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 81 LYS NZ :NH3+ 150:sc= 1.06 (180deg=0.286) USER MOD Set 1.2: A 131 LYS NZ :NH3+ -126:sc= 0 (180deg=-0.0886) USER MOD Set 2.1: A 55 ASN : amide:sc= 0.124 K(o=0.31,f=-1.7!) USER MOD Set 2.2: A 59 TYR OH : rot -44:sc= 0.228 USER MOD Set 2.3: A 76 LYS NZ :NH3+ -144:sc= -0.0411 (180deg=-0.0108) USER MOD Set 3.1: A 43 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 45 ASN : amide:sc= -1.54 K(o=-1.5,f=-2.3!) USER MOD Single : A 1 MET CE :methyl -157:sc= -0.159 (180deg=-1.09) USER MOD Single : A 1 MET N :NH3+ -127:sc= 0.0464 (180deg=-0.28) USER MOD Single : A 3 LYS NZ :NH3+ -115:sc= 0 (180deg=-0.0991) USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 150:sc= -0.897 USER MOD Single : A 23 SER OG : rot 180:sc= -0.582 USER MOD Single : A 27 TYR OH : rot 95:sc= 0.726 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0126) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 174:sc= -0.806 (180deg=-0.951) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -76:sc= -1.38 USER MOD Single : A 68 ASN : amide:sc= -2.62 K(o=-2.6,f=-7!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= -0.0399 X(o=-0.04,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ -117:sc= 0.251 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ -103:sc= 0.0315 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HD1:sc= -4.05 K(o=-4.1,f=-5.2!) USER MOD Single : A 102 SER OG : rot 98:sc= 1.09 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 112 MET CE :methyl -169:sc= -0.592 (180deg=-0.73) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 GLN : amide:sc= -0.0312 X(o=-0.031,f=-0.22) USER MOD Single : A 119 ASN : amide:sc= -0.0455 X(o=-0.045,f=0) USER MOD Single : A 121 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0136) USER MOD Single : A 127 LYS NZ :NH3+ -139:sc= 0 (180deg=-0.0585) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 109.069 22.118 16.065 1.00 0.00 N ATOM 2 CA MET A 1 109.914 21.732 14.898 1.00 0.00 C ATOM 3 C MET A 1 110.459 20.313 15.087 1.00 0.00 C ATOM 4 O MET A 1 110.462 19.794 16.188 1.00 0.00 O ATOM 5 CB MET A 1 111.060 22.747 14.876 1.00 0.00 C ATOM 6 CG MET A 1 110.527 24.117 14.453 1.00 0.00 C ATOM 7 SD MET A 1 111.917 25.234 14.138 1.00 0.00 S ATOM 8 CE MET A 1 112.590 25.242 15.818 1.00 0.00 C ATOM 0 H1 MET A 1 108.140 22.443 15.729 1.00 0.00 H new ATOM 0 H2 MET A 1 108.943 21.296 16.689 1.00 0.00 H new ATOM 0 H3 MET A 1 109.534 22.884 16.592 1.00 0.00 H new ATOM 0 HA MET A 1 109.351 21.737 13.965 1.00 0.00 H new ATOM 0 HB2 MET A 1 111.519 22.813 15.862 1.00 0.00 H new ATOM 0 HB3 MET A 1 111.836 22.419 14.185 1.00 0.00 H new ATOM 0 HG2 MET A 1 109.914 24.020 13.557 1.00 0.00 H new ATOM 0 HG3 MET A 1 109.887 24.527 15.234 1.00 0.00 H new ATOM 0 HE1 MET A 1 113.180 26.146 15.969 1.00 0.00 H new ATOM 0 HE2 MET A 1 111.772 25.218 16.538 1.00 0.00 H new ATOM 0 HE3 MET A 1 113.224 24.367 15.960 1.00 0.00 H new ATOM 20 N VAL A 2 110.913 19.698 14.018 1.00 0.00 N ATOM 21 CA VAL A 2 111.472 18.309 14.097 1.00 0.00 C ATOM 22 C VAL A 2 112.853 18.255 13.432 1.00 0.00 C ATOM 23 O VAL A 2 113.155 19.060 12.569 1.00 0.00 O ATOM 24 CB VAL A 2 110.471 17.391 13.374 1.00 0.00 C ATOM 25 CG1 VAL A 2 109.134 17.401 14.119 1.00 0.00 C ATOM 26 CG2 VAL A 2 110.238 17.843 11.925 1.00 0.00 C ATOM 0 H VAL A 2 110.920 20.105 13.083 1.00 0.00 H new ATOM 0 HA VAL A 2 111.605 17.990 15.131 1.00 0.00 H new ATOM 0 HB VAL A 2 110.891 16.385 13.359 1.00 0.00 H new ATOM 0 HG11 VAL A 2 108.426 16.750 13.605 1.00 0.00 H new ATOM 0 HG12 VAL A 2 109.283 17.043 15.138 1.00 0.00 H new ATOM 0 HG13 VAL A 2 108.740 18.417 14.145 1.00 0.00 H new ATOM 0 HG21 VAL A 2 109.526 17.172 11.445 1.00 0.00 H new ATOM 0 HG22 VAL A 2 109.841 18.858 11.920 1.00 0.00 H new ATOM 0 HG23 VAL A 2 111.182 17.820 11.380 1.00 0.00 H new ATOM 36 N LYS A 3 113.675 17.312 13.832 1.00 0.00 N ATOM 37 CA LYS A 3 115.045 17.178 13.248 1.00 0.00 C ATOM 38 C LYS A 3 115.080 16.029 12.236 1.00 0.00 C ATOM 39 O LYS A 3 114.773 14.898 12.573 1.00 0.00 O ATOM 40 CB LYS A 3 115.957 16.871 14.438 1.00 0.00 C ATOM 41 CG LYS A 3 116.036 18.096 15.353 1.00 0.00 C ATOM 42 CD LYS A 3 117.027 17.825 16.487 1.00 0.00 C ATOM 43 CE LYS A 3 117.014 18.997 17.470 1.00 0.00 C ATOM 44 NZ LYS A 3 117.843 20.051 16.823 1.00 0.00 N ATOM 0 H LYS A 3 113.449 16.622 14.548 1.00 0.00 H new ATOM 0 HA LYS A 3 115.356 18.078 12.718 1.00 0.00 H new ATOM 0 HB2 LYS A 3 115.573 16.015 14.992 1.00 0.00 H new ATOM 0 HB3 LYS A 3 116.953 16.602 14.086 1.00 0.00 H new ATOM 0 HG2 LYS A 3 116.351 18.970 14.782 1.00 0.00 H new ATOM 0 HG3 LYS A 3 115.051 18.321 15.763 1.00 0.00 H new ATOM 0 HD2 LYS A 3 116.762 16.902 17.002 1.00 0.00 H new ATOM 0 HD3 LYS A 3 118.030 17.688 16.082 1.00 0.00 H new ATOM 0 HE2 LYS A 3 115.998 19.349 17.651 1.00 0.00 H new ATOM 0 HE3 LYS A 3 117.428 18.707 18.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 118.696 20.221 17.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 118.121 19.739 15.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 117.293 20.931 16.752 1.00 0.00 H new ATOM 58 N LEU A 4 115.450 16.321 11.010 1.00 0.00 N ATOM 59 CA LEU A 4 115.531 15.267 9.951 1.00 0.00 C ATOM 60 C LEU A 4 116.992 15.014 9.569 1.00 0.00 C ATOM 61 O LEU A 4 117.812 15.912 9.639 1.00 0.00 O ATOM 62 CB LEU A 4 114.761 15.835 8.755 1.00 0.00 C ATOM 63 CG LEU A 4 113.279 15.980 9.107 1.00 0.00 C ATOM 64 CD1 LEU A 4 112.576 16.804 8.026 1.00 0.00 C ATOM 65 CD2 LEU A 4 112.634 14.594 9.186 1.00 0.00 C ATOM 0 H LEU A 4 115.702 17.258 10.696 1.00 0.00 H new ATOM 0 HA LEU A 4 115.116 14.317 10.288 1.00 0.00 H new ATOM 0 HB2 LEU A 4 115.173 16.804 8.474 1.00 0.00 H new ATOM 0 HB3 LEU A 4 114.876 15.178 7.893 1.00 0.00 H new ATOM 0 HG LEU A 4 113.183 16.482 10.070 1.00 0.00 H new ATOM 0 HD11 LEU A 4 111.520 16.907 8.276 1.00 0.00 H new ATOM 0 HD12 LEU A 4 113.033 17.792 7.966 1.00 0.00 H new ATOM 0 HD13 LEU A 4 112.673 16.301 7.064 1.00 0.00 H new ATOM 0 HD21 LEU A 4 111.578 14.698 9.437 1.00 0.00 H new ATOM 0 HD22 LEU A 4 112.731 14.092 8.223 1.00 0.00 H new ATOM 0 HD23 LEU A 4 113.133 14.004 9.954 1.00 0.00 H new ATOM 77 N MET A 5 117.307 13.802 9.172 1.00 0.00 N ATOM 78 CA MET A 5 118.705 13.460 8.765 1.00 0.00 C ATOM 79 C MET A 5 118.776 13.273 7.247 1.00 0.00 C ATOM 80 O MET A 5 117.850 12.760 6.647 1.00 0.00 O ATOM 81 CB MET A 5 119.019 12.145 9.477 1.00 0.00 C ATOM 82 CG MET A 5 120.526 11.889 9.435 1.00 0.00 C ATOM 83 SD MET A 5 120.887 10.279 10.182 1.00 0.00 S ATOM 84 CE MET A 5 122.691 10.385 10.086 1.00 0.00 C ATOM 0 H MET A 5 116.645 13.028 9.113 1.00 0.00 H new ATOM 0 HA MET A 5 119.415 14.244 9.028 1.00 0.00 H new ATOM 0 HB2 MET A 5 118.675 12.188 10.511 1.00 0.00 H new ATOM 0 HB3 MET A 5 118.486 11.324 8.998 1.00 0.00 H new ATOM 0 HG2 MET A 5 120.881 11.911 8.405 1.00 0.00 H new ATOM 