USER MOD reduce.3.24.130724 H: found=0, std=0, add=1167, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1166 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 98 LYS NZ :NH3+ 174:sc= -1.52 (180deg=-1.42) USER MOD Set 1.2: A 100 TYR OH : rot 180:sc= 0.113 USER MOD Set 2.1: A 55 ASN : amide:sc= -0.408 K(o=1.9,f=-2.5!) USER MOD Set 2.2: A 59 TYR OH : rot 180:sc= 1.06 USER MOD Set 2.3: A 76 LYS NZ :NH3+ 176:sc= 1.26 (180deg=0) USER MOD Set 3.1: A 43 THR OG1 : rot 156:sc= 0.679 USER MOD Set 3.2: A 45 ASN : amide:sc= -2.6 K(o=-1.9,f=-2.9) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -126:sc= 0.0513 (180deg=-0.281) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 MET CE :methyl -159:sc= -0.0318 (180deg=-0.525) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot -65:sc= 0.146 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 80:sc= 0.0632 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -136:sc= 0 (180deg=-0.354) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -83:sc= -0.57 USER MOD Single : A 68 ASN : amide:sc= -0.245 X(o=-0.25,f=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ -160:sc= 1.16 (180deg=0.445) USER MOD Single : A 86 ASN : amide:sc= 0.404 K(o=0.4,f=-5.2!) USER MOD Single : A 87 LYS NZ :NH3+ -175:sc=-0.000847 (180deg=-0.0225) USER MOD Single : A 88 LYS NZ :NH3+ -140:sc= 0 (180deg=-0.105) USER MOD Single : A 97 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.0543) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HD1:sc= -0.0545 X(o=-0.054,f=-0.054) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 112 MET CE :methyl -171:sc= -1.94 (180deg=-2.17) USER MOD Single : A 113 LYS NZ :NH3+ -173:sc=-0.000963 (180deg=-0.0175) USER MOD Single : A 117 GLN : amide:sc= -0.0603 X(o=-0.06,f=-0.51) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -147:sc= 1.24 (180deg=-0.343) USER MOD Single : A 131 LYS NZ :NH3+ -174:sc=-0.000783 (180deg=-0.0194) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 111.657 23.849 15.091 1.00 0.00 N ATOM 2 CA MET A 1 112.900 23.029 15.184 1.00 0.00 C ATOM 3 C MET A 1 112.855 21.888 14.163 1.00 0.00 C ATOM 4 O MET A 1 111.797 21.541 13.670 1.00 0.00 O ATOM 5 CB MET A 1 112.912 22.474 16.610 1.00 0.00 C ATOM 6 CG MET A 1 113.213 23.601 17.599 1.00 0.00 C ATOM 7 SD MET A 1 113.500 22.899 19.243 1.00 0.00 S ATOM 8 CE MET A 1 113.645 24.467 20.136 1.00 0.00 C ATOM 0 H1 MET A 1 111.910 24.848 14.954 1.00 0.00 H new ATOM 0 H2 MET A 1 111.085 23.523 14.286 1.00 0.00 H new ATOM 0 H3 MET A 1 111.108 23.748 15.969 1.00 0.00 H new ATOM 0 HA MET A 1 113.795 23.613 14.971 1.00 0.00 H new ATOM 0 HB2 MET A 1 111.948 22.021 16.842 1.00 0.00 H new ATOM 0 HB3 MET A 1 113.663 21.689 16.699 1.00 0.00 H new ATOM 0 HG2 MET A 1 114.089 24.161 17.273 1.00 0.00 H new ATOM 0 HG3 MET A 1 112.380 24.303 17.632 1.00 0.00 H new ATOM 0 HE1 MET A 1 113.828 24.269 21.192 1.00 0.00 H new ATOM 0 HE2 MET A 1 114.474 25.044 19.726 1.00 0.00 H new ATOM 0 HE3 MET A 1 112.720 25.034 20.028 1.00 0.00 H new ATOM 20 N VAL A 2 113.996 21.313 13.855 1.00 0.00 N ATOM 21 CA VAL A 2 114.061 20.192 12.866 1.00 0.00 C ATOM 22 C VAL A 2 114.906 19.038 13.430 1.00 0.00 C ATOM 23 O VAL A 2 115.903 19.267 14.091 1.00 0.00 O ATOM 24 CB VAL A 2 114.676 20.812 11.596 1.00 0.00 C ATOM 25 CG1 VAL A 2 116.097 21.332 11.854 1.00 0.00 C ATOM 26 CG2 VAL A 2 114.716 19.770 10.474 1.00 0.00 C ATOM 0 H VAL A 2 114.896 21.579 14.254 1.00 0.00 H new ATOM 0 HA VAL A 2 113.085 19.760 12.646 1.00 0.00 H new ATOM 0 HB VAL A 2 114.050 21.654 11.302 1.00 0.00 H new ATOM 0 HG11 VAL A 2 116.499 21.762 10.937 1.00 0.00 H new ATOM 0 HG12 VAL A 2 116.069 22.096 12.631 1.00 0.00 H new ATOM 0 HG13 VAL A 2 116.733 20.508 12.177 1.00 0.00 H new ATOM 0 HG21 VAL A 2 115.152 20.215 9.580 1.00 0.00 H new ATOM 0 HG22 VAL A 2 115.322 18.920 10.788 1.00 0.00 H new ATOM 0 HG23 VAL A 2 113.703 19.432 10.255 1.00 0.00 H new ATOM 36 N LYS A 3 114.502 17.816 13.164 1.00 0.00 N ATOM 37 CA LYS A 3 115.259 16.624 13.659 1.00 0.00 C ATOM 38 C LYS A 3 115.283 15.525 12.585 1.00 0.00 C ATOM 39 O LYS A 3 114.965 14.377 12.852 1.00 0.00 O ATOM 40 CB LYS A 3 114.532 16.175 14.939 1.00 0.00 C ATOM 41 CG LYS A 3 113.073 15.793 14.654 1.00 0.00 C ATOM 42 CD LYS A 3 112.358 15.483 15.970 1.00 0.00 C ATOM 43 CE LYS A 3 111.000 14.842 15.677 1.00 0.00 C ATOM 44 NZ LYS A 3 110.314 14.775 16.997 1.00 0.00 N ATOM 0 H LYS A 3 113.669 17.594 12.618 1.00 0.00 H new ATOM 0 HA LYS A 3 116.303 16.852 13.874 1.00 0.00 H new ATOM 0 HB2 LYS A 3 115.054 15.323 15.375 1.00 0.00 H new ATOM 0 HB3 LYS A 3 114.562 16.978 15.676 1.00 0.00 H new ATOM 0 HG2 LYS A 3 112.567 16.608 14.137 1.00 0.00 H new ATOM 0 HG3 LYS A 3 113.036 14.926 13.995 1.00 0.00 H new ATOM 0 HD2 LYS A 3 112.966 14.811 16.576 1.00 0.00 H new ATOM 0 HD3 LYS A 3 112.223 16.398 16.547 1.00 0.00 H new ATOM 0 HE2 LYS A 3 110.428 15.437 14.965 1.00 0.00 H new ATOM 0 HE3 LYS A 3 111.117 13.849 15.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 109.374 14.346 16.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 110.878 14.197 17.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 110.210 15.735 17.383 1.00 0.00 H new ATOM 58 N LEU A 4 115.661 15.882 11.378 1.00 0.00 N ATOM 59 CA LEU A 4 115.702 14.898 10.251 1.00 0.00 C ATOM 60 C LEU A 4 117.153 14.620 9.848 1.00 0.00 C ATOM 61 O LEU A 4 118.004 15.484 9.969 1.00 0.00 O ATOM 62 CB LEU A 4 114.953 15.571 9.098 1.00 0.00 C ATOM 63 CG LEU A 4 113.477 15.753 9.464 1.00 0.00 C ATOM 64 CD1 LEU A 4 112.807 16.672 8.442 1.00 0.00 C ATOM 65 CD2 LEU A 4 112.778 14.392 9.457 1.00 0.00 C ATOM 0 H LEU A 4 115.947 16.828 11.125 1.00 0.00 H new ATOM 0 HA LEU A 4 115.253 13.944 10.526 1.00 0.00 H new ATOM 0 HB2 LEU A 4 115.403 16.539 8.878 1.00 0.00 H new ATOM 0 HB3 LEU A 4 115.040 14.966 8.195 1.00 0.00 H new ATOM 0 HG LEU A 4 113.402 16.196 10.457 1.00 0.00 H new ATOM 0 HD11 LEU A 4 111.757 16.801 8.703 1.00 0.00 H new ATOM 0 HD12 LEU A 4 113.304 17.642 8.445 1.00 0.00 H new ATOM 0 HD13 LEU A 4 112.882 16.228 7.449 1.00 0.00 H new ATOM 0 HD21 LEU A 4 111.727 14.521 9.717 1.00 0.00 H new ATOM 0 HD22 LEU A 4 112.854 13.949 8.464 1.00 0.00 H new ATOM 0 HD23 LEU A 4 113.254 13.735 10.185 1.00 0.00 H new ATOM 77 N MET A 5 117.426 13.424 9.377 1.00 0.00 N ATOM 78 CA MET A 5 118.811 13.061 8.944 1.00 0.00 C ATOM 79 C MET A 5 118.875 12.967 7.419 1.00 0.00 C ATOM 80 O MET A 5 117.923 12.544 6.788 1.00 0.00 O ATOM 81 CB MET A 5 119.080 11.693 9.573 1.00 0.00 C ATOM 82 CG MET A 5 120.564 11.350 9.433 1.00 0.00 C ATOM 83 SD MET A 5 120.850 9.656 10.006 1.00 0.00 S ATOM 84 CE MET A 5 120.662 9.976 11.778 1.00 0.00 C ATOM 0 H MET A 5 116.739 12.677 9.274 1.00 0.00 H new ATOM 0 HA MET A 5 119.548 13.803 9.252 1.00 0.00 H new ATOM 0 HB2 MET A 5 118.796 11.703 10.625 1.00 0.00 H new ATOM 0 HB3 MET A 5 118.472 10.931 9.085 1.00 0.00 H new ATOM 0 HG2 MET A 5 120.875 11.451 8.393 1.00 0.00 H new ATOM 0 HG3 MET A 5 121.166 12.048 10.015 1.00 0.00 H new ATOM 0 HE1 MET A 5 121.151 9.183 12.345 1.00 0.00 H new ATOM 0 HE2 MET A 5 121.120 10.934 12.025 1.00 0.00 H new ATOM 0 HE3 MET A 5 119.602 10.004 12.032 1.00 0.00 H new ATOM 94 N ILE A 6 119.985 13.358 6.837 1.00 0.00 N ATOM 95 CA ILE A 6 120.124 13.352 5.345 1.00 0.00 C ATOM 96 C ILE A 6 121.397 12.588 4.959 1.00 0.00 C ATOM 97 O ILE A 6 122.463 12.858 5.482 1.00 0.00 O ATOM 98 CB ILE A 6 120.214 14.833 4.918 1.00 0.00 C ATOM 99 CG1 ILE A 6 119.001 15.648 5.415 1.00 0.00 C ATOM 100 CG2 ILE A 6 120.303 14.944 3.388 1.00 0.00 C ATOM 101 CD1 ILE A 6 117.671 15.077 4.899 1.00 0.00 C ATOM 0 H ILE A 6 120.810 13.685 7.339 1.00 0.00 H new ATOM 0 HA ILE A 6 119.285 12.861 4.852 1.00 0.00 H new ATOM 0 HB ILE A 6 121.115 15.244 5.373 1.00 0.00 H new ATOM 0 HG12 ILE A 6 118.993 15.657 6.505 1.00 0.00 H new ATOM 0 HG13 ILE A 6 119.102 16.683 5.088 1.00 0.00 H new ATOM 0 HG21 ILE A 6 120.366 15.994 3.102 1.00 0.00 H new ATOM 0 HG22 ILE A 6 121.191 14.418 3.036 1.00 0.00 H new ATOM 0 HG23 ILE A 6 119.416 14.498 2.939 1.00 0.00 H new ATOM 0 HD11 ILE A 6 116.845 15.682 5.274 1.00 0.00 H new ATOM 0 HD12 ILE A 6 117.667 15.093 3.809 1.00 0.00 H new ATOM 0 HD13 ILE A 6 117.556 14.051 5.248 1.00 0.00 H new ATOM 113 N ILE A 7 121.278 11.644 4.052 1.00 0.00 N ATOM 114 CA ILE A 7 122.475 10.894 3.551 1.00 0.00 C ATOM 115 C ILE A 7 122.459 10.901 2.016 1.00 0.00 C ATOM 116 O ILE A 7 121.401 10.928 1.411 1.00 0.00 O ATOM 117 CB ILE A 7 122.354 9.462 4.112 1.00 0.00 C ATOM 118 CG1 ILE A 7 122.310 9.488 5.646 1.00 0.00 C ATOM 119 CG2 ILE A 7 123.566 8.623 3.683 1.00 0.00 C ATOM 120 CD1 ILE A 7 121.852 8.126 6.174 1.00 0.00 C ATOM 0 H ILE A 7 120.392 11.359 3.634 1.00 0.00 H new ATOM 0 HA ILE A 7 123.415 11.343 3.871 1.00 0.00 H new ATOM 0 HB ILE A 7 121.435 9.025 3.722 1.00 0.00 H new ATOM 0 HG12 ILE A 7 123.296 9.730 6.043 1.00 0.00 H new ATOM 0 HG13 ILE A 7 121.629 10.268 5.986 1.00 0.00 H new ATOM 0 HG21 ILE A 7 123.471 7.614 4.084 1.00 0.00 H new ATOM 0 HG22 ILE A 7 123.611 8.578 2.595 1.00 0.00 H new ATOM 0 HG23 ILE A 7 124.479 9.080 4.065 1.00 0.00 H new ATOM 0 HD11 ILE A 7 121.822 8.149 7.263 1.00 0.00 H new ATOM 0 HD12 ILE A 7 120.857 7.902 5.789 1.00 0.00 H new ATOM 0 HD13 ILE A 7 122.550 7.355 5.846 1.00 0.00 H new ATOM 132 N GLU A 8 123.619 10.878 1.401 1.00 0.00 N ATOM 133 CA GLU A 8 123.705 10.884 -0.093 1.00 0.00 C ATOM 134 C GLU A 8 124.097 9.496 -0.608 1.00 0.00 C ATOM 135 O GLU A 8 124.905 8.816 0.001 1.00 0.00 O ATOM 136 CB GLU A 8 124.796 11.904 -0.426 1.00 0.00 C ATOM 137 CG GLU A 8 124.319 13.308 -0.048 1.00 0.00 C ATOM 138 CD GLU A 8 125.375 14.335 -0.459 1.00 0.00 C ATOM 139 OE1 GLU A 8 126.382 14.426 0.224 1.00 0.00 O ATOM 140 OE2 GLU A 8 125.161 15.014 -1.450 1.00 0.00 O ATOM 0 H GLU A 8 124.520 10.855 1.878 1.00 0.00 H new ATOM 0 HA GLU A 8 122.752 11.139 -0.558 1.00 0.00 H new ATOM 0 HB2 GLU A 8 125.711 11.662 0.114 1.00 0.00 H new ATOM 0 HB3 GLU A 8 125.033 11.864 -1.489 1.00 0.00 H new ATOM 0 HG2 GLU A 8 123.372 13.527 -0.542 1.00 0.00 H new ATOM 0 HG3 GLU A 8 124.139 13.366 1.026 1.00 0.00 H new ATOM 147 N GLY A 9 123.527 9.083 -1.718 1.00 0.00 N ATOM 148 CA GLY A 9 123.860 7.753 -2.315 1.00 0.00 C ATOM 149 C GLY A 9 124.055 7.903 -3.826 1.00 0.00 C ATOM 150 O GLY A 9 123.459 8.770 -4.442 1.00 0.00 O ATOM 0 H GLY A 9 122.836 9.621 -2.241 1.00 0.00 H new ATOM 0 HA2 GLY A 9 124.766 7.355 -1.859 1.00 0.00 H new ATOM 0 HA3 GLY A 9 123.061 7.041 -2.110 1.00 0.00 H new ATOM 154 N GLU A 10 124.879 7.064 -4.413 1.00 0.00 N ATOM 155 CA GLU A 10 125.142 7.137 -5.883 1.00 0.00 C ATOM 156 C GLU A 10 124.438 5.985 -6.605 1.00 0.00 C ATOM 157 O GLU A 10 124.379 4.881 -6.094 1.00 0.00 O ATOM 158 CB GLU A 10 126.660 7.015 -6.033 1.00 0.00 C ATOM 159 CG GLU A 10 127.056 7.339 -7.476 1.00 0.00 C ATOM 160 CD GLU A 10 128.556 7.100 -7.663 1.00 0.00 C ATOM 161 OE1 GLU A 10 129.037 6.077 -7.203 1.00 0.00 O ATOM 162 OE2 GLU A 10 129.199 7.945 -8.264 1.00 0.00 O ATOM 0 H GLU A 10 125.385 6.324 -3.927 1.00 0.00 H new ATOM 0 HA GLU A 10 124.767 8.064 -6.318 1.00 0.00 H new ATOM 0 HB2 GLU A 10 127.160 7.697 -5.345 1.00 0.00 H new ATOM 0 HB3 GLU A 10 126.982 6.007 -5.773 1.00 0.00 H new ATOM 0 HG2 GLU A 10 126.489 6.716 -8.168 1.00 0.00 H new ATOM 0 HG3 GLU A 10 126.811 8.376 -7.707 1.00 0.00 H new ATOM 169 N VAL A 11 123.912 6.246 -7.782 1.00 0.00 N ATOM 170 CA VAL A 11 123.196 5.186 -8.576 1.00 0.00 C ATOM 171 C VAL A 11 124.192 4.086 -8.974 1.00 0.00 C ATOM 172 O VAL A 11 125.197 4.367 -9.600 1.00 0.00 O ATOM 173 CB VAL A 11 122.632 5.883 -9.835 1.00 0.00 C ATOM 174 CG1 VAL A 11 121.851 4.885 -10.703 1.00 0.00 C ATOM 175 CG2 VAL A 11 121.683 7.028 -9.447 1.00 0.00 C ATOM 0 H VAL A 11 123.948 7.160 -8.233 1.00 0.00 H new ATOM 0 HA VAL A 11 122.395 4.723 -8.000 1.00 0.00 H new ATOM 0 HB VAL A 11 123.480 6.279 -10.394 1.00 0.00 H new ATOM 0 HG11 VAL A 11 121.462 5.396 -11.584 1.00 0.00 H new ATOM 0 HG12 VAL A 11 122.513 4.077 -11.014 1.00 0.00 H new ATOM 0 HG13 VAL A 11 121.022 4.473 -10.127 1.00 0.00 H new ATOM 0 HG21 VAL A 11 121.299 7.504 -10.349 1.00 0.00 H new ATOM 0 HG22 VAL A 11 120.852 6.630 -8.864 1.00 0.00 H new ATOM 0 HG23 VAL A 11 122.224 7.763 -8.852 1.00 0.00 H new ATOM 185 N VAL A 12 123.910 2.856 -8.612 1.00 0.00 N ATOM 186 CA VAL A 12 124.785 1.707 -9.018 1.00 0.00 C ATOM 187 C VAL A 12 123.963 0.659 -9.778 1.00 0.00 C ATOM 188 O VAL A 12 122.753 0.603 -9.638 1.00 0.00 O ATOM 189 CB VAL A 12 125.371 1.120 -7.720 1.00 0.00 C ATOM 190 CG1 VAL A 12 126.259 2.166 -7.041 1.00 0.00 C ATOM 191 CG2 VAL A 12 124.263 0.695 -6.745 1.00 0.00 C ATOM 0 H VAL A 12 123.102 2.596 -8.046 1.00 0.00 H new ATOM 0 HA VAL A 12 125.584 2.030 -9.686 1.00 0.00 H new ATOM 0 HB VAL A 12 125.955 0.238 -7.984 1.00 0.00 H new ATOM 0 HG11 VAL A 12 126.674 1.750 -6.123 1.00 0.00 H new ATOM 0 HG12 VAL A 12 127.071 2.445 -7.712 1.00 0.00 H new ATOM 0 HG13 VAL A 12 125.665 3.049 -6.804 1.00 0.00 H new ATOM 0 HG21 VAL A 12 124.712 0.285 -5.840 1.00 0.00 H new ATOM 0 HG22 VAL A 12 123.653 1.561 -6.487 1.00 0.00 H new ATOM 0 HG23 VAL A 12 123.636 -0.063 -7.214 1.00 0.00 H new ATOM 201 N SER A 13 124.619 -0.159 -10.570 1.00 0.00 N ATOM 202 CA SER A 13 123.897 -1.191 -11.383 1.00 0.00 C ATOM 203 C SER A 13 123.663 -2.454 -10.550 1.00 0.00 C ATOM 204 O SER A 13 124.591 -3.196 -10.277 1.00 0.00 O ATOM 205 CB SER A 13 124.808 -1.499 -12.573 1.00 0.00 C ATOM 206 OG SER A 13 124.128 -2.361 -13.474 1.00 0.00 O ATOM 0 H SER A 13 125.632 -0.155 -10.688 1.00 0.00 H new ATOM 0 HA SER A 13 122.920 -0.834 -11.709 1.00 0.00 H new ATOM 0 HB2 SER A 13 125.090 -0.575 -13.078 1.00 0.00 H new ATOM 0 HB3 SER A 13 125.730 -1.968 -12.228 1.00 0.00 H new ATOM 0 HG SER A 13 124.708 -2.559 -14.238 1.00 0.00 H new ATOM 212 N GLY A 14 122.434 -2.691 -10.151 1.00 0.00 N ATOM 213 CA GLY A 14 122.097 -3.907 -9.350 1.00 0.00 C ATOM 214 C GLY A 14 120.576 -4.045 -9.246 1.00 0.00 C ATOM 215 O GLY A 14 119.911 -3.160 -8.735 1.00 0.00 O ATOM 0 H GLY A 14 121.640 -2.082 -10.351 1.00 0.00 H new ATOM 0 HA2 GLY A 14 122.522 -4.794 -9.820 1.00 0.00 H new ATOM 0 HA3 GLY A 14 122.535 -3.833 -8.355 1.00 0.00 H new ATOM 219 N LEU A 15 120.036 -5.143 -9.725 1.00 0.00 N ATOM 220 CA LEU A 15 118.554 -5.362 -9.665 1.00 0.00 C ATOM 221 C LEU A 15 118.158 -5.884 -8.281 1.00 0.00 C ATOM 222 O LEU A 15 117.296 -5.318 -7.631 1.00 0.00 O ATOM 223 CB LEU A 15 118.238 -6.404 -10.743 1.00 0.00 C ATOM 224 CG LEU A 15 116.722 -6.511 -10.922 1.00 0.00 C ATOM 225 CD1 LEU A 15 116.203 -5.265 -11.643 1.00 0.00 C ATOM 226 CD2 LEU A 15 116.395 -7.753 -11.754 1.00 0.00 C ATOM 0 H LEU A 15 120.563 -5.902 -10.158 1.00 0.00 H new ATOM 0 HA LEU A 15 118.001 -4.438 -9.834 1.00 0.00 H new ATOM 0 HB2 LEU A 15 118.707 -6.121 -11.685 1.00 0.00 H new ATOM 0 HB3 LEU A 15 118.651 -7.372 -10.460 1.00 0.00 H new ATOM 0 HG LEU A 15 116.246 -6.590 -9.945 1.00 0.00 H new ATOM 0 HD11 LEU A 15 115.123 -5.342 -11.770 1.00 0.00 H new ATOM 0 HD12 LEU A 15 116.437 -4.379 -11.053 1.00 0.00 H new ATOM 0 HD13 LEU A 15 116.679 -5.186 -12.620 1.00 0.00 H new ATOM 0 HD21 LEU A 15 115.315 -7.831 -11.883 1.00 0.00 H new ATOM 0 HD22 LEU A 15 116.872 -7.672 -12.731 1.00 0.00 H new ATOM 0 HD23 LEU A 15 116.764 -8.642 -11.242 1.00 0.00 H new ATOM 238 N GLY A 16 118.784 -6.952 -7.841 1.00 0.00 N ATOM 239 CA GLY A 16 118.488 -7.524 -6.491 1.00 0.00 C ATOM 240 C GLY A 16 119.743 -8.201 -5.935 1.00 0.00 C ATOM 241 O GLY A 16 120.710 -8.393 -6.649 1.00 0.00 O ATOM 0 H GLY A 16 119.496 -7.456 -8.369 1.00 0.00 H new ATOM 0 HA2 GLY A 16 118.158 -6.735 -5.815 1.00 0.00 H new ATOM 0 HA3 GLY A 16 117.674 -8.245 -6.561 1.00 0.00 H new ATOM 245 N GLU A 17 119.721 -8.555 -4.670 1.00 0.00 N ATOM 246 CA GLU A 17 120.872 -9.276 -4.046 1.00 0.00 C ATOM 247 C GLU A 17 120.569 -10.774 -3.966 1.00 0.00 C ATOM 248 O GLU A 17 121.320 -11.587 -4.477 1.00 0.00 O ATOM 249 CB GLU A 17 121.003 -8.675 -2.645 1.00 0.00 C ATOM 250 CG GLU A 17 122.292 -9.176 -1.990 1.00 0.00 C ATOM 251 CD GLU A 17 122.363 -8.673 -0.546 1.00 0.00 C ATOM 252 OE1 GLU A 17 122.091 -7.502 -0.332 1.00 0.00 O ATOM 253 OE2 GLU A 17 122.689 -9.466 0.322 1.00 0.00 O ATOM 0 H GLU A 17 118.942 -8.371 -4.037 1.00 0.00 H new ATOM 0 HA GLU A 17 121.792 -9.168 -4.620 1.00 0.00 H new ATOM 0 HB2 GLU A 17 121.013 -7.587 -2.705 1.00 0.00 H new ATOM 0 HB3 GLU A 17 120.142 -8.953 -2.037 1.00 0.00 H new ATOM 0 HG2 GLU A 17 122.321 -10.265 -2.008 1.00 0.00 H new ATOM 0 HG3 GLU A 17 123.158 -8.824 -2.551 1.00 0.00 H new ATOM 260 N GLY A 18 119.476 -11.131 -3.328 1.00 0.00 N ATOM 261 CA GLY A 18 