.072 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -10.468 5.105 -5.470 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -10.090 3.094 -7.071 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -11.799 2.772 -6.854 1.00 0.00 H new ATOM 0 HE ARG A 23 -12.190 5.173 -7.603 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -9.509 3.187 -8.780 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -9.175 4.255 -10.147 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -11.687 6.567 -9.331 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -10.392 6.141 -10.454 1.00 0.00 H new ATOM 398 N GLU A 24 -10.378 6.267 -3.170 1.00 0.00 N ATOM 399 CA GLU A 24 -9.998 7.673 -3.281 1.00 0.00 C ATOM 400 C GLU A 24 -9.182 8.115 -2.080 1.00 0.00 C ATOM 401 O GLU A 24 -8.175 8.806 -2.228 1.00 0.00 O ATOM 402 CB GLU A 24 -11.231 8.554 -3.452 1.00 0.00 C ATOM 403 CG GLU A 24 -11.928 8.376 -4.792 1.00 0.00 C ATOM 404 CD GLU A 24 -11.084 8.854 -5.957 1.00 0.00 C ATOM 405 OE1 GLU A 24 -10.907 10.072 -6.123 1.00 0.00 O ATOM 406 OE2 GLU A 24 -10.589 8.031 -6.743 1.00 0.00 O ATOM 0 H GLU A 24 -11.383 6.114 -3.091 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.374 7.783 -4.168 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.938 8.333 -2.652 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.939 9.598 -3.340 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -12.172 7.323 -4.933 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.871 8.923 -4.782 1.00 0.00 H new ATOM 413 N GLN A 25 -9.597 7.676 -0.898 1.00 0.00 N ATOM 414 CA GLN A 25 -8.877 7.979 0.332 1.00 0.00 C ATOM 415 C GLN A 25 -7.475 7.390 0.282 1.00 0.00 C ATOM 416 O GLN A 25 -6.505 8.023 0.696 1.00 0.00 O ATOM 417 CB GLN A 25 -9.622 7.445 1.546 1.00 0.00 C ATOM 418 CG GLN A 25 -10.957 8.106 1.802 1.00 0.00 C ATOM 419 CD GLN A 25 -11.694 7.479 2.960 1.00 0.00 C ATOM 420 OE1 GLN A 25 -11.528 7.877 4.120 1.00 0.00 O ATOM 421 NE2 GLN A 25 -12.523 6.509 2.662 1.00 0.00 N ATOM 0 H GLN A 25 -10.433 7.106 -0.766 1.00 0.00 H new ATOM 0 HA GLN A 25 -8.805 9.063 0.422 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -9.780 6.374 1.418 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -8.993 7.571 2.427 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -10.802 9.166 2.004 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -11.571 8.039 0.904 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -12.631 6.210 1.693 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -13.060 6.053 3.399 1.00 0.00 H new ATOM 430 N LEU A 26 -7.379 6.190 -0.266 1.00 0.00 N ATOM 431 CA LEU A 26 -6.107 5.504 -0.415 1.00 0.00 C ATOM 432 C LEU A 26 -5.191 6.272 -1.360 1.00 0.00 C ATOM 433 O LEU A 26 -4.010 6.413 -1.098 1.00 0.00 O ATOM 434 CB LEU A 26 -6.323 4.075 -0.917 1.00 0.00 C ATOM 435 CG LEU A 26 -7.112 3.147 0.012 1.00 0.00 C ATOM 436 CD1 LEU A 26 -7.340 1.804 -0.644 1.00 0.00 C ATOM 437 CD2 LEU A 26 -6.391 2.971 1.341 1.00 0.00 C ATOM 0 H LEU A 26 -8.179 5.665 -0.619 1.00 0.00 H new ATOM 0 HA LEU A 26 -5.627 5.455 0.562 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.841 4.122 -1.875 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.348 3.626 -1.103 1.00 0.00 H new ATOM 0 HG LEU A 26 -8.081 3.607 0.205 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -7.902 1.160 0.032 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.903 1.941 -1.567 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.379 1.342 -0.871 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -6.970 2.308 1.984 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.406 2.538 1.166 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.280 3.941 1.826 1.00 0.00 H new ATOM 449 N LYS A 27 -5.768 6.808 -2.429 1.00 0.00 N ATOM 450 CA LYS A 27 -5.035 7.602 -3.409 1.00 0.00 C ATOM 451 C LYS A 27 -4.491 8.866 -2.769 1.00 0.00 C ATOM 452 O LYS A 27 -3.361 9.285 -3.040 1.00 0.00 O ATOM 453 CB LYS A 27 -5.948 7.964 -4.584 1.00 0.00 C ATOM 454 CG LYS A 27 -6.280 6.801 -5.511 1.00 0.00 C ATOM 455 CD LYS A 27 -7.441 7.129 -6.451 1.00 0.00 C ATOM 456 CE LYS A 27 -7.236 8.431 -7.224 1.00 0.00 C ATOM 457 NZ LYS A 27 -8.378 8.712 -8.108 1.00 0.00 N ATOM 0 H LYS A 27 -6.760 6.704 -2.642 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.198 7.009 -3.778 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.878 8.375 -4.191 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.472 8.752 -5.167 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -5.399 6.544 -6.099 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -6.533 5.924 -4.915 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -7.571 6.310 -7.158 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.362 7.198 -5.871 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.104 9.256 -6.524 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -6.323 8.366 -7.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -8.376 9.719 -8.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -8.302 8.132 -8.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -9.264 8.483 -7.614 1.00 0.00 H new ATOM 471 N LYS A 28 -5.284 9.455 -1.898 1.00 0.00 N ATOM 472 CA LYS A 28 -4.887 10.668 -1.227 1.00 0.00 C ATOM 473 C LYS A 28 -3.764 10.414 -0.256 1.00 0.00 C ATOM 474 O LYS A 28 -2.841 11.221 -0.141 1.00 0.00 O ATOM 475 CB LYS A 28 -6.063 11.357 -0.538 1.00 0.00 C ATOM 476 CG LYS A 28 -7.203 11.731 -1.481 1.00 0.00 C ATOM 477 CD LYS A 28 -6.716 12.541 -2.684 1.00 0.00 C ATOM 478 CE LYS A 28 -6.137 13.902 -2.296 1.00 0.00 C ATOM 479 NZ LYS A 28 -7.163 14.799 -1.727 1.00 0.00 N ATOM 0 H LYS A 28 -6.209 9.110 -1.640 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.522 11.349 -1.996 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.450 10.700 0.241 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.703 12.259 -0.044 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.695 10.824 -1.831 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -7.949 12.308 -0.935 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -5.957 11.968 -3.217 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -7.546 12.690 -3.375 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -5.336 13.761 -1.570 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -5.693 14.371 -3.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -6.757 15.746 -1.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -7.971 14.860 -2.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -7.484 14.423 -0.812 1.00 0.00 H new ATOM 493 N LYS A 29 -3.811 9.305 0.439 1.00 0.00 N ATOM 494 CA LYS A 29 -2.752 8.992 1.331 1.00 0.00 C ATOM 495 C LYS A 29 -1.513 8.494 0.605 1.00 0.00 C ATOM 496 O LYS A 29 -0.438 8.471 1.157 1.00 0.00 O ATOM 497 CB LYS A 29 -3.228 8.051 2.389 1.00 0.00 C ATOM 498 CG LYS A 29 -4.432 8.627 3.096 1.00 0.00 C ATOM 499 CD LYS A 29 -4.803 7.859 4.304 1.00 0.00 C ATOM 500 CE LYS A 29 -3.742 8.008 5.405 1.00 0.00 C ATOM 501 NZ LYS A 29 -3.455 9.432 5.722 1.00 0.00 N ATOM 0 H LYS A 29 -4.565 8.620 0.398 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.441 9.911 1.827 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.484 7.090 1.943 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.429 7.866 3.107 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.225 9.660 3.376 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.278 8.647 2.408 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.768 8.205 4.676 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.919 6.806 4.047 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -4.083 7.499 6.306 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -2.822 7.516 5.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -3.014 9.496 6.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -2.807 9.823 5.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.342 9.974 5.718 1.00 0.00 H new ATOM 515 N LEU A 30 -1.657 8.118 -0.636 1.00 0.00 N ATOM 516 CA LEU A 30 -0.506 7.754 -1.421 1.00 0.00 C ATOM 517 C LEU A 30 0.231 8.993 -1.874 1.00 0.00 C ATOM 518 O LEU A 30 1.450 9.032 -1.855 1.00 0.00 O ATOM 519 CB LEU A 30 -0.865 6.865 -2.617 1.00 0.00 C ATOM 520 CG LEU A 30 -1.325 5.442 -2.292 1.00 0.00 C ATOM 521 CD1 LEU A 30 -1.696 4.696 -3.563 1.00 0.00 C ATOM 522 CD2 LEU A 30 -0.238 4.689 -1.539 1.00 0.00 C ATOM 0 H LEU A 30 -2.551 8.055 -1.124 1.00 0.00 H new ATOM 0 HA LEU A 30 0.148 7.163 -0.780 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.654 7.358 -3.185 1.00 0.00 H new ATOM 0 HB3 LEU A 30 0.006 6.802 -3.270 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.209 5.506 -1.657 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -2.020 3.686 -3.311 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -2.505 5.221 -4.070 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -0.829 4.645 -4.221 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.583 3.679 -1.316 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.661 4.638 -2.153 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.013 5.209 -0.608 1.00 0.00 H new ATOM 534 N VAL A 31 -0.505 10.038 -2.224 1.00 0.00 N ATOM 535 CA VAL A 31 0.127 11.257 -2.689 1.00 0.00 C ATOM 536 C VAL A 31 0.872 11.970 -1.542 1.00 0.00 C ATOM 537 O VAL A 31 1.848 12.684 -1.775 1.00 0.00 O ATOM 538 CB VAL A 31 -0.865 12.227 -3.432 1.00 0.00 C ATOM 539 CG1 VAL A 31 -1.861 12.888 -2.504 1.00 0.00 C ATOM 540 CG2 VAL A 31 -0.116 13.258 -4.265 1.00 0.00 C ATOM 0 H VAL A 31 -1.524 10.065 -2.195 1.00 0.00 H new ATOM 0 HA VAL A 31 0.862 10.957 -3.436 1.00 0.00 H new ATOM 0 HB VAL A 31 -1.448 11.602 -4.108 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.515 13.543 -3.079 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.459 12.124 -2.008 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.328 13.474 -1.755 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -0.831 13.911 -4.764 1.00 0.00 H new ATOM 0 HG22 VAL A 31 0.527 13.853 -3.616 1.00 0.00 H new ATOM 0 HG23 VAL A 31 0.493 12.749 -5.012 1.00 0.00 H new ATOM 550 N GLU A 32 0.449 11.730 -0.298 1.00 0.00 N ATOM 551 CA GLU A 32 1.119 12.345 0.837 1.00 0.00 C ATOM 552 C GLU A 32 2.443 11.618 1.128 1.00 0.00 C ATOM 553 O GLU A 32 3.437 12.248 1.515 1.00 0.00 O ATOM 554 CB GLU A 32 0.219 12.402 2.101 1.00 0.00 C ATOM 555 CG GLU A 32 -0.102 11.055 2.725 1.00 0.00 C ATOM 556 CD GLU A 32 -0.996 11.141 3.944 1.00 0.00 C ATOM 557 OE1 GLU A 32 -0.493 11.421 5.043 1.00 0.00 O ATOM 558 OE2 GLU A 32 -2.210 10.907 3.836 1.00 0.00 O ATOM 0 H GLU A 32 -0.338 11.126 -0.060 1.00 0.00 H new ATOM 0 HA GLU A 32 1.335 13.379 0.569 1.00 0.00 H new ATOM 0 HB2 GLU A 32 0.710 13.024 2.850 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -0.717 12.896 1.840 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -0.583 10.425 1.977 1.00 0.00 H new ATOM 0 HG3 GLU A 32 0.830 10.563 3.004 1.00 0.00 H new ATOM 565 N VAL A 33 2.484 10.304 0.871 1.00 0.00 N ATOM 566 CA VAL A 33 3.695 9.520 1.154 1.00 0.00 C ATOM 567 C VAL A 33 4.698 9.696 0.071 1.00 0.00 C ATOM 568 O VAL A 33 5.845 9.347 0.215 1.00 0.00 O ATOM 569 CB VAL A 33 3.430 8.013 1.372 1.00 0.00 C ATOM 570 CG1 VAL A 33 2.315 7.860 2.299 1.00 0.00 C ATOM 571 CG2 VAL A 33 3.175 7.244 0.089 1.00 0.00 C ATOM 0 H VAL A 33 1.710 9.770 0.476 1.00 0.00 H new ATOM 0 HA VAL A 33 4.082 9.910 2.095 1.00 0.00 H new ATOM 0 HB VAL A 33 4.338 7.580 1.791 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.119 6.800 2.460 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.565 8.332 3.249 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.427 8.334 1.881 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.998 6.194 0.323 1.00 0.00 H new ATOM 0 HG22 VAL A 33 2.301 7.656 -0.415 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.043 7.328 -0.564 1.00 0.00 H new ATOM 581 N LEU A 34 4.271 10.258 -1.019 1.00 0.00 N ATOM 582 CA LEU A 34 5.213 10.502 -2.103 1.00 0.00 C ATOM 583 C LEU A 34 6.232 11.588 -1.683 1.00 0.00 C ATOM 584 O LEU A 34 7.320 11.704 -2.253 1.00 0.00 O ATOM 585 CB LEU A 34 4.541 10.872 -3.439 1.00 0.00 C ATOM 586 CG LEU A 34 3.489 9.900 -3.983 1.00 0.00 C ATOM 587 CD1 LEU A 34 2.924 10.415 -5.289 1.00 0.00 C ATOM 588 CD2 LEU A 34 4.071 8.519 -4.184 1.00 0.00 C ATOM 0 H LEU A 34 3.310 10.553 -1.193 1.00 0.00 H new ATOM 0 HA LEU A 34 5.729 9.559 -2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 34 4.071 11.849 -3.322 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.322 10.982 -4.192 1.00 0.00 H new ATOM 0 HG LEU A 34 2.688 9.830 -3.247 1.00 0.00 H new ATOM 0 HD11 LEU A 34 2.178 9.714 -5.664 1.00 0.00 H new ATOM 0 HD12 LEU A 34 2.459 11.387 -5.126 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.727 10.515 -6.019 1.00 0.00 H new ATOM 0 HD21 LEU A 34 3.300 7.852 -4.571 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.895 8.572 -4.895 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.437 8.136 -3.231 1.00 0.00 H new ATOM 600 N GLU A 35 5.856 12.376 -0.693 1.00 0.00 N ATOM 601 CA GLU A 35 6.721 13.368 -0.133 1.00 0.00 C ATOM 602 C GLU A 35 7.501 12.773 1.038 1.00 0.00 C ATOM 603 O GLU A 35 8.652 13.130 1.277 1.00 0.00 O ATOM 604 CB GLU A 35 5.900 14.548 0.343 1.00 0.00 C ATOM 605 CG GLU A 35 5.126 15.253 -0.751 1.00 0.00 C ATOM 606 CD GLU A 35 4.197 16.294 -0.201 1.00 0.00 C ATOM 607 OE1 GLU A 35 3.090 15.932 0.236 1.00 0.00 O ATOM 608 OE2 GLU A 35 4.540 17.484 -0.174 1.00 0.00 O ATOM 0 H GLU A 35 4.933 12.336 -0.260 1.00 0.00 H new ATOM 0 HA GLU A 35 7.424 13.704 -0.895 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.199 14.204 1.104 1.00 0.00 H new ATOM 0 HB3 GLU A 35 6.564 15.267 0.823 1.00 0.00 H new ATOM 0 HG2 GLU A 35 5.824 15.721 -1.445 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.553 14.520 -1.320 1.00 0.00 H new ATOM 615 N SER A 36 6.869 11.875 1.771 1.00 0.00 N ATOM 616 CA SER A 36 7.473 11.233 2.938 1.00 0.00 C ATOM 617 C SER A 36 6.852 9.831 3.156 1.00 0.00 C ATOM 618 O SER A 36 5.771 9.706 3.719 1.00 0.00 O ATOM 619 CB SER A 36 7.286 12.123 4.180 1.00 0.00 C ATOM 620 OG SER A 36 7.890 13.401 3.968 1.00 0.00 O ATOM 0 H SER A 36 5.917 11.565 1.578 1.00 0.00 H new ATOM 0 HA SER A 36 8.542 11.105 2.767 1.00 0.00 H new ATOM 0 HB2 SER A 36 6.224 12.245 4.392 1.00 0.00 H new ATOM 0 HB3 SER A 36 7.731 11.642 5.051 1.00 0.00 H new ATOM 0 HG SER A 36 7.763 13.959 4.764 1.00 0.00 H new ATOM 626 N PRO A 37 7.492 8.775 2.617 1.00 0.00 N ATOM 627 CA PRO A 37 6.972 7.407 2.690 1.00 0.00 C ATOM 628 C PRO A 37 7.555 6.537 3.803 1.00 0.00 C ATOM 629 O PRO A 37 7.116 5.408 3.994 1.00 0.00 O ATOM 630 CB PRO A 37 7.395 6.852 1.343 1.00 0.00 C ATOM 631 CG PRO A 37 8.727 7.504 1.079 1.00 0.00 C ATOM 632 CD PRO A 37 8.712 8.840 1.791 1.00 0.00 C ATOM 0 HA PRO A 37 5.904 7.409 2.910 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.481 5.766 1.369 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.671 7.096 0.566 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.542 6.880 1.446 1.00 0.00 H new ATOM 0 HG3 PRO A 37 8.886 7.638 0.009 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.604 8.979 2.402 1.00 0.00 H new ATOM 0 HD3 PRO A 37 8.676 9.670 1.086 1.00 0.00 H new ATOM 640 N ARG A 38 8.504 7.049 4.537 1.00 0.00 N ATOM 641 CA ARG A 38 9.175 6.245 5.545 1.00 0.00 C ATOM 642 C ARG A 38 8.446 6.348 6.858 1.00 0.00 C ATOM 643 O ARG A 38 8.897 7.017 7.790 1.00 0.00 O ATOM 644 CB ARG A 38 10.619 6.687 5.713 1.00 0.00 C ATOM 645 CG ARG A 38 11.438 6.620 4.445 1.00 0.00 C ATOM 646 CD ARG A 38 12.750 7.337 4.634 1.00 0.00 C ATOM 647 NE ARG A 38 12.539 8.767 4.924 1.00 0.00 N ATOM 648 CZ ARG A 38 13.506 9.645 5.206 1.00 0.00 C ATOM 649 NH1 ARG A 38 14.771 9.253 5.251 1.00 0.00 N ATOM 650 NH2 ARG A 38 13.204 10.918 5.446 1.00 0.00 N ATOM 0 H ARG A 38 8.835 8.011 4.464 1.00 0.00 H new ATOM 0 HA ARG A 38 9.170 5.206 5.216 1.00 0.00 H new ATOM 0 HB2 ARG A 38 10.633 7.711 6.088 1.00 0.00 H new ATOM 0 HB3 ARG A 38 11.092 6.063 6.471 1.00 0.00 H new ATOM 0 HG2 ARG A 38 11.619 5.580 4.175 1.00 0.00 H new ATOM 0 HG3 ARG A 38 10.884 7.071 3.622 1.00 0.00 H new ATOM 0 HD2 ARG A 38 13.305 6.876 5.451 1.00 0.00 H new ATOM 0 HD3 ARG A 38 13.358 7.231 3.736 1.00 0.00 H new ATOM 0 HE ARG A 38 11.580 9.113 4.908 1.00 0.00 H new ATOM 0 HH11 ARG A 38 15.010 8.278 5.070 1.00 0.00 H new ATOM 0 HH12 ARG A 38 15.506 9.926 5.467 1.00 0.00 H new ATOM 0 HH21 ARG A 38 12.232 11.226 5.415 1.00 0.00 H new ATOM 0 HH22 ARG A 38 13.944 11.586 5.661 1.00 0.00 H new ATOM 664 N ILE A 39 7.304 5.730 6.930 1.00 0.00 N ATOM 665 CA ILE A 39 6.502 5.825 8.107 1.00 0.00 C ATOM 666 C ILE A 39 6.850 4.684 9.060 1.00 0.00 C ATOM 667 O ILE A 39 6.190 3.648 9.109 1.00 0.00 O ATOM 668 CB ILE A 39 4.987 5.865 7.772 1.00 0.00 C ATOM 669 CG1 ILE A 39 4.728 6.956 6.695 1.00 0.00 C ATOM 670 CG2 ILE A 39 4.187 6.169 9.040 1.00 0.00 C ATOM 671 CD1 ILE A 39 3.290 7.088 6.248 1.00 0.00 C ATOM 0 H ILE A 39 6.909 5.155 6.185 1.00 0.00 H new ATOM 0 HA ILE A 39 6.725 6.768 8.605 1.00 0.00 H new ATOM 0 HB ILE A 39 4.670 4.898 7.383 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.060 7.917 7.087 1.00 0.00 H new ATOM 0 HG13 ILE A 39 5.345 6.737 5.823 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.124 6.196 8.802 1.00 0.00 H new ATOM 0 HG22 ILE A 39 4.373 5.393 9.782 1.00 0.00 H new ATOM 0 HG23 ILE A 39 4.494 7.135 9.441 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.213 7.874 5.497 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.954 6.143 5.821 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.665 7.342 7.104 1.00 0.00 H new ATOM 683 N GLU A 40 7.915 4.907 9.800 1.00 0.00 N ATOM 684 CA GLU A 40 8.511 3.945 10.742 1.00 0.00 C ATOM 685 C GLU A 40 7.543 3.424 11.801 1.00 0.00 C ATOM 686 O GLU A 40 7.738 2.342 12.362 1.00 0.00 O ATOM 687 CB GLU A 40 9.787 4.535 11.386 1.00 0.00 C ATOM 688 CG GLU A 40 9.759 6.058 11.661 1.00 0.00 C ATOM 689 CD GLU A 40 8.613 6.540 12.522 1.00 0.00 C ATOM 690 OE1 GLU A 40 7.517 6.767 11.993 1.00 0.00 O ATOM 691 OE2 GLU A 40 8.793 6.728 13.740 1.00 0.00 O ATOM 0 H GLU A 40 8.419 5.793 9.771 1.00 0.00 H new ATOM 0 HA GLU A 40 8.780 3.071 10.149 1.00 0.00 H new ATOM 0 HB2 GLU A 40 9.968 4.018 12.328 1.00 0.00 H new ATOM 0 HB3 GLU A 40 10.634 4.318 10.735 1.00 0.00 H new ATOM 0 HG2 GLU A 40 10.696 6.341 12.141 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.719 6.582 10.706 1.00 0.00 H new ATOM 698 N ALA A 41 6.536 4.188 12.081 1.00 0.00 N ATOM 699 CA ALA A 41 5.540 3.811 13.041 1.00 0.00 C ATOM 700 C ALA A 41 4.671 2.671 12.513 1.00 0.00 C ATOM 701 O ALA A 41 4.375 1.709 13.231 1.00 0.00 O ATOM 702 CB ALA A 41 4.681 5.007 13.409 1.00 0.00 C ATOM 0 H ALA A 41 6.378 5.098 11.649 1.00 0.00 H new ATOM 0 HA ALA A 41 6.050 3.458 13.937 1.00 0.00 H new ATOM 0 HB1 ALA A 41 3.930 4.705 14.139 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.309 5.788 13.837 1.00 0.00 H new ATOM 0 HB3 ALA A 41 4.186 5.388 12.516 1.00 0.00 H new ATOM 708 N ASN A 42 4.339 2.740 11.242 1.00 0.00 N ATOM 709 CA ASN A 42 3.405 1.798 10.642 1.00 0.00 C ATOM 710 C ASN A 42 4.099 0.712 9.860 1.00 0.00 C ATOM 711 O ASN A 42 3.452 -0.008 9.098 1.00 0.00 O ATOM 712 CB ASN A 42 2.441 2.528 9.733 1.00 0.00 C ATOM 713 CG ASN A 42 1.526 3.470 10.469 1.00 0.00 C ATOM 714 OD1 ASN A 42 1.134 3.224 11.612 1.00 0.00 O ATOM 715 ND2 ASN A 42 1.210 4.554 9.842 1.00 0.00 N ATOM 0 H ASN A 42 4.702 3.441 10.597 1.00 0.00 H new ATOM 0 HA ASN A 42 2.866 1.324 11.462 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.007 3.089 8.990 1.00 0.00 H new ATOM 0 HB3 ASN A 42 1.840 1.798 9.191 1.00 0.00 H new ATOM 0 HD21 ASN A 42 0.613 5.248 10.292 1.00 0.00 H new ATOM 0 HD22 ASN A 42 1.557 4.716 8.897 1.00 0.00 H new ATOM 722 N LYS A 43 5.397 0.595 10.018 1.00 0.00 N ATOM 723 CA LYS A 43 6.126 -0.478 9.367 1.00 0.00 C ATOM 724 C LYS A 43 5.707 -1.807 10.002 1.00 0.00 C ATOM 725 O LYS A 43 5.383 -1.857 11.201 1.00 0.00 O ATOM 726 CB LYS A 43 7.645 -0.261 9.475 1.00 0.00 C ATOM 727 CG LYS A 43 8.198 -0.414 10.869 1.00 0.00 C ATOM 728 CD LYS A 43 9.672 -0.093 10.925 1.00 0.00 C ATOM 729 CE LYS A 43 10.195 -0.295 12.326 1.00 0.00 C ATOM 730 NZ LYS A 43 11.591 0.120 12.464 1.00 0.00 N ATOM 0 H LYS A 43 5.969 1.221 10.585 1.00 0.00 H new ATOM 0 HA LYS A 43 5.885 -0.492 8.304 1.00 0.00 H new ATOM 0 HB2 LYS A 43 8.149 -0.970 8.818 1.00 0.00 H new ATOM 0 HB3 LYS A 43 7.884 0.738 9.110 1.00 0.00 H new ATOM 0 HG2 LYS A 43 7.657 0.244 11.549 1.00 0.00 H new ATOM 0 HG3 LYS A 43 8.035 -1.435 11.215 1.00 0.00 H new ATOM 0 HD2 LYS A 43 10.217 -0.731 10.230 1.00 0.00 H new ATOM 0 HD3 LYS A 43 9.840 0.937 10.611 1.00 0.00 H new ATOM 0 HE2 LYS A 43 9.580 0.270 13.026 1.00 0.00 H new ATOM 0 HE3 LYS A 43 10.103 -1.347 12.