0 HG3 MET A 5 121.055 12.677 9.971 1.00 0.00 H new ATOM 0 HE1 MET A 5 123.131 9.478 10.501 1.00 0.00 H new ATOM 0 HE2 MET A 5 122.994 10.492 9.045 1.00 0.00 H new ATOM 0 HE3 MET A 5 123.036 11.249 10.655 1.00 0.00 H new ATOM 94 N ILE A 6 119.865 13.685 6.640 1.00 0.00 N ATOM 95 CA ILE A 6 120.009 13.585 5.151 1.00 0.00 C ATOM 96 C ILE A 6 121.306 12.835 4.819 1.00 0.00 C ATOM 97 O ILE A 6 122.360 13.163 5.336 1.00 0.00 O ATOM 98 CB ILE A 6 120.057 15.038 4.633 1.00 0.00 C ATOM 99 CG1 ILE A 6 118.805 15.837 5.059 1.00 0.00 C ATOM 100 CG2 ILE A 6 120.175 15.062 3.100 1.00 0.00 C ATOM 101 CD1 ILE A 6 117.509 15.198 4.539 1.00 0.00 C ATOM 0 H ILE A 6 120.669 14.091 7.119 1.00 0.00 H new ATOM 0 HA ILE A 6 119.188 13.038 4.687 1.00 0.00 H new ATOM 0 HB ILE A 6 120.935 15.508 5.076 1.00 0.00 H new ATOM 0 HG12 ILE A 6 118.767 15.899 6.147 1.00 0.00 H new ATOM 0 HG13 ILE A 6 118.882 16.858 4.684 1.00 0.00 H new ATOM 0 HG21 ILE A 6 120.207 16.095 2.754 1.00 0.00 H new ATOM 0 HG22 ILE A 6 121.088 14.549 2.797 1.00 0.00 H new ATOM 0 HG23 ILE A 6 119.313 14.559 2.661 1.00 0.00 H new ATOM 0 HD11 ILE A 6 116.655 15.793 4.862 1.00 0.00 H new ATOM 0 HD12 ILE A 6 117.533 15.160 3.450 1.00 0.00 H new ATOM 0 HD13 ILE A 6 117.418 14.187 4.935 1.00 0.00 H new ATOM 113 N ILE A 7 121.220 11.840 3.966 1.00 0.00 N ATOM 114 CA ILE A 7 122.444 11.106 3.505 1.00 0.00 C ATOM 115 C ILE A 7 122.428 11.032 1.972 1.00 0.00 C ATOM 116 O ILE A 7 121.372 10.997 1.367 1.00 0.00 O ATOM 117 CB ILE A 7 122.371 9.702 4.141 1.00 0.00 C ATOM 118 CG1 ILE A 7 122.334 9.812 5.673 1.00 0.00 C ATOM 119 CG2 ILE A 7 123.606 8.878 3.750 1.00 0.00 C ATOM 120 CD1 ILE A 7 121.928 8.467 6.279 1.00 0.00 C ATOM 0 H ILE A 7 120.345 11.502 3.566 1.00 0.00 H new ATOM 0 HA ILE A 7 123.369 11.602 3.800 1.00 0.00 H new ATOM 0 HB ILE A 7 121.465 9.215 3.780 1.00 0.00 H new ATOM 0 HG12 ILE A 7 123.313 10.110 6.049 1.00 0.00 H new ATOM 0 HG13 ILE A 7 121.627 10.585 5.974 1.00 0.00 H new ATOM 0 HG21 ILE A 7 123.543 7.889 4.205 1.00 0.00 H new ATOM 0 HG22 ILE A 7 123.647 8.776 2.666 1.00 0.00 H new ATOM 0 HG23 ILE A 7 124.506 9.382 4.102 1.00 0.00 H new ATOM 0 HD11 ILE A 7 121.903 8.550 7.366 1.00 0.00 H new ATOM 0 HD12 ILE A 7 120.940 8.187 5.914 1.00 0.00 H new ATOM 0 HD13 ILE A 7 122.651 7.705 5.990 1.00 0.00 H new ATOM 132 N GLU A 8 123.590 11.010 1.358 1.00 0.00 N ATOM 133 CA GLU A 8 123.677 10.971 -0.135 1.00 0.00 C ATOM 134 C GLU A 8 124.071 9.568 -0.610 1.00 0.00 C ATOM 135 O GLU A 8 124.864 8.900 0.028 1.00 0.00 O ATOM 136 CB GLU A 8 124.767 11.983 -0.498 1.00 0.00 C ATOM 137 CG GLU A 8 124.288 13.398 -0.164 1.00 0.00 C ATOM 138 CD GLU A 8 125.343 14.416 -0.604 1.00 0.00 C ATOM 139 OE1 GLU A 8 125.854 14.276 -1.702 1.00 0.00 O ATOM 140 OE2 GLU A 8 125.621 15.320 0.166 1.00 0.00 O ATOM 0 H GLU A 8 124.491 11.018 1.836 1.00 0.00 H new ATOM 0 HA GLU A 8 122.724 11.210 -0.607 1.00 0.00 H new ATOM 0 HB2 GLU A 8 125.682 11.759 0.051 1.00 0.00 H new ATOM 0 HB3 GLU A 8 125.006 11.910 -1.559 1.00 0.00 H new ATOM 0 HG2 GLU A 8 123.342 13.600 -0.666 1.00 0.00 H new ATOM 0 HG3 GLU A 8 124.106 13.488 0.907 1.00 0.00 H new ATOM 147 N GLY A 9 123.517 9.134 -1.720 1.00 0.00 N ATOM 148 CA GLY A 9 123.866 7.796 -2.291 1.00 0.00 C ATOM 149 C GLY A 9 124.059 7.920 -3.805 1.00 0.00 C ATOM 150 O GLY A 9 123.455 8.772 -4.434 1.00 0.00 O ATOM 0 H GLY A 9 122.829 9.659 -2.260 1.00 0.00 H new ATOM 0 HA2 GLY A 9 124.777 7.418 -1.828 1.00 0.00 H new ATOM 0 HA3 GLY A 9 123.075 7.078 -2.072 1.00 0.00 H new ATOM 154 N GLU A 10 124.890 7.077 -4.377 1.00 0.00 N ATOM 155 CA GLU A 10 125.155 7.132 -5.848 1.00 0.00 C ATOM 156 C GLU A 10 124.447 5.974 -6.557 1.00 0.00 C ATOM 157 O GLU A 10 124.381 4.877 -6.033 1.00 0.00 O ATOM 158 CB GLU A 10 126.673 7.001 -5.992 1.00 0.00 C ATOM 159 CG GLU A 10 127.076 7.302 -7.437 1.00 0.00 C ATOM 160 CD GLU A 10 128.574 7.042 -7.617 1.00 0.00 C ATOM 161 OE1 GLU A 10 129.040 6.017 -7.146 1.00 0.00 O ATOM 162 OE2 GLU A 10 129.230 7.873 -8.223 1.00 0.00 O ATOM 0 H GLU A 10 125.400 6.347 -3.879 1.00 0.00 H new ATOM 0 HA GLU A 10 124.785 8.054 -6.296 1.00 0.00 H new ATOM 0 HB2 GLU A 10 127.174 7.690 -5.312 1.00 0.00 H new ATOM 0 HB3 GLU A 10 126.990 5.995 -5.717 1.00 0.00 H new ATOM 0 HG2 GLU A 10 126.503 6.677 -8.123 1.00 0.00 H new ATOM 0 HG3 GLU A 10 126.845 8.339 -7.681 1.00 0.00 H new ATOM 169 N VAL A 11 123.927 6.221 -7.740 1.00 0.00 N ATOM 170 CA VAL A 11 123.209 5.155 -8.522 1.00 0.00 C ATOM 171 C VAL A 11 124.201 4.043 -8.900 1.00 0.00 C ATOM 172 O VAL A 11 125.202 4.307 -9.540 1.00 0.00 O ATOM 173 CB VAL A 11 122.652 5.838 -9.793 1.00 0.00 C ATOM 174 CG1 VAL A 11 121.870 4.833 -10.648 1.00 0.00 C ATOM 175 CG2 VAL A 11 121.708 6.993 -9.422 1.00 0.00 C ATOM 0 H VAL A 11 123.970 7.128 -8.204 1.00 0.00 H new ATOM 0 HA VAL A 11 122.403 4.704 -7.943 1.00 0.00 H new ATOM 0 HB VAL A 11 123.502 6.223 -10.356 1.00 0.00 H new ATOM 0 HG11 VAL A 11 121.486 5.333 -11.537 1.00 0.00 H new ATOM 0 HG12 VAL A 11 122.530 4.018 -10.946 1.00 0.00 H new ATOM 0 HG13 VAL A 11 121.038 4.433 -10.069 1.00 0.00 H new ATOM 0 HG21 VAL A 11 121.328 7.459 -10.331 1.00 0.00 H new ATOM 0 HG22 VAL A 11 120.874 6.607 -8.836 1.00 0.00 H new ATOM 0 HG23 VAL A 11 122.252 7.733 -8.835 1.00 0.00 H new ATOM 185 N VAL A 12 123.918 2.823 -8.508 1.00 0.00 N ATOM 186 CA VAL A 12 124.793 1.664 -8.878 1.00 0.00 C ATOM 187 C VAL A 12 123.958 0.561 -9.540 1.00 0.00 C ATOM 188 O VAL A 12 122.745 0.558 -9.430 1.00 0.00 O ATOM 189 CB VAL A 12 125.438 1.165 -7.573 1.00 0.00 C ATOM 190 CG1 VAL A 12 126.335 2.261 -6.991 1.00 0.00 C ATOM 191 CG2 VAL A 12 124.375 0.784 -6.531 1.00 0.00 C ATOM 0 H VAL A 12 123.107 2.578 -7.940 1.00 0.00 H new ATOM 0 HA VAL A 12 125.560 1.956 -9.595 1.00 0.00 H new ATOM 0 HB VAL A 12 126.026 0.278 -7.808 1.00 0.00 H new ATOM 0 HG11 VAL A 12 126.791 1.906 -6.067 1.00 0.00 H new ATOM 0 HG12 VAL A 12 127.117 2.511 -7.709 1.00 0.00 H new ATOM 0 HG13 VAL A 12 125.737 3.148 -6.783 1.00 0.00 H new ATOM 0 HG21 VAL A 12 124.865 0.436 -5.622 1.00 0.00 H new ATOM 0 HG22 VAL A 12 123.762 1.655 -6.302 1.00 0.00 H new ATOM 0 HG23 VAL A 12 123.743 -0.010 -6.929 1.00 0.00 H new ATOM 201 N SER A 13 124.606 -0.361 -10.216 1.00 0.00 N ATOM 202 CA SER A 13 123.872 -1.467 -10.911 1.00 0.00 C ATOM 203 C SER A 13 123.599 -2.615 -9.935 1.00 0.00 C ATOM 204 O SER A 13 124.517 -3.167 -9.355 1.00 0.00 O ATOM 205 CB SER A 13 124.795 -1.936 -12.039 1.00 0.00 C ATOM 206 OG SER A 13 124.119 -2.908 -12.825 1.00 0.00 O ATOM 0 H SER A 13 125.621 -0.394 -10.316 1.00 0.00 H new ATOM 0 HA SER A 13 122.908 -1.132 -11.295 1.00 0.00 H new ATOM 0 HB2 SER A 13 125.089 -1.090 -12.660 1.00 0.00 H new ATOM 0 HB3 SER A 13 125.710 -2.359 -11.624 1.00 0.00 H new ATOM 0 HG SER A 13 124.706 -3.209 -13.549 1.00 0.00 H new ATOM 212 N GLY A 14 122.344 -2.966 -9.758 1.00 0.00 N ATOM 213 CA GLY A 14 121.972 -4.083 -8.837 1.00 0.00 C ATOM 214 C GLY A 14 120.492 -4.425 -9.020 1.00 0.00 C ATOM 215 O GLY A 14 119.638 -3.566 -8.888 1.00 0.00 O ATOM 0 H GLY A 14 121.554 -2.517 -10.221 1.00 0.00 H new ATOM 0 HA2 GLY A 14 122.587 -4.959 -9.044 1.00 0.00 H new ATOM 0 HA3 GLY A 14 122.165 -3.795 -7.803 1.00 0.00 H new ATOM 219 N LEU A 15 120.196 -5.670 -9.321 1.00 0.00 N ATOM 220 CA LEU A 15 118.779 -6.101 -9.527 1.00 0.00 C ATOM 221 C LEU A 15 118.632 -7.600 -9.249 1.00 0.00 C ATOM 222 O LEU A 15 117.726 -8.012 -8.546 1.00 0.00 O ATOM 223 CB LEU A 15 118.482 -5.796 -10.996 1.00 0.00 C ATOM 224 CG LEU A 15 116.969 -5.790 -11.221 1.00 0.00 C ATOM 225 CD1 LEU A 15 116.642 -4.974 -12.473 1.00 0.00 C ATOM 226 CD2 LEU A 15 116.475 -7.227 -11.408 1.00 0.00 C ATOM 0 H LEU A 15 120.887 -6.412 -9.433 1.00 0.00 H new ATOM 0 HA LEU A 15 118.091 -5.587 -8.856 1.00 0.00 H new ATOM 0 HB2 LEU A 15 118.905 -4.830 -11.270 1.00 0.00 H new ATOM 0 HB3 LEU A 15 118.952 -6.543 -11.636 1.00 0.00 H new ATOM 0 HG LEU A 15 116.476 -5.344 -10.357 1.00 0.00 H new ATOM 0 HD11 LEU A 15 115.564 -4.970 -12.633 1.00 0.00 H new ATOM 0 HD12 LEU A 15 116.993 -3.951 -12.342 1.00 0.00 H new ATOM 0 HD13 LEU A 15 117.135 -5.419 -13.337 1.00 0.00 H new ATOM 0 HD21 LEU A 15 115.397 -7.223 -11.568 1.00 0.00 H new ATOM 0 HD22 LEU A 15 116.969 -7.672 -12.272 1.00 0.00 H new ATOM 0 HD23 LEU A 15 116.707 -7.810 -10.517 1.00 0.00 H new ATOM 238 N GLY A 16 119.517 -8.402 -9.797 1.00 0.00 N ATOM 239 CA GLY A 16 119.444 -9.884 -9.606 1.00 0.00 C ATOM 240 C GLY A 16 120.457 -10.321 -8.544 1.00 0.00 C ATOM 241 O GLY A 16 121.044 -11.383 -8.652 1.00 0.00 O ATOM 0 H GLY A 16 120.296 -8.086 -10.375 1.00 0.00 H new ATOM 0 HA2 GLY A 16 118.438 -10.171 -9.302 1.00 0.00 H new ATOM 0 HA3 GLY A 16 119.649 -10.392 -10.548 1.00 0.00 H new ATOM 245 N GLU A 17 120.657 -9.507 -7.531 1.00 0.00 N ATOM 246 CA GLU A 17 121.617 -9.863 -6.433 1.00 0.00 C ATOM 247 C GLU A 17 121.053 -11.017 -5.598 1.00 0.00 C ATOM 248 O GLU A 17 121.795 -11.862 -5.130 1.00 0.00 O ATOM 249 CB GLU A 17 121.772 -8.605 -5.570 1.00 0.00 C ATOM 250 CG GLU A 17 122.917 -8.803 -4.575 1.00 0.00 C ATOM 251 CD GLU A 17 122.988 -7.600 -3.632 1.00 0.00 C ATOM 252 OE1 GLU A 17 123.247 -6.509 -4.113 1.00 0.00 O ATOM 253 OE2 GLU A 17 122.780 -7.790 -2.445 1.00 0.00 O ATOM 0 H GLU A 17 120.193 -8.606 -7.417 1.00 0.00 H new ATOM 0 HA GLU A 17 122.579 -10.186 -6.832 1.00 0.00 H new ATOM 0 HB2 GLU A 17 121.972 -7.740 -6.203 1.00 0.00 H new ATOM 0 HB3 GLU A 17 120.844 -8.401 -5.036 1.00 0.00 H new ATOM 0 HG2 GLU A 17 122.762 -9.718 -4.003 1.00 0.00 H new ATOM 0 HG3 GLU A 17 123.861 -8.917 -5.108 1.00 0.00 H new ATOM 260 N GLY A 18 119.751 -11.047 -5.417 1.00 0.00 N ATOM 261 CA GLY A 18 119.102 -12.125 -4.609 1.00 0.00 C ATOM 262 C GLY A 18 117.917 -12.704 -5.387 1.00 0.00 C ATOM 263 O GLY A 18 118.000 -12.890 -6.589 1.00 0.00 O ATOM 0 H GLY A 18 119.104 -10.359 -5.802 1.00 0.00 H new ATOM 0 HA2 GLY A 18 119.823 -12.911 -4.386 1.00 0.00 H new ATOM 0 HA3 GLY A 18 118.763 -11.724 -3.654 1.00 0.00 H new ATOM 267 N ARG A 19 116.831 -12.986 -4.706 1.00 0.00 N ATOM 268 CA ARG A 19 115.622 -13.561 -5.375 1.00 0.00 C ATOM 269 C ARG A 19 114.610 -12.454 -5.679 1.00 0.00 C ATOM 270 O ARG A 19 114.426 -11.549 -4.884 1.00 0.00 O ATOM 271 CB ARG A 19 115.042 -14.556 -4.367 1.00 0.00 C ATOM 272 CG ARG A 19 116.001 -15.738 -4.203 1.00 0.00 C ATOM 273 CD ARG A 19 115.380 -16.777 -3.265 1.00 0.00 C ATOM 274 NE ARG A 19 115.348 -16.119 -1.922 1.00 0.00 N ATOM 275 CZ ARG A 19 116.421 -15.982 -1.166 1.00 0.00 C ATOM 276 NH1 ARG A 19 117.609 -16.406 -1.530 1.00 0.00 N ATOM 277 NH2 ARG A 19 116.297 -15.397 -0.006 1.00 0.00 N ATOM 0 H ARG A 19 116.731 -12.840 -3.702 1.00 0.00 H new ATOM 0 HA ARG A 19 115.865 -14.040 -6.324 1.00 0.00 H new ATOM 0 HB2 ARG A 19 114.885 -14.066 -3.406 1.00 0.00 H new ATOM 0 HB3 ARG A 19 114.069 -14.909 -4.708 1.00 0.00 H new ATOM 0 HG2 ARG A 19 116.209 -16.188 -5.174 1.00 0.00 H new ATOM 0 HG3 ARG A 19 116.954 -15.393 -3.801 1.00 0.00 H new ATOM 0 HD2 ARG A 19 114.378 -17.055 -3.592 1.00 0.00 H new ATOM 0 HD3 ARG A 19 115.973 -17.692 -3.242 1.00 0.00 H new ATOM 0 HE ARG A 19 114.458 -15.761 -1.575 1.00 0.00 H new ATOM 0 HH11 ARG A 19 117.732 -16.865 -2.433 1.00 0.00 H new ATOM 0 HH12 ARG A 19 118.409 -16.277 -0.910 1.00 0.00 H new ATOM 0 HH21 ARG A 19 115.385 -15.057 0.299 1.00 0.00 H new ATOM 0 HH22 ARG A 19 117.112 -15.280 0.596 1.00 0.00 H new ATOM 291 N TYR A 20 113.964 -12.530 -6.821 1.00 0.00 N ATOM 292 CA TYR A 20 112.975 -11.482 -7.224 1.00 0.00 C ATOM 293 C TYR A 20 111.630 -12.127 -7.571 1.00 0.00 C ATOM 294 O TYR A 20 111.548 -12.936 -8.479 1.00 0.00 O ATOM 295 CB TYR A 20 113.589 -10.818 -8.457 1.00 0.00 C ATOM 296 CG TYR A 20 112.830 -9.600 -8.926 1.00 0.00 C ATOM 297 CD1 TYR A 20 113.104 -8.322 -8.349 1.00 0.00 C ATOM 298 CD2 TYR A 20 111.839 -9.724 -9.949 1.00 0.00 C ATOM 299 CE1 TYR A 20 112.387 -7.168 -8.792 1.00 0.00 C ATOM 300 CE2 TYR A 20 111.121 -8.571 -10.392 1.00 0.00 C ATOM 301 CZ TYR A 20 111.395 -7.292 -9.814 1.00 0.00 C ATOM 302 OH TYR A 20 110.702 -6.179 -10.243 1.00 0.00 O ATOM 0 H TYR A 20 114.083 -13.284 -7.498 1.00 0.00 H new ATOM 0 HA TYR A 20 112.783 -10.764 -6.427 1.00 0.00 H new ATOM 0 HB2 TYR A 20 114.616 -10.532 -8.232 1.00 0.00 H new ATOM 0 HB3 TYR A 20 113.631 -11.545 -9.268 1.00 0.00 H new ATOM 0 HD1 TYR A 20 113.854 -8.228 -7.577 1.00 0.00 H new ATOM 0 HD2 TYR A 20 111.633 -10.689 -10.387 1.00 0.00 H new ATOM 0 HE1 TYR A 20 112.594 -6.202 -8.355 1.00 0.00 H new ATOM 0 HE2 TYR A 20 110.371 -8.665 -11.164 1.00 0.00 H new ATOM 0 HH TYR A 20 110.452 -6.292 -11.184 1.00 0.00 H new ATOM 312 N PHE A 21 110.590 -11.768 -6.854 1.00 0.00 N ATOM 313 CA PHE A 21 109.230 -12.331 -7.119 1.00 0.00 C ATOM 314 C PHE A 21 108.153 -11.292 -6.783 1.00 0.00 C ATOM 315 O PHE A 21 107.072 -11.639 -6.340 1.00 0.00 O ATOM 316 CB PHE A 21 109.120 -13.547 -6.196 1.00 0.00 C ATOM 317 CG PHE A 21 109.982 -14.711 -6.622 1.00 0.00 C ATOM 318 CD1 PHE A 21 109.458 -15.699 -7.512 1.00 0.00 C ATOM 319 CD2 PHE A 21 111.321 -14.826 -6.137 1.00 0.00 C ATOM 320 CE1 PHE A 21 110.272 -16.801 -7.916 1.00 0.00 C ATOM 321 CE2 PHE A 21 112.137 -15.928 -6.541 1.00 0.00 C ATOM 322 CZ PHE A 21 111.612 -16.916 -7.431 1.00 0.00 C ATOM 0 H PHE A 21 110.629 -11.099 -6.085 1.00 0.00 H new ATOM 0 HA PHE A 21 109.088 -12.603 -8.165 1.00 0.00 H new ATOM 0 HB2 PHE A 21 109.398 -13.251 -5.185 1.00 0.00 H new ATOM 0 HB3 PHE A 21 108.080 -13.871 -6.158 1.00 0.00 H new ATOM 0 HD1 PHE A 21 108.446 -15.612 -7.879 1.00 0.00 H new ATOM 0 HD2 PHE A 21 111.717 -14.080 -5.464 1.00 0.00 H new ATOM 0 HE1 PHE A 21 109.875 -17.548 -8.588 1.00 0.00 H new ATOM 0 HE2 PHE A 21 113.149 -16.014 -6.174 1.00 0.00 H new ATOM 0 HZ PHE A 21 112.227 -17.749 -7.737 1.00 0.00 H new ATOM 332 N LEU A 22 108.448 -10.029 -6.997 1.00 0.00 N ATOM 333 