119.063 -12.564 -3.236 1.00 0.00 C ATOM 262 C GLY A 18 118.129 -12.899 -4.401 1.00 0.00 C ATOM 263 O GLY A 18 117.969 -12.106 -5.311 1.00 0.00 O ATOM 0 H GLY A 18 118.847 -10.478 -2.862 1.00 0.00 H new ATOM 0 HA2 GLY A 18 119.941 -13.209 -3.262 1.00 0.00 H new ATOM 0 HA3 GLY A 18 118.560 -12.749 -2.287 1.00 0.00 H new ATOM 267 N ARG A 19 117.521 -14.064 -4.366 1.00 0.00 N ATOM 268 CA ARG A 19 116.583 -14.480 -5.454 1.00 0.00 C ATOM 269 C ARG A 19 115.132 -14.263 -5.011 1.00 0.00 C ATOM 270 O ARG A 19 114.625 -14.990 -4.176 1.00 0.00 O ATOM 271 CB ARG A 19 116.862 -15.968 -5.669 1.00 0.00 C ATOM 272 CG ARG A 19 116.131 -16.452 -6.922 1.00 0.00 C ATOM 273 CD ARG A 19 116.434 -17.936 -7.152 1.00 0.00 C ATOM 274 NE ARG A 19 115.745 -18.674 -6.042 1.00 0.00 N ATOM 275 CZ ARG A 19 116.135 -19.865 -5.628 1.00 0.00 C ATOM 276 NH1 ARG A 19 117.139 -20.518 -6.165 1.00 0.00 N ATOM 277 NH2 ARG A 19 115.484 -20.425 -4.646 1.00 0.00 N ATOM 0 H ARG A 19 117.638 -14.750 -3.620 1.00 0.00 H new ATOM 0 HA ARG A 19 116.726 -13.903 -6.368 1.00 0.00 H new ATOM 0 HB2 ARG A 19 117.934 -16.136 -5.774 1.00 0.00 H new ATOM 0 HB3 ARG A 19 116.533 -16.539 -4.801 1.00 0.00 H new ATOM 0 HG2 ARG A 19 115.057 -16.303 -6.809 1.00 0.00 H new ATOM 0 HG3 ARG A 19 116.445 -15.868 -7.787 1.00 0.00 H new ATOM 0 HD2 ARG A 19 116.067 -18.263 -8.125 1.00 0.00 H new ATOM 0 HD3 ARG A 19 117.508 -18.122 -7.137 1.00 0.00 H new ATOM 0 HE ARG A 19 114.942 -18.237 -5.589 1.00 0.00 H new ATOM 0 HH11 ARG A 19 117.658 -20.107 -6.940 1.00 0.00 H new ATOM 0 HH12 ARG A 19 117.400 -21.437 -5.807 1.00 0.00 H new ATOM 0 HH21 ARG A 19 114.694 -19.943 -4.217 1.00 0.00 H new ATOM 0 HH22 ARG A 19 115.765 -21.345 -4.307 1.00 0.00 H new ATOM 291 N TYR A 20 114.478 -13.269 -5.569 1.00 0.00 N ATOM 292 CA TYR A 20 113.051 -12.986 -5.220 1.00 0.00 C ATOM 293 C TYR A 20 112.357 -12.252 -6.374 1.00 0.00 C ATOM 294 O TYR A 20 113.005 -11.587 -7.163 1.00 0.00 O ATOM 295 CB TYR A 20 113.105 -12.112 -3.962 1.00 0.00 C ATOM 296 CG TYR A 20 113.863 -10.814 -4.136 1.00 0.00 C ATOM 297 CD1 TYR A 20 115.267 -10.765 -3.872 1.00 0.00 C ATOM 298 CD2 TYR A 20 113.175 -9.636 -4.564 1.00 0.00 C ATOM 299 CE1 TYR A 20 115.982 -9.539 -4.036 1.00 0.00 C ATOM 300 CE2 TYR A 20 113.891 -8.410 -4.728 1.00 0.00 C ATOM 301 CZ TYR A 20 115.295 -8.362 -4.463 1.00 0.00 C ATOM 302 OH TYR A 20 115.985 -7.177 -4.621 1.00 0.00 O ATOM 0 H TYR A 20 114.880 -12.635 -6.260 1.00 0.00 H new ATOM 0 HA TYR A 20 112.481 -13.899 -5.045 1.00 0.00 H new ATOM 0 HB2 TYR A 20 112.086 -11.885 -3.648 1.00 0.00 H new ATOM 0 HB3 TYR A 20 113.567 -12.683 -3.157 1.00 0.00 H new ATOM 0 HD1 TYR A 20 115.787 -11.655 -3.549 1.00 0.00 H new ATOM 0 HD2 TYR A 20 112.114 -9.673 -4.763 1.00 0.00 H new ATOM 0 HE1 TYR A 20 117.043 -9.502 -3.837 1.00 0.00 H new ATOM 0 HE2 TYR A 20 113.372 -7.520 -5.052 1.00 0.00 H new ATOM 0 HH TYR A 20 116.323 -6.877 -3.752 1.00 0.00 H new ATOM 312 N PHE A 21 111.051 -12.375 -6.463 1.00 0.00 N ATOM 313 CA PHE A 21 110.279 -11.683 -7.541 1.00 0.00 C ATOM 314 C PHE A 21 109.115 -10.894 -6.934 1.00 0.00 C ATOM 315 O PHE A 21 108.631 -11.230 -5.869 1.00 0.00 O ATOM 316 CB PHE A 21 109.756 -12.808 -8.436 1.00 0.00 C ATOM 317 CG PHE A 21 110.851 -13.598 -9.112 1.00 0.00 C ATOM 318 CD1 PHE A 21 111.402 -13.140 -10.349 1.00 0.00 C ATOM 319 CD2 PHE A 21 111.337 -14.803 -8.516 1.00 0.00 C ATOM 320 CE1 PHE A 21 112.439 -13.887 -10.990 1.00 0.00 C ATOM 321 CE2 PHE A 21 112.374 -15.549 -9.157 1.00 0.00 C ATOM 322 CZ PHE A 21 112.924 -15.092 -10.394 1.00 0.00 C ATOM 0 H PHE A 21 110.483 -12.933 -5.825 1.00 0.00 H new ATOM 0 HA PHE A 21 110.890 -10.971 -8.096 1.00 0.00 H new ATOM 0 HB2 PHE A 21 109.147 -13.485 -7.837 1.00 0.00 H new ATOM 0 HB3 PHE A 21 109.103 -12.382 -9.198 1.00 0.00 H new ATOM 0 HD1 PHE A 21 111.035 -12.230 -10.799 1.00 0.00 H new ATOM 0 HD2 PHE A 21 110.921 -15.150 -7.582 1.00 0.00 H new ATOM 0 HE1 PHE A 21 112.856 -13.541 -11.924 1.00 0.00 H new ATOM 0 HE2 PHE A 21 112.742 -16.459 -8.706 1.00 0.00 H new ATOM 0 HZ PHE A 21 113.706 -15.657 -10.879 1.00 0.00 H new ATOM 332 N LEU A 22 108.677 -9.855 -7.610 1.00 0.00 N ATOM 333 CA LEU A 22 107.528 -9.033 -7.113 1.00 0.00 C ATOM 334 C LEU A 22 106.197 -9.435 -7.771 1.00 0.00 C ATOM 335 O LEU A 22 105.149 -9.010 -7.317 1.00 0.00 O ATOM 336 CB LEU A 22 107.888 -7.591 -7.478 1.00 0.00 C ATOM 337 CG LEU A 22 109.090 -7.133 -6.649 1.00 0.00 C ATOM 338 CD1 LEU A 22 109.632 -5.821 -7.217 1.00 0.00 C ATOM 339 CD2 LEU A 22 108.657 -6.917 -5.197 1.00 0.00 C ATOM 0 H LEU A 22 109.073 -9.540 -8.495 1.00 0.00 H new ATOM 0 HA LEU A 22 107.381 -9.175 -6.042 1.00 0.00 H new ATOM 0 HB2 LEU A 22 108.120 -7.522 -8.541 1.00 0.00 H new ATOM 0 HB3 LEU A 22 107.036 -6.936 -7.294 1.00 0.00 H new ATOM 0 HG LEU A 22 109.868 -7.896 -6.688 1.00 0.00 H new ATOM 0 HD11 LEU A 22 110.488 -5.495 -6.626 1.00 0.00 H new ATOM 0 HD12 LEU A 22 109.941 -5.972 -8.251 1.00 0.00 H new ATOM 0 HD13 LEU A 22 108.854 -5.059 -7.179 1.00 0.00 H new ATOM 0 HD21 LEU A 22 109.513 -6.591 -4.607 1.00 0.00 H new ATOM 0 HD22 LEU A 22 107.879 -6.155 -5.159 1.00 0.00 H new ATOM 0 HD23 LEU A 22 108.270 -7.851 -4.790 1.00 0.00 H new ATOM 351 N SER A 23 106.222 -10.236 -8.820 1.00 0.00 N ATOM 352 CA SER A 23 104.955 -10.634 -9.526 1.00 0.00 C ATOM 353 C SER A 23 104.011 -11.406 -8.594 1.00 0.00 C ATOM 354 O SER A 23 102.804 -11.350 -8.762 1.00 0.00 O ATOM 355 CB SER A 23 105.375 -11.527 -10.699 1.00 0.00 C ATOM 356 OG SER A 23 106.314 -10.830 -11.506 1.00 0.00 O ATOM 0 H SER A 23 107.073 -10.633 -9.218 1.00 0.00 H new ATOM 0 HA SER A 23 104.415 -9.749 -9.862 1.00 0.00 H new ATOM 0 HB2 SER A 23 105.814 -12.453 -10.327 1.00 0.00 H new ATOM 0 HB3 SER A 23 104.503 -11.803 -11.292 1.00 0.00 H new ATOM 0 HG SER A 23 106.586 -11.399 -12.256 1.00 0.00 H new ATOM 362 N LEU A 24 104.549 -12.116 -7.626 1.00 0.00 N ATOM 363 CA LEU A 24 103.696 -12.952 -6.710 1.00 0.00 C ATOM 364 C LEU A 24 102.756 -12.050 -5.884 1.00 0.00 C ATOM 365 O LEU A 24 103.191 -11.005 -5.437 1.00 0.00 O ATOM 366 CB LEU A 24 104.672 -13.700 -5.788 1.00 0.00 C ATOM 367 CG LEU A 24 104.077 -15.046 -5.367 1.00 0.00 C ATOM 368 CD1 LEU A 24 104.051 -15.996 -6.566 1.00 0.00 C ATOM 369 CD2 LEU A 24 104.937 -15.653 -4.257 1.00 0.00 C ATOM 0 H LEU A 24 105.549 -12.153 -7.429 1.00 0.00 H new ATOM 0 HA LEU A 24 103.068 -13.645 -7.269 1.00 0.00 H new ATOM 0 HB2 LEU A 24 105.620 -13.858 -6.302 1.00 0.00 H new ATOM 0 HB3 LEU A 24 104.885 -13.096 -4.906 1.00 0.00 H new ATOM 0 HG LEU A 24 103.060 -14.895 -5.004 1.00 0.00 H new ATOM 0 HD11 LEU A 24 103.627 -16.953 -6.263 1.00 0.00 H new ATOM 0 HD12 LEU A 24 103.441 -15.564 -7.359 1.00 0.00 H new ATOM 0 HD13 LEU A 24 105.067 -16.149 -6.931 1.00 0.00 H new ATOM 0 HD21 LEU A 24 104.517 -16.612 -3.954 1.00 0.00 H new ATOM 0 HD22 LEU A 24 105.953 -15.802 -4.624 1.00 0.00 H new ATOM 0 HD23 LEU A 24 104.955 -14.978 -3.401 1.00 0.00 H new ATOM 381 N PRO A 25 101.507 -12.456 -5.694 1.00 0.00 N ATOM 382 CA PRO A 25 100.515 -11.596 -4.963 1.00 0.00 C ATOM 383 C PRO A 25 101.001 -11.133 -3.571 1.00 0.00 C ATOM 384 O PRO A 25 100.908 -9.951 -3.295 1.00 0.00 O ATOM 385 CB PRO A 25 99.287 -12.497 -4.837 1.00 0.00 C ATOM 386 CG PRO A 25 99.403 -13.402 -6.013 1.00 0.00 C ATOM 387 CD PRO A 25 100.863 -13.720 -6.119 1.00 0.00 C ATOM 0 HA PRO A 25 100.330 -10.665 -5.499 1.00 0.00 H new ATOM 0 HB2 PRO A 25 99.291 -13.053 -3.900 1.00 0.00 H new ATOM 0 HB3 PRO A 25 98.362 -11.921 -4.862 1.00 0.00 H new ATOM 0 HG2 PRO A 25 98.812 -14.307 -5.874 1.00 0.00 H new ATOM 0 HG3 PRO A 25 99.038 -12.919 -6.919 1.00 0.00 H new ATOM 0 HD2 PRO A 25 101.143 -14.553 -5.474 1.00 0.00 H new ATOM 0 HD3 PRO A 25 101.144 -13.995 -7.136 1.00 0.00 H new ATOM 395 N PRO A 26 101.500 -12.028 -2.723 1.00 0.00 N ATOM 396 CA PRO A 26 101.775 -11.658 -1.295 1.00 0.00 C ATOM 397 C PRO A 26 102.691 -10.430 -1.172 1.00 0.00 C ATOM 398 O PRO A 26 102.547 -9.651 -0.248 1.00 0.00 O ATOM 399 CB PRO A 26 102.457 -12.898 -0.710 1.00 0.00 C ATOM 400 CG PRO A 26 102.042 -14.019 -1.596 1.00 0.00 C ATOM 401 CD PRO A 26 101.863 -13.439 -2.969 1.00 0.00 C ATOM 0 HA PRO A 26 100.859 -11.383 -0.772 1.00 0.00 H new ATOM 0 HB2 PRO A 26 103.541 -12.784 -0.699 1.00 0.00 H new ATOM 0 HB3 PRO A 26 102.144 -13.072 0.320 1.00 0.00 H new ATOM 0 HG2 PRO A 26 102.796 -14.806 -1.604 1.00 0.00 H new ATOM 0 HG3 PRO A 26 101.115 -14.469 -1.242 1.00 0.00 H new ATOM 0 HD2 PRO A 26 102.777 -13.518 -3.557 1.00 0.00 H new ATOM 0 HD3 PRO A 26 101.082 -13.960 -3.523 1.00 0.00 H new ATOM 409 N TYR A 27 103.611 -10.261 -2.095 1.00 0.00 N ATOM 410 CA TYR A 27 104.581 -9.117 -2.017 1.00 0.00 C ATOM 411 C TYR A 27 103.850 -7.782 -2.192 1.00 0.00 C ATOM 412 O TYR A 27 104.082 -6.847 -1.447 1.00 0.00 O ATOM 413 CB TYR A 27 105.589 -9.323 -3.152 1.00 0.00 C ATOM 414 CG TYR A 27 106.507 -10.501 -2.932 1.00 0.00 C ATOM 415 CD1 TYR A 27 107.265 -10.601 -1.725 1.00 0.00 C ATOM 416 CD2 TYR A 27 106.615 -11.518 -3.931 1.00 0.00 C ATOM 417 CE1 TYR A 27 108.131 -11.719 -1.516 1.00 0.00 C ATOM 418 CE2 TYR A 27 107.481 -12.635 -3.721 1.00 0.00 C ATOM 419 CZ TYR A 27 108.240 -12.736 -2.514 1.00 0.00 C ATOM 420 OH TYR A 27 109.076 -13.815 -2.313 1.00 0.00 O ATOM 0 H TYR A 27 103.733 -10.870 -2.904 1.00 0.00 H new ATOM 0 HA TYR A 27 105.078 -9.090 -1.047 1.00 0.00 H new ATOM 0 HB2 TYR A 27 105.048 -9.463 -4.088 1.00 0.00 H new ATOM 0 HB3 TYR A 27 106.189 -8.420 -3.263 1.00 0.00 H new ATOM 0 HD1 TYR A 27 107.184 -9.832 -0.971 1.00 0.00 H new ATOM 0 HD2 TYR A 27 106.043 -11.442 -4.844 1.00 0.00 H new ATOM 0 HE1 TYR A 27 108.703 -11.795 -0.603 1.00 0.00 H new ATOM 0 HE2 TYR A 27 107.562 -13.404 -4.475 1.00 0.00 H new ATOM 0 HH TYR A 27 108.631 -14.471 -1.736 1.00 0.00 H new ATOM 430 N LYS A 28 102.970 -7.698 -3.166 1.00 0.00 N ATOM 431 CA LYS A 28 102.208 -6.426 -3.408 1.00 0.00 C ATOM 432 C LYS A 28 101.265 -6.141 -2.234 1.00 0.00 C ATOM 433 O LYS A 28 101.094 -5.000 -1.842 1.00 0.00 O ATOM 434 CB LYS A 28 101.402 -6.642 -4.694 1.00 0.00 C ATOM 435 CG LYS A 28 102.361 -6.797 -5.877 1.00 0.00 C ATOM 436 CD LYS A 28 101.557 -7.019 -7.160 1.00 0.00 C ATOM 437 CE LYS A 28 100.889 -5.708 -7.578 1.00 0.00 C ATOM 438 NZ LYS A 28 100.672 -5.837 -9.047 1.00 0.00 N ATOM 0 H LYS A 28 102.746 -8.459 -3.807 1.00 0.00 H new ATOM 0 HA LYS A 28 102.882 -5.574 -3.502 1.00 0.00 H new ATOM 0 HB2 LYS A 28 100.777 -7.530 -4.600 1.00 0.00 H new ATOM 0 HB3 LYS A 28 100.733 -5.798 -4.863 1.00 0.00 H new ATOM 0 HG2 LYS A 28 102.982 -5.907 -5.974 1.00 0.00 H new ATOM 0 HG3 LYS A 28 103.033 -7.638 -5.706 1.00 0.00 H new ATOM 0 HD2 LYS A 28 102.212 -7.375 -7.955 1.00 0.00 H new ATOM 0 HD3 LYS A 28 100.802 -7.789 -7.000 1.00 0.00 H new ATOM 0 HE2 LYS A 28 99.946 -5.560 -7.051 1.00 0.00 H new ATOM 0 HE3 LYS A 28 101.522 -4.851 -7.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 100.216 -4.974 -9.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 101.587 -5.970 -9.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 100.061 -6.657 -9.237 1.00 0.00 H new ATOM 452 N GLU A 29 100.668 -7.171 -1.675 1.00 0.00 N ATOM 453 CA GLU A 29 99.693 -6.982 -0.547 1.00 0.00 C ATOM 454 C GLU A 29 100.407 -6.427 0.691 1.00 0.00 C ATOM 455 O GLU A 29 99.942 -5.478 1.299 1.00 0.00 O ATOM 456 CB GLU A 29 99.108 -8.366 -0.247 1.00 0.00 C ATOM 457 CG GLU A 29 97.920 -8.226 0.708 1.00 0.00 C ATOM 458 CD GLU A 29 97.415 -9.615 1.107 1.00 0.00 C ATOM 459 OE1 GLU A 29 98.240 -10.459 1.417 1.00 0.00 O ATOM 460 OE2 GLU A 29 96.210 -9.810 1.097 1.00 0.00 O ATOM 0 H GLU A 29 100.815 -8.141 -1.954 1.00 0.00 H new ATOM 0 HA GLU A 29 98.912 -6.271 -0.816 1.00 0.00 H new ATOM 0 HB2 GLU A 29 98.789 -8.845 -1.172 1.00 0.00 H new ATOM 0 HB3 GLU A 29 99.871 -9.006 0.197 1.00 0.00 H new ATOM 0 HG2 GLU A 29 98.218 -7.668 1.595 1.00 0.00 H new ATOM 0 HG3 GLU A 29 97.120 -7.661 0.229 1.00 0.00 H new ATOM 467 N ILE A 30 101.529 -7.009 1.053 1.00 0.00 N ATOM 468 CA ILE A 30 102.249 -6.577 2.295 1.00 0.00 C ATOM 469 C ILE A 30 102.834 -5.169 2.102 1.00 0.00 C ATOM 470 O ILE A 30 102.824 -4.364 3.018 1.00 0.00 O ATOM 471 CB ILE A 30 103.331 -7.643 2.565 1.00 0.00 C ATOM 472 CG1 ILE A 30 104.027 -7.350 3.897 1.00 0.00 C ATOM 473 CG2 ILE A 30 104.382 -7.686 1.449 1.00 0.00 C ATOM 474 CD1 ILE A 30 104.785 -8.598 4.355 1.00 0.00 C ATOM 0 H ILE A 30 101.978 -7.767 0.539 1.00 0.00 H new ATOM 0 HA ILE A 30 101.584 -6.507 3.156 1.00 0.00 H new ATOM 0 HB ILE A 30 102.834 -8.612 2.602 1.00 0.00 H new ATOM 0 HG12 ILE A 30 104.716 -6.513 3.784 1.00 0.00 H new ATOM 0 HG13 ILE A 30 103.293 -7.060 4.648 1.00 0.00 H new ATOM 0 HG21 ILE A 30 105.125 -8.450 1.678 1.00 0.00 H new ATOM 0 HG22 ILE A 30 103.898 -7.924 0.502 1.00 0.00 H new ATOM 0 HG23 ILE A 30 104.871 -6.715 1.372 1.00 0.00 H new ATOM 0 HD11 ILE A 30 105.282 -8.394 5.303 1.00 0.00 H new ATOM 0 HD12 ILE A 30 104.084 -9.423 4.483 1.00 0.00 H new ATOM 0 HD13 ILE A 30 105.529 -8.867 3.606 1.00 0.00 H new ATOM 486 N PHE A 31 103.329 -4.877 0.920 1.00 0.00 N ATOM 487 CA PHE A 31 103.883 -3.511 0.629 1.00 0.00 C ATOM 488 C PHE A 31 102.768 -2.458 0.685 1.00 0.00 C ATOM 489 O PHE A 31 102.973 -1.374 1.197 1.00 0.00 O ATOM 490 CB PHE A 31 104.495 -3.584 -0.778 1.00 0.00 C ATOM 491 CG PHE A 31 105.953 -3.988 -0.791 1.00 0.00 C ATOM 492 CD1 PHE A 31 106.886 -3.347 0.085 1.00 0.00 C ATOM 493 CD2 PHE A 31 106.401 -5.009 -1.684 1.00 0.00 C ATOM 494 CE1 PHE A 31 108.263 -3.731 0.068 1.00 0.00 C ATOM 495 CE2 PHE A 31 107.779 -5.392 -1.701 1.00 0.00 C ATOM 496 CZ PHE A 31 108.709 -4.753 -0.824 1.00 0.00 C ATOM 0 H PHE A 31 103.374 -5.531 0.138 1.00 0.00 H new ATOM 0 HA PHE A 31 104.632 -3.220 1.366 1.00 0.00 H new ATOM 0 HB2 PHE A 31 103.925 -4.296 -1.375 1.00 0.00 H new ATOM 0 HB3 PHE A 31 104.393 -2.611 -1.259 1.00 0.00 H new ATOM 0 HD1 PHE A 31 106.550 -2.573 0.759 1.00 0.00 H new ATOM 0 HD2 PHE A 31 105.699 -5.492 -2.347 1.00 0.00 H new ATOM 0 HE1 PHE A 31 108.966 -3.248 0.730 1.00 0.00 H new ATOM 0 HE2 PHE A 31 108.117 -6.164 -2.377 1.00 0.00 H new ATOM 0 HZ PHE A 31 109.749 -5.043 -0.836 1.00 0.00 H new ATOM 506 N LYS A 32 101.604 -2.779 0.167 1.00 0.00 N ATOM 507 CA LYS A 32 100.456 -1.808 0.179 1.00 0.00 C ATOM 508 C LYS A 32 100.007 -1.531 1.621 1.00 0.00 C ATOM 509 O LYS A 32 99.651 -0.414 1.950 1.00 0.00 O ATOM 510 CB LYS A 32 99.322 -2.471 -0.626 1.00 0.00 C ATOM 511 CG LYS A 32 98.585 -1.438 -1.489 1.00 0.00 C ATOM 512 CD LYS A 32 97.842 -0.435 -0.598 1.00 0.00 C ATOM 513 CE LYS A 32 96.673 0.178 -1.374 1.00 0.00 C ATOM 514 NZ LYS A 32 95.757 0.714 -0.330 1.00 0.00 N ATOM 0 H LYS A 32 101.397 -3.678 -0.267 1.00 0.00 H new ATOM 0 HA LYS A 32 100.739 -0.850 -0.258 1.00 0.00 H new ATOM 0 HB2 LYS A 32 99.733 -3.255 -1.262 1.00 0.00 H new ATOM 0 HB3 LYS A 32 98.619 -2.949 0.056 1.00 0.00 H new ATOM 0 HG2 LYS A 32 99.296 -0.912 -2.126 1.00 0.00 H new ATOM 0 HG3 LYS A 32 97.879 -1.942 -2.148 1.00 0.00 H new ATOM 0 HD2 LYS A 32 97.474 -0.934 0.299 1.00 0.00 H new ATOM 0 HD3 LYS A 32 98.524 0.349 -0.270 1.00 0.00 H new ATOM 0 HE2 LYS A 32 97.014 0.968 -2.043 1.00 0.00 H new ATOM 0 HE3 LYS A 32 96.174 -0.569 -1.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 94.930 1.151 -0.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 95.443 -0.062 0.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 96.257 1.428 0.237 1.00 0.00 H new ATOM 528 N LYS A 33 100.026 -2.540 2.462 1.00 0.00 N ATOM 529 CA LYS A 33 99.608 -2.358 3.891 1.00 0.00 C ATOM 530 C LYS A 33 100.614 -1.476 4.637 1.00 0.00 C ATOM 531 O LYS A 33 100.224 -0.663 5.457 1.00 0.00 O ATOM 532 CB LYS A 33 99.562 -3.759 4.511 1.00 0.00 C ATOM 533 CG LYS A 33 98.886 -3.691 5.882 1.00 0.00 C ATOM 534 CD LYS A 33 97.376 -3.525 5.698 1.00 0.00 C ATOM 535 CE LYS A 33 96.688 -3.557 7.065 1.00 0.00 C ATOM 536 NZ LYS A 33 95.230 -3.580 6.762 1.00 0.00 N ATOM 0 H LYS A 33 100.315 -3.487 2.218 1.00 0.00 H new ATOM 0 HA LYS A 33 98.638 -1.866 3.957 1.00 0.00 H new ATOM 0 HB2 LYS A 33 99.015 -4.439 3.858 1.00 0.00 H new ATOM 0 HB3 LYS A 33 100.572 -4.157 4.611 1.00 0.00 H new ATOM 0 HG2 LYS A 33 99.097 -4.598 6.449 1.00 0.00 H new ATOM 0 HG3 LYS A 33 99.287 -2.856 6.456 1.00 0.00 H new ATOM 0 HD2 LYS A 33 97.162 -2.583 5.193 1.00 0.00 H new ATOM 0 HD3 LYS A 33 96.986 -4.322 5.064 1.00 0.00 H new ATOM 0 HE2 LYS A 33 96.986 -4.436 7.637 1.00 0.00 H new ATOM 0 HE3 LYS A 33 96.954 -2.684 7.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 94.691 -3.603 7.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 94.974 -2.728 6.