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 11.905 -0.038 13.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 12.184 -0.437 11.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 11.678 1.130 12.231 1.00 0.00 H new ATOM 744 N LEU A 44 5.692 -2.852 9.230 1.00 0.00 N ATOM 745 CA LEU A 44 5.234 -4.137 9.696 1.00 0.00 C ATOM 746 C LEU A 44 6.210 -4.771 10.694 1.00 0.00 C ATOM 747 O LEU A 44 7.345 -4.292 10.869 1.00 0.00 O ATOM 748 CB LEU A 44 4.989 -5.061 8.517 1.00 0.00 C ATOM 749 CG LEU A 44 3.890 -4.644 7.533 1.00 0.00 C ATOM 750 CD1 LEU A 44 3.803 -5.632 6.384 1.00 0.00 C ATOM 751 CD2 LEU A 44 2.543 -4.535 8.238 1.00 0.00 C ATOM 0 H LEU A 44 5.997 -2.843 8.257 1.00 0.00 H new ATOM 0 HA LEU A 44 4.295 -3.982 10.228 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.922 -5.160 7.963 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.742 -6.049 8.905 1.00 0.00 H new ATOM 0 HG LEU A 44 4.148 -3.663 7.133 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.018 -5.321 5.695 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.757 -5.662 5.857 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.572 -6.623 6.773 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.779 -4.238 7.519 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.279 -5.500 8.670 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.606 -3.789 9.030 1.00 0.00 H new ATOM 763 N ARG A 45 5.755 -5.847 11.338 1.00 0.00 N ATOM 764 CA ARG A 45 6.515 -6.549 12.381 1.00 0.00 C ATOM 765 C ARG A 45 7.895 -7.004 11.883 1.00 0.00 C ATOM 766 O ARG A 45 8.918 -6.623 12.453 1.00 0.00 O ATOM 767 CB ARG A 45 5.715 -7.756 12.917 1.00 0.00 C ATOM 768 CG ARG A 45 6.405 -8.502 14.064 1.00 0.00 C ATOM 769 CD ARG A 45 5.667 -9.783 14.457 1.00 0.00 C ATOM 770 NE ARG A 45 4.286 -9.539 14.915 1.00 0.00 N ATOM 771 CZ ARG A 45 3.434 -10.501 15.324 1.00 0.00 C ATOM 772 NH1 ARG A 45 3.816 -11.775 15.363 1.00 0.00 N ATOM 773 NH2 ARG A 45 2.209 -10.183 15.690 1.00 0.00 N ATOM 0 H ARG A 45 4.842 -6.261 11.151 1.00 0.00 H new ATOM 0 HA ARG A 45 6.677 -5.840 13.193 1.00 0.00 H new ATOM 0 HB2 ARG A 45 4.739 -7.410 13.258 1.00 0.00 H new ATOM 0 HB3 ARG A 45 5.538 -8.454 12.098 1.00 0.00 H new ATOM 0 HG2 ARG A 45 7.425 -8.750 13.770 1.00 0.00 H new ATOM 0 HG3 ARG A 45 6.473 -7.845 14.931 1.00 0.00 H new ATOM 0 HD2 ARG A 45 5.646 -10.459 13.603 1.00 0.00 H new ATOM 0 HD3 ARG A 45 6.222 -10.287 15.248 1.00 0.00 H new ATOM 0 HE ARG A 45 3.952 -8.575 14.923 1.00 0.00 H new ATOM 0 HH11 ARG A 45 4.762 -12.033 15.082 1.00 0.00 H new ATOM 0 HH12 ARG A 45 3.163 -12.494 15.674 1.00 0.00 H new ATOM 0 HH21 ARG A 45 1.905 -9.210 15.664 1.00 0.00 H new ATOM 0 HH22 ARG A 45 1.564 -10.910 15.999 1.00 0.00 H new ATOM 787 N GLY A 46 7.916 -7.805 10.831 1.00 0.00 N ATOM 788 CA GLY A 46 9.175 -8.289 10.302 1.00 0.00 C ATOM 789 C GLY A 46 9.443 -7.831 8.882 1.00 0.00 C ATOM 790 O GLY A 46 10.060 -8.553 8.099 1.00 0.00 O ATOM 0 H GLY A 46 7.087 -8.129 10.334 1.00 0.00 H new ATOM 0 HA2 GLY A 46 9.986 -7.949 10.946 1.00 0.00 H new ATOM 0 HA3 GLY A 46 9.179 -9.379 10.332 1.00 0.00 H new ATOM 794 N MET A 47 8.978 -6.648 8.550 1.00 0.00 N ATOM 795 CA MET A 47 9.185 -6.059 7.223 1.00 0.00 C ATOM 796 C MET A 47 9.463 -4.571 7.380 1.00 0.00 C ATOM 797 O MET A 47 8.547 -3.803 7.661 1.00 0.00 O ATOM 798 CB MET A 47 7.967 -6.263 6.299 1.00 0.00 C ATOM 799 CG MET A 47 7.704 -7.690 5.846 1.00 0.00 C ATOM 800 SD MET A 47 9.013 -8.335 4.799 1.00 0.00 S ATOM 801 CE MET A 47 8.368 -9.956 4.400 1.00 0.00 C ATOM 0 H MET A 47 8.443 -6.056 9.186 1.00 0.00 H new ATOM 0 HA MET A 47 10.033 -6.562 6.759 1.00 0.00 H new ATOM 0 HB2 MET A 47 7.079 -5.898 6.815 1.00 0.00 H new ATOM 0 HB3 MET A 47 8.100 -5.641 5.414 1.00 0.00 H new ATOM 0 HG2 MET A 47 7.595 -8.331 6.721 1.00 0.00 H new ATOM 0 HG3 MET A 47 6.759 -7.727 5.304 1.00 0.00 H new ATOM 0 HE1 MET A 47 8.874 -10.341 3.515 1.00 0.00 H new ATOM 0 HE2 MET A 47 8.538 -10.632 5.238 1.00 0.00 H new ATOM 0 HE3 MET A 47 7.298 -9.884 4.203 1.00 0.00 H new ATOM 811 N PRO A 48 10.731 -4.146 7.254 1.00 0.00 N ATOM 812 CA PRO A 48 11.129 -2.745 7.450 1.00 0.00 C ATOM 813 C PRO A 48 10.607 -1.799 6.367 1.00 0.00 C ATOM 814 O PRO A 48 10.157 -0.693 6.667 1.00 0.00 O ATOM 815 CB PRO A 48 12.667 -2.783 7.396 1.00 0.00 C ATOM 816 CG PRO A 48 13.028 -4.219 7.537 1.00 0.00 C ATOM 817 CD PRO A 48 11.892 -4.992 6.943 1.00 0.00 C ATOM 0 HA PRO A 48 10.717 -2.362 8.383 1.00 0.00 H new ATOM 0 HB2 PRO A 48 13.038 -2.374 6.456 1.00 0.00 H new ATOM 0 HB3 PRO A 48 13.104 -2.187 8.197 1.00 0.00 H new ATOM 0 HG2 PRO A 48 13.962 -4.439 7.020 1.00 0.00 H new ATOM 0 HG3 PRO A 48 13.174 -4.483 8.584 1.00 0.00 H new ATOM 0 HD2 PRO A 48 12.015 -5.133 5.869 1.00 0.00 H new ATOM 0 HD3 PRO A 48 11.801 -5.984 7.386 1.00 0.00 H new ATOM 825 N ASP A 49 10.657 -2.231 5.115 1.00 0.00 N ATOM 826 CA ASP A 49 10.283 -1.359 3.988 1.00 0.00 C ATOM 827 C ASP A 49 8.815 -1.440 3.661 1.00 0.00 C ATOM 828 O ASP A 49 8.327 -0.730 2.774 1.00 0.00 O ATOM 829 CB ASP A 49 11.105 -1.658 2.724 1.00 0.00 C ATOM 830 CG ASP A 49 12.549 -1.231 2.816 1.00 0.00 C ATOM 831 OD1 ASP A 49 12.855 -0.045 2.547 1.00 0.00 O ATOM 832 OD2 ASP A 49 13.421 -2.073 3.126 1.00 0.00 O ATOM 0 H ASP A 49 10.949 -3.170 4.845 1.00 0.00 H new ATOM 0 HA ASP A 49 10.508 -0.345 4.319 1.00 0.00 H new ATOM 0 HB2 ASP A 49 11.065 -2.728 2.522 1.00 0.00 H new ATOM 0 HB3 ASP A 49 10.642 -1.156 1.875 1.00 0.00 H new ATOM 837 N CYS A 50 8.112 -2.294 4.350 1.00 0.00 N ATOM 838 CA CYS A 50 6.705 -2.458 4.122 1.00 0.00 C ATOM 839 C CYS A 50 5.939 -1.758 5.229 1.00 0.00 C ATOM 840 O CYS A 50 6.146 -2.043 6.409 1.00 0.00 O ATOM 841 CB CYS A 50 6.352 -3.937 4.088 1.00 0.00 C ATOM 842 SG CYS A 50 7.356 -4.911 2.938 1.00 0.00 S ATOM 0 H CYS A 50 8.496 -2.893 5.081 1.00 0.00 H new ATOM 0 HA CYS A 50 6.435 -2.018 3.162 1.00 0.00 H new ATOM 0 HB2 CYS A 50 6.464 -4.349 5.091 1.00 0.00 H new ATOM 0 HB3 CYS A 50 5.302 -4.043 3.816 1.00 0.00 H new ATOM 0 HG CYS A 50 7.133 -6.177 3.132 1.00 0.00 H new ATOM 848 N TYR A 51 5.083 -0.856 4.854 1.00 0.00 N ATOM 849 CA TYR A 51 4.312 -0.088 5.787 1.00 0.00 C ATOM 850 C TYR A 51 2.849 -0.339 5.518 1.00 0.00 C ATOM 851 O TYR A 51 2.469 -0.746 4.406 1.00 0.00 O ATOM 852 CB TYR A 51 4.596 1.406 5.615 1.00 0.00 C ATOM 853 CG TYR A 51 6.062 1.776 5.589 1.00 0.00 C ATOM 854 CD1 TYR A 51 6.788 1.913 6.747 1.00 0.00 C ATOM 855 CD2 TYR A 51 6.709 1.990 4.390 1.00 0.00 C ATOM 856 CE1 TYR A 51 8.123 2.258 6.721 1.00 0.00 C ATOM 857 CE2 TYR A 51 8.034 2.333 4.349 1.00 0.00 C ATOM 858 CZ TYR A 51 8.741 2.466 5.510 1.00 0.00 C ATOM 859 OH TYR A 51 10.074 2.824 5.459 1.00 0.00 O ATOM 0 H TYR A 51 4.897 -0.629 3.877 1.00 0.00 H new ATOM 0 HA TYR A 51 4.578 -0.383 6.802 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.134 1.744 4.687 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.113 1.949 6.428 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.303 1.747 7.698 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.160 1.885 3.466 1.00 0.00 H new ATOM 0 HE1 TYR A 51 8.677 2.364 7.642 1.00 0.00 H new ATOM 0 HE2 TYR A 51 8.520 2.498 3.399 1.00 0.00 H new ATOM 0 HH TYR A 51 10.349 2.929 4.524 1.00 0.00 H new ATOM 869 N LYS A 52 2.037 -0.090 6.500 1.00 0.00 N ATOM 870 CA LYS A 52 0.627 -0.288 6.386 1.00 0.00 C ATOM 871 C LYS A 52 -0.080 1.029 6.611 1.00 0.00 C ATOM 872 O LYS A 52 0.294 1.809 7.481 1.00 0.00 O ATOM 873 CB LYS A 52 0.142 -1.356 7.389 1.00 0.00 C ATOM 874 CG LYS A 52 0.367 -0.972 8.839 1.00 0.00 C ATOM 875 CD LYS A 52 -0.023 -2.062 9.810 1.00 0.00 C ATOM 876 CE LYS A 52 0.171 -1.562 11.220 1.00 0.00 C ATOM 877 NZ LYS A 52 -0.085 -2.593 12.243 1.00 0.00 N ATOM 0 H LYS A 52 2.338 0.259 7.410 1.00 0.00 H new ATOM 0 HA LYS A 52 0.393 -0.650 5.385 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.921 -1.536 7.230 1.00 0.00 H new ATOM 0 HB3 LYS A 52 0.658 -2.294 7.186 1.00 0.00 H new ATOM 0 HG2 LYS A 52 1.419 -0.724 8.984 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -0.206 -0.072 9.063 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -1.062 -2.350 9.653 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.584 -2.951 9.640 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.191 -1.195 11.331 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.493 -0.715 11.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.402 -2.138 13.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.823 -3.243 11.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.789 -3.126 12.425 1.00 0.00 H new ATOM 891 N ILE A 53 -1.028 1.305 5.793 1.00 0.00 N ATOM 892 CA ILE A 53 -1.838 2.470 5.935 1.00 0.00 C ATOM 893 C ILE A 53 -3.221 1.987 6.248 1.00 0.00 C ATOM 894 O ILE A 53 -3.590 0.885 5.844 1.00 0.00 O ATOM 895 CB ILE A 53 -1.888 3.321 4.640 1.00 0.00 C ATOM 896 CG1 ILE A 53 -0.477 3.578 4.109 1.00 0.00 C ATOM 897 CG2 ILE A 53 -2.591 4.645 4.924 1.00 0.00 C ATOM 898 CD1 ILE A 53 -0.434 4.432 2.856 1.00 0.00 C ATOM 0 H ILE A 53 -1.271 0.722 4.992 1.00 0.00 H new ATOM 0 HA ILE A 53 -1.421 3.106 6.716 1.00 0.00 H new ATOM 0 HB ILE A 53 -2.445 2.772 3.880 1.00 0.00 H new ATOM 0 HG12 ILE A 53 0.110 4.065 4.888 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.001 2.621 3.900 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.625 5.242 4.012 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.607 4.451 5.269 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.044 5.189 5.694 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.601 4.568 2.544 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.991 3.938 2.060 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.881 5.404 3.063 1.00 0.00 H new ATOM 910 N LYS A 54 -3.962 2.763 6.965 1.00 0.00 N ATOM 911 CA LYS A 54 -5.287 2.414 7.350 1.00 0.00 C ATOM 912 C LYS A 54 -6.169 3.605 7.121 1.00 0.00 C ATOM 913 O LYS A 54 -5.698 4.751 7.154 1.00 0.00 O ATOM 914 CB LYS A 54 -5.302 2.098 8.827 1.00 0.00 C ATOM 915 CG LYS A 54 -4.400 0.955 9.258 1.00 0.00 C ATOM 916 CD LYS A 54 -4.112 1.044 10.740 1.00 0.00 C ATOM 917 CE LYS A 54 -5.384 0.965 11.583 1.00 0.00 C ATOM 918 NZ LYS A 54 -5.109 1.149 13.021 1.00 0.00 N ATOM 0 H LYS A 54 -3.658 3.675 7.306 1.00 0.00 H new ATOM 0 HA LYS A 54 -5.632 1.554 6.776 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -5.012 2.994 9.376 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -6.325 1.862 9.120 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -4.876 0.001 9.030 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -3.466 0.988 8.697 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -3.438 0.236 11.026 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -3.596 1.980 10.952 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -6.088 1.727 11.249 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -5.863 -0.002 11.