CA LEU A 22 107.501 -8.929 -6.603 1.00 0.00 C ATOM 334 C LEU A 22 106.181 -9.031 -7.378 1.00 0.00 C ATOM 335 O LEU A 22 105.140 -8.649 -6.872 1.00 0.00 O ATOM 336 CB LEU A 22 108.204 -7.607 -6.938 1.00 0.00 C ATOM 337 CG LEU A 22 109.471 -7.458 -6.093 1.00 0.00 C ATOM 338 CD1 LEU A 22 110.302 -6.287 -6.622 1.00 0.00 C ATOM 339 CD2 LEU A 22 109.089 -7.188 -4.636 1.00 0.00 C ATOM 0 H LEU A 22 109.313 -9.709 -7.432 1.00 0.00 H new ATOM 0 HA LEU A 22 107.256 -8.998 -5.543 1.00 0.00 H new ATOM 0 HB2 LEU A 22 108.459 -7.579 -7.998 1.00 0.00 H new ATOM 0 HB3 LEU A 22 107.531 -6.770 -6.750 1.00 0.00 H new ATOM 0 HG LEU A 22 110.053 -8.378 -6.152 1.00 0.00 H new ATOM 0 HD11 LEU A 22 111.205 -6.180 -6.020 1.00 0.00 H new ATOM 0 HD12 LEU A 22 110.578 -6.476 -7.660 1.00 0.00 H new ATOM 0 HD13 LEU A 22 109.716 -5.370 -6.563 1.00 0.00 H new ATOM 0 HD21 LEU A 22 109.993 -7.082 -4.036 1.00 0.00 H new ATOM 0 HD22 LEU A 22 108.505 -6.269 -4.577 1.00 0.00 H new ATOM 0 HD23 LEU A 22 108.496 -8.020 -4.255 1.00 0.00 H new ATOM 351 N SER A 23 106.224 -9.539 -8.591 1.00 0.00 N ATOM 352 CA SER A 23 104.983 -9.643 -9.437 1.00 0.00 C ATOM 353 C SER A 23 103.920 -10.534 -8.776 1.00 0.00 C ATOM 354 O SER A 23 102.739 -10.363 -9.027 1.00 0.00 O ATOM 355 CB SER A 23 105.421 -10.256 -10.770 1.00 0.00 C ATOM 356 OG SER A 23 105.822 -11.603 -10.558 1.00 0.00 O ATOM 0 H SER A 23 107.072 -9.889 -9.036 1.00 0.00 H new ATOM 0 HA SER A 23 104.531 -8.660 -9.568 1.00 0.00 H new ATOM 0 HB2 SER A 23 104.602 -10.217 -11.488 1.00 0.00 H new ATOM 0 HB3 SER A 23 106.245 -9.682 -11.194 1.00 0.00 H new ATOM 0 HG SER A 23 106.101 -11.999 -11.410 1.00 0.00 H new ATOM 362 N LEU A 24 104.330 -11.469 -7.947 1.00 0.00 N ATOM 363 CA LEU A 24 103.352 -12.400 -7.287 1.00 0.00 C ATOM 364 C LEU A 24 102.429 -11.623 -6.331 1.00 0.00 C ATOM 365 O LEU A 24 102.805 -10.558 -5.878 1.00 0.00 O ATOM 366 CB LEU A 24 104.188 -13.422 -6.507 1.00 0.00 C ATOM 367 CG LEU A 24 104.639 -14.541 -7.447 1.00 0.00 C ATOM 368 CD1 LEU A 24 105.783 -14.037 -8.329 1.00 0.00 C ATOM 369 CD2 LEU A 24 105.121 -15.736 -6.622 1.00 0.00 C ATOM 0 H LEU A 24 105.306 -11.628 -7.698 1.00 0.00 H new ATOM 0 HA LEU A 24 102.715 -12.889 -8.024 1.00 0.00 H new ATOM 0 HB2 LEU A 24 105.056 -12.934 -6.063 1.00 0.00 H new ATOM 0 HB3 LEU A 24 103.602 -13.836 -5.687 1.00 0.00 H new ATOM 0 HG LEU A 24 103.803 -14.846 -8.076 1.00 0.00 H new ATOM 0 HD11 LEU A 24 106.104 -14.834 -8.999 1.00 0.00 H new ATOM 0 HD12 LEU A 24 105.441 -13.185 -8.917 1.00 0.00 H new ATOM 0 HD13 LEU A 24 106.620 -13.732 -7.701 1.00 0.00 H new ATOM 0 HD21 LEU A 24 105.443 -16.534 -7.291 1.00 0.00 H new ATOM 0 HD22 LEU A 24 105.957 -15.430 -5.993 1.00 0.00 H new ATOM 0 HD23 LEU A 24 104.307 -16.096 -5.993 1.00 0.00 H new ATOM 381 N PRO A 25 101.253 -12.161 -6.043 1.00 0.00 N ATOM 382 CA PRO A 25 100.232 -11.410 -5.241 1.00 0.00 C ATOM 383 C PRO A 25 100.750 -10.984 -3.852 1.00 0.00 C ATOM 384 O PRO A 25 100.712 -9.804 -3.552 1.00 0.00 O ATOM 385 CB PRO A 25 99.082 -12.410 -5.103 1.00 0.00 C ATOM 386 CG PRO A 25 99.247 -13.299 -6.285 1.00 0.00 C ATOM 387 CD PRO A 25 100.727 -13.493 -6.413 1.00 0.00 C ATOM 0 HA PRO A 25 99.950 -10.476 -5.726 1.00 0.00 H new ATOM 0 HB2 PRO A 25 99.146 -12.969 -4.169 1.00 0.00 H new ATOM 0 HB3 PRO A 25 98.113 -11.910 -5.109 1.00 0.00 H new ATOM 0 HG2 PRO A 25 98.734 -14.250 -6.140 1.00 0.00 H new ATOM 0 HG3 PRO A 25 98.828 -12.845 -7.183 1.00 0.00 H new ATOM 0 HD2 PRO A 25 101.094 -14.274 -5.747 1.00 0.00 H new ATOM 0 HD3 PRO A 25 101.014 -13.777 -7.426 1.00 0.00 H new ATOM 395 N PRO A 26 101.220 -11.916 -3.033 1.00 0.00 N ATOM 396 CA PRO A 26 101.371 -11.631 -1.570 1.00 0.00 C ATOM 397 C PRO A 26 102.349 -10.474 -1.319 1.00 0.00 C ATOM 398 O PRO A 26 102.186 -9.730 -0.368 1.00 0.00 O ATOM 399 CB PRO A 26 101.898 -12.943 -0.978 1.00 0.00 C ATOM 400 CG PRO A 26 102.439 -13.713 -2.135 1.00 0.00 C ATOM 401 CD PRO A 26 101.664 -13.288 -3.348 1.00 0.00 C ATOM 0 HA PRO A 26 100.432 -11.318 -1.114 1.00 0.00 H new ATOM 0 HB2 PRO A 26 102.673 -12.755 -0.235 1.00 0.00 H new ATOM 0 HB3 PRO A 26 101.103 -13.495 -0.477 1.00 0.00 H new ATOM 0 HG2 PRO A 26 103.502 -13.513 -2.268 1.00 0.00 H new ATOM 0 HG3 PRO A 26 102.335 -14.785 -1.967 1.00 0.00 H new ATOM 0 HD2 PRO A 26 102.284 -13.310 -4.244 1.00 0.00 H new ATOM 0 HD3 PRO A 26 100.816 -13.949 -3.531 1.00 0.00 H new ATOM 409 N TYR A 27 103.346 -10.326 -2.162 1.00 0.00 N ATOM 410 CA TYR A 27 104.351 -9.224 -1.983 1.00 0.00 C ATOM 411 C TYR A 27 103.686 -7.858 -2.185 1.00 0.00 C ATOM 412 O TYR A 27 103.926 -6.936 -1.425 1.00 0.00 O ATOM 413 CB TYR A 27 105.436 -9.447 -3.039 1.00 0.00 C ATOM 414 CG TYR A 27 106.303 -10.652 -2.767 1.00 0.00 C ATOM 415 CD1 TYR A 27 107.165 -10.671 -1.627 1.00 0.00 C ATOM 416 CD2 TYR A 27 106.264 -11.773 -3.652 1.00 0.00 C ATOM 417 CE1 TYR A 27 107.987 -11.812 -1.372 1.00 0.00 C ATOM 418 CE2 TYR A 27 107.084 -12.914 -3.397 1.00 0.00 C ATOM 419 CZ TYR A 27 107.947 -12.935 -2.257 1.00 0.00 C ATOM 420 OH TYR A 27 108.742 -14.035 -2.012 1.00 0.00 O ATOM 0 H TYR A 27 103.508 -10.925 -2.972 1.00 0.00 H new ATOM 0 HA TYR A 27 104.772 -9.237 -0.978 1.00 0.00 H new ATOM 0 HB2 TYR A 27 104.964 -9.562 -4.015 1.00 0.00 H new ATOM 0 HB3 TYR A 27 106.067 -8.560 -3.093 1.00 0.00 H new ATOM 0 HD1 TYR A 27 107.195 -9.823 -0.958 1.00 0.00 H new ATOM 0 HD2 TYR A 27 105.614 -11.757 -4.514 1.00 0.00 H new ATOM 0 HE1 TYR A 27 108.639 -11.826 -0.511 1.00 0.00 H new ATOM 0 HE2 TYR A 27 107.052 -13.762 -4.066 1.00 0.00 H new ATOM 0 HH TYR A 27 108.228 -14.706 -1.516 1.00 0.00 H new ATOM 430 N LYS A 28 102.856 -7.732 -3.198 1.00 0.00 N ATOM 431 CA LYS A 28 102.158 -6.428 -3.465 1.00 0.00 C ATOM 432 C LYS A 28 101.190 -6.100 -2.321 1.00 0.00 C ATOM 433 O LYS A 28 101.054 -4.952 -1.939 1.00 0.00 O ATOM 434 CB LYS A 28 101.385 -6.612 -4.776 1.00 0.00 C ATOM 435 CG LYS A 28 102.374 -6.805 -5.928 1.00 0.00 C ATOM 436 CD LYS A 28 101.611 -6.856 -7.253 1.00 0.00 C ATOM 437 CE LYS A 28 102.590 -7.134 -8.396 1.00 0.00 C ATOM 438 NZ LYS A 28 101.813 -6.871 -9.640 1.00 0.00 N ATOM 0 H LYS A 28 102.631 -8.480 -3.854 1.00 0.00 H new ATOM 0 HA LYS A 28 102.870 -5.606 -3.537 1.00 0.00 H new ATOM 0 HB2 LYS A 28 100.723 -7.475 -4.702 1.00 0.00 H new ATOM 0 HB3 LYS A 28 100.755 -5.742 -4.965 1.00 0.00 H new ATOM 0 HG2 LYS A 28 103.095 -5.988 -5.943 1.00 0.00 H new ATOM 0 HG3 LYS A 28 102.939 -7.726 -5.786 1.00 0.00 H new ATOM 0 HD2 LYS A 28 100.848 -7.634 -7.216 1.00 0.00 H new ATOM 0 HD3 LYS A 28 101.095 -5.911 -7.424 1.00 0.00 H new ATOM 0 HE2 LYS A 28 103.465 -6.487 -8.333 1.00 0.00 H new ATOM 0 HE3 LYS A 28 102.951 -8.162 -8.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 102.418 -7.040 -10.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 100.990 -7.506 -9.