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 95.006 -4.426 6.200 1.00 0.00 H new ATOM 550 N ILE A 34 101.888 -1.633 4.355 1.00 0.00 N ATOM 551 CA ILE A 34 102.942 -0.877 5.109 1.00 0.00 C ATOM 552 C ILE A 34 103.068 0.543 4.538 1.00 0.00 C ATOM 553 O ILE A 34 103.301 1.482 5.278 1.00 0.00 O ATOM 554 CB ILE A 34 104.257 -1.664 4.946 1.00 0.00 C ATOM 555 CG1 ILE A 34 104.099 -3.097 5.471 1.00 0.00 C ATOM 556 CG2 ILE A 34 105.385 -0.990 5.740 1.00 0.00 C ATOM 557 CD1 ILE A 34 105.254 -3.958 4.956 1.00 0.00 C ATOM 0 H ILE A 34 102.245 -2.256 3.631 1.00 0.00 H new ATOM 0 HA ILE A 34 102.691 -0.780 6.165 1.00 0.00 H new ATOM 0 HB ILE A 34 104.501 -1.681 3.884 1.00 0.00 H new ATOM 0 HG12 ILE A 34 104.089 -3.097 6.561 1.00 0.00 H new ATOM 0 HG13 ILE A 34 103.146 -3.513 5.143 1.00 0.00 H new ATOM 0 HG21 ILE A 34 106.307 -1.557 5.615 1.00 0.00 H new ATOM 0 HG22 ILE A 34 105.531 0.026 5.373 1.00 0.00 H new ATOM 0 HG23 ILE A 34 105.118 -0.959 6.796 1.00 0.00 H new ATOM 0 HD11 ILE A 34 105.143 -4.976 5.328 1.00 0.00 H new ATOM 0 HD12 ILE A 34 105.243 -3.967 3.866 1.00 0.00 H new ATOM 0 HD13 ILE A 34 106.200 -3.545 5.306 1.00 0.00 H new ATOM 569 N LEU A 35 102.913 0.696 3.241 1.00 0.00 N ATOM 570 CA LEU A 35 103.157 2.022 2.588 1.00 0.00 C ATOM 571 C LEU A 35 101.842 2.731 2.243 1.00 0.00 C ATOM 572 O LEU A 35 101.807 3.947 2.166 1.00 0.00 O ATOM 573 CB LEU A 35 103.927 1.703 1.304 1.00 0.00 C ATOM 574 CG LEU A 35 105.297 1.105 1.636 1.00 0.00 C ATOM 575 CD1 LEU A 35 105.934 0.563 0.355 1.00 0.00 C ATOM 576 CD2 LEU A 35 106.201 2.185 2.235 1.00 0.00 C ATOM 0 H LEU A 35 102.626 -0.047 2.604 1.00 0.00 H new ATOM 0 HA LEU A 35 103.705 2.690 3.253 1.00 0.00 H new ATOM 0 HB2 LEU A 35 103.356 1.003 0.695 1.00 0.00 H new ATOM 0 HB3 LEU A 35 104.053 2.610 0.713 1.00 0.00 H new ATOM 0 HG LEU A 35 105.175 0.297 2.358 1.00 0.00 H new ATOM 0 HD11 LEU A 35 106.910 0.136 0.586 1.00 0.00 H new ATOM 0 HD12 LEU A 35 105.293 -0.208 -0.072 1.00 0.00 H new ATOM 0 HD13 LEU A 35 106.054 1.374 -0.363 1.00 0.00 H new ATOM 0 HD21 LEU A 35 107.175 1.755 2.470 1.00 0.00 H new ATOM 0 HD22 LEU A 35 106.326 2.995 1.516 1.00 0.00 H new ATOM 0 HD23 LEU A 35 105.747 2.575 3.146 1.00 0.00 H new ATOM 588 N GLY A 36 100.776 1.989 2.042 1.00 0.00 N ATOM 589 CA GLY A 36 99.503 2.586 1.535 1.00 0.00 C ATOM 590 C GLY A 36 99.521 2.732 0.003 1.00 0.00 C ATOM 591 O GLY A 36 98.674 3.417 -0.543 1.00 0.00 O ATOM 0 H GLY A 36 100.737 0.984 2.211 1.00 0.00 H new ATOM 0 HA2 GLY A 36 98.662 1.959 1.832 1.00 0.00 H new ATOM 0 HA3 GLY A 36 99.350 3.563 1.993 1.00 0.00 H new ATOM 595 N PHE A 37 100.460 2.112 -0.687 1.00 0.00 N ATOM 596 CA PHE A 37 100.406 2.053 -2.180 1.00 0.00 C ATOM 597 C PHE A 37 101.107 0.787 -2.686 1.00 0.00 C ATOM 598 O PHE A 37 101.898 0.192 -1.973 1.00 0.00 O ATOM 599 CB PHE A 37 101.113 3.323 -2.674 1.00 0.00 C ATOM 600 CG PHE A 37 102.584 3.424 -2.326 1.00 0.00 C ATOM 601 CD1 PHE A 37 103.542 2.616 -3.016 1.00 0.00 C ATOM 602 CD2 PHE A 37 103.020 4.344 -1.322 1.00 0.00 C ATOM 603 CE1 PHE A 37 104.932 2.723 -2.700 1.00 0.00 C ATOM 604 CE2 PHE A 37 104.410 4.450 -1.004 1.00 0.00 C ATOM 605 CZ PHE A 37 105.365 3.640 -1.694 1.00 0.00 C ATOM 0 H PHE A 37 101.264 1.643 -0.270 1.00 0.00 H new ATOM 0 HA PHE A 37 99.382 2.009 -2.552 1.00 0.00 H new ATOM 0 HB2 PHE A 37 101.009 3.379 -3.758 1.00 0.00 H new ATOM 0 HB3 PHE A 37 100.598 4.190 -2.259 1.00 0.00 H new ATOM 0 HD1 PHE A 37 103.214 1.924 -3.777 1.00 0.00 H new ATOM 0 HD2 PHE A 37 102.299 4.959 -0.804 1.00 0.00 H new ATOM 0 HE1 PHE A 37 105.654 2.111 -3.221 1.00 0.00 H new ATOM 0 HE2 PHE A 37 104.739 5.142 -0.243 1.00 0.00 H new ATOM 0 HZ PHE A 37 106.415 3.722 -1.454 1.00 0.00 H new ATOM 615 N GLU A 38 100.818 0.386 -3.901 1.00 0.00 N ATOM 616 CA GLU A 38 101.502 -0.799 -4.508 1.00 0.00 C ATOM 617 C GLU A 38 102.727 -0.338 -5.316 1.00 0.00 C ATOM 618 O GLU A 38 102.545 0.240 -6.372 1.00 0.00 O ATOM 619 CB GLU A 38 100.462 -1.437 -5.434 1.00 0.00 C ATOM 620 CG GLU A 38 99.339 -2.050 -4.597 1.00 0.00 C ATOM 621 CD GLU A 38 98.468 -2.942 -5.484 1.00 0.00 C ATOM 622 OE1 GLU A 38 98.774 -4.118 -5.589 1.00 0.00 O ATOM 623 OE2 GLU A 38 97.511 -2.433 -6.044 1.00 0.00 O ATOM 0 H GLU A 38 100.129 0.835 -4.505 1.00 0.00 H new ATOM 0 HA GLU A 38 101.856 -1.502 -3.754 1.00 0.00 H new ATOM 0 HB2 GLU A 38 100.056 -0.687 -6.113 1.00 0.00 H new ATOM 0 HB3 GLU A 38 100.931 -2.204 -6.050 1.00 0.00 H new ATOM 0 HG2 GLU A 38 99.759 -2.633 -3.778 1.00 0.00 H new ATOM 0 HG3 GLU A 38 98.733 -1.262 -4.149 1.00 0.00 H new ATOM 630 N PRO A 39 103.933 -0.592 -4.824 1.00 0.00 N ATOM 631 CA PRO A 39 105.160 -0.107 -5.529 1.00 0.00 C ATOM 632 C PRO A 39 105.331 -0.838 -6.866 1.00 0.00 C ATOM 633 O PRO A 39 104.769 -1.901 -7.063 1.00 0.00 O ATOM 634 CB PRO A 39 106.286 -0.462 -4.560 1.00 0.00 C ATOM 635 CG PRO A 39 105.754 -1.642 -3.828 1.00 0.00 C ATOM 636 CD PRO A 39 104.304 -1.335 -3.599 1.00 0.00 C ATOM 0 HA PRO A 39 105.131 0.956 -5.769 1.00 0.00 H new ATOM 0 HB2 PRO A 39 107.210 -0.700 -5.088 1.00 0.00 H new ATOM 0 HB3 PRO A 39 106.509 0.363 -3.884 1.00 0.00 H new ATOM 0 HG2 PRO A 39 105.877 -2.556 -4.410 1.00 0.00 H new ATOM 0 HG3 PRO A 39 106.280 -1.791 -2.885 1.00 0.00 H new ATOM 0 HD2 PRO A 39 103.712 -2.242 -3.480 1.00 0.00 H new ATOM 0 HD3 PRO A 39 104.154 -0.736 -2.701 1.00 0.00 H new ATOM 644 N TYR A 40 106.099 -0.270 -7.769 1.00 0.00 N ATOM 645 CA TYR A 40 106.310 -0.903 -9.112 1.00 0.00 C ATOM 646 C TYR A 40 107.231 -2.117 -8.977 1.00 0.00 C ATOM 647 O TYR A 40 107.940 -2.247 -7.992 1.00 0.00 O ATOM 648 CB TYR A 40 106.971 0.163 -9.991 1.00 0.00 C ATOM 649 CG TYR A 40 107.107 -0.250 -11.437 1.00 0.00 C ATOM 650 CD1 TYR A 40 108.281 -0.934 -11.879 1.00 0.00 C ATOM 651 CD2 TYR A 40 106.059 0.044 -12.366 1.00 0.00 C ATOM 652 CE1 TYR A 40 108.409 -1.325 -13.248 1.00 0.00 C ATOM 653 CE2 TYR A 40 106.187 -0.346 -13.734 1.00 0.00 C ATOM 654 CZ TYR A 40 107.362 -1.031 -14.175 1.00 0.00 C ATOM 655 OH TYR A 40 107.486 -1.409 -15.497 1.00 0.00 O ATOM 0 H TYR A 40 106.592 0.612 -7.631 1.00 0.00 H new ATOM 0 HA TYR A 40 105.369 -1.245 -9.544 1.00 0.00 H new ATOM 0 HB2 TYR A 40 106.386 1.081 -9.937 1.00 0.00 H new ATOM 0 HB3 TYR A 40 107.959 0.391 -9.592 1.00 0.00 H new ATOM 0 HD1 TYR A 40 109.072 -1.156 -11.178 1.00 0.00 H new ATOM 0 HD2 TYR A 40 105.171 0.561 -12.033 1.00 0.00 H new ATOM 0 HE1 TYR A 40 109.296 -1.842 -13.581 1.00 0.00 H new ATOM 0 HE2 TYR A 40 105.396 -0.124 -14.435 1.00 0.00 H new ATOM 0 HH TYR A 40 106.686 -1.135 -15.992 1.00 0.00 H new ATOM 665 N GLU A 41 107.227 -2.992 -9.958 1.00 0.00 N ATOM 666 CA GLU A 41 108.106 -4.205 -9.900 1.00 0.00 C ATOM 667 C GLU A 41 109.536 -3.827 -10.314 1.00 0.00 C ATOM 668 O GLU A 41 109.956 -4.055 -11.437 1.00 0.00 O ATOM 669 CB GLU A 41 107.493 -5.210 -10.886 1.00 0.00 C ATOM 670 CG GLU A 41 106.126 -5.664 -10.370 1.00 0.00 C ATOM 671 CD GLU A 41 105.549 -6.732 -11.303 1.00 0.00 C ATOM 672 OE1 GLU A 41 105.639 -6.554 -12.508 1.00 0.00 O ATOM 673 OE2 GLU A 41 105.026 -7.711 -10.797 1.00 0.00 O ATOM 0 H GLU A 41 106.652 -2.917 -10.797 1.00 0.00 H new ATOM 0 HA GLU A 41 108.164 -4.628 -8.897 1.00 0.00 H new ATOM 0 HB2 GLU A 41 107.388 -4.752 -11.870 1.00 0.00 H new ATOM 0 HB3 GLU A 41 108.153 -6.070 -11.003 1.00 0.00 H new ATOM 0 HG2 GLU A 41 106.222 -6.063 -9.360 1.00 0.00 H new ATOM 0 HG3 GLU A 41 105.448 -4.813 -10.313 1.00 0.00 H new ATOM 680 N GLY A 42 110.275 -3.243 -9.396 1.00 0.00 N ATOM 681 CA GLY A 42 111.712 -2.914 -9.646 1.00 0.00 C ATOM 682 C GLY A 42 112.311 -2.274 -8.390 1.00 0.00 C ATOM 683 O GLY A 42 111.596 -1.987 -7.446 1.00 0.00 O ATOM 0 H GLY A 42 109.935 -2.978 -8.472 1.00 0.00 H new ATOM 0 HA2 GLY A 42 112.264 -3.817 -9.906 1.00 0.00 H new ATOM 0 HA3 GLY A 42 111.799 -2.232 -10.492 1.00 0.00 H new ATOM 687 N THR A 43 113.606 -2.056 -8.383 1.00 0.00 N ATOM 688 CA THR A 43 114.272 -1.406 -7.213 1.00 0.00 C ATOM 689 C THR A 43 115.311 -0.383 -7.679 1.00 0.00 C ATOM 690 O THR A 43 115.812 -0.460 -8.787 1.00 0.00 O ATOM 691 CB THR A 43 114.958 -2.528 -6.422 1.00 0.00 C ATOM 692 OG1 THR A 43 115.550 -3.478 -7.307 1.00 0.00 O ATOM 693 CG2 THR A 43 113.936 -3.211 -5.508 1.00 0.00 C ATOM 0 H THR A 43 114.234 -2.304 -9.147 1.00 0.00 H new ATOM 0 HA THR A 43 113.544 -0.873 -6.601 1.00 0.00 H new ATOM 0 HB THR A 43 115.751 -2.097 -5.811 1.00 0.00 H new ATOM 0 HG1 THR A 43 116.278 -3.945 -6.846 1.00 0.00 H new ATOM 0 HG21 THR A 43 114.425 -4.008 -4.947 1.00 0.00 H new ATOM 0 HG22 THR A 43 113.522 -2.479 -4.814 1.00 0.00 H new ATOM 0 HG23 THR A 43 113.133 -3.633 -6.112 1.00 0.00 H new ATOM 701 N LEU A 44 115.624 0.567 -6.830 1.00 0.00 N ATOM 702 CA LEU A 44 116.764 1.496 -7.084 1.00 0.00 C ATOM 703 C LEU A 44 117.879 1.190 -6.081 1.00 0.00 C ATOM 704 O LEU A 44 117.680 1.316 -4.887 1.00 0.00 O ATOM 705 CB LEU A 44 116.187 2.898 -6.854 1.00 0.00 C ATOM 706 CG LEU A 44 117.232 3.963 -7.197 1.00 0.00 C ATOM 707 CD1 LEU A 44 117.442 4.011 -8.711 1.00 0.00 C ATOM 708 CD2 LEU A 44 116.745 5.330 -6.709 1.00 0.00 C ATOM 0 H LEU A 44 115.126 0.738 -5.956 1.00 0.00 H new ATOM 0 HA LEU A 44 117.186 1.402 -8.084 1.00 0.00 H new ATOM 0 HB2 LEU A 44 115.298 3.039 -7.469 1.00 0.00 H new ATOM 0 HB3 LEU A 44 115.876 3.005 -5.815 1.00 0.00 H new ATOM 0 HG LEU A 44 118.174 3.714 -6.709 1.00 0.00 H new ATOM 0 HD11 LEU A 44 118.186 4.770 -8.951 1.00 0.00 H new ATOM 0 HD12 LEU A 44 117.789 3.039 -9.061 1.00 0.00 H new ATOM 0 HD13 LEU A 44 116.500 4.258 -9.201 1.00 0.00 H new ATOM 0 HD21 LEU A 44 117.488 6.089 -6.953 1.00 0.00 H new ATOM 0 HD22 LEU A 44 115.802 5.576 -7.197 1.00 0.00 H new ATOM 0 HD23 LEU A 44 116.598 5.300 -5.629 1.00 0.00 H new ATOM 720 N ASN A 45 119.032 0.791 -6.564 1.00 0.00 N ATOM 721 CA ASN A 45 120.148 0.390 -5.656 1.00 0.00 C ATOM 722 C ASN A 45 121.140 1.546 -5.499 1.00 0.00 C ATOM 723 O ASN A 45 121.688 2.025 -6.476 1.00 0.00 O ATOM 724 CB ASN A 45 120.816 -0.800 -6.344 1.00 0.00 C ATOM 725 CG ASN A 45 119.959 -2.052 -6.149 1.00 0.00 C ATOM 726 OD1 ASN A 45 118.797 -2.069 -6.504 1.00 0.00 O ATOM 727 ND2 ASN A 45 120.487 -3.109 -5.594 1.00 0.00 N ATOM 0 H ASN A 45 119.247 0.726 -7.559 1.00 0.00 H new ATOM 0 HA ASN A 45 119.795 0.134 -4.657 1.00 0.00 H new ATOM 0 HB2 ASN A 45 120.942 -0.595 -7.407 1.00 0.00 H new ATOM 0 HB3 ASN A 45 121.812 -0.960 -5.930 1.00 0.00 H new ATOM 0 HD21 ASN A 45 119.924 -3.949 -5.458 1.00 0.00 H new ATOM 0 HD22 ASN A 45 121.462 -3.095 -5.296 1.00 0.00 H new ATOM 734 N LEU A 46 121.363 1.983 -4.281 1.00 0.00 N ATOM 735 CA LEU A 46 122.297 3.124 -4.028 1.00 0.00 C ATOM 736 C LEU A 46 123.448 2.686 -3.117 1.00 0.00 C ATOM 737 O LEU A 46 123.235 1.999 -2.133 1.00 0.00 O ATOM 738 CB LEU A 46 121.449 4.198 -3.343 1.00 0.00 C ATOM 739 CG LEU A 46 120.541 4.869 -4.376 1.00 0.00 C ATOM 740 CD1 LEU A 46 119.493 5.721 -3.657 1.00 0.00 C ATOM 741 CD2 LEU A 46 121.381 5.767 -5.289 1.00 0.00 C ATOM 0 H LEU A 46 120.932 1.592 -3.443 1.00 0.00 H new ATOM 0 HA LEU A 46 122.748 3.490 -4.950 1.00 0.00 H new ATOM 0 HB2 LEU A 46 120.848 3.751 -2.551 1.00 0.00 H new ATOM 0 HB3 LEU A 46 122.094 4.941 -2.873 1.00 0.00 H new ATOM 0 HG LEU A 46 120.045 4.103 -4.972 1.00 0.00 H new ATOM 0 HD11 LEU A 46 118.846 6.199 -4.392 1.00 0.00 H new ATOM 0 HD12 LEU A 46 118.894 5.086 -3.004 1.00 0.00 H new ATOM 0 HD13 LEU A 46 119.992 6.485 -3.061 1.00 0.00 H new ATOM 0 HD21 LEU A 46 120.734 6.245 -6.025 1.00 0.00 H new ATOM 0 HD22 LEU A 46 121.877 6.532 -4.691 1.00 0.00 H new ATOM 0 HD23 LEU A 46 122.131 5.165 -5.802 1.00 0.00 H new ATOM 753 N LYS A 47 124.652 3.085 -3.455 1.00 0.00 N ATOM 754 CA LYS A 47 125.830 2.835 -2.568 1.00 0.00 C ATOM 755 C LYS A 47 126.091 4.077 -1.711 1.00 0.00 C ATOM 756 O LYS A 47 126.101 5.183 -2.221 1.00 0.00 O ATOM 757 CB LYS A 47 127.001 2.578 -3.521 1.00 0.00 C ATOM 758 CG LYS A 47 128.232 2.134 -2.727 1.00 0.00 C ATOM 759 CD LYS A 47 129.437 2.044 -3.666 1.00 0.00 C ATOM 760 CE LYS A 47 130.633 1.462 -2.908 1.00 0.00 C ATOM 761 NZ LYS A 47 130.425 -0.013 -2.940 1.00 0.00 N ATOM 0 H LYS A 47 124.869 3.580 -4.320 1.00 0.00 H new ATOM 0 HA LYS A 47 125.677 1.996 -1.889 1.00 0.00 H new ATOM 0 HB2 LYS A 47 126.729 1.811 -4.246 1.00 0.00 H new ATOM 0 HB3 LYS A 47 127.228 3.483 -4.084 1.00 0.00 H new ATOM 0 HG2 LYS A 47 128.435 2.842 -1.924 1.00 0.00 H new ATOM 0 HG3 LYS A 47 128.048 1.166 -2.260 1.00 0.00 H new ATOM 0 HD2 LYS A 47 129.197 1.416 -4.524 1.00 0.00 H new ATOM 0 HD3 LYS A 47 129.684 3.032 -4.053 1.00 0.00 H new ATOM 0 HE2 LYS A 47 131.574 1.739 -3.383 1.00 0.00 H new ATOM 0 HE3 LYS A 47 130.671 1.834 -1.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 130.621 -0.412 -2.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 129.441 -0.219 -3.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 131.068 -0.439 -3.638 1.00 0.00 H new ATOM 775 N LEU A 48 126.296 3.890 -0.428 1.00 0.00 N ATOM 776 CA LEU A 48 126.495 5.043 0.502 1.00 0.00 C ATOM 777 C LEU A 48 127.936 5.076 1.011 1.00 0.00 C ATOM 778 O LEU A 48 128.637 4.081 0.957 1.00 0.00 O ATOM 779 CB LEU A 48 125.538 4.800 1.671 1.00 0.00 C ATOM 780 CG LEU A 48 124.087 4.876 1.193 1.00 0.00 C ATOM 781 CD1 LEU A 48 123.162 4.359 2.296 1.00 0.00 C ATOM 782 CD2 LEU A 48 123.730 6.329 0.872 1.00 0.00 C ATOM 0 H LEU A 48 126.334 2.973 0.018 1.00 0.00 H new ATOM 0 HA LEU A 48 126.302 5.994 0.005 1.00 0.00 H new ATOM 0 HB2 LEU A 48 125.732 3.822 2.112 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.710 5.541 2.451 1.00 0.00 H new ATOM 0 HG LEU A 48 123.967 4.266 0.298 1.00 0.00 H new ATOM 0 HD11 LEU A 48 122.127 4.412 1.958 1.00 0.00 H new ATOM 0 HD12 LEU A 48 123.415 3.325 2.528 1.00 0.00 H new ATOM 0 HD13 LEU A 48 123.284 4.971 3.189 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.696 6.383 0.531 1.00 0.00 H new ATOM 0 HD22 LEU A 48 123.849 6.939 1.767 1.00 0.00 H new ATOM 0 HD23 LEU A 48 124.390 6.701 0.088 1.00 0.00 H new ATOM 794 N ASP A 49 128.369 6.217 1.499 1.00 0.00 N ATOM 795 CA ASP A 49 129.704 6.312 2.173 1.00 0.00 C ATOM 796 C ASP A 49 129.608 6.023 3.684 1.00 0.00 C ATOM 797 O ASP A 49 130.551 6.283 4.410 1.00 0.00 O ATOM 798 CB ASP A 49 130.206 7.744 1.911 1.00 0.00 C ATOM 799 CG ASP A 49 129.259 8.795 2.505 1.00 0.00 C ATOM 800 OD1 ASP A 49 128.090 8.779 2.155 1.00 0.00 O ATOM 801 OD2 ASP A 49 129.720 9.597 3.301 1.00 0.00 O ATOM 0 H ASP A 49 127.849 7.093 1.458 1.00 0.00 H new ATOM 0 HA ASP A 49 130.393 5.566 1.777 1.00 0.00 H new ATOM 0 HB2 ASP A 49 131.200 7.865 2.341 1.00 0.00 H new ATOM 0 HB3 ASP A 49 130.301 7.905 0.837 1.00 0.00 H new ATOM 806 N ARG A 50 128.495 5.494 4.154 1.00 0.00 N ATOM 807 CA ARG A 50 128.313 5.228 5.614 1.00 0.00 C ATOM 808 C ARG A 50 127.472 3.963 5.800 1.00 0.00 C ATOM 809 O ARG A 50 126.546 3.725 5.044 1.00 0.00 O ATOM 810 CB ARG A 50 127.564 6.446 6.161 1.00 0.00 C ATOM 811 CG ARG A 50 128.446 7.693 6.072 1.00 0.00 C ATOM 812 CD ARG A 50 127.739 8.866 6.760 1.00 0.00 C ATOM 813 NE ARG A 50 128.583 10.074 6.481 1.00 0.00 N ATOM 814 CZ ARG A 50 128.094 11.300 6.480 1.00 0.00 C ATOM 815 NH1 ARG A 50 126.837 11.573 6.749 1.00 0.00 N ATOM 816 NH2 ARG A 50 128.899 12.291 6.211 1.00 0.00 N ATOM 0 H ARG A 50 127.697 5.234 3.574 1.00 0.00 H new ATOM 0 HA ARG A 50 129.262 5.076 6.129 1.00 0.00 H new ATOM 0 HB2 ARG A 50 126.645 6.601 5.596 1.00 0.00 H new ATOM 0 HB3 ARG A 50 127.275 6.269 7.197 1.00 0.00 H new ATOM 0 HG2 ARG A 50 129.409 7.505 6.547 1.00 0.00 H new ATOM 0 HG3 ARG A 50 128.647 7.936 5.029 1.00 0.00 H new ATOM 0 HD2 ARG A 50 126.729 8.996 6.371 1.00 0.00 H new ATOM 0 HD3 ARG A 50 127.647 8.692 7.832 1.00 0.00 H new ATOM 0 HE ARG A 50 129.575 9.943 6.284 1.00 0.00 H new ATOM 0 HH11 ARG A 50 126.188 10.819 6.972 1.00 0.00 H new ATOM 0 HH12 ARG A 50 126.511 12.539 6.734 1.00 0.00 H new ATOM 0 HH21 ARG A 50 129.882 12.109 6.008 1.00 0.00 H new ATOM 0 HH22 ARG A 50 128.545 13.248 6.204 1.00 0.00 H new ATOM 830 N GLU A 51 127.790 3.161 6.793 1.00 0.00 N ATOM 831 CA GLU A 51 126.995 1.914 7.067 1.00 0.00 C ATOM 832 C GLU A 51 125.562 2.275 7.475 1.00 0.00 C ATOM 833 O GLU A 51 125.339 3.294 8.106 1.00 0.00 O ATOM 834 CB GLU A 51 127.703 1.195 8.221 1.00 0.00 C ATOM 835 CG GLU A 51 129.091 0.738 7.767 1.00 0.00 C ATOM 836 CD GLU A 51 129.771 -0.043 8.893 1.00 0.00 C ATOM 837 OE1 GLU A 51 129.111 -0.873 9.497 1.00 0.00 O ATOM 838 OE2 GLU A 51 130.942 0.201 9.133 1.00 0.00 O ATOM 0 H GLU A 51 128.571 3.317 7.430 1.00 0.00 H new ATOM 0 HA GLU A 51 126.936 1.283 6.180 1.00 0.00 H new ATOM 0 HB2 GLU A 51 127.791 1.862 9.079 1.00 0.00 H new ATOM 0 HB3 GLU A 51 127.114 0.337 8.544 1.00 0.00 H new ATOM 0 HG2 GLU A 51 129.006 0.113 6.878 1.00 0.00 H