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -5.999 1.088 13.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -4.458 0.407 13.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -4.676 2.082 13.175 1.00 0.00 H new ATOM 932 N LEU A 55 -7.405 3.351 6.873 1.00 0.00 N ATOM 933 CA LEU A 55 -8.376 4.372 6.743 1.00 0.00 C ATOM 934 C LEU A 55 -9.157 4.417 8.030 1.00 0.00 C ATOM 935 O LEU A 55 -9.938 3.498 8.345 1.00 0.00 O ATOM 936 CB LEU A 55 -9.271 4.130 5.538 1.00 0.00 C ATOM 937 CG LEU A 55 -8.580 4.118 4.178 1.00 0.00 C ATOM 938 CD1 LEU A 55 -9.594 3.885 3.076 1.00 0.00 C ATOM 939 CD2 LEU A 55 -7.825 5.420 3.944 1.00 0.00 C ATOM 0 H LEU A 55 -7.774 2.408 6.753 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.899 5.336 6.569 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.777 3.174 5.674 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.042 4.900 5.524 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.858 3.301 4.166 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -9.087 3.879 2.111 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -10.088 2.926 3.233 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.337 4.682 3.091 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.340 5.389 2.968 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.523 6.256 3.976 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.070 5.548 4.720 1.00 0.00 H new ATOM 951 N ARG A 56 -8.931 5.485 8.745 1.00 0.00 N ATOM 952 CA ARG A 56 -9.378 5.711 10.123 1.00 0.00 C ATOM 953 C ARG A 56 -10.855 5.393 10.368 1.00 0.00 C ATOM 954 O ARG A 56 -11.196 4.758 11.357 1.00 0.00 O ATOM 955 CB ARG A 56 -9.114 7.165 10.481 1.00 0.00 C ATOM 956 CG ARG A 56 -7.658 7.588 10.358 1.00 0.00 C ATOM 957 CD ARG A 56 -7.528 9.099 10.421 1.00 0.00 C ATOM 958 NE ARG A 56 -8.327 9.738 9.354 1.00 0.00 N ATOM 959 CZ ARG A 56 -8.184 10.985 8.896 1.00 0.00 C ATOM 960 NH1 ARG A 56 -7.246 11.777 9.376 1.00 0.00 N ATOM 961 NH2 ARG A 56 -8.995 11.431 7.944 1.00 0.00 N ATOM 0 H ARG A 56 -8.402 6.275 8.375 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.815 5.023 10.753 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.720 7.801 9.836 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.445 7.340 11.504 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -7.074 7.135 11.159 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -7.247 7.222 9.417 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.861 9.457 11.395 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -6.481 9.383 10.318 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.059 9.172 8.925 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -6.618 11.440 10.106 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -7.148 12.727 9.017 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -9.722 10.823 7.567 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -8.891 12.382 7.590 1.00 0.00 H new ATOM 975 N SER A 57 -11.712 5.789 9.467 1.00 0.00 N ATOM 976 CA SER A 57 -13.130 5.655 9.704 1.00 0.00 C ATOM 977 C SER A 57 -13.770 4.520 8.884 1.00 0.00 C ATOM 978 O SER A 57 -14.995 4.411 8.821 1.00 0.00 O ATOM 979 CB SER A 57 -13.796 6.992 9.412 1.00 0.00 C ATOM 980 OG SER A 57 -13.132 8.039 10.131 1.00 0.00 O ATOM 0 H SER A 57 -11.461 6.204 8.570 1.00 0.00 H new ATOM 0 HA SER A 57 -13.281 5.380 10.748 1.00 0.00 H new ATOM 0 HB2 SER A 57 -13.764 7.198 8.342 1.00 0.00 H new ATOM 0 HB3 SER A 57 -14.847 6.954 9.698 1.00 0.00 H new ATOM 0 HG SER A 57 -13.566 8.896 9.936 1.00 0.00 H new ATOM 986 N SER A 58 -12.964 3.667 8.285 1.00 0.00 N ATOM 987 CA SER A 58 -13.525 2.579 7.504 1.00 0.00 C ATOM 988 C SER A 58 -12.890 1.225 7.834 1.00 0.00 C ATOM 989 O SER A 58 -13.542 0.189 7.723 1.00 0.00 O ATOM 990 CB SER A 58 -13.461 2.897 6.013 1.00 0.00 C ATOM 991 OG SER A 58 -12.149 3.239 5.638 1.00 0.00 O ATOM 0 H SER A 58 -11.945 3.701 8.320 1.00 0.00 H new ATOM 0 HA SER A 58 -14.575 2.487 7.783 1.00 0.00 H new ATOM 0 HB2 SER A 58 -13.797 2.035 5.437 1.00 0.00 H new ATOM 0 HB3 SER A 58 -14.138 3.719 5.781 1.00 0.00 H new ATOM 0 HG SER A 58 -12.124 3.438 4.679 1.00 0.00 H new ATOM 997 N GLY A 59 -11.625 1.228 8.232 1.00 0.00 N ATOM 998 CA GLY A 59 -10.975 -0.012 8.615 1.00 0.00 C ATOM 999 C GLY A 59 -10.256 -0.684 7.459 1.00 0.00 C ATOM 1000 O GLY A 59 -9.757 -1.808 7.598 1.00 0.00 O ATOM 0 H GLY A 59 -11.039 2.061 8.297 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -10.260 0.190 9.413 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -11.720 -0.697 9.020 1.00 0.00 H new ATOM 1004 N TYR A 60 -10.220 -0.016 6.318 1.00 0.00 N ATOM 1005 CA TYR A 60 -9.502 -0.525 5.158 1.00 0.00 C ATOM 1006 C TYR A 60 -8.026 -0.248 5.291 1.00 0.00 C ATOM 1007 O TYR A 60 -7.619 0.528 6.141 1.00 0.00 O ATOM 1008 CB TYR A 60 -10.066 0.030 3.853 1.00 0.00 C ATOM 1009 CG TYR A 60 -11.343 -0.647 3.418 1.00 0.00 C ATOM 1010 CD1 TYR A 60 -12.575 -0.292 3.952 1.00 0.00 C ATOM 1011 CD2 TYR A 60 -11.307 -1.660 2.474 1.00 0.00 C ATOM 1012 CE1 TYR A 60 -13.735 -0.934 3.553 1.00 0.00 C ATOM 1013 CE2 TYR A 60 -12.454 -2.305 2.073 1.00 0.00 C ATOM 1014 CZ TYR A 60 -13.666 -1.941 2.614 1.00 0.00 C ATOM 1015 OH TYR A 60 -14.820 -2.601 2.222 1.00 0.00 O ATOM 0 H TYR A 60 -10.680 0.882 6.169 1.00 0.00 H new ATOM 0 HA TYR A 60 -9.642 -1.605 5.122 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.251 1.098 3.970 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -9.319 -0.080 3.067 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -12.629 0.496 4.689 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -10.359 -1.949 2.044 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -14.687 -0.648 3.974 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -12.404 -3.094 1.337 1.00 0.00 H new ATOM 0 HH TYR A 60 -14.597 -3.281 1.553 1.00 0.00 H new ATOM 1025 N ARG A 61 -7.222 -0.896 4.485 1.00 0.00 N ATOM 1026 CA ARG A 61 -5.785 -0.780 4.598 1.00 0.00 C ATOM 1027 C ARG A 61 -5.155 -0.790 3.230 1.00 0.00 C ATOM 1028 O ARG A 61 -5.797 -1.170 2.246 1.00 0.00 O ATOM 1029 CB ARG A 61 -5.233 -1.985 5.346 1.00 0.00 C ATOM 1030 CG ARG A 61 -5.797 -2.175 6.718 1.00 0.00 C ATOM 1031 CD ARG A 61 -5.304 -3.443 7.323 1.00 0.00 C ATOM 1032 NE ARG A 61 -5.831 -3.607 8.662 1.00 0.00 N ATOM 1033 CZ ARG A 61 -5.102 -3.679 9.761 1.00 0.00 C ATOM 1034 NH1 ARG A 61 -3.776 -3.573 9.700 1.00 0.00 N ATOM 1035 NH2 ARG A 61 -5.694 -3.847 10.925 1.00 0.00 N ATOM 0 H ARG A 61 -7.539 -1.514 3.738 1.00 0.00 H new ATOM 0 HA ARG A 61 -5.560 0.149 5.121 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -5.429 -2.882 4.759 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -4.150 -1.884 5.423 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -5.517 -1.333 7.351 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -6.886 -2.190 6.669 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -5.602 -4.288 6.703 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -4.214 -3.438 7.353 1.00 0.00 H new ATOM 0 HE ARG A 61 -6.844 -3.672 8.764 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -3.316 -3.435 8.800 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -3.220 -3.630 10.553 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -6.710 -3.921 10.974 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -5.136 -3.903 11.777 1.00 0.00 H new ATOM 1049 N LEU A 62 -3.909 -0.403 3.189 1.00 0.00 N ATOM 1050 CA LEU A 62 -3.100 -0.448 1.999 1.00 0.00 C ATOM 1051 C LEU A 62 -1.657 -0.661 2.422 1.00 0.00 C ATOM 1052 O LEU A 62 -1.084 0.158 3.114 1.00 0.00 O ATOM 1053 CB LEU A 62 -3.293 0.843 1.157 1.00 0.00 C ATOM 1054 CG LEU A 62 -2.531 0.955 -0.187 1.00 0.00 C ATOM 1055 CD1 LEU A 62 -3.199 1.987 -1.070 1.00 0.00 C ATOM 1056 CD2 LEU A 62 -1.078 1.369 0.027 1.00 0.00 C ATOM 0 H LEU A 62 -3.415 -0.038 4.003 1.00 0.00 H new ATOM 0 HA LEU A 62 -3.402 -1.274 1.355 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.357 0.949 0.947 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.004 1.692 1.776 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.552 -0.027 -0.660 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.659 2.062 -2.014 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.229 1.688 -1.264 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.190 2.955 -0.569 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.574 1.438 -0.937 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.045 2.339 0.524 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.576 0.627 0.647 1.00 0.00 H new ATOM 1068 N VAL A 63 -1.109 -1.768 2.045 1.00 0.00 N ATOM 1069 CA VAL A 63 0.244 -2.127 2.390 1.00 0.00 C ATOM 1070 C VAL A 63 1.125 -1.916 1.189 1.00 0.00 C ATOM 1071 O VAL A 63 0.842 -2.440 0.105 1.00 0.00 O ATOM 1072 CB VAL A 63 0.324 -3.601 2.840 1.00 0.00 C ATOM 1073 CG1 VAL A 63 1.746 -3.998 3.224 1.00 0.00 C ATOM 1074 CG2 VAL A 63 -0.628 -3.843 3.986 1.00 0.00 C ATOM 0 H VAL A 63 -1.589 -2.467 1.478 1.00 0.00 H new ATOM 0 HA VAL A 63 0.578 -1.500 3.217 1.00 0.00 H new ATOM 0 HB VAL A 63 0.032 -4.227 1.997 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.761 -5.043 3.535 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.405 -3.866 2.366 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.090 -3.370 4.046 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -0.565 -4.886 4.297 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -0.361 -3.198 4.823 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -1.646 -3.621 3.666 1.00 0.00 H new ATOM 1084 N TYR A 64 2.175 -1.174 1.368 1.00 0.00 N ATOM 1085 CA TYR A 64 3.066 -0.846 0.290 1.00 0.00 C ATOM 1086 C TYR A 64 4.488 -1.004 0.750 1.00 0.00 C ATOM 1087 O TYR A 64 4.758 -1.014 1.937 1.00 0.00 O ATOM 1088 CB TYR A 64 2.839 0.612 -0.179 1.00 0.00 C ATOM 1089 CG TYR A 64 3.203 1.673 0.863 1.00 0.00 C ATOM 1090 CD1 TYR A 64 2.365 1.938 1.932 1.00 0.00 C ATOM 1091 CD2 TYR A 64 4.397 2.394 0.773 1.00 0.00 C ATOM 1092 CE1 TYR A 64 2.695 2.877 2.881 1.00 0.00 C ATOM 1093 CE2 TYR A 64 4.727 3.343 1.722 1.00 0.00 C ATOM 1094 CZ TYR A 64 3.866 3.577 2.777 1.00 0.00 C ATOM 1095 OH TYR A 64 4.185 4.502 3.745 1.00 0.00 O ATOM 0 H TYR A 64 2.442 -0.776 2.268 1.00 0.00 H new ATOM 0 HA TYR A 64 2.868 -1.519 -0.544 1.00 0.00 H new ATOM 0 HB2 TYR A 64 3.427 0.787 -1.080 1.00 0.00 H new ATOM 0 HB3 TYR A 64 1.791 0.734 -0.454 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.435 1.397 2.023 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.071 2.207 -0.050 1.00 0.00 H new ATOM 0 HE1 TYR A 64 2.028 3.062 3.710 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.650 3.897 1.640 1.00 0.00 H new ATOM 0 HH TYR A 64 5.146 4.691 3.713 1.00 0.00 H new ATOM 1105 N GLN A 65 5.366 -1.137 -0.168 1.00 0.00 N ATOM 1106 CA GLN A 65 6.753 -1.172 0.104 1.00 0.00 C ATOM 1107 C GLN A 65 7.364 -0.005 -0.613 1.00 0.00 C ATOM 1108 O GLN A 65 7.092 0.204 -1.806 1.00 0.00 O ATOM 1109 CB GLN A 65 7.371 -2.468 -0.405 1.00 0.00 C ATOM 1110 CG GLN A 65 8.874 -2.527 -0.218 1.00 0.00 C ATOM 1111 CD GLN A 65 9.487 -3.729 -0.859 1.00 0.00 C ATOM 1112 OE1 GLN A 65 9.635 -4.771 -0.236 1.00 0.00 O ATOM 1113 NE2 GLN A 65 9.824 -3.598 -2.111 1.00 0.00 N ATOM 0 H GLN A 65 5.136 -1.227 -1.158 1.00 0.00 H new ATOM 0 HA GLN A 65 6.933 -1.121 1.178 1.00 0.00 H new ATOM 0 HB2 GLN A 65 6.913 -3.310 0.115 1.00 0.00 H new ATOM 0 HB3 GLN A 65 7.138 -2.583 -1.464 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.324 -1.627 -0.637 1.00 0.00 H new ATOM 0 HG3 GLN A 65 9.104 -2.531 0.848 1.00 0.00 H new ATOM 0 HE21 GLN A 65 9.680 -2.708 -2.587 1.00 0.00 H new ATOM 0 HE22 GLN A 65 10.231 -4.386 -2.615 1.00 0.00 H new ATOM 1122 N VAL A 66 8.139 0.770 0.072 1.00 0.00 N ATOM 1123 CA VAL A 66 8.765 1.874 -0.577 1.00 0.00 C ATOM 1124 C VAL A 66 10.121 1.432 -1.071 1.00 0.00 C ATOM 1125 O VAL A 66 10.834 0.685 -0.397 1.00 0.00 O ATOM 1126 CB VAL A 66 8.883 3.144 0.318 1.00 0.00 C ATOM 1127 CG1 VAL A 66 9.865 2.945 1.458 1.00 0.00 C ATOM 1128 CG2 VAL A 66 9.268 4.348 -0.527 1.00 0.00 C ATOM 0 H VAL A 66 8.352 0.663 1.064 1.00 0.00 H new ATOM 0 HA VAL A 66 8.130 2.173 -1.411 1.00 0.00 H new ATOM 0 HB VAL A 66 7.907 3.327 0.767 1.00 0.00 H new ATOM 0 HG11 VAL A 66 9.917 3.854 2.057 1.00 0.00 H new ATOM 0 HG12 VAL A 66 9.533 2.117 2.084 1.00 0.00 H new ATOM 0 HG13 VAL A 66 10.852 2.721 1.053 1.00 0.00 H new ATOM 0 HG21 VAL A 66 9.347 5.229 0.110 1.00 0.00 H new ATOM 0 HG22 VAL A 66 10.227 4.162 -1.010 1.00 0.00 H new ATOM 0 HG23 VAL A 66 8.506 4.517 -1.288 1.00 0.00 H new ATOM 1138 N ILE A 67 10.428 1.800 -2.258 1.00 0.00 N ATOM 1139 CA ILE A 67 11.676 1.477 -2.841 1.00 0.00 C ATOM 1140 C ILE A 67 12.346 2.782 -3.207 1.00 0.00 C ATOM 1141 O ILE A 67 11.885 3.474 -4.105 1.00 0.00 O ATOM 1142 CB ILE A 67 11.487 0.612 -4.111 1.00 0.00 C ATOM 1143 CG1 ILE A 67 10.538 -0.569 -3.824 1.00 0.00 C ATOM 1144 CG2 ILE A 67 12.831 0.081 -4.561 1.00 0.00 C ATOM 1145 CD1 ILE A 67 10.250 -1.450 -5.022 1.00 0.00 C ATOM 0 H ILE A 67 9.810 2.342 -2.862 1.00 0.00 H new ATOM 0 HA ILE A 67 12.281 0.902 -2.140 1.00 0.00 H new ATOM 0 HB ILE A 67 11.050 1.230 -4.896 1.00 0.00 H new ATOM 0 HG12 ILE A 67 10.971 -1.182 -3.034 1.00 0.00 H new ATOM 0 HG13 ILE A 67 9.595 -0.177 -3.443 1.00 0.00 H new ATOM 0 HG21 ILE A 67 12.701 -0.528 -5.455 1.00 0.00 H new ATOM 0 HG22 ILE A 67 13.496 0.916 -4.784 1.00 0.00 H new ATOM 0 HG23 ILE A 67 13.266 -0.527 -3.768 1.00 0.00 H new ATOM 0 HD11 ILE A 67 9.575 -2.254 -4.729 1.00 0.00 H new ATOM 0 HD12 ILE A 67 9.785 -0.855 -5.808 1.00 0.00 H new ATOM 0 HD13 ILE A 67 11.182 -1.876 -5.393 1.00 0.00 H new ATOM 1157 N ASP A 68 13.390 3.136 -2.508 1.00 0.00 N ATOM 1158 CA ASP A 68 14.071 4.399 -2.750 1.00 0.00 C ATOM 1159 C ASP A 68 15.101 4.307 -3.865 1.00 0.00 C ATOM 1160 O ASP A 68 15.527 5.321 -4.410 1.00 0.00 O ATOM 1161 CB ASP A 68 14.652 5.030 -1.463 1.00 0.00 C ATOM 1162 CG ASP A 68 15.600 4.142 -0.681 1.00 0.00 C ATOM 1163 OD1 ASP A 68 16.784 4.053 -1.029 1.00 0.00 O ATOM 1164 OD2 ASP A 68 15.167 3.534 0.331 1.00 0.00 O ATOM 0 H ASP A 68 13.796 2.572 -1.761 1.00 0.00 H new ATOM 0 HA ASP A 68 13.300 5.085 -3.100 1.00 0.00 H new ATOM 0 HB2 ASP A 68 15.177 5.947 -1.732 1.00 0.00 H new ATOM 0 HB3 ASP A 68 13.826 5.315 -0.812 1.00 0.00 H new ATOM 1169 N GLU A 69 15.488 3.098 -4.230 1.00 0.00 N ATOM 1170 CA GLU A 69 16.393 2.933 -5.367 1.00 0.00 C ATOM 1171 C GLU A 69 15.638 3.104 -6.695 1.00 0.00 C ATOM 1172 O GLU A 69 16.105 3.772 -7.599 1.00 0.00 O ATOM 1173 CB GLU A 69 17.119 1.579 -5.342 1.00 0.00 C ATOM 1174 CG GLU A 69 16.191 0.389 -5.261 1.00 0.00 C ATOM 1175 CD GLU A 69 16.865 -0.916 -5.499 1.00 0.00 C ATOM 1176 OE1 GLU A 69 17.595 -1.395 -4.609 1.00 0.00 O ATOM 1177 OE2 GLU A 69 16.654 -1.515 -6.592 1.00 0.00 O ATOM 0 H GLU A 69 15.202 2.232 -3.773 1.00 0.00 H new ATOM 0 HA GLU A 69 17.150 3.713 -5.284 1.00 0.00 H new ATOM 0 HB2 GLU A 69 17.732 1.489 -6.239 1.00 0.00 H new ATOM 0 HB3 GLU A 69 17.798 1.557 -4.489 1.00 0.00 H new ATOM 0 HG2 GLU A 69 15.723 0.371 -4.277 1.00 0.00 H new ATOM 0 HG3 GLU A 69 15.392 0.513 -5.992 1.00 0.00 H new ATOM 1184 N LYS A 70 14.456 2.514 -6.775 1.00 0.00 N ATOM 1185 CA LYS A 70 13.633 2.546 -7.987 1.00 0.00 C ATOM 1186 C LYS A 70 12.732 3.767 -7.983 1.00 0.00 C ATOM 1187 O LYS A 70 12.173 4.148 -9.012 1.00 0.00 O ATOM 1188 CB LYS A 70 12.796 1.255 -8.092 1.00 0.00 C ATOM 1189 CG LYS A 70 13.622 -0.026 -8.266 1.00 0.00 C ATOM 1190 CD LYS A 70 12.728 -1.261 -8.343 1.00 0.00 C ATOM 1191 CE LYS A 70 13.531 -2.547 -8.576 1.00 0.00 C ATOM 1192 NZ LYS A 70 14.431 -2.901 -7.444 1.00 0.00 N ATOM 0 H LYS A 70 14.034 1.997 -6.004 1.00 0.00 H new ATOM 0 HA LYS A 70 14.289 2.608 -8.856 1.00 0.00 H new ATOM 0 HB2 LYS A 70 12.185 1.159 -7.194 1.00 0.00 H new ATOM 0 HB3 LYS A 70 12.112 1.348 -8.935 1.00 0.00 H new ATOM 0 HG2 LYS A 70 14.222 0.047 -9.173 1.00 0.00 H new ATOM 0 HG3 LYS A 70 14.316 -0.129 -7.432 1.00 0.00 H new ATOM 0 HD2 LYS A 70 12.159 -1.353 -7.418 1.00 0.00 H new ATOM 0 HD3 LYS A 70 12.006 -1.135 -9.150 1.00 0.00 H new ATOM 0 HE2 LYS A 70 12.839 -3.371 -8.750 1.00 0.00 H new ATOM 0 HE3 LYS A 70 14.127 -2.434 -9.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 14.865 -3.829 -7.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 15.177 -2.181 -7.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 13.881 -2.940 -6.562 1.00 0.00 H new ATOM 1206 N VAL A 71 12.616 4.356 -6.796 1.00 0.00 N ATOM 1207 CA VAL A 71 11.834 5.552 -6.513 1.00 0.00 C ATOM 1208 C VAL A 71 10.369 5.283 -6.797 1.00 0.00 C ATOM 1209 O VAL A 71 9.746 5.915 -7.634 1.00 0.00 O ATOM 1210 CB VAL A 71 12.338 6.810 -7.283 1.00 0.00 C ATOM 1211 CG1 VAL A 71 11.667 8.058 -6.769 1.00 0.00 C ATOM 1212 CG2 VAL A 71 13.825 6.953 -7.162 1.00 0.00 C ATOM 0 H VAL A 71 13.088 3.994 -5.967 1.00 0.00 H new ATOM 0 HA VAL A 71 11.962 5.783 -5.455 1.00 0.00 H new ATOM 0 HB VAL A 71 12.081 6.677 -8.334 1.00 0.00 H new ATOM 0 HG11 VAL A 71 12.035 8.923 -7.321 1.00 0.00 H new ATOM 0 HG12 VAL A 71 10.589 7.973 -6.904 1.00 0.00 H new ATOM 0 HG13 VAL A 71 11.892 8.182 -5.710 1.00 0.00 H new ATOM 0 HG21 VAL A 71 14.151 7.838 -7.708 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.096 7.054 -6.111 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.310 6.070 -7.579 1.00 0.00 H new ATOM 1222 N VAL A 72 9.834 4.317 -6.104 1.00 0.00 N ATOM 1223 CA VAL A 72 8.477 3.883 -6.333 1.00 0.00 C ATOM 1224 C VAL A 72 7.802 3.464 -5.050 1.00 0.00 C ATOM 1225 O VAL A 72 8.459 3.039 -4.090 1.00 0.00 O ATOM 1226 CB VAL A 72 8.404 2.687 -7.338 1.00 0.00 C ATOM 1227 CG1 VAL A 72 8.774 3.103 -8.734 1.00 0.00 C ATOM 1228 CG2 VAL A 72 9.290 1.544 -6.895 1.00 0.00 C ATOM 0 H VAL A 72 10.321 3.808 -5.366 1.00 0.00 H new ATOM 0 HA VAL A 72 7.959 4.743 -6.758 1.00 0.00 H new ATOM 0 HB VAL A 72 7.368 2.350 -7.346 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.710 2.242 -9.399 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.088 3.878 -9.077 1.00 0.00 H new ATOM 0 HG13 VAL A 72 9.793 3.491 -8.740 1.00 0.00 H new ATOM 0 HG21 VAL A 72 9.218 0.728 -7.614 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.323 1.886 -6.837 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.968 1.193 -5.914 1.00 0.00 H new ATOM 1238 N VAL A 73 6.520 3.631 -5.024 1.00 0.00 N ATOM 1239 CA VAL A 73 5.682 3.140 -3.988 1.00 0.00 C ATOM 1240 C VAL A 73 4.998 1.934 -4.566 1.00 0.00 C ATOM 1241 O VAL A 73 4.066 2.057 -5.357 1.00 0.00 O ATOM 1242 CB VAL A 73 4.634 4.193 -3.538 1.00 0.00 C ATOM 1243 CG1 VAL A 73 3.687 3.628 -2.488 1.00 0.00 C ATOM 1244 CG2 VAL A 73 5.334 5.417 -2.991 1.00 0.00 C ATOM 0 H VAL A 73 6.012 4.132 -5.753 1.00 0.00 H new ATOM 0 HA VAL A 73 6.265 2.901 -3.099 1.00 0.00 H new ATOM 0 HB VAL A 73 4.042 4.468 -4.411 1.00 0.00 H new ATOM 0 HG11 VAL A 73 2.968 4.394 -2.197 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.157 2.770 -2.901 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.258 3.316 -1.614 1.00 0.00 H new ATOM 0 HG21 VAL A 73 4.592 6.151 -2.677 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.948 5.134 -2.136 1.00 0.00 H new ATOM 0 HG23 VAL A 73 5.968 5.850 -3.765 1.00 0.00 H new ATOM 1254 N PHE A 74 5.517 0.798 -4.253 1.00 0.00 N ATOM 1255 CA PHE A 74 5.037 -0.422 -4.807 1.00 0.00 C ATOM 1256 C PHE A 74 4.019 -1.035 -3.873 1.00 0.00 C ATOM 1257 O PHE A 74 4.365 -1.673 -2.887 1.00 0.00 O ATOM 1258 CB PHE A 74 6.236 -1.346 -5.080 1.00 0.00 C ATOM 1259 CG PHE A 74 5.939 -2.702 -5.668 1.00 0.00 C ATOM 1260 CD1 PHE A 74 4.836 -2.929 -6.493 1.00 0.00 C ATOM 1261 CD2 PHE A 74 6.790 -3.758 -5.393 1.00 0.00 C ATOM 1262 CE1 PHE A 74 4.604 -4.179 -7.013 1.00 0.00 C ATOM 1263 CE2 PHE A 74 6.558 -5.005 -5.916 1.00 0.00 C ATOM 1264 CZ PHE A 74 5.467 -5.215 -6.726 1.00 0.00 C ATOM 0 H PHE A 74 6.293 0.687 -3.600 1.00 0.00 H new ATOM 0 HA PHE A 74 4.530 -0.251 -5.757 1.00 0.00 H new ATOM 0 HB2 PHE A 74 6.916 -0.827 -5.755 1.00 0.00 H new ATOM 0 HB3 PHE A 74 6.769 -1.494 -4.141 1.00 0.00 H new ATOM 0 HD1 PHE A 74 4.162 -2.118 -6.724 