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 101.488 -5.883 -9.644 1.00 0.00 H new ATOM 452 N GLU A 29 100.533 -7.102 -1.781 1.00 0.00 N ATOM 453 CA GLU A 29 99.555 -6.874 -0.664 1.00 0.00 C ATOM 454 C GLU A 29 100.280 -6.365 0.588 1.00 0.00 C ATOM 455 O GLU A 29 99.853 -5.402 1.201 1.00 0.00 O ATOM 456 CB GLU A 29 98.899 -8.231 -0.381 1.00 0.00 C ATOM 457 CG GLU A 29 97.710 -8.042 0.563 1.00 0.00 C ATOM 458 CD GLU A 29 97.133 -9.408 0.938 1.00 0.00 C ATOM 459 OE1 GLU A 29 96.663 -10.097 0.047 1.00 0.00 O ATOM 460 OE2 GLU A 29 97.171 -9.743 2.111 1.00 0.00 O ATOM 0 H GLU A 29 100.633 -8.076 -2.068 1.00 0.00 H new ATOM 0 HA GLU A 29 98.814 -6.123 -0.938 1.00 0.00 H new ATOM 0 HB2 GLU A 29 98.566 -8.687 -1.314 1.00 0.00 H new ATOM 0 HB3 GLU A 29 99.625 -8.911 0.065 1.00 0.00 H new ATOM 0 HG2 GLU A 29 98.026 -7.510 1.461 1.00 0.00 H new ATOM 0 HG3 GLU A 29 96.945 -7.432 0.083 1.00 0.00 H new ATOM 467 N ILE A 30 101.371 -7.002 0.955 1.00 0.00 N ATOM 468 CA ILE A 30 102.097 -6.616 2.210 1.00 0.00 C ATOM 469 C ILE A 30 102.743 -5.233 2.040 1.00 0.00 C ATOM 470 O ILE A 30 102.818 -4.466 2.985 1.00 0.00 O ATOM 471 CB ILE A 30 103.125 -7.734 2.478 1.00 0.00 C ATOM 472 CG1 ILE A 30 103.843 -7.475 3.806 1.00 0.00 C ATOM 473 CG2 ILE A 30 104.162 -7.828 1.352 1.00 0.00 C ATOM 474 CD1 ILE A 30 104.550 -8.756 4.256 1.00 0.00 C ATOM 0 H ILE A 30 101.790 -7.774 0.437 1.00 0.00 H new ATOM 0 HA ILE A 30 101.429 -6.525 3.066 1.00 0.00 H new ATOM 0 HB ILE A 30 102.583 -8.678 2.524 1.00 0.00 H new ATOM 0 HG12 ILE A 30 104.566 -6.668 3.690 1.00 0.00 H new ATOM 0 HG13 ILE A 30 103.127 -7.155 4.563 1.00 0.00 H new ATOM 0 HG21 ILE A 30 104.870 -8.626 1.575 1.00 0.00 H new ATOM 0 HG22 ILE A 30 103.658 -8.043 0.410 1.00 0.00 H new ATOM 0 HG23 ILE A 30 104.697 -6.882 1.270 1.00 0.00 H new ATOM 0 HD11 ILE A 30 105.062 -8.576 5.201 1.00 0.00 H new ATOM 0 HD12 ILE A 30 103.815 -9.550 4.387 1.00 0.00 H new ATOM 0 HD13 ILE A 30 105.277 -9.055 3.501 1.00 0.00 H new ATOM 486 N PHE A 31 103.198 -4.917 0.846 1.00 0.00 N ATOM 487 CA PHE A 31 103.785 -3.562 0.576 1.00 0.00 C ATOM 488 C PHE A 31 102.706 -2.479 0.707 1.00 0.00 C ATOM 489 O PHE A 31 102.946 -1.441 1.294 1.00 0.00 O ATOM 490 CB PHE A 31 104.343 -3.608 -0.854 1.00 0.00 C ATOM 491 CG PHE A 31 105.785 -4.058 -0.929 1.00 0.00 C ATOM 492 CD1 PHE A 31 106.772 -3.452 -0.091 1.00 0.00 C ATOM 493 CD2 PHE A 31 106.162 -5.091 -1.843 1.00 0.00 C ATOM 494 CE1 PHE A 31 108.134 -3.879 -0.165 1.00 0.00 C ATOM 495 CE2 PHE A 31 107.524 -5.517 -1.918 1.00 0.00 C ATOM 496 CZ PHE A 31 108.510 -4.911 -1.078 1.00 0.00 C ATOM 0 H PHE A 31 103.187 -5.545 0.042 1.00 0.00 H new ATOM 0 HA PHE A 31 104.570 -3.318 1.292 1.00 0.00 H new ATOM 0 HB2 PHE A 31 103.730 -4.282 -1.453 1.00 0.00 H new ATOM 0 HB3 PHE A 31 104.257 -2.617 -1.300 1.00 0.00 H new ATOM 0 HD1 PHE A 31 106.488 -2.671 0.599 1.00 0.00 H new ATOM 0 HD2 PHE A 31 105.417 -5.549 -2.477 1.00 0.00 H new ATOM 0 HE1 PHE A 31 108.879 -3.421 0.469 1.00 0.00 H new ATOM 0 HE2 PHE A 31 107.809 -6.297 -2.609 1.00 0.00 H new ATOM 0 HZ PHE A 31 109.539 -5.234 -1.134 1.00 0.00 H new ATOM 506 N LYS A 32 101.533 -2.723 0.166 1.00 0.00 N ATOM 507 CA LYS A 32 100.413 -1.727 0.265 1.00 0.00 C ATOM 508 C LYS A 32 99.966 -1.551 1.720 1.00 0.00 C ATOM 509 O LYS A 32 99.522 -0.482 2.099 1.00 0.00 O ATOM 510 CB LYS A 32 99.262 -2.284 -0.582 1.00 0.00 C ATOM 511 CG LYS A 32 98.189 -1.209 -0.761 1.00 0.00 C ATOM 512 CD LYS A 32 97.025 -1.779 -1.574 1.00 0.00 C ATOM 513 CE LYS A 32 96.011 -0.669 -1.861 1.00 0.00 C ATOM 514 NZ LYS A 32 95.168 -0.592 -0.635 1.00 0.00 N ATOM 0 H LYS A 32 101.302 -3.576 -0.344 1.00 0.00 H new ATOM 0 HA LYS A 32 100.732 -0.747 -0.091 1.00 0.00 H new ATOM 0 HB2 LYS A 32 99.635 -2.605 -1.555 1.00 0.00 H new ATOM 0 HB3 LYS A 32 98.834 -3.162 -0.099 1.00 0.00 H new ATOM 0 HG2 LYS A 32 97.834 -0.869 0.212 1.00 0.00 H new ATOM 0 HG3 LYS A 32 98.610 -0.341 -1.268 1.00 0.00 H new ATOM 0 HD2 LYS A 32 97.393 -2.201 -2.509 1.00 0.00 H new ATOM 0 HD3 LYS A 32 96.547 -2.590 -1.025 1.00 0.00 H new ATOM 0 HE2 LYS A 32 96.510 0.280 -2.058 1.00 0.00 H new ATOM 0 HE3 LYS A 32 95.410 -0.901 -2.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 94.386 0.075 -0.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 94.782 -1.533 -0.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 95.747 -0.264 0.164 1.00 0.00 H new ATOM 528 N LYS A 33 100.076 -2.587 2.520 1.00 0.00 N ATOM 529 CA LYS A 33 99.716 -2.475 3.972 1.00 0.00 C ATOM 530 C LYS A 33 100.717 -1.579 4.710 1.00 0.00 C ATOM 531 O LYS A 33 100.327 -0.777 5.540 1.00 0.00 O ATOM 532 CB LYS A 33 99.750 -3.899 4.538 1.00 0.00 C ATOM 533 CG LYS A 33 99.138 -3.909 5.941 1.00 0.00 C ATOM 534 CD LYS A 33 99.225 -5.320 6.525 1.00 0.00 C ATOM 535 CE LYS A 33 98.459 -5.371 7.849 1.00 0.00 C ATOM 536 NZ LYS A 33 98.372 -6.820 8.187 1.00 0.00 N ATOM 0 H LYS A 33 100.401 -3.509 2.229 1.00 0.00 H new ATOM 0 HA LYS A 33 98.732 -2.024 4.098 1.00 0.00 H new ATOM 0 HB2 LYS A 33 99.197 -4.574 3.885 1.00 0.00 H new ATOM 0 HB3 LYS A 33 100.777 -4.262 4.576 1.00 0.00 H new ATOM 0 HG2 LYS A 33 99.665 -3.204 6.584 1.00 0.00 H new ATOM 0 HG3 LYS A 33 98.098 -3.585 5.898 1.00 0.00 H new ATOM 0 HD2 LYS A 33 98.808 -6.042 5.823 1.00 0.00 H new ATOM 0 HD3 LYS A 33 100.267 -5.596 6.685 1.00 0.00 H new ATOM 0 HE2 LYS A 33 98.980 -4.814 8.628 1.00 0.00 H new ATOM 0 HE3 LYS A 33 97.468 -4.929 7.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 97.859 -6.937 9.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 97.866 -7.323 7.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 99.330 -7.212 8.282 1.00 0.00 H new ATOM 550 N ILE A 34 101.989 -1.714 4.410 1.00 0.00 N ATOM 551 CA ILE A 34 103.042 -0.942 5.151 1.00 0.00 C ATOM 552 C ILE A 34 103.144 0.478 4.575 1.00 0.00 C ATOM 553 O ILE A 34 103.361 1.425 5.310 1.00 0.00 O ATOM 554 CB ILE A 34 104.367 -1.712 4.972 1.00 0.00 C ATOM 555 CG1 ILE A 34 104.234 -3.151 5.485 1.00 0.00 C ATOM 556 CG2 ILE A 34 105.490 -1.026 5.764 1.00 0.00 C ATOM 557 CD1 ILE A 34 105.402 -3.988 4.958 1.00 0.00 C ATOM 0 H ILE A 34 102.346 -2.330 3.679 1.00 0.00 H new ATOM 0 HA ILE A 34 102.801 -0.847 6.210 1.00 0.00 H new ATOM 0 HB ILE A 34 104.603 -1.720 3.908 1.00 0.00 H new ATOM 0 HG12 ILE A 34 104.227 -3.161 6.575 1.00 0.00 H new ATOM 0 HG13 ILE A 34 103.287 -3.580 5.157 1.00 0.00 H new ATOM 0 HG21 ILE A 34 106.420 -1.579 5.630 1.00 0.00 H new ATOM 0 HG22 ILE A 34 105.619 -0.006 5.403 1.00 0.00 H new ATOM 0 HG23 ILE A 34 105.229 -1.006 6.822 1.00 0.00 H new ATOM 0 HD11 ILE A 34 105.309 -5.011 5.322 1.00 0.00 H new ATOM 0 HD12 ILE A 34 105.387 -3.987 3.868 1.00 0.00 H new ATOM 0 HD13 ILE A 34 106.342 -3.562 5.309 1.00 0.00 H new ATOM 569 N LEU A 35 102.986 0.620 3.279 1.00 0.00 N ATOM 570 CA LEU A 35 103.186 1.945 2.614 1.00 0.00 C ATOM 571 C LEU A 35 101.850 2.607 2.258 1.00 0.00 C ATOM 572 O LEU A 35 101.773 3.820 2.169 1.00 0.00 O ATOM 573 CB LEU A 35 103.963 