new ATOM 0 HG3 GLU A 51 129.697 1.601 7.493 1.00 0.00 H new ATOM 845 N PHE A 52 124.606 1.448 7.115 1.00 0.00 N ATOM 846 CA PHE A 52 123.175 1.734 7.441 1.00 0.00 C ATOM 847 C PHE A 52 122.492 0.492 8.023 1.00 0.00 C ATOM 848 O PHE A 52 122.689 -0.609 7.541 1.00 0.00 O ATOM 849 CB PHE A 52 122.533 2.125 6.108 1.00 0.00 C ATOM 850 CG PHE A 52 121.091 2.557 6.240 1.00 0.00 C ATOM 851 CD1 PHE A 52 120.776 3.902 6.607 1.00 0.00 C ATOM 852 CD2 PHE A 52 120.041 1.616 6.004 1.00 0.00 C ATOM 853 CE1 PHE A 52 119.411 4.306 6.737 1.00 0.00 C ATOM 854 CE2 PHE A 52 118.676 2.022 6.132 1.00 0.00 C ATOM 855 CZ PHE A 52 118.362 3.366 6.500 1.00 0.00 C ATOM 0 H PHE A 52 124.761 0.579 6.604 1.00 0.00 H new ATOM 0 HA PHE A 52 123.078 2.521 8.189 1.00 0.00 H new ATOM 0 HB2 PHE A 52 123.108 2.936 5.660 1.00 0.00 H new ATOM 0 HB3 PHE A 52 122.590 1.278 5.424 1.00 0.00 H new ATOM 0 HD1 PHE A 52 121.569 4.613 6.786 1.00 0.00 H new ATOM 0 HD2 PHE A 52 120.279 0.599 5.729 1.00 0.00 H new ATOM 0 HE1 PHE A 52 119.173 5.322 7.014 1.00 0.00 H new ATOM 0 HE2 PHE A 52 117.882 1.312 5.950 1.00 0.00 H new ATOM 0 HZ PHE A 52 117.331 3.672 6.599 1.00 0.00 H new ATOM 865 N ASP A 53 121.699 0.679 9.054 1.00 0.00 N ATOM 866 CA ASP A 53 120.888 -0.438 9.624 1.00 0.00 C ATOM 867 C ASP A 53 119.480 0.064 9.961 1.00 0.00 C ATOM 868 O ASP A 53 119.329 1.062 10.642 1.00 0.00 O ATOM 869 CB ASP A 53 121.629 -0.859 10.896 1.00 0.00 C ATOM 870 CG ASP A 53 121.048 -2.175 11.417 1.00 0.00 C ATOM 871 OD1 ASP A 53 119.834 -2.288 11.463 1.00 0.00 O ATOM 872 OD2 ASP A 53 121.828 -3.048 11.762 1.00 0.00 O ATOM 0 H ASP A 53 121.580 1.574 9.529 1.00 0.00 H new ATOM 0 HA ASP A 53 120.776 -1.270 8.929 1.00 0.00 H new ATOM 0 HB2 ASP A 53 122.692 -0.977 10.687 1.00 0.00 H new ATOM 0 HB3 ASP A 53 121.537 -0.083 11.656 1.00 0.00 H new ATOM 877 N ILE A 54 118.465 -0.624 9.487 1.00 0.00 N ATOM 878 CA ILE A 54 117.049 -0.192 9.749 1.00 0.00 C ATOM 879 C ILE A 54 116.719 -0.239 11.256 1.00 0.00 C ATOM 880 O ILE A 54 115.814 0.446 11.699 1.00 0.00 O ATOM 881 CB ILE A 54 116.152 -1.137 8.923 1.00 0.00 C ATOM 882 CG1 ILE A 54 114.687 -0.693 9.037 1.00 0.00 C ATOM 883 CG2 ILE A 54 116.293 -2.590 9.397 1.00 0.00 C ATOM 884 CD1 ILE A 54 113.840 -1.410 7.983 1.00 0.00 C ATOM 0 H ILE A 54 118.556 -1.471 8.927 1.00 0.00 H new ATOM 0 HA ILE A 54 116.886 0.844 9.452 1.00 0.00 H new ATOM 0 HB ILE A 54 116.471 -1.086 7.882 1.00 0.00 H new ATOM 0 HG12 ILE A 54 114.307 -0.916 10.034 1.00 0.00 H new ATOM 0 HG13 ILE A 54 114.614 0.386 8.902 1.00 0.00 H new ATOM 0 HG21 ILE A 54 115.649 -3.233 8.797 1.00 0.00 H new ATOM 0 HG22 ILE A 54 117.329 -2.910 9.287 1.00 0.00 H new ATOM 0 HG23 ILE A 54 116.001 -2.661 10.445 1.00 0.00 H new ATOM 0 HD11 ILE A 54 112.802 -1.089 8.071 1.00 0.00 H new ATOM 0 HD12 ILE A 54 114.213 -1.165 6.988 1.00 0.00 H new ATOM 0 HD13 ILE A 54 113.901 -2.487 8.138 1.00 0.00 H new ATOM 896 N ASN A 55 117.437 -1.030 12.025 1.00 0.00 N ATOM 897 CA ASN A 55 117.151 -1.143 13.496 1.00 0.00 C ATOM 898 C ASN A 55 117.627 0.093 14.278 1.00 0.00 C ATOM 899 O ASN A 55 117.446 0.146 15.482 1.00 0.00 O ATOM 900 CB ASN A 55 117.896 -2.391 13.982 1.00 0.00 C ATOM 901 CG ASN A 55 117.299 -3.638 13.323 1.00 0.00 C ATOM 902 OD1 ASN A 55 116.101 -3.727 13.138 1.00 0.00 O ATOM 903 ND2 ASN A 55 118.089 -4.610 12.960 1.00 0.00 N ATOM 0 H ASN A 55 118.212 -1.605 11.695 1.00 0.00 H new ATOM 0 HA ASN A 55 116.076 -1.213 13.663 1.00 0.00 H new ATOM 0 HB2 ASN A 55 118.956 -2.311 13.739 1.00 0.00 H new ATOM 0 HB3 ASN A 55 117.823 -2.471 15.067 1.00 0.00 H new ATOM 0 HD21 ASN A 55 117.702 -5.445 12.521 1.00 0.00 H new ATOM 0 HD22 ASN A 55 119.094 -4.535 13.115 1.00 0.00 H new ATOM 910 N LYS A 56 118.224 1.070 13.624 1.00 0.00 N ATOM 911 CA LYS A 56 118.525 2.374 14.297 1.00 0.00 C ATOM 912 C LYS A 56 117.367 3.374 14.129 1.00 0.00 C ATOM 913 O LYS A 56 117.328 4.373 14.825 1.00 0.00 O ATOM 914 CB LYS A 56 119.796 2.904 13.626 1.00 0.00 C ATOM 915 CG LYS A 56 120.974 1.989 13.967 1.00 0.00 C ATOM 916 CD LYS A 56 122.262 2.579 13.391 1.00 0.00 C ATOM 917 CE LYS A 56 123.419 1.605 13.626 1.00 0.00 C ATOM 918 NZ LYS A 56 124.500 2.066 12.710 1.00 0.00 N ATOM 0 H LYS A 56 118.515 1.015 12.648 1.00 0.00 H new ATOM 0 HA LYS A 56 118.658 2.239 15.370 1.00 0.00 H new ATOM 0 HB2 LYS A 56 119.658 2.949 12.546 1.00 0.00 H new ATOM 0 HB3 LYS A 56 120.001 3.920 13.964 1.00 0.00 H new ATOM 0 HG2 LYS A 56 121.063 1.880 15.048 1.00 0.00 H new ATOM 0 HG3 LYS A 56 120.804 0.992 13.559 1.00 0.00 H new ATOM 0 HD2 LYS A 56 122.143 2.768 12.324 1.00 0.00 H new ATOM 0 HD3 LYS A 56 122.478 3.538 13.862 1.00 0.00 H new ATOM 0 HE2 LYS A 56 123.747 1.624 14.665 1.00 0.00 H new ATOM 0 HE3 LYS A 56 123.124 0.580 13.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 125.329 1.447 12.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 124.161 2.030 11.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 124.765 3.043 12.950 1.00 0.00 H new ATOM 932 N PHE A 57 116.439 3.121 13.226 1.00 0.00 N ATOM 933 CA PHE A 57 115.227 3.987 13.095 1.00 0.00 C ATOM 934 C PHE A 57 113.972 3.158 13.388 1.00 0.00 C ATOM 935 O PHE A 57 114.061 1.959 13.588 1.00 0.00 O ATOM 936 CB PHE A 57 115.212 4.481 11.644 1.00 0.00 C ATOM 937 CG PHE A 57 116.472 5.204 11.222 1.00 0.00 C ATOM 938 CD1 PHE A 57 116.583 6.618 11.402 1.00 0.00 C ATOM 939 CD2 PHE A 57 117.555 4.469 10.649 1.00 0.00 C ATOM 940 CE1 PHE A 57 117.778 7.296 11.008 1.00 0.00 C ATOM 941 CE2 PHE A 57 118.750 5.148 10.255 1.00 0.00 C ATOM 942 CZ PHE A 57 118.861 6.561 10.434 1.00 0.00 C ATOM 0 H PHE A 57 116.476 2.341 12.570 1.00 0.00 H new ATOM 0 HA PHE A 57 115.246 4.823 13.794 1.00 0.00 H new ATOM 0 HB2 PHE A 57 115.057 3.628 10.983 1.00 0.00 H new ATOM 0 HB3 PHE A 57 114.361 5.148 11.508 1.00 0.00 H new ATOM 0 HD1 PHE A 57 115.764 7.173 11.835 1.00 0.00 H new ATOM 0 HD2 PHE A 57 117.471 3.401 10.514 1.00 0.00 H new ATOM 0 HE1 PHE A 57 117.863 8.364 11.144 1.00 0.00 H new ATOM 0 HE2 PHE A 57 119.569 4.593 9.822 1.00 0.00 H new ATOM 0 HZ PHE A 57 119.763 7.074 10.136 1.00 0.00 H new ATOM 952 N LYS A 58 112.821 3.790 13.412 1.00 0.00 N ATOM 953 CA LYS A 58 111.553 3.072 13.759 1.00 0.00 C ATOM 954 C LYS A 58 110.891 2.528 12.489 1.00 0.00 C ATOM 955 O LYS A 58 110.288 3.271 11.736 1.00 0.00 O ATOM 956 CB LYS A 58 110.656 4.116 14.431 1.00 0.00 C ATOM 957 CG LYS A 58 111.276 4.557 15.759 1.00 0.00 C ATOM 958 CD LYS A 58 111.163 3.425 16.782 1.00 0.00 C ATOM 959 CE LYS A 58 111.620 3.926 18.153 1.00 0.00 C ATOM 960 NZ LYS A 58 111.184 2.873 19.112 1.00 0.00 N ATOM 0 H LYS A 58 112.706 4.782 13.204 1.00 0.00 H new ATOM 0 HA LYS A 58 111.734 2.221 14.416 1.00 0.00 H new ATOM 0 HB2 LYS A 58 110.530 4.977 13.775 1.00 0.00 H new ATOM 0 HB3 LYS A 58 109.664 3.699 14.603 1.00 0.00 H new ATOM 0 HG2 LYS A 58 112.322 4.824 15.612 1.00 0.00 H new ATOM 0 HG3 LYS A 58 110.769 5.448 16.130 1.00 0.00 H new ATOM 0 HD2 LYS A 58 110.133 3.072 16.837 1.00 0.00 H new ATOM 0 HD3 LYS A 58 111.774 2.578 16.471 1.00 0.00 H new ATOM 0 HE2 LYS A 58 112.701 4.064 18.183 1.00 0.00 H new ATOM 0 HE3 LYS A 58 111.169 4.889 18.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 111.462 3.145 20.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 110.150 2.768 19.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 111.635 1.969 18.864 1.00 0.00 H new ATOM 974 N TYR A 59 111.007 1.238 12.262 1.00 0.00 N ATOM 975 CA TYR A 59 110.402 0.602 11.052 1.00 0.00 C ATOM 976 C TYR A 59 109.213 -0.284 11.449 1.00 0.00 C ATOM 977 O TYR A 59 108.900 -0.413 12.619 1.00 0.00 O ATOM 978 CB TYR A 59 111.547 -0.213 10.429 1.00 0.00 C ATOM 979 CG TYR A 59 112.018 -1.389 11.262 1.00 0.00 C ATOM 980 CD1 TYR A 59 113.060 -1.218 12.227 1.00 0.00 C ATOM 981 CD2 TYR A 59 111.412 -2.672 11.088 1.00 0.00 C ATOM 982 CE1 TYR A 59 113.495 -2.329 13.015 1.00 0.00 C ATOM 983 CE2 TYR A 59 111.846 -3.781 11.875 1.00 0.00 C ATOM 984 CZ TYR A 59 112.887 -3.610 12.839 1.00 0.00 C ATOM 985 OH TYR A 59 113.306 -4.683 13.600 1.00 0.00 O ATOM 0 H TYR A 59 111.504 0.592 12.876 1.00 0.00 H new ATOM 0 HA TYR A 59 110.002 1.329 10.345 1.00 0.00 H new ATOM 0 HB2 TYR A 59 111.224 -0.582 9.456 1.00 0.00 H new ATOM 0 HB3 TYR A 59 112.393 0.451 10.253 1.00 0.00 H new ATOM 0 HD1 TYR A 59 113.518 -0.249 12.360 1.00 0.00 H new ATOM 0 HD2 TYR A 59 110.625 -2.802 10.360 1.00 0.00 H new ATOM 0 HE1 TYR A 59 114.283 -2.200 13.743 1.00 0.00 H new ATOM 0 HE2 TYR A 59 111.387 -4.750 11.742 1.00 0.00 H new ATOM 0 HH TYR A 59 112.789 -5.479 13.356 1.00 0.00 H new ATOM 995 N ILE A 60 108.562 -0.883 10.477 1.00 0.00 N ATOM 996 CA ILE A 60 107.458 -1.853 10.764 1.00 0.00 C ATOM 997 C ILE A 60 107.931 -3.255 10.358 1.00 0.00 C ATOM 998 O ILE A 60 108.442 -3.442 9.268 1.00 0.00 O ATOM 999 CB ILE A 60 106.257 -1.393 9.914 1.00 0.00 C ATOM 1000 CG1 ILE A 60 105.844 0.032 10.301 1.00 0.00 C ATOM 1001 CG2 ILE A 60 105.057 -2.320 10.144 1.00 0.00 C ATOM 1002 CD1 ILE A 60 104.913 0.605 9.229 1.00 0.00 C ATOM 0 H ILE A 60 108.753 -0.738 9.486 1.00 0.00 H new ATOM 0 HA ILE A 60 107.179 -1.887 11.817 1.00 0.00 H new ATOM 0 HB ILE A 60 106.557 -1.422 8.866 1.00 0.00 H new ATOM 0 HG12 ILE A 60 105.341 0.026 11.268 1.00 0.00 H new ATOM 0 HG13 ILE A 60 106.727 0.662 10.405 1.00 0.00 H new ATOM 0 HG21 ILE A 60 104.216 -1.984 9.538 1.00 0.00 H new ATOM 0 HG22 ILE A 60 105.324 -3.338 9.861 1.00 0.00 H new ATOM 0 HG23 ILE A 60 104.777 -2.298 11.197 1.00 0.00 H new ATOM 0 HD11 ILE A 60 104.620 1.618 9.505 1.00 0.00 H new ATOM 0 HD12 ILE A 60 105.431 0.626 8.270 1.00 0.00 H new ATOM 0 HD13 ILE A 60 104.024 -0.020 9.147 1.00 0.00 H new ATOM 1014 N GLU A 61 107.762 -4.223 11.230 1.00 0.00 N ATOM 1015 CA GLU A 61 108.206 -5.618 10.935 1.00 0.00 C ATOM 1016 C GLU A 61 106.994 -6.505 10.637 1.00 0.00 C ATOM 1017 O GLU A 61 105.943 -6.329 11.228 1.00 0.00 O ATOM 1018 CB GLU A 61 108.901 -6.085 12.215 1.00 0.00 C ATOM 1019 CG GLU A 61 109.640 -7.398 11.949 1.00 0.00 C ATOM 1020 CD GLU A 61 110.252 -7.913 13.254 1.00 0.00 C ATOM 1021 OE1 GLU A 61 110.859 -7.118 13.953 1.00 0.00 O ATOM 1022 OE2 GLU A 61 110.103 -9.091 13.531 1.00 0.00 O ATOM 0 H GLU A 61 107.329 -4.100 12.145 1.00 0.00 H new ATOM 0 HA GLU A 61 108.862 -5.669 10.066 1.00 0.00 H new ATOM 0 HB2 GLU A 61 109.602 -5.324 12.558 1.00 0.00 H new ATOM 0 HB3 GLU A 61 108.167 -6.223 13.009 1.00 0.00 H new ATOM 0 HG2 GLU A 61 108.952 -8.138 11.540 1.00 0.00 H new ATOM 0 HG3 GLU A 61 110.421 -7.244 11.205 1.00 0.00 H new ATOM 1029 N THR A 62 107.141 -7.445 9.730 1.00 0.00 N ATOM 1030 CA THR A 62 106.020 -8.382 9.402 1.00 0.00 C ATOM 1031 C THR A 62 106.462 -9.841 9.576 1.00 0.00 C ATOM 1032 O THR A 62 107.555 -10.212 9.189 1.00 0.00 O ATOM 1033 CB THR A 62 105.670 -8.085 7.944 1.00 0.00 C ATOM 1034 OG1 THR A 62 106.851 -8.124 7.157 1.00 0.00 O ATOM 1035 CG2 THR A 62 105.033 -6.698 7.852 1.00 0.00 C ATOM 0 H THR A 62 107.998 -7.603 9.200 1.00 0.00 H new ATOM 0 HA THR A 62 105.163 -8.243 10.061 1.00 0.00 H new ATOM 0 HB THR A 62 104.968 -8.832 7.574 1.00 0.00 H new ATOM 0 HG1 THR A 62 107.313 -7.262 7.217 1.00 0.00 H new ATOM 0 HG21 THR A 62 104.781 -6.481 6.814 1.00 0.00 H new ATOM 0 HG22 THR A 62 104.127 -6.673 8.458 1.00 0.00 H new ATOM 0 HG23 THR A 62 105.736 -5.950 8.219 1.00 0.00 H new ATOM 1043 N GLU A 63 105.601 -10.651 10.149 1.00 0.00 N ATOM 1044 CA GLU A 63 105.996 -12.025 10.607 1.00 0.00 C ATOM 1045 C GLU A 63 106.101 -13.010 9.435 1.00 0.00 C ATOM 1046 O GLU A 63 105.749 -12.688 8.313 1.00 0.00 O ATOM 1047 CB GLU A 63 104.921 -12.478 11.613 1.00 0.00 C ATOM 1048 CG GLU A 63 103.527 -12.511 10.972 1.00 0.00 C ATOM 1049 CD GLU A 63 102.599 -13.389 11.814 1.00 0.00 C ATOM 1050 OE1 GLU A 63 102.799 -14.591 11.822 1.00 0.00 O ATOM 1051 OE2 GLU A 63 101.703 -12.841 12.437 1.00 0.00 O ATOM 0 H GLU A 63 104.624 -10.414 10.322 1.00 0.00 H new ATOM 0 HA GLU A 63 106.984 -12.002 11.067 1.00 0.00 H new ATOM 0 HB2 GLU A 63 105.171 -13.469 11.993 1.00 0.00 H new ATOM 0 HB3 GLU A 63 104.913 -11.802 12.468 1.00 0.00 H new ATOM 0 HG2 GLU A 63 103.124 -11.501 10.901 1.00 0.00 H new ATOM 0 HG3 GLU A 63 103.591 -12.901 9.956 1.00 0.00 H new ATOM 1058 N ASP A 64 106.583 -14.206 9.705 1.00 0.00 N ATOM 1059 CA ASP A 64 106.767 -15.239 8.630 1.00 0.00 C ATOM 1060 C ASP A 64 105.396 -15.683 8.108 1.00 0.00 C ATOM 1061 O ASP A 64 104.464 -15.832 8.879 1.00 0.00 O ATOM 1062 CB ASP A 64 107.491 -16.429 9.284 1.00 0.00 C ATOM 1063 CG ASP A 64 108.853 -15.995 9.834 1.00 0.00 C ATOM 1064 OD1 ASP A 64 109.677 -15.557 9.050 1.00 0.00 O ATOM 1065 OD2 ASP A 64 109.048 -16.108 11.033 1.00 0.00 O ATOM 0 H ASP A 64 106.860 -14.513 10.638 1.00 0.00 H new ATOM 0 HA ASP A 64 107.340 -14.845 7.791 1.00 0.00 H new ATOM 0 HB2 ASP A 64 106.880 -16.835 10.090 1.00 0.00 H new ATOM 0 HB3 ASP A 64 107.625 -17.226 8.553 1.00 0.00 H new ATOM 1070 N PHE A 65 105.277 -15.893 6.815 1.00 0.00 N ATOM 1071 CA PHE A 65 103.952 -16.239 6.208 1.00 0.00 C ATOM 1072 C PHE A 65 104.108 -17.368 5.183 1.00 0.00 C ATOM 1073 O PHE A 65 105.213 -17.698 4.791 1.00 0.00 O ATOM 1074 CB PHE A 65 103.467 -14.948 5.538 1.00 0.00 C ATOM 1075 CG PHE A 65 104.389 -14.418 4.462 1.00 0.00 C ATOM 1076 CD1 PHE A 65 105.431 -13.499 4.799 1.00 0.00 C ATOM 1077 CD2 PHE A 65 104.215 -14.837 3.107 1.00 0.00 C ATOM 1078 CE1 PHE A 65 106.300 -13.001 3.780 1.00 0.00 C ATOM 1079 CE2 PHE A 65 105.085 -14.338 2.088 1.00 0.00 C ATOM 1080 CZ PHE A 65 106.126 -13.419 2.425 1.00 0.00 C ATOM 0 H PHE A 65 106.049 -15.838 6.151 1.00 0.00 H new ATOM 0 HA PHE A 65 103.240 -16.596 6.952 1.00 0.00 H new ATOM 0 HB2 PHE A 65 102.484 -15.127 5.102 1.00 0.00 H new ATOM 0 HB3 PHE A 65 103.342 -14.181 6.302 1.00 0.00 H new ATOM 0 HD1 PHE A 65 105.561 -13.181 5.823 1.00 0.00 H new ATOM 0 HD2 PHE A 65 103.427 -15.530 2.853 1.00 0.00 H new ATOM 0 HE1 PHE A 65 107.089 -12.308 4.034 1.00 0.00 H new ATOM 0 HE2 PHE A 65 104.955 -14.656 1.064 1.00 0.00 H new ATOM 0 HZ PHE A 65 106.782 -13.040 1.655 1.00 0.00 H new ATOM 1090 N GLU A 66 103.009 -17.951 4.757 1.00 0.00 N ATOM 1091 CA GLU A 66 103.057 -19.045 3.738 1.00 0.00 C ATOM 1092 C GLU A 66 102.158 -18.707 2.542 1.00 0.00 C ATOM 1093 O GLU A 66 101.156 -18.031 2.686 1.00 0.00 O ATOM 1094 CB GLU A 66 102.540 -20.292 4.463 1.00 0.00 C ATOM 1095 CG GLU A 66 103.706 -21.020 5.141 1.00 0.00 C ATOM 1096 CD GLU A 66 103.189 -22.210 5.957 1.00 0.00 C ATOM 1097 OE1 GLU A 66 102.130 -22.093 6.554 1.00 0.00 O ATOM 1098 OE2 GLU A 66 103.872 -23.221 5.980 1.00 0.00 O ATOM 0 H GLU A 66 102.071 -17.710 5.078 1.00 0.00 H new ATOM 0 HA GLU A 66 104.063 -19.190 3.344 1.00 0.00 H new ATOM 0 HB2 GLU A 66 101.795 -20.009 5.206 1.00 0.00 H new ATOM 0 HB3 GLU A 66 102.047 -20.957 3.754 1.00 0.00 H new ATOM 0 HG2 GLU A 66 104.414 -21.367 4.388 1.00 0.00 H new ATOM 0 HG3 GLU A 66 104.245 -20.331 5.792 1.00 0.00 H new ATOM 1105 N PHE A 67 102.527 -19.181 1.374 1.00 0.00 N ATOM 1106 CA PHE A 67 101.682 -19.008 0.155 1.00 0.00 C ATOM 1107 C PHE A 67 101.885 -20.210 -0.773 1.00 0.00 C ATOM 1108 O PHE A 67 103.003 -20.623 -1.016 1.00 0.00 O ATOM 1109 CB PHE A 67 102.184 -17.717 -0.496 1.00 0.00 C ATOM 1110 CG PHE A 67 101.467 -17.351 -1.775 1.00 0.00 C ATOM 1111 CD1 PHE A 67 100.164 -16.763 -1.724 1.00 0.00 C ATOM 1112 CD2 PHE A 67 102.091 -17.593 -3.038 1.00 0.00 C ATOM 1113 CE1 PHE A 67 99.488 -16.417 -2.934 1.00 0.00 C ATOM 1114 CE2 PHE A 67 101.414 -17.248 -4.248 1.00 0.00 C ATOM 1115 CZ PHE A 67 100.113 -16.659 -4.197 1.00 0.00 C ATOM 0 H PHE A 67 103.396 -19.690 1.215 1.00 0.00 H new ATOM 0 HA PHE A 67 100.617 -18.949 0.378 1.00 0.00 H new ATOM 0 HB2 PHE A 67 102.076 -16.898 0.215 1.00 0.00 H new ATOM 0 HB3 PHE A 67 103.249 -17.819 -0.705 1.00 0.00 H new ATOM 0 HD1 PHE A 67 99.691 -16.581 -0.770 1.00 0.00 H new ATOM 0 HD2 PHE A 67 103.075 -18.037 -3.078 1.00 0.00 H new ATOM 0 HE1 PHE A 67 98.505 -15.972 -2.895 1.00 0.00 H new ATOM 0 HE2 PHE A 67 101.886 -17.432 -5.202 1.00 0.00 H new ATOM 0 HZ PHE A 67 99.602 -16.397 -5.112 1.00 0.00 H new ATOM 1125 N ASN A 68 100.812 -20.776 -1.288 1.00 0.00 N ATOM 1126 CA ASN A 68 100.885 -21.957 -2.222 1.00 0.00 C ATOM 1127 C ASN A 68 101.734 -23.099 -1.637 1.00 0.00 C ATOM 1128 O ASN A 68 102.400 -23.815 -2.365 1.00 0.00 O ATOM 1129 CB ASN A 68 101.505 -21.427 -3.525 1.00 0.00 C ATOM 1130 CG ASN A 68 100.409 -20.881 -4.445 1.00 0.00 C ATOM 1131 OD1 ASN A 68 100.307 -21.279 -5.589 1.00 0.00 O ATOM 1132 ND2 ASN A 68 99.582 -19.977 -3.995 1.00 0.00 N ATOM 0 H ASN A 68 99.862 -20.460 -1.094 1.00 0.00 H new ATOM 0 HA ASN A 68 99.894 -22.379 -2.388 1.00 0.00 H new ATOM 0 HB2 ASN A 68 102.227 -20.642 -3.300 1.00 0.00 H new ATOM 0 HB3 ASN A 68 102.049 -22.226 -4.029 1.00 0.00 H new ATOM 0 HD21 ASN A 68 98.852 -19.606 -4.603 1.00 0.00 H new ATOM 0 HD22 ASN A 68 99.666 -19.642 -3.035 1.00 0.00 H new ATOM 1139 N GLY A 69 101.704 -23.262 -0.334 1.00 0.00 N ATOM 1140 CA GLY A 69 102.425 -24.395 0.327 1.00 0.00 C ATOM 1141 C GLY A 69 103.933 -24.123 0.446 1.00 0.00 C ATOM 1142 O GLY A 69 104.693 -25.044 0.690 1.00 0.00 O ATOM 0 H GLY A 69 101.202 -22.648 0.307 1.00 0.00 H new ATOM 0 HA2 GLY A 69 102.007 -24.562 1.320 1.00 0.00 H new ATOM 0 HA3 GLY A 69 102.265 -25.310 -0.244 1.00 0.00 H new ATOM 1146 N LYS A 70 104.370 -22.892 0.281 1.00 0.00 N ATOM 1147 CA LYS A 70 105.823 -22.558 0.407 1.00 0.00 C ATOM 1148 C LYS A 70 106.021 -21.531 1.524 1.00 0.00 C ATOM 1149 O LYS A 70 105.222 -20.624 1.672 1.00 0.00 O ATOM 1150 CB LYS A 70 106.216 -21.963 -0.946 1.00 0.00 C ATOM 1151 CG LYS A 70 106.152 -23.049 -2.022 1.00 0.00 C ATOM 1152 CD LYS A 70 106.746 -22.514 -3.328 1.00 0.00 C ATOM 1153 CE LYS A 70 105.786 -21.500 -3.953 1.00 0.00 C ATOM 1154 NZ LYS A 70 106.085 -21.535 -5.411 1.00 0.00 N ATOM 0 H LYS A 70 103.770 -22.097 0.062 1.00 0.00 H new ATOM 0 HA LYS A 70 106.431 -23.428 0.655 1.00 0.00 H new ATOM 0 HB2 LYS A 70 105.546 -21.143 -1.203 1.00 0.00 H new ATOM 0 HB3 LYS A 70 107.222 -21.548 -0.894 1.00 0.00 H new ATOM 0 HG2 LYS A 70 106.702 -23.932 -1.695 1.00 0.00 H new ATOM 0 HG3 LYS A 70 105.119 -23.358 -2.180 1.00 0.00 H new ATOM 0 HD2 LYS A 70 107.711 -22.045 -3.135 1.00 0.00 H new ATOM 0 HD3 LYS A 70 106.924 -23.336 -4.021 1.00 0.00 H new ATOM 0 HE2 LYS A 70 104.748 -21.767 -3.756 1.00 0.00 H new ATOM 0 HE3 LYS A 70 105.942 -20.503 -3.