1.00 0.00 H new ATOM 0 HD2 PHE A 74 7.649 -3.598 -4.758 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.746 -4.350 -7.646 1.00 0.00 H new ATOM 0 HE2 PHE A 74 7.231 -5.820 -5.692 1.00 0.00 H new ATOM 0 HZ PHE A 74 5.285 -6.196 -7.139 1.00 0.00 H new ATOM 1274 N VAL A 75 2.773 -0.779 -4.156 1.00 0.00 N ATOM 1275 CA VAL A 75 1.683 -1.268 -3.361 1.00 0.00 C ATOM 1276 C VAL A 75 1.511 -2.752 -3.602 1.00 0.00 C ATOM 1277 O VAL A 75 1.381 -3.191 -4.742 1.00 0.00 O ATOM 1278 CB VAL A 75 0.369 -0.526 -3.674 1.00 0.00 C ATOM 1279 CG1 VAL A 75 -0.753 -1.014 -2.770 1.00 0.00 C ATOM 1280 CG2 VAL A 75 0.558 0.981 -3.535 1.00 0.00 C ATOM 0 H VAL A 75 2.482 -0.217 -4.956 1.00 0.00 H new ATOM 0 HA VAL A 75 1.919 -1.087 -2.313 1.00 0.00 H new ATOM 0 HB VAL A 75 0.091 -0.742 -4.706 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -1.671 -0.477 -3.008 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.907 -2.082 -2.925 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.486 -0.833 -1.729 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.381 1.488 -3.760 1.00 0.00 H new ATOM 0 HG22 VAL A 75 0.862 1.217 -2.515 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.327 1.317 -4.230 1.00 0.00 H new ATOM 1290 N ILE A 76 1.533 -3.502 -2.544 1.00 0.00 N ATOM 1291 CA ILE A 76 1.455 -4.935 -2.617 1.00 0.00 C ATOM 1292 C ILE A 76 0.045 -5.415 -2.315 1.00 0.00 C ATOM 1293 O ILE A 76 -0.476 -6.287 -2.983 1.00 0.00 O ATOM 1294 CB ILE A 76 2.438 -5.590 -1.610 1.00 0.00 C ATOM 1295 CG1 ILE A 76 3.878 -5.094 -1.844 1.00 0.00 C ATOM 1296 CG2 ILE A 76 2.372 -7.117 -1.714 1.00 0.00 C ATOM 1297 CD1 ILE A 76 4.471 -5.514 -3.163 1.00 0.00 C ATOM 0 H ILE A 76 1.606 -3.137 -1.594 1.00 0.00 H new ATOM 0 HA ILE A 76 1.726 -5.228 -3.631 1.00 0.00 H new ATOM 0 HB ILE A 76 2.139 -5.297 -0.604 1.00 0.00 H new ATOM 0 HG12 ILE A 76 3.889 -4.006 -1.784 1.00 0.00 H new ATOM 0 HG13 ILE A 76 4.513 -5.464 -1.039 1.00 0.00 H new ATOM 0 HG21 ILE A 76 3.067 -7.561 -1.001 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.360 -7.453 -1.491 1.00 0.00 H new ATOM 0 HG23 ILE A 76 2.642 -7.425 -2.724 1.00 0.00 H new ATOM 0 HD11 ILE A 76 5.485 -5.123 -3.247 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.495 -6.602 -3.221 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.862 -5.121 -3.977 1.00 0.00 H new ATOM 1309 N SER A 77 -0.572 -4.861 -1.305 1.00 0.00 N ATOM 1310 CA SER A 77 -1.878 -5.327 -0.902 1.00 0.00 C ATOM 1311 C SER A 77 -2.806 -4.162 -0.603 1.00 0.00 C ATOM 1312 O SER A 77 -2.349 -3.079 -0.259 1.00 0.00 O ATOM 1313 CB SER A 77 -1.723 -6.251 0.302 1.00 0.00 C ATOM 1314 OG SER A 77 -0.838 -7.315 -0.025 1.00 0.00 O ATOM 0 H SER A 77 -0.198 -4.093 -0.748 1.00 0.00 H new ATOM 0 HA SER A 77 -2.335 -5.886 -1.719 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.337 -5.692 1.155 1.00 0.00 H new ATOM 0 HB3 SER A 77 -2.694 -6.649 0.595 1.00 0.00 H new ATOM 0 HG SER A 77 -0.366 -7.608 0.782 1.00 0.00 H new ATOM 1320 N VAL A 78 -4.095 -4.385 -0.769 1.00 0.00 N ATOM 1321 CA VAL A 78 -5.126 -3.378 -0.552 1.00 0.00 C ATOM 1322 C VAL A 78 -6.384 -4.097 -0.060 1.00 0.00 C ATOM 1323 O VAL A 78 -6.821 -5.065 -0.676 1.00 0.00 O ATOM 1324 CB VAL A 78 -5.502 -2.605 -1.875 1.00 0.00 C ATOM 1325 CG1 VAL A 78 -6.588 -1.585 -1.617 1.00 0.00 C ATOM 1326 CG2 VAL A 78 -4.310 -1.922 -2.519 1.00 0.00 C ATOM 0 H VAL A 78 -4.467 -5.288 -1.064 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.745 -2.653 0.167 1.00 0.00 H new ATOM 0 HB VAL A 78 -5.866 -3.361 -2.571 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.828 -1.067 -2.545 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -7.479 -2.089 -1.242 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.241 -0.863 -0.878 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -4.631 -1.407 -3.425 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.884 -1.200 -1.822 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -3.557 -2.668 -2.773 1.00 0.00 H new ATOM 1336 N GLY A 79 -6.925 -3.674 1.048 1.00 0.00 N ATOM 1337 CA GLY A 79 -8.149 -4.260 1.520 1.00 0.00 C ATOM 1338 C GLY A 79 -8.133 -4.455 3.000 1.00 0.00 C ATOM 1339 O GLY A 79 -7.252 -3.928 3.688 1.00 0.00 O ATOM 0 H GLY A 79 -6.543 -2.933 1.636 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.988 -3.620 1.246 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.306 -5.220 1.028 1.00 0.00 H new ATOM 1343 N LYS A 80 -9.072 -5.209 3.505 1.00 0.00 N ATOM 1344 CA LYS A 80 -9.182 -5.414 4.922 1.00 0.00 C ATOM 1345 C LYS A 80 -8.560 -6.720 5.367 1.00 0.00 C ATOM 1346 O LYS A 80 -9.148 -7.794 5.218 1.00 0.00 O ATOM 1347 CB LYS A 80 -10.638 -5.347 5.400 1.00 0.00 C ATOM 1348 CG LYS A 80 -11.308 -4.003 5.178 1.00 0.00 C ATOM 1349 CD LYS A 80 -12.727 -3.966 5.734 1.00 0.00 C ATOM 1350 CE LYS A 80 -12.737 -4.105 7.250 1.00 0.00 C ATOM 1351 NZ LYS A 80 -14.097 -4.060 7.805 1.00 0.00 N ATOM 0 H LYS A 80 -9.777 -5.695 2.950 1.00 0.00 H new ATOM 0 HA LYS A 80 -8.625 -4.598 5.382 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -11.213 -6.116 4.884 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -10.670 -5.584 6.463 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -10.714 -3.221 5.651 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -11.332 -3.783 4.111 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -13.205 -3.029 5.451 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -13.314 -4.770 5.290 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -12.264 -5.046 7.529 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -12.141 -3.306 7.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -14.053 -4.158 8.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -14.541 -3.152 7.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -14.660 -4.838 7.407 1.00 0.00 H new ATOM 1715 N GLU B 54 -2.062 -8.502 13.446 1.00 0.00 N ATOM 1716 CA GLU B 54 -2.472 -8.085 12.123 1.00 0.00 C ATOM 1717 C GLU B 54 -1.237 -7.915 11.261 1.00 0.00 C ATOM 1718 O GLU B 54 -1.235 -8.236 10.097 1.00 0.00 O ATOM 1719 CB GLU B 54 -3.247 -6.775 12.167 1.00 0.00 C ATOM 1720 CG GLU B 54 -2.553 -5.686 12.963 1.00 0.00 C ATOM 1721 CD GLU B 54 -3.160 -4.347 12.755 1.00 0.00 C ATOM 1722 OE1 GLU B 54 -4.272 -4.093 13.238 1.00 0.00 O ATOM 1723 OE2 GLU B 54 -2.557 -3.521 12.039 1.00 0.00 O ATOM 0 HA GLU B 54 -3.129 -8.848 11.705 1.00 0.00 H new ATOM 0 HB2 GLU B 54 -3.407 -6.423 11.148 1.00 0.00 H new ATOM 0 HB3 GLU B 54 -4.231 -6.959 12.599 1.00 0.00 H new ATOM 0 HG2 GLU B 54 -2.591 -5.937 14.023 1.00 0.00 H new ATOM 0 HG3 GLU B 54 -1.501 -5.651 12.681 1.00 0.00 H new ATOM 1730 N ASP B 55 -0.162 -7.452 11.875 1.00 0.00 N ATOM 1731 CA ASP B 55 1.101 -7.246 11.189 1.00 0.00 C ATOM 1732 C ASP B 55 1.626 -8.566 10.692 1.00 0.00 C ATOM 1733 O ASP B 55 2.232 -8.643 9.637 1.00 0.00 O ATOM 1734 CB ASP B 55 2.117 -6.578 12.117 1.00 0.00 C ATOM 1735 CG ASP B 55 1.664 -5.215 12.561 1.00 0.00 C ATOM 1736 OD1 ASP B 55 0.840 -5.122 13.485 1.00 0.00 O ATOM 1737 OD2 ASP B 55 2.089 -4.211 11.974 1.00 0.00 O ATOM 0 H ASP B 55 -0.141 -7.208 12.865 1.00 0.00 H new ATOM 0 HA ASP B 55 0.938 -6.584 10.338 1.00 0.00 H new ATOM 0 HB2 ASP B 55 2.279 -7.209 12.991 1.00 0.00 H new ATOM 0 HB3 ASP B 55 3.075 -6.492 11.604 1.00 0.00 H new ATOM 1742 N ALA B 56 1.319 -9.612 11.436 1.00 0.00 N ATOM 1743 CA ALA B 56 1.709 -10.966 11.071 1.00 0.00 C ATOM 1744 C ALA B 56 0.881 -11.470 9.881 1.00 0.00 C ATOM 1745 O ALA B 56 1.317 -12.349 9.147 1.00 0.00 O ATOM 1746 CB ALA B 56 1.573 -11.904 12.260 1.00 0.00 C ATOM 0 H ALA B 56 0.794 -9.550 12.308 1.00 0.00 H new ATOM 0 HA ALA B 56 2.757 -10.948 10.770 1.00 0.00 H new ATOM 0 HB1 ALA B 56 1.870 -12.911 11.965 1.00 0.00 H new ATOM 0 HB2 ALA B 56 2.215 -11.559 13.071 1.00 0.00 H new ATOM 0 HB3 ALA B 56 0.537 -11.915 12.598 1.00 0.00 H new ATOM 1752 N GLU B 57 -0.286 -10.859 9.668 1.00 0.00 N ATOM 1753 CA GLU B 57 -1.175 -11.229 8.577 1.00 0.00 C ATOM 1754 C GLU B 57 -0.620 -10.605 7.320 1.00 0.00 C ATOM 1755 O GLU B 57 -0.472 -11.245 6.289 1.00 0.00 O ATOM 1756 CB GLU B 57 -2.595 -10.669 8.853 1.00 0.00 C ATOM 1757 CG GLU B 57 -3.636 -10.909 7.758 1.00 0.00 C ATOM 1758 CD GLU B 57 -4.192 -12.310 7.726 1.00 0.00 C ATOM 1759 OE1 GLU B 57 -3.443 -13.273 7.457 1.00 0.00 O ATOM 1760 OE2 GLU B 57 -5.410 -12.471 7.937 1.00 0.00 O ATOM 0 H GLU B 57 -0.636 -10.096 10.248 1.00 0.00 H new ATOM 0 HA GLU B 57 -1.242 -12.312 8.477 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -2.964 -11.109 9.780 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -2.514 -9.595 9.020 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -4.459 -10.207 7.895 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -3.186 -10.687 6.790 1.00 0.00 H new ATOM 1767 N LEU B 58 -0.251 -9.355 7.441 1.00 0.00 N ATOM 1768 CA LEU B 58 0.251 -8.612 6.323 1.00 0.00 C ATOM 1769 C LEU B 58 1.638 -9.045 5.877 1.00 0.00 C ATOM 1770 O LEU B 58 1.917 -9.008 4.697 1.00 0.00 O ATOM 1771 CB LEU B 58 0.180 -7.095 6.531 1.00 0.00 C ATOM 1772 CG LEU B 58 -1.210 -6.433 6.456 1.00 0.00 C ATOM 1773 CD1 LEU B 58 -1.966 -6.856 5.205 1.00 0.00 C ATOM 1774 CD2 LEU B 58 -2.045 -6.661 7.696 1.00 0.00 C ATOM 0 H LEU B 58 -0.291 -8.830 8.314 1.00 0.00 H new ATOM 0 HA LEU B 58 -0.427 -8.857 5.505 1.00 0.00 H new ATOM 0 HB2 LEU B 58 0.609 -6.868 7.507 1.00 0.00 H new ATOM 0 HB3 LEU B 58 0.819 -6.622 5.785 1.00 0.00 H new ATOM 0 HG LEU B 58 -1.026 -5.360 6.398 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -2.941 -6.369 5.187 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -1.399 -6.565 4.321 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -2.101 -7.938 5.209 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -3.011 -6.170 7.580 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -2.197 -7.731 7.841 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -1.530 -6.247 8.563 1.00 0.00 H new ATOM 1786 N VAL B 59 2.504 -9.472 6.802 1.00 0.00 N ATOM 1787 CA VAL B 59 3.862 -9.883 6.401 1.00 0.00 C ATOM 1788 C VAL B 59 3.853 -11.127 5.518 1.00 0.00 C ATOM 1789 O VAL B 59 4.666 -11.245 4.605 1.00 0.00 O ATOM 1790 CB VAL B 59 4.852 -10.092 7.579 1.00 0.00 C ATOM 1791 CG1 VAL B 59 5.066 -8.816 8.368 1.00 0.00 C ATOM 1792 CG2 VAL B 59 4.415 -11.233 8.474 1.00 0.00 C ATOM 0 H VAL B 59 2.304 -9.543 7.800 1.00 0.00 H