1.638 1.331 1.00 0.00 C ATOM 574 CG LEU A 35 105.356 1.097 1.665 1.00 0.00 C ATOM 575 CD1 LEU A 35 105.954 0.444 0.417 1.00 0.00 C ATOM 576 CD2 LEU A 35 106.260 2.247 2.117 1.00 0.00 C ATOM 0 H LEU A 35 102.724 -0.137 2.648 1.00 0.00 H new ATOM 0 HA LEU A 35 103.711 2.635 3.274 1.00 0.00 H new ATOM 0 HB2 LEU A 35 103.417 0.908 0.734 1.00 0.00 H new ATOM 0 HB3 LEU A 35 104.052 2.541 0.728 1.00 0.00 H new ATOM 0 HG LEU A 35 105.278 0.362 2.466 1.00 0.00 H new ATOM 0 HD11 LEU A 35 106.946 0.057 0.649 1.00 0.00 H new ATOM 0 HD12 LEU A 35 105.312 -0.375 0.092 1.00 0.00 H new ATOM 0 HD13 LEU A 35 106.030 1.184 -0.380 1.00 0.00 H new ATOM 0 HD21 LEU A 35 107.251 1.859 2.354 1.00 0.00 H new ATOM 0 HD22 LEU A 35 106.340 2.983 1.317 1.00 0.00 H new ATOM 0 HD23 LEU A 35 105.834 2.719 3.002 1.00 0.00 H new ATOM 588 N GLY A 36 100.810 1.827 2.061 1.00 0.00 N ATOM 589 CA GLY A 36 99.516 2.375 1.554 1.00 0.00 C ATOM 590 C GLY A 36 99.518 2.498 0.021 1.00 0.00 C ATOM 591 O GLY A 36 98.662 3.171 -0.528 1.00 0.00 O ATOM 0 H GLY A 36 100.807 0.822 2.233 1.00 0.00 H new ATOM 0 HA2 GLY A 36 98.698 1.727 1.867 1.00 0.00 H new ATOM 0 HA3 GLY A 36 99.335 3.354 1.998 1.00 0.00 H new ATOM 595 N PHE A 37 100.453 1.872 -0.672 1.00 0.00 N ATOM 596 CA PHE A 37 100.386 1.799 -2.165 1.00 0.00 C ATOM 597 C PHE A 37 101.108 0.547 -2.676 1.00 0.00 C ATOM 598 O PHE A 37 101.897 -0.048 -1.962 1.00 0.00 O ATOM 599 CB PHE A 37 101.059 3.079 -2.676 1.00 0.00 C ATOM 600 CG PHE A 37 102.527 3.225 -2.329 1.00 0.00 C ATOM 601 CD1 PHE A 37 103.507 2.417 -2.989 1.00 0.00 C ATOM 602 CD2 PHE A 37 102.939 4.190 -1.358 1.00 0.00 C ATOM 603 CE1 PHE A 37 104.892 2.570 -2.677 1.00 0.00 C ATOM 604 CE2 PHE A 37 104.325 4.342 -1.043 1.00 0.00 C ATOM 605 CZ PHE A 37 105.301 3.532 -1.703 1.00 0.00 C ATOM 0 H PHE A 37 101.262 1.408 -0.258 1.00 0.00 H new ATOM 0 HA PHE A 37 99.358 1.727 -2.522 1.00 0.00 H new ATOM 0 HB2 PHE A 37 100.954 3.116 -3.760 1.00 0.00 H new ATOM 0 HB3 PHE A 37 100.521 3.937 -2.274 1.00 0.00 H new ATOM 0 HD1 PHE A 37 103.198 1.690 -3.725 1.00 0.00 H new ATOM 0 HD2 PHE A 37 102.202 4.805 -0.862 1.00 0.00 H new ATOM 0 HE1 PHE A 37 105.629 1.959 -3.177 1.00 0.00 H new ATOM 0 HE2 PHE A 37 104.635 5.069 -0.307 1.00 0.00 H new ATOM 0 HZ PHE A 37 106.348 3.647 -1.465 1.00 0.00 H new ATOM 615 N GLU A 38 100.839 0.158 -3.902 1.00 0.00 N ATOM 616 CA GLU A 38 101.548 -1.007 -4.517 1.00 0.00 C ATOM 617 C GLU A 38 102.760 -0.509 -5.324 1.00 0.00 C ATOM 618 O GLU A 38 102.560 0.085 -6.368 1.00 0.00 O ATOM 619 CB GLU A 38 100.521 -1.660 -5.446 1.00 0.00 C ATOM 620 CG GLU A 38 99.540 -2.492 -4.618 1.00 0.00 C ATOM 621 CD GLU A 38 98.692 -3.360 -5.550 1.00 0.00 C ATOM 622 OE1 GLU A 38 97.875 -2.804 -6.265 1.00 0.00 O ATOM 623 OE2 GLU A 38 98.875 -4.566 -5.533 1.00 0.00 O ATOM 0 H GLU A 38 100.150 0.605 -4.507 1.00 0.00 H new ATOM 0 HA GLU A 38 101.919 -1.708 -3.770 1.00 0.00 H new ATOM 0 HB2 GLU A 38 99.983 -0.895 -6.006 1.00 0.00 H new ATOM 0 HB3 GLU A 38 101.026 -2.293 -6.176 1.00 0.00 H new ATOM 0 HG2 GLU A 38 100.085 -3.121 -3.914 1.00 0.00 H new ATOM 0 HG3 GLU A 38 98.898 -1.837 -4.030 1.00 0.00 H new ATOM 630 N PRO A 39 103.974 -0.752 -4.846 1.00 0.00 N ATOM 631 CA PRO A 39 105.186 -0.225 -5.546 1.00 0.00 C ATOM 632 C PRO A 39 105.358 -0.905 -6.909 1.00 0.00 C ATOM 633 O PRO A 39 104.829 -1.979 -7.133 1.00 0.00 O ATOM 634 CB PRO A 39 106.328 -0.592 -4.599 1.00 0.00 C ATOM 635 CG PRO A 39 105.819 -1.801 -3.897 1.00 0.00 C ATOM 636 CD PRO A 39 104.368 -1.521 -3.646 1.00 0.00 C ATOM 0 HA PRO A 39 105.135 0.844 -5.751 1.00 0.00 H new ATOM 0 HB2 PRO A 39 107.249 -0.801 -5.143 1.00 0.00 H new ATOM 0 HB3 PRO A 39 106.546 0.216 -3.901 1.00 0.00 H new ATOM 0 HG2 PRO A 39 105.949 -2.695 -4.506 1.00 0.00 H new ATOM 0 HG3 PRO A 39 106.356 -1.971 -2.964 1.00 0.00 H new ATOM 0 HD2 PRO A 39 103.790 -2.439 -3.546 1.00 0.00 H new ATOM 0 HD3 PRO A 39 104.218 -0.948 -2.731 1.00 0.00 H new ATOM 644 N TYR A 40 106.092 -0.283 -7.804 1.00 0.00 N ATOM 645 CA TYR A 40 106.291 -0.858 -9.175 1.00 0.00 C ATOM 646 C TYR A 40 107.249 -2.049 -9.107 1.00 0.00 C ATOM 647 O TYR A 40 107.965 -2.211 -8.132 1.00 0.00 O ATOM 648 CB TYR A 40 106.905 0.259 -10.026 1.00 0.00 C ATOM 649 CG TYR A 40 107.041 -0.101 -11.486 1.00 0.00 C ATOM 650 CD1 TYR A 40 108.236 -0.727 -11.959 1.00 0.00 C ATOM 651 CD2 TYR A 40 105.975 0.184 -12.395 1.00 0.00 C ATOM 652 CE1 TYR A 40 108.366 -1.068 -13.340 1.00 0.00 C ATOM 653 CE2 TYR A 40 106.105 -0.159 -13.777 1.00 0.00 C ATOM 654 CZ TYR A 40 107.300 -0.785 -14.249 1.00 0.00 C ATOM 655 OH TYR A 40 107.425 -1.114 -15.584 1.00 0.00 O ATOM 0 H TYR A 40 106.565 0.606 -7.641 1.00 0.00 H new ATOM 0 HA TYR A 40 105.350 -1.209 -9.599 1.00 0.00 H new ATOM 0 HB2 TYR A 40 106.289 1.154 -9.937 1.00 0.00 H new ATOM 0 HB3 TYR A 40 107.889 0.509 -9.628 1.00 0.00 H new ATOM 0 HD1 TYR A 40 109.041 -0.942 -11.272 1.00 0.00 H new ATOM 0 HD2 TYR A 40 105.072 0.658 -12.038 1.00 0.00 H new ATOM 0 HE1 TYR A 40 109.270 -1.540 -13.697 1.00 0.00 H new ATOM 0 HE2 TYR A 40 105.300 0.055 -14.464 1.00 0.00 H new ATOM 0 HH TYR A 40 106.610 -0.854 -16.063 1.00 0.00 H new ATOM 665 N GLU A 41 107.266 -2.870 -10.135 1.00 0.00 N ATOM 666 CA GLU A 41 108.185 -4.054 -10.147 1.00 0.00 C ATOM 667 C GLU A 41 109.599 -3.607 -10.547 1.00 0.00 C ATOM 668 O GLU A 41 110.018 -3.759 -11.682 1.00 0.00 O ATOM 669 CB GLU A 41 107.598 -5.023 -11.183 1.00 0.00 C ATOM 670 CG GLU A 41 106.251 -5.550 -10.685 1.00 0.00 C ATOM 671 CD GLU A 41 105.700 -6.577 -11.679 1.00 0.00 C ATOM 672 OE1 GLU A 41 106.466 -7.417 -12.122 1.00 0.00 O ATOM 673 OE2 GLU A 41 104.519 -6.506 -11.979 1.00 0.00 O ATOM 0 H GLU A 41 106.682 -2.770 -10.965 1.00 0.00 H new ATOM 0 HA GLU A 41 108.264 -4.528 -9.169 1.00 0.00 H new ATOM 0 HB2 GLU A 41 107.471 -4.516 -12.139 1.00 0.00 H new ATOM 0 HB3 GLU A 41 108.285 -5.852 -11.351 1.00 0.00 H new ATOM 0 HG2 GLU A 41 106.369 -6.007 -9.703 1.00 0.00 H new ATOM 0 HG3 GLU A 41 105.547 -4.726 -10.571 1.00 0.00 H new ATOM 680 N GLY A 42 110.324 -3.049 -9.602 1.00 0.00 N ATOM 681 CA GLY A 42 111.751 -2.668 -9.838 1.00 0.00 C ATOM 682 C GLY A 42 112.338 -2.085 -8.550 1.00 0.00 C ATOM 683 O GLY A 42 111.617 -1.844 -7.598 1.00 0.00 O ATOM 0 H GLY A 42 109.979 -2.840 -8.665 1.00 0.00 H new ATOM 0 HA2 GLY A 42 112.325 -3.540 -10.151 1.00 0.00 H new ATOM 0 HA3 GLY A 42 111.816 -1.937 -10.644 1.00 0.00 H new ATOM 687 N THR A 43 113.632 -1.862 -8.524 1.00 0.00 N ATOM 688 CA THR A 43 114.291 -1.273 -7.316 1.00 0.00 C ATOM 689 C THR A 43 115.328 -0.222 -7.719 1.00 0.00 C ATOM 690 O THR A 43 115.834 -0.235 -8.827 1.00 0.00 O ATOM 691 CB THR A 43 114.977 -2.436 -6.586 1.00 0.00 C ATOM 692 OG1 THR A 43 115.548 -3.342 -7.521 1.00 0.00 O ATOM 693 CG2 THR A 43 113.958 -3.167 -5.712 1.00 0.00 C ATOM 0 H THR A 43 114.265 -2.066 -9.297 1.00 0.00 H new ATOM 0 HA THR A 43 113.559 -0.776 -6.680 1.00 