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 105.465 -20.864 -5.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 107.078 -21.270 -5.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 105.921 -22.495 -5.776 1.00 0.00 H new ATOM 1168 N ARG A 71 107.074 -21.674 2.296 1.00 0.00 N ATOM 1169 CA ARG A 71 107.310 -20.761 3.457 1.00 0.00 C ATOM 1170 C ARG A 71 108.209 -19.591 3.045 1.00 0.00 C ATOM 1171 O ARG A 71 109.238 -19.789 2.424 1.00 0.00 O ATOM 1172 CB ARG A 71 108.000 -21.623 4.517 1.00 0.00 C ATOM 1173 CG ARG A 71 107.015 -22.672 5.038 1.00 0.00 C ATOM 1174 CD ARG A 71 107.686 -23.511 6.130 1.00 0.00 C ATOM 1175 NE ARG A 71 106.678 -24.553 6.520 1.00 0.00 N ATOM 1176 CZ ARG A 71 107.018 -25.715 7.044 1.00 0.00 C ATOM 1177 NH1 ARG A 71 108.262 -26.051 7.296 1.00 0.00 N ATOM 1178 NH2 ARG A 71 106.073 -26.566 7.337 1.00 0.00 N ATOM 0 H ARG A 71 107.786 -22.393 2.168 1.00 0.00 H new ATOM 0 HA ARG A 71 106.381 -20.328 3.829 1.00 0.00 H new ATOM 0 HB2 ARG A 71 108.877 -22.111 4.091 1.00 0.00 H new ATOM 0 HB3 ARG A 71 108.351 -20.998 5.338 1.00 0.00 H new ATOM 0 HG2 ARG A 71 106.125 -22.184 5.436 1.00 0.00 H new ATOM 0 HG3 ARG A 71 106.687 -23.315 4.221 1.00 0.00 H new ATOM 0 HD2 ARG A 71 108.603 -23.972 5.762 1.00 0.00 H new ATOM 0 HD3 ARG A 71 107.961 -22.893 6.985 1.00 0.00 H new ATOM 0 HE ARG A 71 105.688 -24.354 6.374 1.00 0.00 H new ATOM 0 HH11 ARG A 71 109.019 -25.400 7.086 1.00 0.00 H new ATOM 0 HH12 ARG A 71 108.472 -26.963 7.702 1.00 0.00 H new ATOM 0 HH21 ARG A 71 105.098 -26.326 7.160 1.00 0.00 H new ATOM 0 HH22 ARG A 71 106.310 -27.471 7.743 1.00 0.00 H new ATOM 1192 N PHE A 72 107.817 -18.387 3.392 1.00 0.00 N ATOM 1193 CA PHE A 72 108.640 -17.179 3.082 1.00 0.00 C ATOM 1194 C PHE A 72 108.995 -16.450 4.380 1.00 0.00 C ATOM 1195 O PHE A 72 108.200 -16.409 5.304 1.00 0.00 O ATOM 1196 CB PHE A 72 107.746 -16.308 2.198 1.00 0.00 C ATOM 1197 CG PHE A 72 107.391 -16.957 0.881 1.00 0.00 C ATOM 1198 CD1 PHE A 72 106.344 -17.929 0.822 1.00 0.00 C ATOM 1199 CD2 PHE A 72 108.103 -16.600 -0.306 1.00 0.00 C ATOM 1200 CE1 PHE A 72 106.009 -18.543 -0.424 1.00 0.00 C ATOM 1201 CE2 PHE A 72 107.767 -17.215 -1.552 1.00 0.00 C ATOM 1202 CZ PHE A 72 106.720 -18.186 -1.612 1.00 0.00 C ATOM 0 H PHE A 72 106.946 -18.190 3.885 1.00 0.00 H new ATOM 0 HA PHE A 72 109.579 -17.426 2.586 1.00 0.00 H new ATOM 0 HB2 PHE A 72 106.829 -16.075 2.739 1.00 0.00 H new ATOM 0 HB3 PHE A 72 108.251 -15.362 2.004 1.00 0.00 H new ATOM 0 HD1 PHE A 72 105.807 -18.199 1.719 1.00 0.00 H new ATOM 0 HD2 PHE A 72 108.894 -15.866 -0.262 1.00 0.00 H new ATOM 0 HE1 PHE A 72 105.218 -19.277 -0.468 1.00 0.00 H new ATOM 0 HE2 PHE A 72 108.305 -16.946 -2.449 1.00 0.00 H new ATOM 0 HZ PHE A 72 106.466 -18.650 -2.554 1.00 0.00 H new ATOM 1212 N PHE A 73 110.173 -15.875 4.442 1.00 0.00 N ATOM 1213 CA PHE A 73 110.719 -15.374 5.744 1.00 0.00 C ATOM 1214 C PHE A 73 110.225 -13.952 6.021 1.00 0.00 C ATOM 1215 O PHE A 73 109.874 -13.225 5.109 1.00 0.00 O ATOM 1216 CB PHE A 73 112.242 -15.396 5.595 1.00 0.00 C ATOM 1217 CG PHE A 73 112.814 -16.789 5.462 1.00 0.00 C ATOM 1218 CD1 PHE A 73 113.080 -17.567 6.630 1.00 0.00 C ATOM 1219 CD2 PHE A 73 113.089 -17.327 4.166 1.00 0.00 C ATOM 1220 CE1 PHE A 73 113.621 -18.884 6.504 1.00 0.00 C ATOM 1221 CE2 PHE A 73 113.629 -18.644 4.040 1.00 0.00 C ATOM 1222 CZ PHE A 73 113.896 -19.422 5.208 1.00 0.00 C ATOM 0 H PHE A 73 110.785 -15.730 3.639 1.00 0.00 H new ATOM 0 HA PHE A 73 110.391 -15.992 6.580 1.00 0.00 H new ATOM 0 HB2 PHE A 73 112.522 -14.811 4.719 1.00 0.00 H new ATOM 0 HB3 PHE A 73 112.691 -14.908 6.460 1.00 0.00 H new ATOM 0 HD1 PHE A 73 112.872 -17.160 7.609 1.00 0.00 H new ATOM 0 HD2 PHE A 73 112.889 -16.738 3.283 1.00 0.00 H new ATOM 0 HE1 PHE A 73 113.822 -19.472 7.387 1.00 0.00 H new ATOM 0 HE2 PHE A 73 113.835 -19.051 3.061 1.00 0.00 H new ATOM 0 HZ PHE A 73 114.306 -20.417 5.112 1.00 0.00 H new ATOM 1232 N GLY A 74 110.203 -13.566 7.278 1.00 0.00 N ATOM 1233 CA GLY A 74 109.676 -12.227 7.677 1.00 0.00 C ATOM 1234 C GLY A 74 110.587 -11.122 7.137 1.00 0.00 C ATOM 1235 O GLY A 74 111.741 -11.362 6.824 1.00 0.00 O ATOM 0 H GLY A 74 110.535 -14.137 8.055 1.00 0.00 H new ATOM 0 HA2 GLY A 74 108.665 -12.096 7.292 1.00 0.00 H new ATOM 0 HA3 GLY A 74 109.615 -12.160 8.763 1.00 0.00 H new ATOM 1239 N VAL A 75 110.067 -9.921 7.036 1.00 0.00 N ATOM 1240 CA VAL A 75 110.830 -8.801 6.398 1.00 0.00 C ATOM 1241 C VAL A 75 110.638 -7.505 7.193 1.00 0.00 C ATOM 1242 O VAL A 75 109.677 -7.367 7.928 1.00 0.00 O ATOM 1243 CB VAL A 75 110.288 -8.657 4.964 1.00 0.00 C ATOM 1244 CG1 VAL A 75 110.585 -9.935 4.174 1.00 0.00 C ATOM 1245 CG2 VAL A 75 108.773 -8.407 4.958 1.00 0.00 C ATOM 0 H VAL A 75 109.138 -9.667 7.372 1.00 0.00 H new ATOM 0 HA VAL A 75 111.900 -9.009 6.383 1.00 0.00 H new ATOM 0 HB VAL A 75 110.781 -7.801 4.504 1.00 0.00 H new ATOM 0 HG11 VAL A 75 110.201 -9.833 3.159 1.00 0.00 H new ATOM 0 HG12 VAL A 75 111.662 -10.100 4.140 1.00 0.00 H new ATOM 0 HG13 VAL A 75 110.104 -10.783 4.660 1.00 0.00 H new ATOM 0 HG21 VAL A 75 108.424 -8.310 3.930 1.00 0.00 H new ATOM 0 HG22 VAL A 75 108.264 -9.244 5.437 1.00 0.00 H new ATOM 0 HG23 VAL A 75 108.554 -7.489 5.503 1.00 0.00 H new ATOM 1255 N LYS A 76 111.550 -6.573 7.044 1.00 0.00 N ATOM 1256 CA LYS A 76 111.433 -5.252 7.735 1.00 0.00 C ATOM 1257 C LYS A 76 111.346 -4.135 6.692 1.00 0.00 C ATOM 1258 O LYS A 76 112.074 -4.149 5.713 1.00 0.00 O ATOM 1259 CB LYS A 76 112.715 -5.114 8.562 1.00 0.00 C ATOM 1260 CG LYS A 76 112.747 -6.182 9.659 1.00 0.00 C ATOM 1261 CD LYS A 76 114.000 -5.997 10.516 1.00 0.00 C ATOM 1262 CE LYS A 76 114.068 -7.104 11.571 1.00 0.00 C ATOM 1263 NZ LYS A 76 114.993 -6.581 12.616 1.00 0.00 N ATOM 0 H LYS A 76 112.382 -6.675 6.464 1.00 0.00 H new ATOM 0 HA LYS A 76 110.543 -5.186 8.361 1.00 0.00 H new ATOM 0 HB2 LYS A 76 113.587 -5.218 7.916 1.00 0.00 H new ATOM 0 HB3 LYS A 76 112.765 -4.121 9.008 1.00 0.00 H new ATOM 0 HG2 LYS A 76 111.855 -6.107 10.280 1.00 0.00 H new ATOM 0 HG3 LYS A 76 112.742 -7.177 9.213 1.00 0.00 H new ATOM 0 HD2 LYS A 76 114.890 -6.024 9.887 1.00 0.00 H new ATOM 0 HD3 LYS A 76 113.981 -5.020 11.000 1.00 0.00 H new ATOM 0 HE2 LYS A 76 113.082 -7.316 11.986 1.00 0.00 H new ATOM 0 HE3 LYS A 76 114.441 -8.035 11.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 115.039 -7.254 13.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 115.943 -6.459 12.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 114.644 -5.664 12.961 1.00 0.00 H new ATOM 1277 N VAL A 77 110.470 -3.179 6.901 1.00 0.00 N ATOM 1278 CA VAL A 77 110.252 -2.093 5.891 1.00 0.00 C ATOM 1279 C VAL A 77 110.219 -0.735 6.604 1.00 0.00 C ATOM 1280 O VAL A 77 109.675 -0.621 7.687 1.00 0.00 O ATOM 1281 CB VAL A 77 108.901 -2.407 5.218 1.00 0.00 C ATOM 1282 CG1 VAL A 77 108.586 -1.369 4.134 1.00 0.00 C ATOM 1283 CG2 VAL A 77 108.940 -3.789 4.554 1.00 0.00 C ATOM 0 H VAL A 77 109.891 -3.105 7.737 1.00 0.00 H new ATOM 0 HA VAL A 77 111.048 -2.048 5.148 1.00 0.00 H new ATOM 0 HB VAL A 77 108.134 -2.384 5.992 1.00 0.00 H new ATOM 0 HG11 VAL A 77 107.629 -1.607 3.670 1.00 0.00 H new ATOM 0 HG12 VAL A 77 108.535 -0.377 4.584 1.00 0.00 H new ATOM 0 HG13 VAL A 77 109.370 -1.384 3.377 1.00 0.00 H new ATOM 0 HG21 VAL A 77 107.978 -3.994 4.084 1.00 0.00 H new ATOM 0 HG22 VAL A 77 109.725 -3.807 3.798 1.00 0.00 H new ATOM 0 HG23 VAL A 77 109.145 -4.549 5.308 1.00 0.00 H new ATOM 1293 N LEU A 78 110.796 0.279 5.996 1.00 0.00 N ATOM 1294 CA LEU A 78 110.768 1.652 6.588 1.00 0.00 C ATOM 1295 C LEU A 78 110.477 2.697 5.490 1.00 0.00 C ATOM 1296 O LEU A 78 111.188 2.716 4.503 1.00 0.00 O ATOM 1297 CB LEU A 78 112.176 1.837 7.167 1.00 0.00 C ATOM 1298 CG LEU A 78 112.296 3.177 7.902 1.00 0.00 C ATOM 1299 CD1 LEU A 78 111.437 3.166 9.169 1.00 0.00 C ATOM 1300 CD2 LEU A 78 113.757 3.394 8.296 1.00 0.00 C ATOM 0 H LEU A 78 111.289 0.209 5.106 1.00 0.00 H new ATOM 0 HA LEU A 78 109.993 1.777 7.344 1.00 0.00 H new ATOM 0 HB2 LEU A 78 112.401 1.020 7.853 1.00 0.00 H new ATOM 0 HB3 LEU A 78 112.912 1.791 6.364 1.00 0.00 H new ATOM 0 HG LEU A 78 111.954 3.977 7.246 1.00 0.00 H new ATOM 0 HD11 LEU A 78 111.532 4.124 9.681 1.00 0.00 H new ATOM 0 HD12 LEU A 78 110.394 3.000 8.900 1.00 0.00 H new ATOM 0 HD13 LEU A 78 111.773 2.367 9.829 1.00 0.00 H new ATOM 0 HD21 LEU A 78 113.855 4.345 8.820 1.00 0.00 H new ATOM 0 HD22 LEU A 78 114.082 2.584 8.949 1.00 0.00 H new ATOM 0 HD23 LEU A 78 114.377 3.408 7.400 1.00 0.00 H new ATOM 1312 N PRO A 79 109.461 3.531 5.668 1.00 0.00 N ATOM 1313 CA PRO A 79 109.164 4.610 4.669 1.00 0.00 C ATOM 1314 C PRO A 79 110.315 5.623 4.582 1.00 0.00 C ATOM 1315 O PRO A 79 111.012 5.855 5.552 1.00 0.00 O ATOM 1316 CB PRO A 79 107.904 5.278 5.231 1.00 0.00 C ATOM 1317 CG PRO A 79 107.301 4.226 6.092 1.00 0.00 C ATOM 1318 CD PRO A 79 108.471 3.576 6.764 1.00 0.00 C ATOM 0 HA PRO A 79 109.034 4.221 3.659 1.00 0.00 H new ATOM 0 HB2 PRO A 79 108.147 6.173 5.803 1.00 0.00 H new ATOM 0 HB3 PRO A 79 107.224 5.583 4.436 1.00 0.00 H new ATOM 0 HG2 PRO A 79 106.613 4.655 6.820 1.00 0.00 H new ATOM 0 HG3 PRO A 79 106.733 3.507 5.502 1.00 0.00 H new ATOM 0 HD2 PRO A 79 108.829 4.156 7.615 1.00 0.00 H new ATOM 0 HD3 PRO A 79 108.228 2.581 7.137 1.00 0.00 H new ATOM 1326 N ILE A 80 110.504 6.214 3.423 1.00 0.00 N ATOM 1327 CA ILE A 80 111.474 7.347 3.275 1.00 0.00 C ATOM 1328 C ILE A 80 110.918 8.404 2.313 1.00 0.00 C ATOM 1329 O ILE A 80 109.921 8.178 1.652 1.00 0.00 O ATOM 1330 CB ILE A 80 112.781 6.741 2.725 1.00 0.00 C ATOM 1331 CG1 ILE A 80 112.543 6.034 1.379 1.00 0.00 C ATOM 1332 CG2 ILE A 80 113.349 5.740 3.738 1.00 0.00 C ATOM 1333 CD1 ILE A 80 113.882 5.678 0.729 1.00 0.00 C ATOM 0 H ILE A 80 110.020 5.955 2.563 1.00 0.00 H new ATOM 0 HA ILE A 80 111.649 7.843 4.230 1.00 0.00 H new ATOM 0 HB ILE A 80 113.492 7.551 2.564 1.00 0.00 H new ATOM 0 HG12 ILE A 80 111.953 5.131 1.533 1.00 0.00 H new ATOM 0 HG13 ILE A 80 111.968 6.681 0.716 1.00 0.00 H new ATOM 0 HG21 ILE A 80 114.273 5.312 3.348 1.00 0.00 H new ATOM 0 HG22 ILE A 80 113.554 6.251 4.679 1.00 0.00 H new ATOM 0 HG23 ILE A 80 112.624 4.944 3.908 1.00 0.00 H new ATOM 0 HD11 ILE A 80 113.703 5.178 -0.223 1.00 0.00 H new ATOM 0 HD12 ILE A 80 114.457 6.588 0.558 1.00 0.00 H new ATOM 0 HD13 ILE A 80 114.441 5.014 1.388 1.00 0.00 H new ATOM 1345 N LYS A 81 111.564 9.543 2.241 1.00 0.00 N ATOM 1346 CA LYS A 81 111.273 10.531 1.157 1.00 0.00 C ATOM 1347 C LYS A 81 112.503 10.663 0.255 1.00 0.00 C ATOM 1348 O LYS A 81 113.604 10.839 0.742 1.00 0.00 O ATOM 1349 CB LYS A 81 110.987 11.851 1.876 1.00 0.00 C ATOM 1350 CG LYS A 81 109.696 11.732 2.691 1.00 0.00 C ATOM 1351 CD LYS A 81 108.491 11.746 1.747 1.00 0.00 C ATOM 1352 CE LYS A 81 107.201 11.888 2.560 1.00 0.00 C ATOM 1353 NZ LYS A 81 106.250 12.593 1.655 1.00 0.00 N ATOM 0 H LYS A 81 112.290 9.833 2.897 1.00 0.00 H new ATOM 0 HA LYS A 81 110.433 10.233 0.530 1.00 0.00 H new ATOM 0 HB2 LYS A 81 111.819 12.105 2.532 1.00 0.00 H new ATOM 0 HB3 LYS A 81 110.896 12.658 1.149 1.00 0.00 H new ATOM 0 HG2 LYS A 81 109.705 10.810 3.273 1.00 0.00 H new ATOM 0 HG3 LYS A 81 109.625 12.556 3.401 1.00 0.00 H new ATOM 0 HD2 LYS A 81 108.580 12.571 1.040 1.00 0.00 H new ATOM 0 HD3 LYS A 81 108.464 10.827 1.162 1.00 0.00 H new ATOM 0 HE2 LYS A 81 106.813 10.914 2.858 1.00 0.00 H new ATOM 0 HE3 LYS A 81 107.371 12.457 3.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 105.489 13.024 2.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 106.756 13.335 1.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 105.840 11.912 0.984 1.00 0.00 H new ATOM 1367 N ILE A 82 112.314 10.581 -1.041 1.00 0.00 N ATOM 1368 CA ILE A 82 113.471 10.585 -1.993 1.00 0.00 C ATOM 1369 C ILE A 82 113.526 11.946 -2.697 1.00 0.00 C ATOM 1370 O ILE A 82 112.563 12.355 -3.322 1.00 0.00 O ATOM 1371 CB ILE A 82 113.202 9.441 -2.992 1.00 0.00 C ATOM 1372 CG1 ILE A 82 113.106 8.098 -2.255 1.00 0.00 C ATOM 1373 CG2 ILE A 82 114.344 9.345 -4.013 1.00 0.00 C ATOM 1374 CD1 ILE A 82 112.486 7.048 -3.180 1.00 0.00 C ATOM 0 H ILE A 82 111.398 10.511 -1.484 1.00 0.00 H new ATOM 0 HA ILE A 82 114.430 10.434 -1.497 1.00 0.00 H new ATOM 0 HB ILE A 82 112.262 9.656 -3.500 1.00 0.00 H new ATOM 0 HG12 ILE A 82 114.097 7.776 -1.935 1.00 0.00 H new ATOM 0 HG13 ILE A 82 112.500 8.208 -1.355 1.00 0.00 H new ATOM 0 HG21 ILE A 82 114.140 8.533 -4.711 1.00 0.00 H new ATOM 0 HG22 ILE A 82 114.422 10.284 -4.561 1.00 0.00 H new ATOM 0 HG23 ILE A 82 115.282 9.149 -3.493 1.00 0.00 H new ATOM 0 HD11 ILE A 82 112.419 6.095 -2.655 1.00 0.00 H new ATOM 0 HD12 ILE A 82 111.488 7.369 -3.478 1.00 0.00 H new ATOM 0 HD13 ILE A 82 113.109 6.931 -4.067 1.00 0.00 H new ATOM 1386 N LEU A 83 114.642 12.630 -2.591 1.00 0.00 N ATOM 1387 CA LEU A 83 114.784 13.983 -3.209 1.00 0.00 C ATOM 1388 C LEU A 83 115.711 13.913 -4.426 1.00 0.00 C ATOM 1389 O LEU A 83 116.883 13.603 -4.296 1.00 0.00 O ATOM 1390 CB LEU A 83 115.400 14.864 -2.119 1.00 0.00 C ATOM 1391 CG LEU A 83 114.426 15.014 -0.946 1.00 0.00 C ATOM 1392 CD1 LEU A 83 115.147 15.670 0.233 1.00 0.00 C ATOM 1393 CD2 LEU A 83 113.245 15.893 -1.367 1.00 0.00 C ATOM 0 H LEU A 83 115.470 12.301 -2.095 1.00 0.00 H new ATOM 0 HA LEU A 83 113.828 14.376 -3.555 1.00 0.00 H new ATOM 0 HB2 LEU A 83 116.335 14.424 -1.771 1.00 0.00 H new ATOM 0 HB3 LEU A 83 115.642 15.845 -2.528 1.00 0.00 H new ATOM 0 HG LEU A 83 114.061 14.030 -0.652 1.00 0.00 H new ATOM 0 HD11 LEU A 83 114.455 15.777 1.068 1.00 0.00 H new ATOM 0 HD12 LEU A 83 115.989 15.048 0.537 1.00 0.00 H new ATOM 0 HD13 LEU A 83 115.512 16.653 -0.065 1.00 0.00 H new ATOM 0 HD21 LEU A 83 112.554 15.998 -0.531 1.00 0.00 H new ATOM 0 HD22 LEU A 83 113.610 16.877 -1.662 1.00 0.00 H new ATOM 0 HD23 LEU A 83 112.729 15.431 -2.209 1.00 0.00 H new ATOM 1405 N ILE A 84 115.186 14.201 -5.596 1.00 0.00 N ATOM 1406 CA ILE A 84 116.020 14.226 -6.839 1.00 0.00 C ATOM 1407 C ILE A 84 115.752 15.548 -7.569 1.00 0.00 C ATOM 1408 O ILE A 84 114.621 15.844 -7.913 1.00 0.00 O ATOM 1409 CB ILE A 84 115.572 13.014 -7.678 1.00 0.00 C ATOM 1410 CG1 ILE A 84 115.805 11.711 -6.899 1.00 0.00 C ATOM 1411 CG2 ILE A 84 116.377 12.942 -8.983 1.00 0.00 C ATOM 1412 CD1 ILE A 84 115.047 10.564 -7.572 1.00 0.00 C ATOM 0 H ILE A 84 114.201 14.423 -5.742 1.00 0.00 H new ATOM 0 HA ILE A 84 117.090 14.165 -6.640 1.00 0.00 H new ATOM 0 HB ILE A 84 114.511 13.133 -7.899 1.00 0.00 H new ATOM 0 HG12 ILE A 84 116.870 11.483 -6.863 1.00 0.00 H new ATOM 0 HG13 ILE A 84 115.468 11.827 -5.869 1.00 0.00 H new ATOM 0 HG21 ILE A 84 116.050 12.081 -9.565 1.00 0.00 H new ATOM 0 HG22 ILE A 84 116.217 13.853 -9.560 1.00 0.00 H new ATOM 0 HG23 ILE A 84 117.437 12.841 -8.751 1.00 0.00 H new ATOM 0 HD11 ILE A 84 115.215 9.641 -7.016 1.00 0.00 H new ATOM 0 HD12 ILE A 84 113.981 10.791 -7.585 1.00 0.00 H new ATOM 0 HD13 ILE A 84 115.405 10.442 -8.594 1.00 0.00 H new ATOM 1424 N GLY A 85 116.781 16.334 -7.796 1.00 0.00 N ATOM 1425 CA GLY A 85 116.613 17.665 -8.464 1.00 0.00 C ATOM 1426 C GLY A 85 115.775 18.592 -7.576 1.00 0.00 C ATOM 1427 O GLY A 85 116.152 18.881 -6.454 1.00 0.00 O ATOM 0 H GLY A 85 117.742 16.105 -7.543 1.00 0.00 H new ATOM 0 HA2 GLY A 85 117.589 18.112 -8.653 1.00 0.00 H new ATOM 0 HA3 GLY A 85 116.128 17.537 -9.432 1.00 0.00 H new ATOM 1431 N ASN A 86 114.650 19.049 -8.079 1.00 0.00 N ATOM 1432 CA ASN A 86 113.714 19.885 -7.261 1.00 0.00 C ATOM 1433 C ASN A 86 112.405 19.139 -6.945 1.00 0.00 C ATOM 1434 O ASN A 86 111.429 19.765 -6.567 1.00 0.00 O ATOM 1435 CB ASN A 86 113.448 21.147 -8.098 1.00 0.00 C ATOM 1436 CG ASN A 86 112.811 20.804 -9.453 1.00 0.00 C ATOM 1437 OD1 ASN A 86 113.314 19.973 -10.182 1.00 0.00 O ATOM 1438 ND2 ASN A 86 111.717 21.415 -9.819 1.00 0.00 N ATOM 0 H ASN A 86 114.338 18.875 -9.034 1.00 0.00 H new ATOM 0 HA ASN A 86 114.150 20.128 -6.292 1.00 0.00 H new ATOM 0 HB2 ASN A 86 112.790 21.818 -7.546 1.00 0.00 H new ATOM 0 HB3 ASN A 86 114.385 21.680 -8.260 1.00 0.00 H new ATOM 0 HD21 ASN A 86 111.285 21.194 -10.716 1.00 0.00 H new ATOM 0 HD22 ASN A 86 111.294 22.113 -9.207 1.00 0.00 H new ATOM 1445 N LYS A 87 112.376 17.830 -7.091 1.00 0.00 N ATOM 1446 CA LYS A 87 111.107 17.059 -6.906 1.00 0.00 C ATOM 1447 C LYS A 87 111.262 16.037 -5.775 1.00 0.00 C ATOM 1448 O LYS A 87 112.322 15.462 -5.600 1.00 0.00 O ATOM 1449 CB LYS A 87 110.879 16.343 -8.239 1.00 0.00 C ATOM 1450 CG LYS A 87 110.562 17.373 -9.327 1.00 0.00 C ATOM 1451 CD LYS A 87 110.221 16.649 -10.631 1.00 0.00 C ATOM 1452 CE LYS A 87 110.018 17.675 -11.747 1.00 0.00 C ATOM 1453 NZ LYS A 87 108.615 18.149 -11.583 1.00 0.00 N ATOM 0 H LYS A 87 113.188 17.262 -7.333 1.00 0.00 H new ATOM 0 HA LYS A 87 110.272 17.706 -6.638 1.00 0.00 H new ATOM 0 HB2 LYS A 87 111.766 15.771 -8.513 1.00 0.00 H new ATOM 0 HB3 LYS A 87 110.058 15.633 -8.146 1.00 0.00 H new ATOM 0 HG2 LYS A 87 109.726 18.000 -9.017 1.00 0.00 H new ATOM 0 HG3 LYS A 87 111.416 18.033 -9.478 1.00 0.00 H new ATOM 0 HD2 LYS A 87 111.023 15.960 -10.897 1.00 0.00 H new ATOM 0 HD3 LYS A 87 109.318 16.052 -10.503 1.00 0.00 H new ATOM 0 HE2 LYS A 87 110.726 18.499 -11.659 1.00 0.00 H new ATOM 0 HE3 LYS A 87 110.171 17.226 -12.