new ATOM 0 HA VAL B 59 4.229 -9.032 5.828 1.00 0.00 H new ATOM 0 HB VAL B 59 5.814 -10.366 7.146 1.00 0.00 H new ATOM 0 HG11 VAL B 59 5.765 -9.005 9.183 1.00 0.00 H new ATOM 0 HG12 VAL B 59 5.473 -8.047 7.712 1.00 0.00 H new ATOM 0 HG13 VAL B 59 4.114 -8.477 8.777 1.00 0.00 H new ATOM 0 HG21 VAL B 59 5.130 -11.352 9.288 1.00 0.00 H new ATOM 0 HG22 VAL B 59 3.430 -11.015 8.886 1.00 0.00 H new ATOM 0 HG23 VAL B 59 4.370 -12.154 7.893 1.00 0.00 H new ATOM 1802 N GLU B 60 2.930 -12.035 5.767 1.00 0.00 N ATOM 1803 CA GLU B 60 2.853 -13.234 4.981 1.00 0.00 C ATOM 1804 C GLU B 60 2.219 -12.967 3.625 1.00 0.00 C ATOM 1805 O GLU B 60 2.634 -13.536 2.622 1.00 0.00 O ATOM 1806 CB GLU B 60 2.173 -14.376 5.737 1.00 0.00 C ATOM 1807 CG GLU B 60 0.822 -14.040 6.320 1.00 0.00 C ATOM 1808 CD GLU B 60 0.219 -15.203 7.032 1.00 0.00 C ATOM 1809 OE1 GLU B 60 0.688 -15.562 8.124 1.00 0.00 O ATOM 1810 OE2 GLU B 60 -0.706 -15.832 6.487 1.00 0.00 O ATOM 0 H GLU B 60 2.230 -11.959 6.505 1.00 0.00 H new ATOM 0 HA GLU B 60 3.873 -13.567 4.791 1.00 0.00 H new ATOM 0 HB2 GLU B 60 2.059 -15.223 5.060 1.00 0.00 H new ATOM 0 HB3 GLU B 60 2.830 -14.699 6.544 1.00 0.00 H new ATOM 0 HG2 GLU B 60 0.923 -13.204 7.012 1.00 0.00 H new ATOM 0 HG3 GLU B 60 0.153 -13.716 5.523 1.00 0.00 H new ATOM 1817 N ILE B 61 1.263 -12.052 3.588 1.00 0.00 N ATOM 1818 CA ILE B 61 0.609 -11.693 2.338 1.00 0.00 C ATOM 1819 C ILE B 61 1.585 -10.949 1.409 1.00 0.00 C ATOM 1820 O ILE B 61 1.636 -11.219 0.203 1.00 0.00 O ATOM 1821 CB ILE B 61 -0.686 -10.848 2.573 1.00 0.00 C ATOM 1822 CG1 ILE B 61 -1.694 -11.653 3.412 1.00 0.00 C ATOM 1823 CG2 ILE B 61 -1.320 -10.434 1.240 1.00 0.00 C ATOM 1824 CD1 ILE B 61 -2.967 -10.899 3.761 1.00 0.00 C ATOM 0 H ILE B 61 0.923 -11.546 4.406 1.00 0.00 H new ATOM 0 HA ILE B 61 0.304 -12.621 1.854 1.00 0.00 H new ATOM 0 HB ILE B 61 -0.411 -9.943 3.114 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -1.961 -12.558 2.867 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -1.209 -11.969 4.336 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -2.219 -9.848 1.431 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -0.610 -9.835 0.670 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -1.583 -11.325 0.670 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -3.620 -11.541 4.353 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -2.716 -10.008 4.336 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -3.480 -10.607 2.845 1.00 0.00 H new ATOM 1836 N VAL B 62 2.397 -10.057 1.978 1.00 0.00 N ATOM 1837 CA VAL B 62 3.355 -9.293 1.183 1.00 0.00 C ATOM 1838 C VAL B 62 4.443 -10.191 0.604 1.00 0.00 C ATOM 1839 O VAL B 62 4.692 -10.146 -0.593 1.00 0.00 O ATOM 1840 CB VAL B 62 3.970 -8.035 1.932 1.00 0.00 C ATOM 1841 CG1 VAL B 62 4.646 -8.405 3.227 1.00 0.00 C ATOM 1842 CG2 VAL B 62 4.960 -7.288 1.048 1.00 0.00 C ATOM 0 H VAL B 62 2.410 -9.848 2.976 1.00 0.00 H new ATOM 0 HA VAL B 62 2.777 -8.878 0.357 1.00 0.00 H new ATOM 0 HB VAL B 62 3.125 -7.385 2.161 1.00 0.00 H new ATOM 0 HG11 VAL B 62 5.048 -7.507 3.697 1.00 0.00 H new ATOM 0 HG12 VAL B 62 3.922 -8.871 3.895 1.00 0.00 H new ATOM 0 HG13 VAL B 62 5.458 -9.105 3.027 1.00 0.00 H new ATOM 0 HG21 VAL B 62 5.361 -6.433 1.593 1.00 0.00 H new ATOM 0 HG22 VAL B 62 5.775 -7.956 0.770 1.00 0.00 H new ATOM 0 HG23 VAL B 62 4.453 -6.939 0.148 1.00 0.00 H new ATOM 1852 N LYS B 63 5.025 -11.062 1.435 1.00 0.00 N ATOM 1853 CA LYS B 63 6.104 -11.945 0.982 1.00 0.00 C ATOM 1854 C LYS B 63 5.587 -12.936 -0.064 1.00 0.00 C ATOM 1855 O LYS B 63 6.306 -13.311 -0.991 1.00 0.00 O ATOM 1856 CB LYS B 63 6.760 -12.678 2.168 1.00 0.00 C ATOM 1857 CG LYS B 63 5.842 -13.648 2.894 1.00 0.00 C ATOM 1858 CD LYS B 63 6.515 -14.304 4.103 1.00 0.00 C ATOM 1859 CE LYS B 63 7.777 -15.058 3.701 1.00 0.00 C ATOM 1860 NZ LYS B 63 8.320 -15.875 4.806 1.00 0.00 N ATOM 0 H LYS B 63 4.770 -11.174 2.416 1.00 0.00 H new ATOM 0 HA LYS B 63 6.871 -11.328 0.514 1.00 0.00 H new ATOM 0 HB2 LYS B 63 7.631 -13.224 1.805 1.00 0.00 H new ATOM 0 HB3 LYS B 63 7.123 -11.938 2.881 1.00 0.00 H new ATOM 0 HG2 LYS B 63 4.948 -13.119 3.224 1.00 0.00 H new ATOM 0 HG3 LYS B 63 5.516 -14.423 2.200 1.00 0.00 H new ATOM 0 HD2 LYS B 63 6.766 -13.541 4.840 1.00 0.00 H new ATOM 0 HD3 LYS B 63 5.817 -14.991 4.581 1.00 0.00 H new ATOM 0 HE2 LYS B 63 7.557 -15.703 2.850 1.00 0.00 H new ATOM 0 HE3 LYS B 63 8.534 -14.346 3.373 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 9.177 -16.368 4.484 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 8.556 -15.259 5.610 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 7.609 -16.574 5.103 1.00 0.00 H new ATOM 1874 N GLU B 64 4.320 -13.311 0.073 1.00 0.00 N ATOM 1875 CA GLU B 64 3.663 -14.192 -0.864 1.00 0.00 C ATOM 1876 C GLU B 64 3.550 -13.523 -2.220 1.00 0.00 C ATOM 1877 O GLU B 64 3.984 -14.062 -3.227 1.00 0.00 O ATOM 1878 CB GLU B 64 2.270 -14.546 -0.367 1.00 0.00 C ATOM 1879 CG GLU B 64 1.439 -15.311 -1.372 1.00 0.00 C ATOM 1880 CD GLU B 64 1.910 -16.732 -1.605 1.00 0.00 C ATOM 1881 OE1 GLU B 64 2.864 -16.948 -2.382 1.00 0.00 O ATOM 1882 OE2 GLU B 64 1.326 -17.668 -1.027 1.00 0.00 O ATOM 0 H GLU B 64 3.724 -13.007 0.843 1.00 0.00 H new ATOM 0 HA GLU B 64 4.258 -15.101 -0.954 1.00 0.00 H new ATOM 0 HB2 GLU B 64 2.359 -15.139 0.543 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.746 -13.628 -0.100 1.00 0.00 H new ATOM 0 HG2 GLU B 64 0.404 -15.333 -1.031 1.00 0.00 H new ATOM 0 HG3 GLU B 64 1.450 -14.775 -2.321 1.00 0.00 H new ATOM 1889 N ARG B 65 2.983 -12.339 -2.242 1.00 0.00 N ATOM 1890 CA ARG B 65 2.806 -11.634 -3.490 1.00 0.00 C ATOM 1891 C ARG B 65 4.129 -11.173 -4.022 1.00 0.00 C ATOM 1892 O ARG B 65 4.295 -11.033 -5.191 1.00 0.00 O ATOM 1893 CB ARG B 65 1.875 -10.437 -3.353 1.00 0.00 C ATOM 1894 CG ARG B 65 0.461 -10.772 -2.951 1.00 0.00 C ATOM 1895 CD ARG B 65 -0.407 -9.540 -3.016 1.00 0.00 C ATOM 1896 NE ARG B 65 -1.767 -9.792 -2.541 1.00 0.00 N ATOM 1897 CZ ARG B 65 -2.814 -8.999 -2.770 1.00 0.00 C ATOM 1898 NH1 ARG B 65 -2.713 -7.992 -3.636 1.00 0.00 N ATOM 1899 NH2 ARG B 65 -3.977 -9.264 -2.180 1.00 0.00 N ATOM 0 H ARG B 65 2.639 -11.847 -1.417 1.00 0.00 H new ATOM 0 HA ARG B 65 2.349 -12.337 -4.186 1.00 0.00 H new ATOM 0 HB2 ARG B 65 2.294 -9.753 -2.615 1.00 0.00 H new ATOM 0 HB3 ARG B 65 1.850 -9.905 -4.304 1.00 0.00 H new ATOM 0 HG2 ARG B 65 0.061 -11.542 -3.610 1.00 0.00 H new ATOM 0 HG3 ARG B 65 0.450 -11.180 -1.940 1.00 0.00 H new ATOM 0 HD2 ARG B 65 0.044 -8.749 -2.417 1.00 0.00 H new ATOM 0 HD3 ARG B 65 -0.445 -9.179 -4.044 1.00 0.00 H new ATOM 0 HE ARG B 65 -1.926 -10.638 -1.994 1.00 0.00 H new ATOM 0 HH11 ARG B 65 -1.833 -7.826 -4.125 1.00 0.00 H new ATOM 0 HH12 ARG B 65 -3.515 -7.386 -3.810 1.00 0.00 H new ATOM 0 HH21 ARG B 65 -4.062 -10.068 -1.558 1.00 0.00 H new ATOM 0 HH22 ARG B 65 -4.783 -8.663 -2.349 1.00 0.00 H new ATOM 1913 N LEU B 66 5.093 -11.026 -3.146 1.00 0.00 N ATOM 1914 CA LEU B 66 6.389 -10.476 -3.515 1.00 0.00 C ATOM 1915 C LEU B 66 7.183 -11.429 -4.428 1.00 0.00 C ATOM 1916 O LEU B 66 8.129 -11.010 -5.119 1.00 0.00 O ATOM 1917 CB LEU B 66 7.191 -10.131 -2.260 1.00 0.00 C ATOM 1918 CG LEU B 66 8.320 -9.125 -2.428 1.00 0.00 C ATOM 1919 CD1 LEU B 66 7.759 -7.789 -2.887 1.00 0.00 C ATOM 1920 CD2 LEU B 66 9.069 -8.960 -1.126 1.00 0.00 C ATOM 0 H LEU B 66 5.010 -11.280 -2.162 1.00 0.00 H new ATOM 0 HA LEU B 66 6.212 -9.564 -4.085 1.00 0.00 H new ATOM 0 HB2 LEU B 66 6.501 -9.746 -1.510 1.00 0.00 H new ATOM 0 HB3 LEU B 66 7.613 -11.053 -1.861 1.00 0.00 H new ATOM 0 HG LEU B 66 9.014 -9.494 -3.183 1.00 0.00 H new ATOM 0 HD11 LEU B 66 8.573 -7.074 -3.005 1.00 0.00 H new ATOM 0 HD12 LEU B 66 7.248 -7.918 -3.841 1.00 0.00 H new ATOM 0 HD13 LEU B 66 7.053 -7.416 -2.144 1.00 0.00 H new ATOM 0 HD21 LEU B 66 9.875 -8.238 -1.259 1.00 0.00 H new ATOM 0 HD22 LEU B 66 8.385 -8.604 -0.356 1.00 0.00 H new ATOM 0 HD23 LEU B 66 9.488 -9.920 -0.823 1.00 0.00 H new ATOM 1932 N ARG B 67 6.802 -12.698 -4.445 1.00 0.00 N ATOM 1933 CA ARG B 67 7.480 -13.664 -5.300 1.00 0.00 C ATOM 1934 C ARG B 67 6.889 -13.673 -6.716 1.00 0.00 C ATOM 1935 O ARG B 67 7.524 -14.149 -7.657 1.00 0.00 O ATOM 1936 CB ARG B 67 7.507 -15.064 -4.669 1.00 0.00 C ATOM 1937 CG ARG B 67 6.146 -15.676 -4.425 1.00 0.00 C ATOM 1938 CD ARG B 67 6.234 -16.919 -3.561 1.00 0.00 C ATOM 1939 NE ARG B 67 6.893 -16.640 -2.267 1.00 0.00 N ATOM 1940 CZ ARG B 67 6.376 -16.897 -1.054 1.00 0.00 C ATOM 1941 NH1 ARG B 67 5.111 -17.280 -0.918 1.00 0.00 N ATOM 1942 NH2 ARG B 67 7.108 -16.684 0.032 1.00 0.00 N ATOM 0 H ARG B 67 6.039 -13.080 -3.886 1.00 0.00 H new ATOM 0 HA ARG B 67 8.519 -13.347 -5.393 1.00 0.00 H new ATOM 0 HB2 ARG B 67 8.078 -15.729 -5.318 1.00 0.00 H new ATOM 0 HB3 ARG B 67 8.041 -15.009 -3.720 1.00 0.00 H new ATOM 0 HG2 ARG B 67 5.499 -14.943 -3.943 1.00 0.00 H new ATOM 0 HG3 ARG B 67 5.685 -15.929 -5.380 1.00 0.00 H new ATOM 0 HD2 ARG B 67 5.232 -17.310 -3.382 1.00 0.00 H new ATOM 0 HD3 ARG B 67 6.788 -17.693 -4.092 1.00 0.00 H new ATOM 0 HE ARG B 67 7.820 -16.216 -2.298 1.00 0.00 H new ATOM 0 HH11 ARG B 67 4.518 -17.383 -1.741 1.00 0.00 H new ATOM 0 HH12 ARG B 67 4.733 -17.471 0.010 1.00 0.00 H new ATOM 0 HH21 ARG B 67 8.059 -16.326 -0.056 1.00 0.00 H new ATOM 0 HH22 ARG B 67 6.719 -16.878 0.955 1.00 0.00 H new ATOM 1956 N ASN B 68 5.694 -13.116 -6.868 1.00 0.00 N ATOM 1957 CA ASN B 68 5.058 -12.986 -8.187 1.00 0.00 C ATOM 1958 C ASN B 68 3.991 -11.876 -8.204 1.00 0.00 C ATOM 1959 O ASN B 68 2.797 -12.134 -8.326 1.00 0.00 O ATOM 1960 CB ASN B 68 4.516 -14.342 -8.752 1.00 0.00 C ATOM 1961 CG ASN B 68 3.509 -15.072 -7.851 1.00 0.00 C ATOM 1962 OD1 ASN B 68 3.890 -15.867 -6.989 1.00 0.00 O ATOM 1963 ND2 ASN B 68 2.234 -14.836 -8.056 1.00 0.00 N ATOM 0 H ASN B 68 5.139 -12.744 -6.097 1.00 0.00 H new ATOM 0 HA ASN B 68 5.849 -12.681 -8.872 1.00 0.00 H new ATOM 0 HB2 ASN B 68 4.045 -14.153 -9.717 1.00 0.00 H new ATOM 0 HB3 ASN B 68 5.362 -15.005 -8.935 1.00 0.00 H new ATOM 0 HD21 ASN B 68 1.530 -15.316 -7.495 1.00 0.00 H new ATOM 0 HD22 ASN B 68 1.947 -14.173 -8.776 1.00 0.00 H new ATOM 1970 N PRO B 69 4.405 -10.609 -8.036 1.00 0.00 N ATOM 1971 CA PRO B 69 3.468 -9.500 -7.991 1.00 0.00 C ATOM 1972 C PRO B 69 3.125 -8.925 -9.364 1.00 0.00 C ATOM 1973 O PRO B 69 1.962 -8.730 -9.678 1.00 0.00 O ATOM 