0.00 H new ATOM 0 HB THR A 43 115.773 -2.036 -5.958 1.00 0.00 H new ATOM 0 HG1 THR A 43 115.983 -4.077 -7.040 1.00 0.00 H new ATOM 0 HG21 THR A 43 114.448 -3.992 -5.195 1.00 0.00 H new ATOM 0 HG22 THR A 43 113.544 -2.474 -4.979 1.00 0.00 H new ATOM 0 HG23 THR A 43 113.155 -3.556 -6.338 1.00 0.00 H new ATOM 701 N LEU A 44 115.633 0.680 -6.816 1.00 0.00 N ATOM 702 CA LEU A 44 116.773 1.622 -7.007 1.00 0.00 C ATOM 703 C LEU A 44 117.881 1.256 -6.017 1.00 0.00 C ATOM 704 O LEU A 44 117.679 1.330 -4.818 1.00 0.00 O ATOM 705 CB LEU A 44 116.196 3.008 -6.698 1.00 0.00 C ATOM 706 CG LEU A 44 117.246 4.090 -6.968 1.00 0.00 C ATOM 707 CD1 LEU A 44 117.458 4.235 -8.476 1.00 0.00 C ATOM 708 CD2 LEU A 44 116.762 5.423 -6.392 1.00 0.00 C ATOM 0 H LEU A 44 115.127 0.802 -5.939 1.00 0.00 H new ATOM 0 HA LEU A 44 117.201 1.588 -8.009 1.00 0.00 H new ATOM 0 HB2 LEU A 44 115.313 3.187 -7.311 1.00 0.00 H new ATOM 0 HB3 LEU A 44 115.876 3.053 -5.657 1.00 0.00 H new ATOM 0 HG LEU A 44 118.187 3.807 -6.496 1.00 0.00 H new ATOM 0 HD11 LEU A 44 118.205 5.005 -8.666 1.00 0.00 H new ATOM 0 HD12 LEU A 44 117.802 3.286 -8.888 1.00 0.00 H new ATOM 0 HD13 LEU A 44 116.518 4.517 -8.950 1.00 0.00 H new ATOM 0 HD21 LEU A 44 117.508 6.194 -6.583 1.00 0.00 H new ATOM 0 HD22 LEU A 44 115.821 5.703 -6.865 1.00 0.00 H new ATOM 0 HD23 LEU A 44 116.612 5.322 -5.317 1.00 0.00 H new ATOM 720 N ASN A 45 119.030 0.865 -6.514 1.00 0.00 N ATOM 721 CA ASN A 45 120.147 0.435 -5.620 1.00 0.00 C ATOM 722 C ASN A 45 121.151 1.577 -5.452 1.00 0.00 C ATOM 723 O ASN A 45 121.716 2.052 -6.422 1.00 0.00 O ATOM 724 CB ASN A 45 120.799 -0.749 -6.336 1.00 0.00 C ATOM 725 CG ASN A 45 119.856 -1.953 -6.299 1.00 0.00 C ATOM 726 OD1 ASN A 45 118.759 -1.898 -6.820 1.00 0.00 O ATOM 727 ND2 ASN A 45 120.240 -3.048 -5.702 1.00 0.00 N ATOM 0 H ASN A 45 119.242 0.826 -7.511 1.00 0.00 H new ATOM 0 HA ASN A 45 119.798 0.164 -4.624 1.00 0.00 H new ATOM 0 HB2 ASN A 45 121.025 -0.483 -7.369 1.00 0.00 H new ATOM 0 HB3 ASN A 45 121.745 -1.000 -5.857 1.00 0.00 H new ATOM 0 HD21 ASN A 45 119.620 -3.857 -5.673 1.00 0.00 H new ATOM 0 HD22 ASN A 45 121.160 -3.095 -5.265 1.00 0.00 H new ATOM 734 N LEU A 46 121.369 2.011 -4.230 1.00 0.00 N ATOM 735 CA LEU A 46 122.304 3.149 -3.969 1.00 0.00 C ATOM 736 C LEU A 46 123.451 2.707 -3.056 1.00 0.00 C ATOM 737 O LEU A 46 123.235 2.021 -2.073 1.00 0.00 O ATOM 738 CB LEU A 46 121.456 4.222 -3.282 1.00 0.00 C ATOM 739 CG LEU A 46 120.528 4.879 -4.307 1.00 0.00 C ATOM 740 CD1 LEU A 46 119.489 5.735 -3.579 1.00 0.00 C ATOM 741 CD2 LEU A 46 121.348 5.771 -5.243 1.00 0.00 C ATOM 0 H LEU A 46 120.933 1.619 -3.396 1.00 0.00 H new ATOM 0 HA LEU A 46 122.758 3.517 -4.889 1.00 0.00 H new ATOM 0 HB2 LEU A 46 120.869 3.777 -2.479 1.00 0.00 H new ATOM 0 HB3 LEU A 46 122.101 4.973 -2.827 1.00 0.00 H new ATOM 0 HG LEU A 46 120.025 4.105 -4.887 1.00 0.00 H new ATOM 0 HD11 LEU A 46 118.828 6.203 -4.308 1.00 0.00 H new ATOM 0 HD12 LEU A 46 118.903 5.105 -2.910 1.00 0.00 H new ATOM 0 HD13 LEU A 46 119.995 6.507 -3.000 1.00 0.00 H new ATOM 0 HD21 LEU A 46 120.686 6.238 -5.972 1.00 0.00 H new ATOM 0 HD22 LEU A 46 121.851 6.544 -4.661 1.00 0.00 H new ATOM 0 HD23 LEU A 46 122.092 5.167 -5.763 1.00 0.00 H new ATOM 753 N LYS A 47 124.657 3.100 -3.393 1.00 0.00 N ATOM 754 CA LYS A 47 125.832 2.853 -2.502 1.00 0.00 C ATOM 755 C LYS A 47 126.093 4.100 -1.652 1.00 0.00 C ATOM 756 O LYS A 47 126.101 5.203 -2.167 1.00 0.00 O ATOM 757 CB LYS A 47 127.006 2.588 -3.450 1.00 0.00 C ATOM 758 CG LYS A 47 128.235 2.150 -2.650 1.00 0.00 C ATOM 759 CD LYS A 47 129.443 2.056 -3.583 1.00 0.00 C ATOM 760 CE LYS A 47 130.641 1.494 -2.815 1.00 0.00 C ATOM 761 NZ LYS A 47 131.724 1.369 -3.830 1.00 0.00 N ATOM 0 H LYS A 47 124.878 3.588 -4.261 1.00 0.00 H new ATOM 0 HA LYS A 47 125.676 2.018 -1.819 1.00 0.00 H new ATOM 0 HB2 LYS A 47 126.736 1.815 -4.170 1.00 0.00 H new ATOM 0 HB3 LYS A 47 127.235 3.489 -4.020 1.00 0.00 H new ATOM 0 HG2 LYS A 47 128.434 2.863 -1.850 1.00 0.00 H new ATOM 0 HG3 LYS A 47 128.050 1.185 -2.178 1.00 0.00 H new ATOM 0 HD2 LYS A 47 129.210 1.415 -4.433 1.00 0.00 H new ATOM 0 HD3 LYS A 47 129.684 3.041 -3.983 1.00 0.00 H new ATOM 0 HE2 LYS A 47 130.936 2.158 -2.003 1.00 0.00 H new ATOM 0 HE3 LYS A 47 130.406 0.528 -2.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 132.581 0.989 -3.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 131.417 0.726 -4.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 131.931 2.305 -4.233 1.00 0.00 H new ATOM 775 N LEU A 48 126.300 3.920 -0.368 1.00 0.00 N ATOM 776 CA LEU A 48 126.505 5.077 0.554 1.00 0.00 C ATOM 777 C LEU A 48 127.945 5.101 1.070 1.00 0.00 C ATOM 778 O LEU A 48 128.637 4.098 1.026 1.00 0.00 O ATOM 779 CB LEU A 48 125.542 4.853 1.721 1.00 0.00 C ATOM 780 CG LEU A 48 124.094 4.945 1.234 1.00 0.00 C ATOM 781 CD1 LEU A 48 123.158 4.445 2.336 1.00 0.00 C ATOM 782 CD2 LEU A 48 123.755 6.400 0.904 1.00 0.00 C ATOM 0 H LEU A 48 126.336 3.006 0.084 1.00 0.00 H new ATOM 0 HA LEU A 48 126.322 6.025 0.048 1.00 0.00 H new ATOM 0 HB2 LEU A 48 125.722 3.875 2.168 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.720 5.597 2.498 1.00 0.00 H new ATOM 0 HG LEU A 48 123.972 4.333 0.341 1.00 0.00 H new ATOM 0 HD11 LEU A 48 122.125 4.509 1.993 1.00 0.00 H new ATOM 0 HD12 LEU A 48 123.398 3.409 2.575 1.00 0.00 H new ATOM 0 HD13 LEU A 48 123.283 5.061 3.227 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.724 6.464 0.557 1.00 0.00 H new ATOM 0 HD22 LEU A 48 123.876 7.013 1.797 1.00 0.00 H new ATOM 0 HD23 LEU A 48 124.423 6.761 0.122 1.00 0.00 H new ATOM 794 N ASP A 49 128.386 6.241 1.550 1.00 0.00 N ATOM 795 CA ASP A 49 129.720 6.330 2.227 1.00 0.00 C ATOM 796 C ASP A 49 129.618 6.051 3.739 1.00 0.00 C ATOM 797 O ASP A 49 130.559 6.312 4.467 1.00 0.00 O ATOM 798 CB ASP A 49 130.235 7.755 1.957 1.00 0.00 C ATOM 799 CG ASP A 49 129.295 8.819 2.542 1.00 0.00 C ATOM 800 OD1 ASP A 49 128.126 8.809 2.190 1.00 0.00 O ATOM 801 OD2 ASP A 49 129.762 9.624 3.331 1.00 0.00 O ATOM 0 H ASP A 49 127.873 7.121 1.501 1.00 0.00 H new ATOM 0 HA ASP A 49 130.404 5.576 1.838 1.00 0.00 H new ATOM 0 HB2 ASP A 49 131.229 7.871 2.389 1.00 0.00 H new ATOM 0 HB3 ASP A 49 130.334 7.908 0.882 1.00 0.00 H new ATOM 806 N ARG A 50 128.501 5.529 4.210 1.00 0.00 N ATOM 807 CA ARG A 50 128.318 5.269 5.671 1.00 0.00 C ATOM 808 C ARG A 50 127.476 4.004 5.860 1.00 0.00 C ATOM 809 O ARG A 50 126.544 3.769 5.111 1.00 0.00 O ATOM 810 CB ARG A 50 127.572 6.489 6.213 1.00 0.00 C ATOM 811 CG ARG A 50 128.461 7.731 6.129 1.00 0.00 C ATOM 812 CD ARG A 50 127.758 8.909 6.810 1.00 0.00 C ATOM 813 NE ARG A 50 127.836 8.639 8.285 1.00 0.00 N ATOM 814 CZ ARG A 50 127.778 9.598 9.189 1.00 0.00 C ATOM 815 NH1 ARG A 50 127.622 10.866 8.883 1.00 0.00 N ATOM 816 NH2 ARG A 50 127.867 9.269 10.449 1.00 0.00 N ATOM 0 H ARG A 50 127.702 5.271 3.631 1.00 0.00 