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 108.372 18.792 -12.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 107.970 17.334 -11.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 108.522 18.652 -10.678 1.00 0.00 H new ATOM 1467 N LYS A 88 110.211 15.817 -5.017 1.00 0.00 N ATOM 1468 CA LYS A 88 110.243 14.805 -3.914 1.00 0.00 C ATOM 1469 C LYS A 88 109.133 13.766 -4.113 1.00 0.00 C ATOM 1470 O LYS A 88 107.985 14.115 -4.324 1.00 0.00 O ATOM 1471 CB LYS A 88 110.062 15.594 -2.605 1.00 0.00 C ATOM 1472 CG LYS A 88 108.733 16.362 -2.580 1.00 0.00 C ATOM 1473 CD LYS A 88 108.631 17.157 -1.277 1.00 0.00 C ATOM 1474 CE LYS A 88 107.205 17.688 -1.112 1.00 0.00 C ATOM 1475 NZ LYS A 88 106.437 16.550 -0.533 1.00 0.00 N ATOM 0 H LYS A 88 109.321 16.304 -5.119 1.00 0.00 H new ATOM 0 HA LYS A 88 111.181 14.250 -3.897 1.00 0.00 H new ATOM 0 HB2 LYS A 88 110.101 14.908 -1.759 1.00 0.00 H new ATOM 0 HB3 LYS A 88 110.889 16.294 -2.486 1.00 0.00 H new ATOM 0 HG2 LYS A 88 108.673 17.035 -3.435 1.00 0.00 H new ATOM 0 HG3 LYS A 88 107.897 15.667 -2.662 1.00 0.00 H new ATOM 0 HD2 LYS A 88 108.894 16.523 -0.430 1.00 0.00 H new ATOM 0 HD3 LYS A 88 109.340 17.985 -1.288 1.00 0.00 H new ATOM 0 HE2 LYS A 88 107.181 18.557 -0.454 1.00 0.00 H new ATOM 0 HE3 LYS A 88 106.787 18.001 -2.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 105.495 16.507 -0.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 106.945 15.661 -0.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 106.334 16.687 0.493 1.00 0.00 H new ATOM 1489 N ILE A 89 109.481 12.500 -4.047 1.00 0.00 N ATOM 1490 CA ILE A 89 108.472 11.405 -4.220 1.00 0.00 C ATOM 1491 C ILE A 89 108.557 10.459 -3.015 1.00 0.00 C ATOM 1492 O ILE A 89 109.623 10.265 -2.458 1.00 0.00 O ATOM 1493 CB ILE A 89 108.848 10.687 -5.532 1.00 0.00 C ATOM 1494 CG1 ILE A 89 108.794 11.667 -6.711 1.00 0.00 C ATOM 1495 CG2 ILE A 89 107.866 9.543 -5.815 1.00 0.00 C ATOM 1496 CD1 ILE A 89 109.508 11.057 -7.920 1.00 0.00 C ATOM 0 H ILE A 89 110.434 12.176 -3.878 1.00 0.00 H new ATOM 0 HA ILE A 89 107.448 11.775 -4.273 1.00 0.00 H new ATOM 0 HB ILE A 89 109.858 10.293 -5.420 1.00 0.00 H new ATOM 0 HG12 ILE A 89 107.758 11.891 -6.963 1.00 0.00 H new ATOM 0 HG13 ILE A 89 109.266 12.610 -6.435 1.00 0.00 H new ATOM 0 HG21 ILE A 89 108.145 9.046 -6.744 1.00 0.00 H new ATOM 0 HG22 ILE A 89 107.898 8.825 -4.996 1.00 0.00 H new ATOM 0 HG23 ILE A 89 106.857 9.944 -5.907 1.00 0.00 H new ATOM 0 HD11 ILE A 89 109.468 11.755 -8.756 1.00 0.00 H new ATOM 0 HD12 ILE A 89 110.548 10.855 -7.665 1.00 0.00 H new ATOM 0 HD13 ILE A 89 109.016 10.126 -8.201 1.00 0.00 H new ATOM 1508 N ASP A 90 107.443 9.881 -2.623 1.00 0.00 N ATOM 1509 CA ASP A 90 107.441 8.905 -1.483 1.00 0.00 C ATOM 1510 C ASP A 90 108.068 7.581 -1.930 1.00 0.00 C ATOM 1511 O ASP A 90 107.787 7.100 -3.013 1.00 0.00 O ATOM 1512 CB ASP A 90 105.973 8.692 -1.101 1.00 0.00 C ATOM 1513 CG ASP A 90 105.389 9.995 -0.555 1.00 0.00 C ATOM 1514 OD1 ASP A 90 105.470 10.201 0.645 1.00 0.00 O ATOM 1515 OD2 ASP A 90 104.869 10.767 -1.345 1.00 0.00 O ATOM 0 H ASP A 90 106.530 10.045 -3.047 1.00 0.00 H new ATOM 0 HA ASP A 90 108.019 9.277 -0.637 1.00 0.00 H new ATOM 0 HB2 ASP A 90 105.405 8.364 -1.971 1.00 0.00 H new ATOM 0 HB3 ASP A 90 105.893 7.904 -0.352 1.00 0.00 H new ATOM 1520 N GLY A 91 108.908 7.003 -1.102 1.00 0.00 N ATOM 1521 CA GLY A 91 109.531 5.684 -1.425 1.00 0.00 C ATOM 1522 C GLY A 91 109.693 4.875 -0.137 1.00 0.00 C ATOM 1523 O GLY A 91 109.159 5.245 0.893 1.00 0.00 O ATOM 0 H GLY A 91 109.190 7.397 -0.205 1.00 0.00 H new ATOM 0 HA2 GLY A 91 108.909 5.139 -2.135 1.00 0.00 H new ATOM 0 HA3 GLY A 91 110.501 5.833 -1.899 1.00 0.00 H new ATOM 1527 N ALA A 92 110.424 3.786 -0.196 1.00 0.00 N ATOM 1528 CA ALA A 92 110.640 2.935 1.016 1.00 0.00 C ATOM 1529 C ALA A 92 111.883 2.060 0.836 1.00 0.00 C ATOM 1530 O ALA A 92 112.268 1.753 -0.277 1.00 0.00 O ATOM 1531 CB ALA A 92 109.385 2.071 1.125 1.00 0.00 C ATOM 0 H ALA A 92 110.884 3.448 -1.041 1.00 0.00 H new ATOM 0 HA ALA A 92 110.801 3.531 1.914 1.00 0.00 H new ATOM 0 HB1 ALA A 92 109.468 1.417 1.993 1.00 0.00 H new ATOM 0 HB2 ALA A 92 108.510 2.712 1.236 1.00 0.00 H new ATOM 0 HB3 ALA A 92 109.280 1.467 0.224 1.00 0.00 H new ATOM 1537 N ILE A 93 112.499 1.664 1.928 1.00 0.00 N ATOM 1538 CA ILE A 93 113.694 0.763 1.863 1.00 0.00 C ATOM 1539 C ILE A 93 113.282 -0.622 2.377 1.00 0.00 C ATOM 1540 O ILE A 93 112.517 -0.727 3.320 1.00 0.00 O ATOM 1541 CB ILE A 93 114.759 1.396 2.780 1.00 0.00 C ATOM 1542 CG1 ILE A 93 115.107 2.815 2.310 1.00 0.00 C ATOM 1543 CG2 ILE A 93 116.045 0.559 2.757 1.00 0.00 C ATOM 1544 CD1 ILE A 93 115.865 3.550 3.419 1.00 0.00 C ATOM 0 H ILE A 93 112.220 1.931 2.872 1.00 0.00 H new ATOM 0 HA ILE A 93 114.084 0.650 0.852 1.00 0.00 H new ATOM 0 HB ILE A 93 114.347 1.431 3.789 1.00 0.00 H new ATOM 0 HG12 ILE A 93 115.715 2.771 1.407 1.00 0.00 H new ATOM 0 HG13 ILE A 93 114.197 3.358 2.055 1.00 0.00 H new ATOM 0 HG21 ILE A 93 116.789 1.017 3.409 1.00 0.00 H new ATOM 0 HG22 ILE A 93 115.828 -0.450 3.107 1.00 0.00 H new ATOM 0 HG23 ILE A 93 116.432 0.515 1.739 1.00 0.00 H new ATOM 0 HD11 ILE A 93 116.112 4.558 3.085 1.00 0.00 H new ATOM 0 HD12 ILE A 93 115.241 3.606 4.311 1.00 0.00 H new ATOM 0 HD13 ILE A 93 116.783 3.010 3.652 1.00 0.00 H new ATOM 1556 N VAL A 94 113.789 -1.665 1.759 1.00 0.00 N ATOM 1557 CA VAL A 94 113.364 -3.058 2.115 1.00 0.00 C ATOM 1558 C VAL A 94 114.602 -3.887 2.483 1.00 0.00 C ATOM 1559 O VAL A 94 115.590 -3.878 1.770 1.00 0.00 O ATOM 1560 CB VAL A 94 112.665 -3.620 0.862 1.00 0.00 C ATOM 1561 CG1 VAL A 94 112.153 -5.041 1.126 1.00 0.00 C ATOM 1562 CG2 VAL A 94 111.464 -2.746 0.480 1.00 0.00 C ATOM 0 H VAL A 94 114.486 -1.609 1.016 1.00 0.00 H new ATOM 0 HA VAL A 94 112.691 -3.084 2.972 1.00 0.00 H new ATOM 0 HB VAL A 94 113.395 -3.629 0.052 1.00 0.00 H new ATOM 0 HG11 VAL A 94 111.662 -5.423 0.231 1.00 0.00 H new ATOM 0 HG12 VAL A 94 112.992 -5.688 1.384 1.00 0.00 H new ATOM 0 HG13 VAL A 94 111.441 -5.024 1.951 1.00 0.00 H new ATOM 0 HG21 VAL A 94 110.982 -3.157 -0.407 1.00 0.00 H new ATOM 0 HG22 VAL A 94 110.751 -2.727 1.304 1.00 0.00 H new ATOM 0 HG23 VAL A 94 111.804 -1.732 0.271 1.00 0.00 H new ATOM 1572 N VAL A 95 114.539 -4.595 3.589 1.00 0.00 N ATOM 1573 CA VAL A 95 115.654 -5.512 3.989 1.00 0.00 C ATOM 1574 C VAL A 95 115.050 -6.751 4.682 1.00 0.00 C ATOM 1575 O VAL A 95 114.143 -6.593 5.476 1.00 0.00 O ATOM 1576 CB VAL A 95 116.536 -4.701 4.959 1.00 0.00 C ATOM 1577 CG1 VAL A 95 117.724 -5.543 5.436 1.00 0.00 C ATOM 1578 CG2 VAL A 95 117.087 -3.452 4.260 1.00 0.00 C ATOM 0 H VAL A 95 113.752 -4.575 4.238 1.00 0.00 H new ATOM 0 HA VAL A 95 116.243 -5.862 3.141 1.00 0.00 H new ATOM 0 HB VAL A 95 115.918 -4.414 5.809 1.00 0.00 H new ATOM 0 HG11 VAL A 95 118.336 -4.955 6.120 1.00 0.00 H new ATOM 0 HG12 VAL A 95 117.357 -6.431 5.950 1.00 0.00 H new ATOM 0 HG13 VAL A 95 118.325 -5.843 4.578 1.00 0.00 H new ATOM 0 HG21 VAL A 95 117.708 -2.889 4.957 1.00 0.00 H new ATOM 0 HG22 VAL A 95 117.686 -3.751 3.400 1.00 0.00 H new ATOM 0 HG23 VAL A 95 116.259 -2.827 3.926 1.00 0.00 H new ATOM 1588 N PRO A 96 115.546 -7.943 4.378 1.00 0.00 N ATOM 1589 CA PRO A 96 115.068 -9.183 5.079 1.00 0.00 C ATOM 1590 C PRO A 96 115.276 -9.091 6.599 1.00 0.00 C ATOM 1591 O PRO A 96 116.165 -8.398 7.060 1.00 0.00 O ATOM 1592 CB PRO A 96 115.948 -10.284 4.485 1.00 0.00 C ATOM 1593 CG PRO A 96 116.321 -9.752 3.146 1.00 0.00 C ATOM 1594 CD PRO A 96 116.569 -8.291 3.370 1.00 0.00 C ATOM 0 HA PRO A 96 114.001 -9.355 4.940 1.00 0.00 H new ATOM 0 HB2 PRO A 96 116.828 -10.470 5.101 1.00 0.00 H new ATOM 0 HB3 PRO A 96 115.409 -11.228 4.405 1.00 0.00 H new ATOM 0 HG2 PRO A 96 117.210 -10.249 2.756 1.00 0.00 H new ATOM 0 HG3 PRO A 96 115.523 -9.911 2.421 1.00 0.00 H new ATOM 0 HD2 PRO A 96 117.579 -8.102 3.735 1.00 0.00 H new ATOM 0 HD3 PRO A 96 116.448 -7.714 2.453 1.00 0.00 H new ATOM 1602 N LYS A 97 114.460 -9.787 7.361 1.00 0.00 N ATOM 1603 CA LYS A 97 114.571 -9.742 8.858 1.00 0.00 C ATOM 1604 C LYS A 97 115.894 -10.364 9.318 1.00 0.00 C ATOM 1605 O LYS A 97 116.475 -9.924 10.295 1.00 0.00 O ATOM 1606 CB LYS A 97 113.390 -10.551 9.404 1.00 0.00 C ATOM 1607 CG LYS A 97 113.264 -10.317 10.911 1.00 0.00 C ATOM 1608 CD LYS A 97 112.303 -11.345 11.511 1.00 0.00 C ATOM 1609 CE LYS A 97 110.869 -11.005 11.101 1.00 0.00 C ATOM 1610 NZ LYS A 97 110.031 -12.080 11.705 1.00 0.00 N ATOM 0 H LYS A 97 113.716 -10.389 7.007 1.00 0.00 H new ATOM 0 HA LYS A 97 114.551 -8.714 9.221 1.00 0.00 H new ATOM 0 HB2 LYS A 97 112.469 -10.255 8.901 1.00 0.00 H new ATOM 0 HB3 LYS A 97 113.537 -11.612 9.201 1.00 0.00 H new ATOM 0 HG2 LYS A 97 114.242 -10.399 11.385 1.00 0.00 H new ATOM 0 HG3 LYS A 97 112.900 -9.308 11.103 1.00 0.00 H new ATOM 0 HD2 LYS A 97 112.563 -12.346 11.166 1.00 0.00 H new ATOM 0 HD3 LYS A 97 112.390 -11.349 12.597 1.00 0.00 H new ATOM 0 HE2 LYS A 97 110.576 -10.022 11.469 1.00 0.00 H new ATOM 0 HE3 LYS A 97 110.763 -10.984 10.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 109.144 -12.171 11.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 110.548 -12.982 11.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 109.816 -11.838 12.693 1.00 0.00 H new ATOM 1624 N LYS A 98 116.360 -11.375 8.621 1.00 0.00 N ATOM 1625 CA LYS A 98 117.626 -12.072 9.019 1.00 0.00 C ATOM 1626 C LYS A 98 118.832 -11.385 8.372 1.00 0.00 C ATOM 1627 O LYS A 98 118.949 -11.350 7.160 1.00 0.00 O ATOM 1628 CB LYS A 98 117.487 -13.508 8.505 1.00 0.00 C ATOM 1629 CG LYS A 98 118.614 -14.368 9.079 1.00 0.00 C ATOM 1630 CD LYS A 98 118.505 -15.789 8.524 1.00 0.00 C ATOM 1631 CE LYS A 98 119.518 -16.693 9.231 1.00 0.00 C ATOM 1632 NZ LYS A 98 120.803 -16.466 8.512 1.00 0.00 N ATOM 0 H LYS A 98 115.912 -11.750 7.785 1.00 0.00 H new ATOM 0 HA LYS A 98 117.782 -12.047 10.098 1.00 0.00 H new ATOM 0 HB2 LYS A 98 116.519 -13.917 8.795 1.00 0.00 H new ATOM 0 HB3 LYS A 98 117.525 -13.521 7.416 1.00 0.00 H new ATOM 0 HG2 LYS A 98 119.582 -13.938 8.820 1.00 0.00 H new ATOM 0 HG3 LYS A 98 118.554 -14.386 10.167 1.00 0.00 H new ATOM 0 HD2 LYS A 98 117.495 -16.172 8.671 1.00 0.00 H new ATOM 0 HD3 LYS A 98 118.691 -15.787 7.450 1.00 0.00 H new ATOM 0 HE2 LYS A 98 119.606 -16.437 10.287 1.00 0.00 H new ATOM 0 HE3 LYS A 98 119.217 -17.739 9.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 121.569 -16.973 9.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 120.722 -16.818 7.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 121.017 -15.448 8.496 1.00 0.00 H new ATOM 1646 N THR A 99 119.717 -10.844 9.180 1.00 0.00 N ATOM 1647 CA THR A 99 120.938 -10.162 8.651 1.00 0.00 C ATOM 1648 C THR A 99 122.186 -10.690 9.364 1.00 0.00 C ATOM 1649 O THR A 99 122.148 -10.970 10.550 1.00 0.00 O ATOM 1650 CB THR A 99 120.728 -8.678 8.959 1.00 0.00 C ATOM 1651 OG1 THR A 99 119.445 -8.279 8.499 1.00 0.00 O ATOM 1652 CG2 THR A 99 121.805 -7.850 8.257 1.00 0.00 C ATOM 0 H THR A 99 119.641 -10.848 10.197 1.00 0.00 H new ATOM 0 HA THR A 99 121.083 -10.338 7.585 1.00 0.00 H new ATOM 0 HB THR A 99 120.796 -8.517 10.035 1.00 0.00 H new ATOM 0 HG1 THR A 99 119.308 -7.329 8.697 1.00 0.00 H new ATOM 0 HG21 THR A 99 121.653 -6.793 8.478 1.00 0.00 H new ATOM 0 HG22 THR A 99 122.789 -8.157 8.612 1.00 0.00 H new ATOM 0 HG23 THR A 99 121.742 -8.008 7.180 1.00 0.00 H new ATOM 1660 N TYR A 100 123.278 -10.822 8.646 1.00 0.00 N ATOM 1661 CA TYR A 100 124.547 -11.335 9.252 1.00 0.00 C ATOM 1662 C TYR A 100 125.424 -10.166 9.711 1.00 0.00 C ATOM 1663 O TYR A 100 125.829 -10.112 10.859 1.00 0.00 O ATOM 1664 CB TYR A 100 125.242 -12.122 8.139 1.00 0.00 C ATOM 1665 CG TYR A 100 124.442 -13.302 7.642 1.00 0.00 C ATOM 1666 CD1 TYR A 100 124.457 -14.532 8.369 1.00 0.00 C ATOM 1667 CD2 TYR A 100 123.668 -13.189 6.445 1.00 0.00 C ATOM 1668 CE1 TYR A 100 123.699 -15.650 7.900 1.00 0.00 C ATOM 1669 CE2 TYR A 100 122.910 -14.307 5.975 1.00 0.00 C ATOM 1670 CZ TYR A 100 122.926 -15.537 6.702 1.00 0.00 C ATOM 1671 OH TYR A 100 122.194 -16.616 6.249 1.00 0.00 O ATOM 0 H TYR A 100 123.343 -10.593 7.654 1.00 0.00 H new ATOM 0 HA TYR A 100 124.359 -11.957 10.127 1.00 0.00 H new ATOM 0 HB2 TYR A 100 125.443 -11.452 7.303 1.00 0.00 H new ATOM 0 HB3 TYR A 100 126.207 -12.475 8.503 1.00 0.00 H new ATOM 0 HD1 TYR A 100 125.041 -14.617 9.273 1.00 0.00 H new ATOM 0 HD2 TYR A 100 123.656 -12.259 5.896 1.00 0.00 H new ATOM 0 HE1 TYR A 100 123.710 -16.579 8.450 1.00 0.00 H new ATOM 0 HE2 TYR A 100 122.326 -14.222 5.071 1.00 0.00 H new ATOM 0 HH TYR A 100 121.726 -16.370 5.424 1.00 0.00 H new ATOM 1681 N HIS A 101 125.710 -9.245 8.820 1.00 0.00 N ATOM 1682 CA HIS A 101 126.562 -8.066 9.167 1.00 0.00 C ATOM 1683 C HIS A 101 125.952 -6.785 8.590 1.00 0.00 C ATOM 1684 O HIS A 101 124.913 -6.828 7.955 1.00 0.00 O ATOM 1685 CB HIS A 101 127.919 -8.351 8.523 1.00 0.00 C ATOM 1686 CG HIS A 101 128.599 -9.577 9.070 1.00 0.00 C ATOM 1687 ND1 HIS A 101 129.079 -9.639 10.368 1.00 0.00 N ATOM 1688 CD2 HIS A 101 128.886 -10.797 8.506 1.00 0.00 C ATOM 1689 CE1 HIS A 101 129.625 -10.856 10.543 1.00 0.00 C ATOM 1690 NE2 HIS A 101 129.535 -11.602 9.439 1.00 0.00 N ATOM 0 H HIS A 101 125.383 -9.263 7.854 1.00 0.00 H new ATOM 0 HA HIS A 101 126.646 -7.921 10.244 1.00 0.00 H new ATOM 0 HB2 HIS A 101 127.784 -8.470 7.448 1.00 0.00 H new ATOM 0 HB3 HIS A 101 128.570 -7.489 8.669 1.00 0.00 H new ATOM 0 HD2 HIS A 101 128.645 -11.087 7.494 1.00 0.00 H new ATOM 0 HE1 HIS A 101 130.080 -11.189 11.464 1.00 0.00 H new ATOM 0 HE2 HIS A 101 129.870 -12.556 9.307 1.00 0.00 H new ATOM 1698 N SER A 102 126.596 -5.662 8.810 1.00 0.00 N ATOM 1699 CA SER A 102 126.094 -4.361 8.268 1.00 0.00 C ATOM 1700 C SER A 102 126.812 -4.029 6.956 1.00 0.00 C ATOM 1701 O SER A 102 127.941 -4.437 6.749 1.00 0.00 O ATOM 1702 CB SER A 102 126.428 -3.321 9.339 1.00 0.00 C ATOM 1703 OG SER A 102 125.767 -3.667 10.549 1.00 0.00 O ATOM 0 H SER A 102 127.459 -5.593 9.349 1.00 0.00 H new ATOM 0 HA SER A 102 125.026 -4.389 8.053 1.00 0.00 H new ATOM 0 HB2 SER A 102 127.505 -3.279 9.498 1.00 0.00 H new ATOM 0 HB3 SER A 102 126.115 -2.330 9.010 1.00 0.00 H new ATOM 0 HG SER A 102 125.979 -3.004 11.239 1.00 0.00 H new