1974 CB PRO B 69 4.189 -8.464 -7.139 1.00 0.00 C ATOM 1975 CG PRO B 69 5.658 -8.739 -7.316 1.00 0.00 C ATOM 1976 CD PRO B 69 5.796 -10.162 -7.808 1.00 0.00 C ATOM 0 HA PRO B 69 2.504 -9.816 -7.592 1.00 0.00 H new ATOM 0 HB2 PRO B 69 3.939 -7.452 -7.459 1.00 0.00 H new ATOM 0 HB3 PRO B 69 3.899 -8.548 -6.092 1.00 0.00 H new ATOM 0 HG2 PRO B 69 6.096 -8.042 -8.031 1.00 0.00 H new ATOM 0 HG3 PRO B 69 6.190 -8.605 -6.374 1.00 0.00 H new ATOM 0 HD2 PRO B 69 6.384 -10.210 -8.724 1.00 0.00 H new ATOM 0 HD3 PRO B 69 6.300 -10.790 -7.073 1.00 0.00 H new ATOM 1984 N LYS B 70 4.154 -8.702 -10.187 1.00 0.00 N ATOM 1985 CA LYS B 70 4.020 -8.059 -11.487 1.00 0.00 C ATOM 1986 C LYS B 70 3.541 -6.623 -11.325 1.00 0.00 C ATOM 1987 O LYS B 70 2.342 -6.341 -11.356 1.00 0.00 O ATOM 1988 CB LYS B 70 3.163 -8.859 -12.514 1.00 0.00 C ATOM 1989 CG LYS B 70 3.826 -10.139 -13.056 1.00 0.00 C ATOM 1990 CD LYS B 70 4.045 -11.195 -11.977 1.00 0.00 C ATOM 1991 CE LYS B 70 4.816 -12.389 -12.502 1.00 0.00 C ATOM 1992 NZ LYS B 70 6.183 -12.029 -12.941 1.00 0.00 N ATOM 0 H LYS B 70 5.113 -8.968 -9.962 1.00 0.00 H new ATOM 0 HA LYS B 70 5.018 -8.044 -11.926 1.00 0.00 H new ATOM 0 HB2 LYS B 70 2.217 -9.129 -12.044 1.00 0.00 H new ATOM 0 HB3 LYS B 70 2.927 -8.206 -13.354 1.00 0.00 H new ATOM 0 HG2 LYS B 70 3.204 -10.558 -13.847 1.00 0.00 H new ATOM 0 HG3 LYS B 70 4.785 -9.883 -13.507 1.00 0.00 H new ATOM 0 HD2 LYS B 70 4.586 -10.753 -11.141 1.00 0.00 H new ATOM 0 HD3 LYS B 70 3.080 -11.526 -11.593 1.00 0.00 H new ATOM 0 HE2 LYS B 70 4.876 -13.150 -11.724 1.00 0.00 H new ATOM 0 HE3 LYS B 70 4.273 -12.830 -13.338 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 6.752 -12.893 -13.049 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 6.135 -11.530 -13.852 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 6.624 -11.411 -12.230 1.00 0.00 H new ATOM 2006 N PRO B 71 4.485 -5.708 -11.034 1.00 0.00 N ATOM 2007 CA PRO B 71 4.176 -4.302 -10.852 1.00 0.00 C ATOM 2008 C PRO B 71 3.847 -3.592 -12.153 1.00 0.00 C ATOM 2009 O PRO B 71 4.585 -3.688 -13.153 1.00 0.00 O ATOM 2010 CB PRO B 71 5.451 -3.721 -10.240 1.00 0.00 C ATOM 2011 CG PRO B 71 6.544 -4.629 -10.682 1.00 0.00 C ATOM 2012 CD PRO B 71 5.926 -5.991 -10.817 1.00 0.00 C ATOM 0 HA PRO B 71 3.290 -4.172 -10.231 1.00 0.00 H new ATOM 0 HB2 PRO B 71 5.623 -2.701 -10.583 1.00 0.00 H new ATOM 0 HB3 PRO B 71 5.385 -3.684 -9.153 1.00 0.00 H new ATOM 0 HG2 PRO B 71 6.967 -4.297 -11.630 1.00 0.00 H new ATOM 0 HG3 PRO B 71 7.358 -4.641 -9.957 1.00 0.00 H new ATOM 0 HD2 PRO B 71 6.355 -6.544 -11.653 1.00 0.00 H new ATOM 0 HD3 PRO B 71 6.085 -6.593 -9.922 1.00 0.00 H new ATOM 2020 N VAL B 72 2.746 -2.920 -12.144 1.00 0.00 N ATOM 2021 CA VAL B 72 2.323 -2.112 -13.246 1.00 0.00 C ATOM 2022 C VAL B 72 2.590 -0.670 -12.869 1.00 0.00 C ATOM 2023 O VAL B 72 2.113 -0.208 -11.823 1.00 0.00 O ATOM 2024 CB VAL B 72 0.810 -2.304 -13.550 1.00 0.00 C ATOM 2025 CG1 VAL B 72 0.382 -1.460 -14.743 1.00 0.00 C ATOM 2026 CG2 VAL B 72 0.491 -3.775 -13.802 1.00 0.00 C ATOM 0 H VAL B 72 2.099 -2.914 -11.356 1.00 0.00 H new ATOM 0 HA VAL B 72 2.869 -2.400 -14.144 1.00 0.00 H new ATOM 0 HB VAL B 72 0.250 -1.972 -12.676 1.00 0.00 H new ATOM 0 HG11 VAL B 72 -0.680 -1.613 -14.934 1.00 0.00 H new ATOM 0 HG12 VAL B 72 0.564 -0.407 -14.528 1.00 0.00 H new ATOM 0 HG13 VAL B 72 0.955 -1.755 -15.622 1.00 0.00 H new ATOM 0 HG21 VAL B 72 -0.573 -3.886 -14.013 1.00 0.00 H new ATOM 0 HG22 VAL B 72 1.069 -4.132 -14.655 1.00 0.00 H new ATOM 0 HG23 VAL B 72 0.749 -4.360 -12.919 1.00 0.00 H new ATOM 2036 N ARG B 73 3.371 0.014 -13.681 1.00 0.00 N ATOM 2037 CA ARG B 73 3.740 1.387 -13.416 1.00 0.00 C ATOM 2038 C ARG B 73 2.560 2.298 -13.690 1.00 0.00 C ATOM 2039 O ARG B 73 2.139 2.495 -14.845 1.00 0.00 O ATOM 2040 CB ARG B 73 4.960 1.775 -14.263 1.00 0.00 C ATOM 2041 CG ARG B 73 5.535 3.169 -14.011 1.00 0.00 C ATOM 2042 CD ARG B 73 5.967 3.364 -12.560 1.00 0.00 C ATOM 2043 NE ARG B 73 6.808 2.264 -12.057 1.00 0.00 N ATOM 2044 CZ ARG B 73 8.150 2.230 -12.047 1.00 0.00 C ATOM 2045 NH1 ARG B 73 8.864 3.172 -12.657 1.00 0.00 N ATOM 2046 NH2 ARG B 73 8.771 1.260 -11.388 1.00 0.00 N ATOM 0 H ARG B 73 3.766 -0.367 -14.541 1.00 0.00 H new ATOM 0 HA ARG B 73 4.014 1.497 -12.367 1.00 0.00 H new ATOM 0 HB2 ARG B 73 5.747 1.042 -14.088 1.00 0.00 H new ATOM 0 HB3 ARG B 73 4.685 1.702 -15.315 1.00 0.00 H new ATOM 0 HG2 ARG B 73 6.390 3.331 -14.667 1.00 0.00 H new ATOM 0 HG3 ARG B 73 4.788 3.920 -14.269 1.00 0.00 H new ATOM 0 HD2 ARG B 73 6.515 4.302 -12.473 1.00 0.00 H new ATOM 0 HD3 ARG B 73 5.081 3.453 -11.932 1.00 0.00 H new ATOM 0 HE ARG B 73 6.324 1.449 -11.680 1.00 0.00 H new ATOM 0 HH11 ARG B 73 8.392 3.935 -13.142 1.00 0.00 H new ATOM 0 HH12 ARG B 73 9.883 3.131 -12.640 1.00 0.00 H new ATOM 0 HH21 ARG B 73 8.229 0.550 -10.896 1.00 0.00 H new ATOM 0 HH22 ARG B 73 9.790 1.225 -11.374 1.00 0.00 H new ATOM 2060 N VAL B 74 2.019 2.829 -12.645 1.00 0.00 N ATOM 2061 CA VAL B 74 0.864 3.665 -12.725 1.00 0.00 C ATOM 2062 C VAL B 74 1.103 4.977 -11.997 1.00 0.00 C ATOM 2063 O VAL B 74 2.187 5.223 -11.454 1.00 0.00 O ATOM 2064 CB VAL B 74 -0.427 2.964 -12.174 1.00 0.00 C ATOM 2065 CG1 VAL B 74 -0.830 1.786 -13.049 1.00 0.00 C ATOM 2066 CG2 VAL B 74 -0.230 2.496 -10.743 1.00 0.00 C ATOM 0 H VAL B 74 2.370 2.694 -11.697 1.00 0.00 H new ATOM 0 HA VAL B 74 0.693 3.866 -13.783 1.00 0.00 H new ATOM 0 HB VAL B 74 -1.227 3.704 -12.193 1.00 0.00 H new ATOM 0 HG11 VAL B 74 -1.728 1.321 -12.642 1.00 0.00 H new ATOM 0 HG12 VAL B 74 -1.030 2.137 -14.061 1.00 0.00 H new ATOM 0 HG13 VAL B 74 -0.021 1.056 -13.071 1.00 0.00 H new ATOM 0 HG21 VAL B 74 -1.141 2.014 -10.389 1.00 0.00 H new ATOM 0 HG22 VAL B 74 0.595 1.785 -10.703 1.00 0.00 H new ATOM 0 HG23 VAL B 74 -0.002 3.352 -10.108 1.00 0.00 H new ATOM 2076 N THR B 75 0.128 5.817 -12.045 1.00 0.00 N ATOM 2077 CA THR B 75 0.141 7.082 -11.390 1.00 0.00 C ATOM 2078 C THR B 75 -1.183 7.243 -10.657 1.00 0.00 C ATOM 2079 O THR B 75 -2.133 6.522 -10.942 1.00 0.00 O ATOM 2080 CB THR B 75 0.344 8.237 -12.415 1.00 0.00 C ATOM 2081 OG1 THR B 75 -0.569 8.085 -13.518 1.00 0.00 O ATOM 2082 CG2 THR B 75 1.775 8.280 -12.939 1.00 0.00 C ATOM 0 H THR B 75 -0.733 5.636 -12.561 1.00 0.00 H new ATOM 0 HA THR B 75 0.971 7.127 -10.685 1.00 0.00 H new ATOM 0 HB THR B 75 0.144 9.175 -11.898 1.00 0.00 H new ATOM 0 HG1 THR B 75 -0.385 7.241 -13.981 1.00 0.00 H new ATOM 0 HG21 THR B 75 1.877 9.099 -13.651 1.00 0.00 H new ATOM 0 HG22 THR B 75 2.462 8.435 -12.107 1.00 0.00 H new ATOM 0 HG23 THR B 75 2.010 7.337 -13.433 1.00 0.00 H new ATOM 2090 N LEU B 76 -1.269 8.182 -9.751 1.00 0.00 N ATOM 2091 CA LEU B 76 -2.514 8.428 -9.020 1.00 0.00 C ATOM 2092 C LEU B 76 -3.450 9.213 -9.898 1.00 0.00 C ATOM 2093 O LEU B 76 -4.640 9.323 -9.641 1.00 0.00 O ATOM 2094 CB LEU B 76 -2.226 9.193 -7.742 1.00 0.00 C ATOM 2095 CG LEU B 76 -1.349 8.459 -6.746 1.00 0.00 C ATOM 2096 CD1 LEU B 76 -0.893 9.389 -5.655 1.00 0.00 C ATOM 2097 CD2 LEU B 76 -2.101 7.289 -6.145 1.00 0.00 C ATOM 0 H LEU B 76 -0.498 8.797 -9.492 1.00 0.00 H new ATOM 0 HA LEU B 76 -2.977 7.478 -8.754 1.00 0.00 H new ATOM 0 HB2 LEU B 76 -1.747 10.137 -8.000 1.00 0.00 H new ATOM 0 HB3 LEU B 76 -3.173 9.438 -7.260 1.00 0.00 H new ATOM 0 HG LEU B 76 -0.472 8.084 -7.274 1.00 0.00 H new ATOM 0 HD11 LEU B 76 -0.265 8.843 -4.951 1.00 0.00 H new ATOM 0 HD12 LEU B 76 -0.322 10.209 -6.091 1.00 0.00 H new ATOM 0 HD13 LEU B 76 -1.761 9.790 -5.132 1.00 0.00 H new ATOM 0 HD21 LEU B 76 -1.459 6.772 -5.432 1.00 0.00 H new ATOM 0 HD22 LEU B 76 -2.992 7.653 -5.633 1.00 0.00 H new ATOM 0 HD23 LEU B 76 -2.394 6.599 -6.937 1.00 0.00 H new ATOM 2109 N ASP B 77 -2.882 9.750 -10.943 1.00 0.00 N ATOM 2110 CA ASP B 77 -3.595 10.519 -11.928 1.00 0.00 C ATOM 2111 C ASP B 77 -4.523 9.618 -12.726 1.00 0.00 C ATOM 2112 O ASP B 77 -5.684 9.948 -12.952 1.00 0.00 O ATOM 2113 CB ASP B 77 -2.594 11.183 -12.867 1.00 0.00 C ATOM 2114 CG ASP B 77 -3.232 12.193 -13.779 1.00 0.00 C ATOM 2115 OD1 ASP B 77 -3.356 13.363 -13.362 1.00 0.00 O ATOM 2116 OD2 ASP B 77 -3.602 11.852 -14.917 1.00 0.00 O ATOM 0 H ASP B 77 -1.885 9.663 -11.139 1.00 0.00 H new ATOM 0 HA ASP B 77 -4.191 11.281 -11.426 1.00 0.00 H new ATOM 0 HB2 ASP B 77 -1.818 11.672 -12.277 1.00 0.00 H new ATOM 0 HB3 ASP B 77 -2.103 10.417 -13.467 1.00 0.00 H new ATOM 2121 N GLU B 78 -4.026 8.447 -13.077 1.00 0.00 N ATOM 2122 CA GLU B 78 -4.761 7.522 -13.938 1.00 0.00 C ATOM 2123 C GLU B 78 -5.665 6.567 -13.146 1.00 0.00 C ATOM 2124 O GLU B 78 -6.463 5.835 -13.738 1.00 0.00 O ATOM 2125 CB GLU B 78 -3.778 6.721 -14.796 1.00 0.00 C ATOM 2126 CG GLU B 78 -2.822 5.870 -13.983 1.00 0.00 C ATOM 2127 CD GLU B 78 -1.775 5.196 -14.812 1.00 0.00 C ATOM 2128 OE1 GLU B 78 -2.039 4.118 -15.370 1.00 0.00 O ATOM 2129 OE2 GLU B 78 -0.645 5.734 -14.888 1.00 0.00 O ATOM 0 H GLU B 78 -3.111 8.107 -12.780 1.00 0.00 H new ATOM 0 HA GLU B 78 -5.411 8.122 -14.575 1.00 0.00 H new ATOM 0 HB2 GLU B 78 -4.340 6.077 -15.473 1.00 0.00 H new ATOM 0 HB3 GLU B 78 -3.203 7.410 -15.415 1.00 0.00 H new ATOM 0 HG2 GLU B 78 -2.335 6.497 -13.235 1.00 0.00 H new ATOM 0 HG3 GLU B 78 -3.391 5.113 -13.443 1.00 0.00 H new ATOM 2136 N LEU B 79 -5.519 6.540 -11.829 1.00 0.00 N ATOM 2137 CA LEU B 79 -6.337 5.653 -11.011 1.00 0.00 C ATOM 2138 C LEU B 79 -7.759 6.172 -10.892 1.00 0.00 C ATOM 2139 O LEU B 79 -7.963 7.197 -10.228 1.00 0.00 O ATOM 2140 CB LEU B 79 -5.737 5.423 -9.621 1.00 0.00 C ATOM 2141 CG LEU B 79 -4.343 4.791 -9.565 1.00 0.00 C ATOM 2142 CD1 LEU B 79 -3.961 4.493 -8.133 1.00 0.00 C ATOM 2143 CD2 LEU B 79 -4.263 3.531 -10.414 1.00 0.00 C ATOM 2144 OXT LEU B 79 -8.693 5.525 -11.421 1.00 0.00 O ATOM 0 H LEU B 79 -4.853 7.112 -11.309 1.00 0.00 H new ATOM 0 HA LEU B 79 -6.357 4.691 -11.522 1.00 0.00 H new ATOM 0 HB2 LEU B 79 -5.695 6.383 -9.106 1.00 0.00 H new ATOM 0 HB3 LEU B 79 -6.420 4.788 -9.057 1.00 0.00 H new ATOM 0 HG LEU B 79 -3.634 5.509 -9.978 1.00 0.00 H new ATOM 0 HD11 LEU B 79 -2.968 4.044 -8.107 1.00 0.00 H new ATOM 0 HD12 LEU B 79 -3.956 5.419 -7.558 1.00 0.00 H new ATOM 0 HD13 LEU B 79 -4.683 3.801 -7.700 1.00 0.00 H new ATOM 0 HD21 LEU B 79 -3.259 3.112 -10.349 1.00 0.00 H new ATOM 0 HD22 LEU B 79 -4.986 2.801 -10.050 1.00 0.00 H new ATOM 0 HD23 LEU B 79 -4.487 3.777 -11.452 1.00 0.00 H new