ATOM 1709 N SER A 103 126.158 -3.297 6.082 1.00 0.00 N ATOM 1710 CA SER A 103 126.745 -2.981 4.744 1.00 0.00 C ATOM 1711 C SER A 103 126.552 -1.501 4.406 1.00 0.00 C ATOM 1712 O SER A 103 125.867 -0.784 5.115 1.00 0.00 O ATOM 1713 CB SER A 103 125.970 -3.853 3.755 1.00 0.00 C ATOM 1714 OG SER A 103 124.616 -3.422 3.710 1.00 0.00 O ATOM 0 H SER A 103 125.232 -2.902 6.244 1.00 0.00 H new ATOM 0 HA SER A 103 127.817 -3.175 4.715 1.00 0.00 H new ATOM 0 HB2 SER A 103 126.418 -3.785 2.764 1.00 0.00 H new ATOM 0 HB3 SER A 103 126.021 -4.899 4.057 1.00 0.00 H new ATOM 0 HG SER A 103 124.117 -3.978 3.076 1.00 0.00 H new ATOM 1720 N GLU A 104 127.157 -1.056 3.329 1.00 0.00 N ATOM 1721 CA GLU A 104 126.904 0.324 2.810 1.00 0.00 C ATOM 1722 C GLU A 104 126.025 0.281 1.552 1.00 0.00 C ATOM 1723 O GLU A 104 126.079 1.192 0.746 1.00 0.00 O ATOM 1724 CB GLU A 104 128.292 0.877 2.469 1.00 0.00 C ATOM 1725 CG GLU A 104 128.890 1.576 3.693 1.00 0.00 C ATOM 1726 CD GLU A 104 130.350 1.944 3.414 1.00 0.00 C ATOM 1727 OE1 GLU A 104 130.618 2.451 2.337 1.00 0.00 O ATOM 1728 OE2 GLU A 104 131.174 1.710 4.282 1.00 0.00 O ATOM 0 H GLU A 104 127.824 -1.600 2.781 1.00 0.00 H new ATOM 0 HA GLU A 104 126.378 0.942 3.538 1.00 0.00 H new ATOM 0 HB2 GLU A 104 128.946 0.067 2.146 1.00 0.00 H new ATOM 0 HB3 GLU A 104 128.219 1.579 1.638 1.00 0.00 H new ATOM 0 HG2 GLU A 104 128.317 2.473 3.928 1.00 0.00 H new ATOM 0 HG3 GLU A 104 128.829 0.922 4.563 1.00 0.00 H new ATOM 1735 N ILE A 105 125.229 -0.754 1.380 1.00 0.00 N ATOM 1736 CA ILE A 105 124.344 -0.859 0.176 1.00 0.00 C ATOM 1737 C ILE A 105 122.883 -0.950 0.636 1.00 0.00 C ATOM 1738 O ILE A 105 122.545 -1.781 1.459 1.00 0.00 O ATOM 1739 CB ILE A 105 124.775 -2.143 -0.564 1.00 0.00 C ATOM 1740 CG1 ILE A 105 126.279 -2.120 -0.916 1.00 0.00 C ATOM 1741 CG2 ILE A 105 123.955 -2.320 -1.851 1.00 0.00 C ATOM 1742 CD1 ILE A 105 126.645 -0.916 -1.798 1.00 0.00 C ATOM 0 H ILE A 105 125.157 -1.536 2.031 1.00 0.00 H new ATOM 0 HA ILE A 105 124.430 0.006 -0.481 1.00 0.00 H new ATOM 0 HB ILE A 105 124.591 -2.981 0.108 1.00 0.00 H new ATOM 0 HG12 ILE A 105 126.866 -2.089 0.002 1.00 0.00 H new ATOM 0 HG13 ILE A 105 126.545 -3.042 -1.433 1.00 0.00 H new ATOM 0 HG21 ILE A 105 124.271 -3.230 -2.361 1.00 0.00 H new ATOM 0 HG22 ILE A 105 122.897 -2.393 -1.601 1.00 0.00 H new ATOM 0 HG23 ILE A 105 124.115 -1.463 -2.505 1.00 0.00 H new ATOM 0 HD11 ILE A 105 127.712 -0.939 -2.021 1.00 0.00 H new ATOM 0 HD12 ILE A 105 126.079 -0.961 -2.728 1.00 0.00 H new ATOM 0 HD13 ILE A 105 126.405 0.007 -1.271 1.00 0.00 H new ATOM 1754 N ILE A 106 122.031 -0.103 0.104 1.00 0.00 N ATOM 1755 CA ILE A 106 120.572 -0.149 0.443 1.00 0.00 C ATOM 1756 C ILE A 106 119.737 -0.250 -0.839 1.00 0.00 C ATOM 1757 O ILE A 106 120.105 0.305 -1.859 1.00 0.00 O ATOM 1758 CB ILE A 106 120.257 1.148 1.211 1.00 0.00 C ATOM 1759 CG1 ILE A 106 120.624 2.392 0.387 1.00 0.00 C ATOM 1760 CG2 ILE A 106 121.043 1.169 2.525 1.00 0.00 C ATOM 1761 CD1 ILE A 106 119.988 3.631 1.020 1.00 0.00 C ATOM 0 H ILE A 106 122.289 0.627 -0.559 1.00 0.00 H new ATOM 0 HA ILE A 106 120.330 -1.020 1.051 1.00 0.00 H new ATOM 0 HB ILE A 106 119.185 1.169 1.409 1.00 0.00 H new ATOM 0 HG12 ILE A 106 121.707 2.507 0.346 1.00 0.00 H new ATOM 0 HG13 ILE A 106 120.277 2.276 -0.640 1.00 0.00 H new ATOM 0 HG21 ILE A 106 120.820 2.087 3.068 1.00 0.00 H new ATOM 0 HG22 ILE A 106 120.759 0.310 3.133 1.00 0.00 H new ATOM 0 HG23 ILE A 106 122.111 1.125 2.311 1.00 0.00 H new ATOM 0 HD11 ILE A 106 120.249 4.513 0.435 1.00 0.00 H new ATOM 0 HD12 ILE A 106 118.904 3.515 1.038 1.00 0.00 H new ATOM 0 HD13 ILE A 106 120.357 3.749 2.039 1.00 0.00 H new ATOM 1773 N GLU A 107 118.625 -0.949 -0.779 1.00 0.00 N ATOM 1774 CA GLU A 107 117.738 -1.092 -1.975 1.00 0.00 C ATOM 1775 C GLU A 107 116.379 -0.442 -1.701 1.00 0.00 C ATOM 1776 O GLU A 107 115.755 -0.707 -0.689 1.00 0.00 O ATOM 1777 CB GLU A 107 117.576 -2.599 -2.182 1.00 0.00 C ATOM 1778 CG GLU A 107 118.764 -3.136 -2.982 1.00 0.00 C ATOM 1779 CD GLU A 107 118.612 -4.646 -3.179 1.00 0.00 C ATOM 1780 OE1 GLU A 107 117.520 -5.074 -3.512 1.00 0.00 O ATOM 1781 OE2 GLU A 107 119.592 -5.349 -2.994 1.00 0.00 O ATOM 0 H GLU A 107 118.294 -1.430 0.057 1.00 0.00 H new ATOM 0 HA GLU A 107 118.157 -0.606 -2.856 1.00 0.00 H new ATOM 0 HB2 GLU A 107 117.515 -3.104 -1.218 1.00 0.00 H new ATOM 0 HB3 GLU A 107 116.645 -2.806 -2.710 1.00 0.00 H new ATOM 0 HG2 GLU A 107 118.819 -2.637 -3.949 1.00 0.00 H new ATOM 0 HG3 GLU A 107 119.695 -2.920 -2.458 1.00 0.00 H new ATOM 1788 N ILE A 108 115.932 0.400 -2.605 1.00 0.00 N ATOM 1789 CA ILE A 108 114.674 1.180 -2.387 1.00 0.00 C ATOM 1790 C ILE A 108 113.618 0.747 -3.415 1.00 0.00 C ATOM 1791 O ILE A 108 113.951 0.321 -4.504 1.00 0.00 O ATOM 1792 CB ILE A 108 115.079 2.657 -2.576 1.00 0.00 C ATOM 1793 CG1 ILE A 108 116.106 3.059 -1.512 1.00 0.00 C ATOM 1794 CG2 ILE A 108 113.861 3.582 -2.442 1.00 0.00 C ATOM 1795 CD1 ILE A 108 116.779 4.372 -1.916 1.00 0.00 C ATOM 0 H ILE A 108 116.394 0.581 -3.496 1.00 0.00 H new ATOM 0 HA ILE A 108 114.237 1.018 -1.402 1.00 0.00 H new ATOM 0 HB ILE A 108 115.505 2.759 -3.574 1.00 0.00 H new ATOM 0 HG12 ILE A 108 115.617 3.172 -0.545 1.00 0.00 H new ATOM 0 HG13 ILE A 108 116.855 2.275 -1.400 1.00 0.00 H new ATOM 0 HG21 ILE A 108 114.173 4.617 -2.579 1.00 0.00 H new ATOM 0 HG22 ILE A 108 113.122 3.322 -3.200 1.00 0.00 H new ATOM 0 HG23 ILE A 108 113.422 3.464 -1.451 1.00 0.00 H new ATOM 0 HD11 ILE A 108 117.509 4.655 -1.157 1.00 0.00 H new ATOM 0 HD12 ILE A 108 117.283 4.243 -2.874 1.00 0.00 H new ATOM 0 HD13 ILE A 108 116.026 5.155 -2.005 1.00 0.00 H new ATOM 1807 N ILE A 109 112.361 0.859 -3.058 1.00 0.00 N ATOM 1808 CA ILE A 109 111.253 0.719 -4.056 1.00 0.00 C ATOM 1809 C ILE A 109 110.498 2.049 -4.172 1.00 0.00 C ATOM 1810 O ILE A 109 110.519 2.848 -3.252 1.00 0.00 O ATOM 1811 CB ILE A 109 110.331 -0.404 -3.546 1.00 0.00 C ATOM 1812 CG1 ILE A 109 109.802 -0.102 -2.134 1.00 0.00 C ATOM 1813 CG2 ILE A 109 111.104 -1.725 -3.520 1.00 0.00 C ATOM 1814 CD1 ILE A 109 108.489 -0.856 -1.907 1.00 0.00 C ATOM 0 H ILE A 109 112.052 1.044 -2.104 1.00 0.00 H new ATOM 0 HA ILE A 109 111.631 0.470 -5.048 1.00 0.00 H new ATOM 0 HB ILE A 109 109.480 -0.474 -4.223 1.00 0.00 H new ATOM 0 HG12 ILE A 109 110.538 -0.400 -1.387 1.00 0.00 H new ATOM 0 HG13 ILE A 109 109.643 0.970 -2.015 1.00 0.00 H new ATOM 0 HG21 ILE A 109 110.452 -2.521 -3.159 1.00 0.00 H new ATOM 0 HG22 ILE A 109 111.447 -1.965 -4.526 1.00 0.00 H new ATOM 0 HG23 ILE A 109 111.963 -1.631 -2.856 1.00 0.00 H new ATOM 0 HD11 ILE A 109 108.115 -0.642 -0.906 1.00 0.00 H new ATOM 0 HD12 ILE A 109 107.754 -0.537 -2.646 1.00 0.00 H new ATOM 0 HD13 ILE A 109 108.663 -1.927 -2.008 1.00 0.00 H new ATOM 1826 N ALA A 110 109.842 2.274 -5.288 1.00 0.00 N ATOM 1827 CA ALA A 110 109.142 3.574 -5.525 1.00 0.00 C ATOM 1828 C ALA A 110 107.831 3.342 -6.296 1.00 0.00 C ATOM 1829 O ALA A 110 107.641 2.265 -6.828 1.00 0.00 O ATOM 1830 CB ALA A 110 110.117 4.415 -6.350 1.00 0.00 C ATOM 0 H ALA A 110 109.763 1.603 -6.052 1.00 0.00 H new ATOM 0 HA ALA A 110 108.874 4.071 -4.593 1.00 0.00 H new ATOM 0 HB1 ALA A 110 109.670 5.386 -6.563 1.00 0.00 H new ATOM 0 HB2 ALA A 110 111.041 4.556 -5.789 1.00 0.00 H new ATOM 0 HB3 ALA A 110 110.336 3.903 -7.287 1.00 0.00 H new ATOM 1836 N PRO A 111 106.957 4.338 -6.340 1.00 0.00 N ATOM 1837 CA PRO A 111 105.680 4.214 -7.119 1.00 0.00 C ATOM 1838 C PRO A 111 105.953 3.962 -8.609 1.00 0.00 C ATOM 1839 O PRO A 111 105.192 3.278 -9.269 1.00 0.00 O ATOM 1840 CB PRO A 111 105.011 5.577 -6.916 1.00 0.00 C ATOM 1841 CG PRO A 111 105.588 6.065 -5.635 1.00 0.00 C ATOM 1842 CD PRO A 111 107.030 5.663 -5.689 1.00 0.00 C ATOM 0 HA PRO A 111 105.066 3.376 -6.788 1.00 0.00 H new ATOM 0 HB2 PRO A 111 105.230 6.257 -7.739 1.00 0.00 H new ATOM 0 HB3 PRO A 111 103.926 5.486 -6.858 1.00 0.00 H new ATOM 0 HG2 PRO A 111 105.482 7.146 -5.539 1.00 0.00 H new ATOM 0 HG3 PRO A 111 105.084 5.618 -4.778 1.00 0.00 H new ATOM 0 HD2 PRO A 111 107.629 6.368 -6.266 1.00 0.00 H new ATOM 0 HD3 PRO A 111 107.475 5.605 -4.696 1.00 0.00 H new ATOM 1850 N MET A 112 107.030 4.513 -9.125 1.00 0.00 N ATOM 1851 CA MET A 112 107.369 4.344 -10.571 1.00 0.00 C ATOM 1852 C MET A 112 108.891 4.263 -10.771 1.00 0.00 C ATOM 1853 O MET A 112 109.650 4.685 -9.916 1.00 0.00 O ATOM 1854 CB MET A 112 106.714 5.530 -11.322 1.00 0.00 C ATOM 1855 CG MET A 112 107.482 6.864 -11.213 1.00 0.00 C ATOM 1856 SD MET A 112 107.379 7.553 -9.542 1.00 0.00 S ATOM 1857 CE MET A 112 105.620 7.979 -9.581 1.00 0.00 C ATOM 0 H MET A 112 107.694 5.079 -8.596 1.00 0.00 H new ATOM 0 HA MET A 112 106.983 3.407 -10.971 1.00 0.00 H new ATOM 0 HB2 MET A 112 106.617 5.267 -12.375 1.00 0.00 H new ATOM 0 HB3 MET A 112 105.705 5.674 -10.936 1.00 0.00 H new ATOM 0 HG2 MET A 112 108.527 6.706 -11.479 1.00 0.00 H new ATOM 0 HG3 MET A 112 107.075 7.579 -11.928 1.00 0.00 H new ATOM 0 HE1 MET A 112 105.369 8.569 -8.700 1.00 0.00 H new ATOM 0 HE2 MET A 112 105.406 8.558 -10.479 1.00 0.00 H new ATOM 0 HE3 MET A 112 105.025 7.066 -9.588 1.00 0.00 H new ATOM 1867 N LYS A 113 109.324 3.725 -11.892 1.00 0.00 N ATOM 1868 CA LYS A 113 110.795 3.598 -12.175 1.00 0.00 C ATOM 1869 C LYS A 113 111.470 4.979 -12.246 1.00 0.00 C ATOM 1870 O LYS A 113 111.328 5.706 -13.215 1.00 0.00 O ATOM 1871 CB LYS A 113 110.925 2.825 -13.500 1.00 0.00 C ATOM 1872 CG LYS A 113 110.253 3.570 -14.661 1.00 0.00 C ATOM 1873 CD LYS A 113 109.967 2.587 -15.799 1.00 0.00 C ATOM 1874 CE LYS A 113 109.400 3.347 -16.999 1.00 0.00 C ATOM 1875 NZ LYS A 113 107.948 3.508 -16.704 1.00 0.00 N ATOM 0 H LYS A 113 108.716 3.366 -12.628 1.00 0.00 H new ATOM 0 HA LYS A 113 111.303 3.063 -11.373 1.00 0.00 H new ATOM 0 HB2 LYS A 113 111.979 2.670 -13.729 1.00 0.00 H new ATOM 0 HB3 LYS A 113 110.474 1.839 -13.391 1.00 0.00 H new ATOM 0 HG2 LYS A 113 109.325 4.032 -14.323 1.00 0.00 H new ATOM 0 HG3 LYS A 113 110.899 4.374 -15.014 1.00 0.00 H new ATOM 0 HD2 LYS A 113 110.882 2.067 -16.083 1.00 0.00 H new ATOM 0 HD3 LYS A 113 109.259 1.827 -15.468 1.00 0.00 H new ATOM 0 HE2 LYS A 113 109.888 4.314 -17.120 1.00 0.00 H new ATOM 0 HE3 LYS A 113 109.555 2.794 -17.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 107.468 3.914 -17.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 107.533 2.580 -16.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 107.828 4.142 -15.889 1.00 0.00 H new ATOM 1889 N LEU A 114 112.203 5.333 -11.211 1.00 0.00 N ATOM 1890 CA LEU A 114 112.846 6.692 -11.135 1.00 0.00 C ATOM 1891 C LEU A 114 113.806 6.930 -12.306 1.00 0.00 C ATOM 1892 O LEU A 114 113.945 8.049 -12.767 1.00 0.00 O ATOM 1893 CB LEU A 114 113.628 6.725 -9.816 1.00 0.00 C ATOM 1894 CG LEU A 114 112.660 6.633 -8.635 1.00 0.00 C ATOM 1895 CD1 LEU A 114 113.449 6.381 -7.350 1.00 0.00 C ATOM 1896 CD2 LEU A 114 111.885 7.946 -8.505 1.00 0.00 C ATOM 0 H LEU A 114 112.385 4.732 -10.407 1.00 0.00 H new ATOM 0 HA LEU A 114 112.085 7.471 -11.184 1.00 0.00 H new ATOM 0 HB2 LEU A 114 114.336 5.897 -9.782 1.00 0.00 H new ATOM 0 HB3 LEU A 114 114.209 7.645 -9.750 1.00 0.00 H new ATOM 0 HG LEU A 114 111.961 5.813 -8.802 1.00 0.00 H new ATOM 0 HD11 LEU A 114 112.761 6.315 -6.507 1.00 0.00 H new ATOM 0 HD12 LEU A 114 114.002 5.446 -7.440 1.00 0.00 H new ATOM 0 HD13 LEU A 114 114.147 7.202 -7.185 1.00 0.00 H new ATOM 0 HD21 LEU A 114 111.196 7.880 -7.663 1.00 0.00 H new ATOM 0 HD22 LEU A 114 112.584 8.766 -8.338 1.00 0.00 H new ATOM 0 HD23 LEU A 114 111.323 8.129 -9.421 1.00 0.00 H new ATOM 1908 N ARG A 115 114.457 5.892 -12.784 1.00 0.00 N ATOM 1909 CA ARG A 115 115.545 6.066 -13.807 1.00 0.00 C ATOM 1910 C ARG A 115 114.999 6.688 -15.096 1.00 0.00 C ATOM 1911 O ARG A 115 115.670 7.494 -15.715 1.00 0.00 O ATOM 1912 CB ARG A 115 116.103 4.671 -14.102 1.00 0.00 C ATOM 1913 CG ARG A 115 116.767 4.104 -12.845 1.00 0.00 C ATOM 1914 CD ARG A 115 117.446 2.771 -13.177 1.00 0.00 C ATOM 1915 NE ARG A 115 116.342 1.821 -13.535 1.00 0.00 N ATOM 1916 CZ ARG A 115 116.531 0.767 -14.306 1.00 0.00 C ATOM 1917 NH1 ARG A 115 117.702 0.443 -14.805 1.00 0.00 N ATOM 1918 NH2 ARG A 115 115.508 0.003 -14.576 1.00 0.00 N ATOM 0 H ARG A 115 114.281 4.926 -12.508 1.00 0.00 H new ATOM 0 HA ARG A 115 116.316 6.735 -13.426 1.00 0.00 H new ATOM 0 HB2 ARG A 115 115.301 4.010 -14.431 1.00 0.00 H new ATOM 0 HB3 ARG A 115 116.827 4.723 -14.915 1.00 0.00 H new ATOM 0 HG2 ARG A 115 117.501 4.811 -12.459 1.00 0.00 H new ATOM 0 HG3 ARG A 115 116.022 3.959 -12.062 1.00 0.00 H new ATOM 0 HD2 ARG A 115 118.146 2.885 -14.005 1.00 0.00 H new ATOM 0 HD3 ARG A 115 118.017 2.402 -12.325 1.00 0.00 H new ATOM 0 HE ARG A 115 115.407 1.997 -13.167 1.00 0.00 H new ATOM 0 HH11 ARG A 115 118.520 1.018 -14.601 1.00 0.00 H new ATOM 0 HH12 ARG A 115 117.794 -0.383 -15.396 1.00 0.00 H new ATOM 0 HH21 ARG A 115 114.589 0.227 -14.194 1.00 0.00 H new ATOM 0 HH22 ARG A 115 115.627 -0.818 -15.170 1.00 0.00 H new ATOM 1932 N GLU A 116 113.802 6.318 -15.486 1.00 0.00 N ATOM 1933 CA GLU A 116 113.183 6.910 -16.714 1.00 0.00 C ATOM 1934 C GLU A 116 112.642 8.300 -16.383 1.00 0.00 C ATOM 1935 O GLU A 116 112.860 9.241 -17.126 1.00 0.00 O ATOM 1936 CB GLU A 116 112.050 5.967 -17.135 1.00 0.00 C ATOM 1937 CG GLU A 116 112.624 4.603 -17.529 1.00 0.00 C ATOM 1938 CD GLU A 116 113.383 4.721 -18.854 1.00 0.00 C ATOM 1939 OE1 GLU A 116 112.870 5.366 -19.755 1.00 0.00 O ATOM 1940 OE2 GLU A 116 114.464 4.164 -18.945 1.00 0.00 O ATOM 0 H GLU A 116 113.225 5.628 -15.004 1.00 0.00 H new ATOM 0 HA GLU A 116 113.905 7.017 -17.524 1.00 0.00 H new ATOM 0 HB2 GLU A 116 111.340 5.849 -16.316 1.00 0.00 H new ATOM 0 HB3 GLU A 116 111.501 6.396 -17.973 1.00 0.00 H new ATOM 0 HG2 GLU A 116 113.292 4.240 -16.748 1.00 0.00 H new ATOM 0 HG3 GLU A 116 111.820 3.874 -17.624 1.00 0.00 H new ATOM 1947 N GLN A 117 111.957 8.433 -15.267 1.00 0.00 N ATOM 1948 CA GLN A 117 111.257 9.722 -14.938 1.00 0.00 C ATOM 1949 C GLN A 117 112.260 10.875 -14.799 1.00 0.00 C ATOM 1950 O GLN A 117 111.956 12.000 -15.158 1.00 0.00 O ATOM 1951 CB GLN A 117 110.526 9.493 -13.609 1.00 0.00 C ATOM 1952 CG GLN A 117 109.437 8.435 -13.795 1.00 0.00 C ATOM 1953 CD GLN A 117 108.284 9.022 -14.614 1.00 0.00 C ATOM 1954 OE1 GLN A 117 107.825 10.114 -14.343 1.00 0.00 O ATOM 1955 NE2 GLN A 117 107.794 8.338 -15.612 1.00 0.00 N ATOM 0 H GLN A 117 111.852 7.700 -14.566 1.00 0.00 H new ATOM 0 HA GLN A 117 110.564 9.997 -15.733 1.00 0.00 H new ATOM 0 HB2 GLN A 117 111.233 9.170 -12.845 1.00 0.00 H new ATOM 0 HB3 GLN A 117 110.084 10.426 -13.261 1.00 0.00 H new ATOM 0 HG2 GLN A 117 109.848 7.561 -14.301 1.00 0.00 H new ATOM 0 HG3 GLN A 117 109.073 8.099 -12.824 1.00 0.00 H new ATOM 0 HE21 GLN A 117 108.179 7.421 -15.840 1.00 0.00 H new ATOM 0 HE22 GLN A 117 107.026 8.720 -16.164 1.00 0.00 H new ATOM 1964 N PHE A 118 113.437 10.595 -14.286 1.00 0.00 N ATOM 1965 CA PHE A 118 114.465 11.665 -14.085 1.00 0.00 C ATOM 1966 C PHE A 118 115.633 11.553 -15.078 1.00 0.00 C ATOM 1967 O PHE A 118 116.613 12.261 -14.936 1.00 0.00 O ATOM 1968 CB PHE A 118 114.966 11.455 -12.655 1.00 0.00 C ATOM 1969 CG PHE A 118 113.938 11.794 -11.602 1.00 0.00 C ATOM 1970 CD1 PHE A 118 113.782 13.145 -11.165 1.00 0.00 C ATOM 1971 CD2 PHE A 118 113.123 10.762 -11.041 1.00 0.00 C ATOM 1972 CE1 PHE A 118 112.810 13.466 -10.167 1.00 0.00 C ATOM 1973 CE2 PHE A 118 112.150 11.083 -10.043 1.00 0.00 C ATOM 1974 CZ PHE A 118 111.994 12.436 -9.606 1.00 0.00 C ATOM 0 H PHE A 118 113.730 9.662 -13.996 1.00 0.00 H new ATOM 0 HA PHE A 118 114.037 12.654 -14.250 1.00 0.00 H new ATOM 0 HB2 PHE A 118 115.270 10.415 -12.534 1.00 0.00 H new ATOM 0 HB3 PHE A 118 115.854 12.067 -12.496 1.00 0.00 H new ATOM 0 HD1 PHE A 118 114.398 13.924 -11.589 1.00 0.00 H new ATOM 0 HD2 PHE A 118 113.242 9.740 -11.371 1.00 0.00 H new ATOM 0 HE1 PHE A 118 112.692 14.488 -9.837 1.00 0.00 H new ATOM 0 HE2 PHE A 118 111.533 10.304 -9.620 1.00 0.00 H new ATOM 0 HZ PHE A 118 111.260 12.679 -8.852 1.00 0.00 H new ATOM 1984 N ASN A 119 115.554 10.687 -16.077 1.00 0.00 N ATOM 1985 CA ASN A 119 116.676 10.493 -17.064 1.00 0.00 C ATOM 1986 C ASN A 119 118.023 10.231 -16.359 1.00 0.00 C ATOM 1987 O ASN A 119 119.032 10.838 -16.680 1.00 0.00 O ATOM 1988 CB ASN A 119 116.722 11.779 -17.901 1.00 0.00 C ATOM 1989 CG ASN A 119 115.442 11.895 -18.733 1.00 0.00 C ATOM 1990 OD1 ASN A 119 115.307 11.249 -19.753 1.00 0.00 O ATOM 1991 ND2 ASN A 119 114.490 12.694 -18.335 1.00 0.00 N ATOM 0 H ASN A 119 114.740 10.096 -16.250 1.00 0.00 H new ATOM 0 HA ASN A 119 116.502 9.616 -17.688 1.00 0.00 H new ATOM 0 HB2 ASN A 119 116.824 12.646 -17.249 1.00 0.00 H new ATOM 0 HB3 ASN A 119 117.594 11.768 -18.555 1.00 0.00 H new ATOM 0 HD21 ASN A 119 113.632 12.776 -18.880 1.00 0.00 H new ATOM 0 HD22 ASN A 119 114.604 13.236 -17.479 1.00 0.00 H new ATOM 1998 N LEU A 120 118.031 9.326 -15.407 1.00 0.00 N ATOM 1999 CA LEU A 120 119.229 9.137 -14.529 1.00 0.00 C ATOM 2000 C LEU A 120 120.169 8.075 -15.105 1.00 0.00 C ATOM 2001 O LEU A 120 119.726 7.047 -15.586 1.00 0.00 O ATOM 2002 CB LEU A 120 118.682 8.681 -13.174 1.00 0.00 C ATOM 2003 CG LEU A 120 117.980 9.850 -12.480 1.00 0.00 C ATOM 2004 CD1 LEU A 120 117.190 9.328 -11.279 1.00 0.00 C ATOM 2005 CD2 LEU A 120 119.026 10.859 -11.997 1.00 0.00 C ATOM 0 H LEU A 120 117.249 8.704 -15.200 1.00 0.00 H new ATOM 0 HA LEU A 120 119.807 10.057 -14.447 1.00 0.00 H new ATOM 0 HB2 LEU A 120 117.984 7.856 -13.312 1.00 0.00 H new ATOM 0 HB3 LEU A 120 119.495 8.310 -12.549 1.00 0.00 H new ATOM 0 HG LEU A 120 117.302 10.335 -13.182 1.00 0.00 H new ATOM 0 HD11 LEU A 120 116.689 10.160 -10.784 1.00 0.00 H new ATOM 0 HD12 LEU A 120 116.446 8.607 -11.618 1.00 0.00 H new ATOM 0 HD13 LEU A 120 117.871 8.845 -10.578 1.00 0.00 H new ATOM 0 HD21 LEU A 120 118.527 11.692 -11.502 1.00 0.00 H new ATOM 0 HD22 LEU A 120 119.703 10.373 -11.294 1.00 0.00 H new ATOM 0 HD23 LEU A 120 119.594 11.231 -12.850 1.00 0.00 H new ATOM 2017 N LYS A 121 121.458 8.331 -15.055 1.00 0.00 N ATOM 2018 CA LYS A 121 122.469 7.329 -15.509 1.00 0.00 C ATOM 2019 C LYS A 121 123.340 6.897 -14.325 1.00 0.00 C ATOM 2020 O LYS A 121 123.434 7.602 -13.335 1.00 0.00 O ATOM 2021 CB LYS A 121 123.316 8.061 -16.553 1.00 0.00 C ATOM 2022 CG LYS A 121 122.465 8.358 -17.790 1.00 0.00 C ATOM 2023 CD LYS A 121 123.341 8.994 -18.871 1.00 0.00 C ATOM 2024 CE LYS A 121 122.469 9.403 -20.060 1.00 0.00 C ATOM 2025 NZ LYS A 121 123.347 10.263 -20.902 1.00 0.00 N ATOM 0 H LYS A 121 121.854 9.207 -14.713 1.00 0.00 H new ATOM 0 HA LYS A 121 122.007 6.430 -15.918 1.00 0.00 H new ATOM 0 HB2 LYS A 121 123.704 8.990 -16.135 1.00 0.00 H new ATOM 0 HB3 LYS A 121 124.177 7.452 -16.829 1.00 0.00 H new ATOM 0 HG2 LYS A 121 122.016 7.438 -18.165 1.00 0.00 H new ATOM 0 HG3 LYS A 121 121.646 9.029 -17.529 1.00 0.00 H new ATOM 0 HD2 LYS A 121 123.858 9.865 -18.469 1.00 0.00 H new ATOM 0 HD3 LYS A 121 124.107 8.289 -19.194 1.00 0.00 H new ATOM 0 HE2 LYS A 121 122.122 8.531 -20.614 1.00 0.00 H new ATOM 0 HE3 LYS A 121 121.582 9.945 -19.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 122.819 10.584 -21.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 123.656 11.089 -20.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 124.179 9.718 -21.205 1.00 0.00 H new ATOM 2039 N ASP A 122 123.978 5.750 -14.425 1.00 0.00 N ATOM 2040 CA ASP A 122 124.841 5.230 -13.304 1.00 0.00 C ATOM 2041 C ASP A 122 125.927 6.243 -12.915 1.00 0.00 C ATOM 2042 O ASP A 122 126.537 6.857 -13.773 1.00 0.00 O ATOM 2043 CB ASP A 122 125.497 3.948 -13.831 1.00 0.00 C ATOM 2044 CG ASP A 122 124.424 2.885 -14.084 1.00 0.00 C ATOM 2045 OD1 ASP A 122 123.559 2.730 -13.239 1.00 0.00 O ATOM 2046 OD2 ASP A 122 124.487 2.245 -15.121 1.00 0.00 O ATOM 0 H ASP A 122 123.938 5.144 -15.244 1.00 0.00 H new ATOM 0 HA ASP A 122 124.240 5.050 -12.413 1.00 0.00 H new ATOM 0 HB2 ASP A 122 126.039 4.158 -14.753 1.00 0.00 H new ATOM 0 HB3 ASP A 122 126.226 3.578 -13.110 1.00 0.00 H new ATOM 2051 N GLY A 123 126.161 6.408 -11.632 1.00 0.00 N ATOM 2052 CA GLY A 123 127.169 7.400 -11.149 1.00 0.00 C ATOM 2053 C GLY A 123 126.492 8.689 -10.666 1.00 0.00 C ATOM 2054 O GLY A 123 127.071 9.414 -9.875 1.00 0.00 O ATOM 0 H GLY A 123 125.688 5.889 -10.892 1.00 0.00 H new ATOM 0 HA2 GLY A 123 127.751 6.965 -10.336 1.00 0.00 H new ATOM 0 HA3 GLY A 123 127.868 7.632 -11.952 1.00 0.00 H new ATOM 2058 N ASP A 124 125.288 8.982 -11.123 1.00 0.00 N ATOM 2059 CA ASP A 124 124.581 10.235 -10.684 1.00 0.00 C ATOM 2060 C ASP A 124 124.264 10.161 -9.187 1.00 0.00 C ATOM 2061 O ASP A 124 124.091 9.084 -8.649 1.00 0.00 O ATOM 2062 CB ASP A 124 123.289 10.326 -11.505 1.00 0.00 C ATOM 2063 CG ASP A 124 123.556 11.052 -12.827 1.00 0.00 C ATOM 2064 OD1 ASP A 124 124.281 12.035 -12.811 1.00 0.00 O ATOM 2065 OD2 ASP A 124 123.026 10.614 -13.833 1.00 0.00 O ATOM 0 H ASP A 124 124.766 8.405 -11.782 1.00 0.00 H new ATOM 0 HA ASP A 124 125.202 11.116 -10.845 1.00 0.00 H new ATOM 0 HB2 ASP A 124 122.903 9.326 -11.702 1.00 0.00 H new ATOM 0 HB3 ASP A 124 122.525 10.857 -10.937 1.00 0.00 H new ATOM 2070 N VAL A 125 124.188 11.295 -8.529 1.00 0.00 N ATOM 2071 CA VAL A 125 124.010 11.315 -7.041 1.00 0.00 C ATOM 2072 C VAL A 125 122.608 11.838 -6.702 1.00 0.00 C ATOM 2073 O VAL A 125 122.165 12.833 -7.249 1.00 0.00 O ATOM 2074 CB VAL A 125 125.107 12.250 -6.493 1.00 0.00 C ATOM 2075 CG1 VAL A 125 125.037 12.315 -4.961 1.00 0.00 C ATOM 2076 CG2 VAL A 125 126.496 11.732 -6.883 1.00 0.00 C ATOM 0 H VAL A 125 124.242 12.216 -8.964 1.00 0.00 H new ATOM 0 HA VAL A 125 124.099 10.323 -6.598 1.00 0.00 H new ATOM 0 HB VAL A 125 124.943 13.240 -6.919 1.00 0.00 H new ATOM 0 HG11 VAL A 125 125.817 12.979 -4.589 1.00 0.00 H new ATOM 0 HG12 VAL A 125 124.062 12.695 -4.657 1.00 0.00 H new ATOM 0 HG13 VAL A 125 125.182 11.317 -4.547 1.00 0.00 H new ATOM 0 HG21 VAL A 125 127.259 12.403 -6.488 1.00 0.00 H new ATOM 0 HG22 VAL A 125 126.642 10.734 -6.469 1.00 0.00 H new ATOM 0 HG23 VAL A 125 126.577 11.690 -7.969 1.00 0.00 H new ATOM 2086 N ILE A 126 121.922 11.163 -5.808 1.00 0.00 N ATOM 2087 CA ILE A 126 120.594 11.645 -5.314 1.00 0.00 C ATOM 2088 C ILE A 126 120.595 11.668 -3.782 1.00 0.00 C ATOM 2089 O ILE A 126 121.409 11.010 -3.158 1.00 0.00 O ATOM 2090 CB ILE A 126 119.539 10.664 -5.860 1.00 0.00 C ATOM 2091 CG1 ILE A 126 119.832 9.221 -5.421 1.00 0.00 C ATOM 2092 CG2 ILE A 126 119.521 10.728 -7.389 1.00 0.00 C ATOM 2093 CD1 ILE A 126 118.599 8.350 -5.675 1.00 0.00 C ATOM 0 H ILE A 126 122.233 10.284 -5.394 1.00 0.00 H new ATOM 0 HA ILE A 126 120.376 12.658 -5.653 1.00 0.00 H new ATOM 0 HB ILE A 126 118.569 10.957 -5.457 1.00 0.00 H new ATOM 0 HG12 ILE A 126 120.687 8.829 -5.971 1.00 0.00 H new ATOM 0 HG13 ILE A 126 120.095 9.198 -4.364 1.00 0.00 H new ATOM 0 HG21 ILE A 126 118.774 10.033 -7.773 1.00 0.00 H new ATOM 0 HG22 ILE A 126 119.273 11.740 -7.708 1.00 0.00 H new ATOM 0 HG23 ILE A 126 120.503 10.456 -7.776 1.00 0.00 H new ATOM 0 HD11 ILE A 126 118.806 7.326 -5.364 1.00 0.00 H new ATOM 0 HD12 ILE A 126 117.755 8.739 -5.105 1.00 0.00 H new ATOM 0 HD13 ILE A 126 118.356 8.364 -6.738 1.00 0.00 H new ATOM 2105 N LYS A 127 119.693 12.415 -3.188 1.00 0.00 N ATOM 2106 CA LYS A 127 119.676 12.568 -1.701 1.00 0.00 C ATOM 2107 C LYS A 127 118.465 11.844 -1.110 1.00 0.00 C ATOM 2108 O LYS A 127 117.377 11.920 -1.651 1.00 0.00 O ATOM 2109 CB LYS A 127 119.570 14.075 -1.456 1.00 0.00 C ATOM 2110 CG LYS A 127 120.857 14.763 -1.912 1.00 0.00 C ATOM 2111 CD LYS A 127 120.788 16.253 -1.571 1.00 0.00 C ATOM 2112 CE LYS A 127 122.015 16.966 -2.144 1.00 0.00 C ATOM 2113 NZ LYS A 127 123.107 16.698 -1.167 1.00 0.00 N ATOM 0 H LYS A 127 118.961 12.930 -3.678 1.00 0.00 H new ATOM 0 HA LYS A 127 120.563 12.141 -1.233 1.00 0.00 H new ATOM 0 HB2 LYS A 127 118.717 14.482 -1.998 1.00 0.00 H new ATOM 0 HB3 LYS A 127 119.397 14.270 -0.398 1.00 0.00 H new ATOM 0 HG2 LYS A 127 121.718 14.307 -1.424 1.00 0.00 H new ATOM 0 HG3 LYS A 127 120.992 14.631 -2.985 1.00 0.00 H new ATOM 0 HD2 LYS A 127 119.877 16.689 -1.981 1.00 0.00 H new ATOM 0 HD3 LYS A 127 120.748 16.388 -0.490 1.00 0.00 H new ATOM 0 HE2 LYS A 127 122.268 16.584 -3.133 1.00 0.00 H new ATOM 0 HE3 LYS A 127 121.835 18.036 -2.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 123.751 17.514 -1.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 122.698 16.541 -0.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 123.635 15.852 -1.461 1.00 0.00 H new ATOM 2127 N ILE A 128 118.654 11.149 -0.011 1.00 0.00 N ATOM 2128 CA ILE A 128 117.513 10.471 0.684 1.00 0.00 C ATOM 2129 C ILE A 128 117.264 11.129 2.046 1.00 0.00 C ATOM 2130 O ILE A 128 118.195 11.436 2.771 1.00 0.00 O ATOM 2131 CB ILE A 128 117.900 8.989 0.831 1.00 0.00 C ATOM 2132 CG1 ILE A 128 119.228 8.822 1.588 1.00 0.00 C ATOM 2133 CG2 ILE A 128 118.033 8.362 -0.560 1.00 0.00 C ATOM 2134 CD1 ILE A 128 119.415 7.354 1.982 1.00 0.00 C ATOM 0 H ILE A 128 119.561 11.022 0.438 1.00 0.00 H new ATOM 0 HA ILE A 128 116.586 10.560 0.117 1.00 0.00 H new ATOM 0 HB ILE A 128 117.118 8.491 1.403 1.00 0.00 H new ATOM 0 HG12 ILE A 128 120.058 9.149 0.962 1.00 0.00 H new ATOM 0 HG13 ILE A 128 119.232 9.451 2.478 1.00 0.00 H new ATOM 0 HG21 ILE A 128 118.307 7.312 -0.461 1.00 0.00 H new ATOM 0 HG22 ILE A 128 117.082 8.441 -1.087 1.00 0.00 H new ATOM 0 HG23 ILE A 128 118.805 8.887 -1.123 1.00 0.00 H new ATOM 0 HD11 ILE A 128 120.357 7.238 2.518 1.00 0.00 H new ATOM 0 HD12 ILE A 128 118.591 7.042 2.624 1.00 0.00 H new ATOM 0 HD13 ILE A 128 119.430 6.736 1.085 1.00 0.00 H new ATOM 2146 N LEU A 129 116.012 11.345 2.381 1.00 0.00 N ATOM 2147 CA LEU A 129 115.653 12.002 3.675 1.00 0.00 C ATOM 2148 C LEU A 129 115.008 10.982 4.616 1.00 0.00 C ATOM 2149 O LEU A 129 114.051 10.323 4.252 1.00 0.00 O ATOM 2150 CB LEU A 129 114.655 13.098 3.295 1.00 0.00 C ATOM 2151 CG LEU A 129 114.400 14.014 4.499 1.00 0.00 C ATOM 2152 CD1 LEU A 129 113.963 15.397 4.009 1.00 0.00 C ATOM 2153 CD2 LEU A 129 113.296 13.417 5.378 1.00 0.00 C ATOM 0 H LEU A 129 115.213 11.088 1.801 1.00 0.00 H new ATOM 0 HA LEU A 129 116.521 12.408 4.195 1.00 0.00 H new ATOM 0 HB2 LEU A 129 115.043 13.681 2.460 1.00 0.00 H new ATOM 0 HB3 LEU A 129 113.718 12.650 2.963 1.00 0.00 H new ATOM 0 HG LEU A 129 115.318 14.105 5.080 1.00 0.00 H new ATOM 0 HD11 LEU A 129 113.782 16.046 4.866 1.00 0.00 H new ATOM 0 HD12 LEU A 129 114.748 15.827 3.387 1.00 0.00 H new ATOM 0 HD13 LEU A 129 113.047 15.304 3.425 1.00 0.00 H new ATOM 0 HD21 LEU A 129 113.118 14.070 6.232 1.00 0.00 H new ATOM 0 HD22 LEU A 129 112.379 13.322 4.796 1.00 0.00 H new ATOM 0 HD23 LEU A 129 113.605 12.433 5.732 1.00 0.00 H new ATOM 2165 N ILE A 130 115.530 10.860 5.815 1.00 0.00 N ATOM 2166 CA ILE A 130 115.017 9.843 6.787 1.00 0.00 C ATOM 2167 C ILE A 130 114.401 10.569 7.991 1.00 0.00 C ATOM 2168 O ILE A 130 115.003 11.477 8.537 1.00 0.00 O ATOM 2169 CB ILE A 130 116.240 9.005 7.209 1.00 0.00 C ATOM 2170 CG1 ILE A 130 116.900 8.341 5.989 1.00 0.00 C ATOM 2171 CG2 ILE A 130 115.815 7.900 8.183 1.00 0.00 C ATOM 2172 CD1 ILE A 130 118.360 8.021 6.315 1.00 0.00 C ATOM 0 H ILE A 130 116.300 11.430 6.165 1.00 0.00 H new ATOM 0 HA ILE A 130 114.245 9.204 6.357 1.00 0.00 H new ATOM 0 HB ILE A 130 116.950 9.679 7.687 1.00 0.00 H new ATOM 0 HG12 ILE A 130 116.366 7.428 5.724 1.00 0.00 H new ATOM 0 HG13 ILE A 130 116.845 9.004 5.126 1.00 0.00 H new ATOM 0 HG21 ILE A 130 116.688 7.315 8.473 1.00 0.00 H new ATOM 0 HG22 ILE A 130 115.368 8.349 9.070 1.00 0.00 H new ATOM 0 HG23 ILE A 130 115.087 7.249 7.699 1.00 0.00 H new ATOM 0 HD11 ILE A 130 118.831 7.550 5.452 1.00 0.00 H new ATOM 0 HD12 ILE A 130 118.889 8.942 6.559 1.00 0.00 H new ATOM 0 HD13 ILE A 130 118.402 7.342 7.167 1.00 0.00 H new ATOM 2184 N LYS A 131 113.215 10.167 8.393 1.00 0.00 N ATOM 2185 CA LYS A 131 112.540 10.803 9.567 1.00 0.00 C ATOM 2186 C LYS A 131 112.892 10.047 10.851 1.00 0.00 C ATOM 2187 O LYS A 131 113.046 8.838 10.834 1.00 0.00 O ATOM 2188 CB LYS A 131 111.038 10.705 9.281 1.00 0.00 C ATOM 2189 CG LYS A 131 110.686 11.587 8.081 1.00 0.00 C ATOM 2190 CD LYS A 131 109.170 11.575 7.867 1.00 0.00 C ATOM 2191 CE LYS A 131 108.828 12.355 6.597 1.00 0.00 C ATOM 2192 NZ LYS A 131 108.807 13.784 7.016 1.00 0.00 N ATOM 0 H LYS A 131 112.683 9.417 7.951 1.00 0.00 H new ATOM 0 HA LYS A 131 112.855 11.837 9.707 1.00 0.00 H new ATOM 0 HB2 LYS A 131 110.763 9.670 9.078 1.00 0.00 H new ATOM 0 HB3 LYS A 131 110.469 11.020 10.156 1.00 0.00 H new ATOM 0 HG2 LYS A 131 111.032 12.606 8.251 1.00 0.00 H new ATOM 0 HG3 LYS A 131 111.193 11.223 7.187 1.00 0.00 H new ATOM 0 HD2 LYS A 131 108.812 10.549 7.784 1.00 0.00 H new ATOM 0 HD3 LYS A 131 108.667 12.019 8.726 1.00 0.00 H new ATOM 0 HE2 LYS A 131 109.570 12.183 5.817 1.00 0.00 H new ATOM 0 HE3 LYS A 131 107.863 12.048 6.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 108.480 14.373 6.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 108.161 13.900 7.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 109.765 14.078 7.294 1.00 0.00 H new ATOM 2206 N GLY A 132 113.016 10.756 11.950 1.00 0.00 N ATOM 2207 CA GLY A 132 113.370 10.113 13.252 1.00 0.00 C ATOM 2208 C GLY A 132 112.902 11.002 14.407 1.00 0.00 C ATOM 2209 O GLY A 132 112.197 11.972 14.194 1.00 0.00 O ATOM 0 H GLY A 132 112.885 11.766 11.997 1.00 0.00 H new ATOM 0 HA2 GLY A 132 112.903 9.131 13.323 1.00 0.00 H new ATOM 0 HA3 GLY A 132 114.447 9.958 13.312 1.00 0.00 H new ATOM 2213 N ASP A 133 113.295 10.671 15.617 1.00 0.00 N ATOM 2214 CA ASP A 133 112.889 11.475 16.812 1.00 0.00 C ATOM 2215 C ASP A 133 114.063 11.607 17.792 1.00 0.00 C ATOM 2216 O ASP A 133 115.119 11.041 17.571 1.00 0.00 O ATOM 2217 CB ASP A 133 111.706 10.724 17.447 1.00 0.00 C ATOM 2218 CG ASP A 133 112.093 9.293 17.849 1.00 0.00 C ATOM 2219 OD1 ASP A 133 112.474 8.535 16.973 1.00 0.00 O ATOM 2220 OD2 ASP A 133 112.000 8.983 19.026 1.00 0.00 O ATOM 0 H ASP A 133 113.887 9.867 15.827 1.00 0.00 H new ATOM 0 HA ASP A 133 112.600 12.490 16.539 1.00 0.00 H new ATOM 0 HB2 ASP A 133 111.359 11.268 18.326 1.00 0.00 H new ATOM 0 HB3 ASP A 133 110.875 10.692 16.743 1.00 0.00 H new ATOM 2225 N LYS A 134 113.871 12.347 18.860 1.00 0.00 N ATOM 2226 CA LYS A 134 114.956 12.542 19.872 1.00 0.00 C ATOM 2227 C LYS A 134 114.785 11.552 21.028 1.00 0.00 C ATOM 2228 O LYS A 134 113.698 11.404 21.558 1.00 0.00 O ATOM 2229 CB LYS A 134 114.790 13.981 20.367 1.00 0.00 C ATOM 2230 CG LYS A 134 115.997 14.371 21.223 1.00 0.00 C ATOM 2231 CD LYS A 134 117.205 14.623 20.318 1.00 0.00 C ATOM 2232 CE LYS A 134 118.387 15.100 21.165 1.00 0.00 C ATOM 2233 NZ LYS A 134 119.503 15.287 20.197 1.00 0.00 N ATOM 0 H LYS A 134 112.998 12.829 19.074 1.00 0.00 H new ATOM 0 HA LYS A 134 115.947 12.371 19.451 1.00 0.00 H new ATOM 0 HB2 LYS A 134 114.698 14.660 19.519 1.00 0.00 H new ATOM 0 HB3 LYS A 134 113.873 14.073 20.950 1.00 0.00 H new ATOM 0 HG2 LYS A 134 115.771 15.266 21.803 1.00 0.00 H new ATOM 0 HG3 LYS A 134 116.222 13.578 21.936 1.00 0.00 H new ATOM 0 HD2 LYS A 134 117.471 13.710 19.786 1.00 0.00 H new ATOM 0 HD3 LYS A 134 116.959 15.371 19.565 1.00 0.00 H new ATOM 0 HE2 LYS A 134 118.152 16.031 21.682 1.00 0.00 H new ATOM 0 HE3 LYS A 134 118.646 14.368 21.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 120.351 15.614 20.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 119.709 14.383 19.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 119.230 15.995 19.485 1.00 0.00 H new ATOM 2247 N ASP A 135 115.852 10.884 21.410 1.00 0.00 N ATOM 2248 CA ASP A 135 115.777 9.884 22.528 1.00 0.00 C ATOM 2249 C ASP A 135 115.502 10.596 23.856 1.00 0.00 C ATOM 2250 O ASP A 135 114.789 10.080 24.698 1.00 0.00 O ATOM 2251 CB ASP A 135 117.140 9.185 22.576 1.00 0.00 C ATOM 2252 CG ASP A 135 117.355 8.386 21.289 1.00 0.00 C ATOM 2253 OD1 ASP A 135 116.428 7.714 20.868 1.00 0.00 O ATOM 2254 OD2 ASP A 135 118.445 8.459 20.744 1.00 0.00 O ATOM 0 H ASP A 135 116.777 10.990 20.993 1.00 0.00 H new ATOM 0 HA ASP A 135 114.971 9.168 22.365 1.00 0.00 H new ATOM 0 HB2 ASP A 135 117.934 9.923 22.695 1.00 0.00 H new ATOM 0 HB3 ASP A 135 117.189 8.522 23.440 1.00 0.00 H new ATOM 2259 N GLU A 136 116.063 11.771 24.035 1.00 0.00 N ATOM 2260 CA GLU A 136 115.855 12.548 25.296 1.00 0.00 C ATOM 2261 C GLU A 136 115.349 13.956 24.972 1.00 0.00 C ATOM 2262 O GLU A 136 114.206 14.240 25.290 1.00 0.00 O ATOM 2263 CB GLU A 136 117.234 12.612 25.954 1.00 0.00 C ATOM 2264 CG GLU A 136 117.644 11.215 26.424 1.00 0.00 C ATOM 2265 CD GLU A 136 118.971 11.292 27.185 1.00 0.00 C ATOM 2266 OE1 GLU A 136 119.861 11.987 26.720 1.00 0.00 O ATOM 2267 OE2 GLU A 136 119.075 10.655 28.219 1.00 0.00 O ATOM 2268 OXT GLU A 136 116.113 14.725 24.412 1.00 0.00 O ATOM 0 H GLU A 136 116.664 12.228 23.349 1.00 0.00 H new ATOM 0 HA GLU A 136 115.113 12.086 25.948 1.00 0.00 H new ATOM 0 HB2 GLU A 136 117.968 12.999 25.247 1.00 0.00 H new ATOM 0 HB3 GLU A 136 117.213 13.300 26.800 1.00 0.00 H new ATOM 0 HG2 GLU A 136 116.870 10.796 27.066 1.00 0.00 H new ATOM 0 HG3 GLU A 136 117.744 10.548 25.568 1.00 0.00 H new TER 2275 GLU A 136