H new ATOM 0 HA ARG A 50 129.266 5.118 6.188 1.00 0.00 H new ATOM 0 HB2 ARG A 50 126.657 6.648 5.642 1.00 0.00 H new ATOM 0 HB3 ARG A 50 127.276 6.314 7.247 1.00 0.00 H new ATOM 0 HG2 ARG A 50 129.420 7.538 6.610 1.00 0.00 H new ATOM 0 HG3 ARG A 50 128.670 7.972 5.087 1.00 0.00 H new ATOM 0 HD2 ARG A 50 128.244 9.852 6.559 1.00 0.00 H new ATOM 0 HD3 ARG A 50 126.722 8.988 6.482 1.00 0.00 H new ATOM 0 HE ARG A 50 127.938 7.675 8.601 1.00 0.00 H new ATOM 0 HH11 ARG A 50 127.539 11.149 7.906 1.00 0.00 H new ATOM 0 HH12 ARG A 50 127.584 11.568 9.622 1.00 0.00 H new ATOM 0 HH21 ARG A 50 127.978 8.290 10.714 1.00 0.00 H new ATOM 0 HH22 ARG A 50 127.825 9.991 11.169 1.00 0.00 H new ATOM 830 N GLU A 51 127.800 3.201 6.850 1.00 0.00 N ATOM 831 CA GLU A 51 127.012 1.951 7.123 1.00 0.00 C ATOM 832 C GLU A 51 125.578 2.302 7.536 1.00 0.00 C ATOM 833 O GLU A 51 125.352 3.317 8.171 1.00 0.00 O ATOM 834 CB GLU A 51 127.727 1.231 8.272 1.00 0.00 C ATOM 835 CG GLU A 51 129.115 0.781 7.811 1.00 0.00 C ATOM 836 CD GLU A 51 129.796 -0.008 8.932 1.00 0.00 C ATOM 837 OE1 GLU A 51 130.226 0.614 9.890 1.00 0.00 O ATOM 838 OE2 GLU A 51 129.875 -1.219 8.813 1.00 0.00 O ATOM 0 H GLU A 51 128.582 3.359 7.485 1.00 0.00 H new ATOM 0 HA GLU A 51 126.953 1.323 6.234 1.00 0.00 H new ATOM 0 HB2 GLU A 51 127.816 1.895 9.132 1.00 0.00 H new ATOM 0 HB3 GLU A 51 127.143 0.369 8.594 1.00 0.00 H new ATOM 0 HG2 GLU A 51 129.030 0.163 6.917 1.00 0.00 H new ATOM 0 HG3 GLU A 51 129.719 1.648 7.543 1.00 0.00 H new ATOM 845 N PHE A 52 124.627 1.470 7.178 1.00 0.00 N ATOM 846 CA PHE A 52 123.195 1.742 7.512 1.00 0.00 C ATOM 847 C PHE A 52 122.538 0.497 8.118 1.00 0.00 C ATOM 848 O PHE A 52 122.745 -0.606 7.645 1.00 0.00 O ATOM 849 CB PHE A 52 122.536 2.105 6.180 1.00 0.00 C ATOM 850 CG PHE A 52 121.088 2.512 6.315 1.00 0.00 C ATOM 851 CD1 PHE A 52 120.750 3.863 6.636 1.00 0.00 C ATOM 852 CD2 PHE A 52 120.054 1.543 6.125 1.00 0.00 C ATOM 853 CE1 PHE A 52 119.379 4.244 6.768 1.00 0.00 C ATOM 854 CE2 PHE A 52 118.683 1.924 6.256 1.00 0.00 C ATOM 855 CZ PHE A 52 118.346 3.275 6.577 1.00 0.00 C ATOM 0 H PHE A 52 124.787 0.604 6.663 1.00 0.00 H new ATOM 0 HA PHE A 52 123.092 2.539 8.248 1.00 0.00 H new ATOM 0 HB2 PHE A 52 123.093 2.921 5.719 1.00 0.00 H new ATOM 0 HB3 PHE A 52 122.604 1.251 5.506 1.00 0.00 H new ATOM 0 HD1 PHE A 52 121.530 4.596 6.779 1.00 0.00 H new ATOM 0 HD2 PHE A 52 120.309 0.522 5.882 1.00 0.00 H new ATOM 0 HE1 PHE A 52 119.123 5.265 7.012 1.00 0.00 H new ATOM 0 HE2 PHE A 52 117.902 1.192 6.113 1.00 0.00 H new ATOM 0 HZ PHE A 52 117.310 3.564 6.675 1.00 0.00 H new ATOM 865 N ASP A 53 121.755 0.683 9.156 1.00 0.00 N ATOM 866 CA ASP A 53 120.987 -0.445 9.764 1.00 0.00 C ATOM 867 C ASP A 53 119.570 0.017 10.111 1.00 0.00 C ATOM 868 O ASP A 53 119.396 0.983 10.834 1.00 0.00 O ATOM 869 CB ASP A 53 121.758 -0.815 11.034 1.00 0.00 C ATOM 870 CG ASP A 53 123.110 -1.423 10.654 1.00 0.00 C ATOM 871 OD1 ASP A 53 124.061 -0.669 10.528 1.00 0.00 O ATOM 872 OD2 ASP A 53 123.171 -2.632 10.497 1.00 0.00 O ATOM 0 H ASP A 53 121.616 1.584 9.612 1.00 0.00 H new ATOM 0 HA ASP A 53 120.892 -1.294 9.088 1.00 0.00 H new ATOM 0 HB2 ASP A 53 121.907 0.070 11.652 1.00 0.00 H new ATOM 0 HB3 ASP A 53 121.182 -1.525 11.627 1.00 0.00 H new ATOM 877 N ILE A 54 118.569 -0.666 9.601 1.00 0.00 N ATOM 878 CA ILE A 54 117.145 -0.260 9.856 1.00 0.00 C ATOM 879 C ILE A 54 116.793 -0.361 11.354 1.00 0.00 C ATOM 880 O ILE A 54 115.871 0.295 11.806 1.00 0.00 O ATOM 881 CB ILE A 54 116.272 -1.185 8.983 1.00 0.00 C ATOM 882 CG1 ILE A 54 114.802 -0.760 9.087 1.00 0.00 C ATOM 883 CG2 ILE A 54 116.421 -2.651 9.411 1.00 0.00 C ATOM 884 CD1 ILE A 54 113.982 -1.443 7.992 1.00 0.00 C ATOM 0 H ILE A 54 118.678 -1.493 9.015 1.00 0.00 H new ATOM 0 HA ILE A 54 116.974 0.784 9.593 1.00 0.00 H new ATOM 0 HB ILE A 54 116.607 -1.096 7.949 1.00 0.00 H new ATOM 0 HG12 ILE A 54 114.407 -1.025 10.068 1.00 0.00 H new ATOM 0 HG13 ILE A 54 114.720 0.323 8.992 1.00 0.00 H new ATOM 0 HG21 ILE A 54 115.795 -3.280 8.779 1.00 0.00 H new ATOM 0 HG22 ILE A 54 117.462 -2.956 9.308 1.00 0.00 H new ATOM 0 HG23 ILE A 54 116.112 -2.760 10.451 1.00 0.00 H new ATOM 0 HD11 ILE A 54 112.939 -1.136 8.073 1.00 0.00 H new ATOM 0 HD12 ILE A 54 114.370 -1.156 7.015 1.00 0.00 H new ATOM 0 HD13 ILE A 54 114.051 -2.525 8.107 1.00 0.00 H new ATOM 896 N ASN A 55 117.512 -1.168 12.108 1.00 0.00 N ATOM 897 CA ASN A 55 117.217 -1.316 13.574 1.00 0.00 C ATOM 898 C ASN A 55 117.643 -0.075 14.378 1.00 0.00 C ATOM 899 O ASN A 55 117.386 -0.014 15.568 1.00 0.00 O ATOM 900 CB ASN A 55 118.005 -2.542 14.051 1.00 0.00 C ATOM 901 CG ASN A 55 117.480 -3.802 13.358 1.00 0.00 C ATOM 902 OD1 ASN A 55 116.297 -3.928 13.109 1.00 0.00 O ATOM 903 ND2 ASN A 55 118.319 -4.749 13.037 1.00 0.00 N ATOM 0 H ASN A 55 118.292 -1.731 11.769 1.00 0.00 H new ATOM 0 HA ASN A 55 116.144 -1.431 13.728 1.00 0.00 H new ATOM 0 HB2 ASN A 55 119.065 -2.411 13.832 1.00 0.00 H new ATOM 0 HB3 ASN A 55 117.913 -2.646 15.132 1.00 0.00 H new ATOM 0 HD21 ASN A 55 117.982 -5.595 12.577 1.00 0.00 H new ATOM 0 HD22 ASN A 55 119.312 -4.643 13.246 1.00 0.00 H new ATOM 910 N LYS A 56 118.283 0.896 13.757 1.00 0.00 N ATOM 911 CA LYS A 56 118.569 2.195 14.448 1.00 0.00 C ATOM 912 C LYS A 56 117.437 3.212 14.229 1.00 0.00 C ATOM 913 O LYS A 56 117.381 4.212 14.923 1.00 0.00 O ATOM 914 CB LYS A 56 119.879 2.707 13.844 1.00 0.00 C ATOM 915 CG LYS A 56 121.039 1.832 14.325 1.00 0.00 C ATOM 916 CD LYS A 56 122.362 2.422 13.835 1.00 0.00 C ATOM 917 CE LYS A 56 123.525 1.566 14.343 1.00 0.00 C ATOM 918 NZ LYS A 56 123.565 0.390 13.430 1.00 0.00 N ATOM 0 H LYS A 56 118.620 0.840 12.796 1.00 0.00 H new ATOM 0 HA LYS A 56 118.646 2.055 15.526 1.00 0.00 H new ATOM 0 HB2 LYS A 56 119.822 2.688 12.756 1.00 0.00 H new ATOM 0 HB3 LYS A 56 120.046 3.744 14.136 1.00 0.00 H new ATOM 0 HG2 LYS A 56 121.036 1.773 15.413 1.00 0.00 H new ATOM 0 HG3 LYS A 56 120.921 0.815 13.950 1.00 0.00 H new ATOM 0 HD2 LYS A 56 122.374 2.460 12.746 1.00 0.00 H new ATOM 0 HD3 LYS A 56 122.469 3.447 14.191 1.00 0.00 H new ATOM 0 HE2 LYS A 56 124.464 2.119 14.315 1.00 0.00 H new ATOM 0 HE3 LYS A 56 123.367 1.258 15.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 124.398 -0.192 13.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 122.703 -0.178 13.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 123.622 0.717 12.445 1.00 0.00 H new ATOM 932 N PHE A 57 116.549 2.973 13.284 1.00 0.00 N ATOM 933 CA PHE A 57 115.342 3.843 13.116 1.00 0.00 C ATOM 934 C PHE A 57 114.082 3.029 13.420 1.00 0.00 C ATOM 935 O PHE A 57 114.163 1.836 13.653 1.00 0.00 O ATOM 936 CB PHE A 57 115.344 4.298 11.652 1.00 0.00 C ATOM 937 CG PHE A 57 116.619 4.986 11.213 1.00 0.00 C ATOM 938 CD1 PHE A 57 116.757 6.400 11.353 1.00 0.00 C ATOM 939 CD2 PHE A 57 117.689 4.213 10.664 1.00 0.00 C ATOM 940 CE1 PHE A 57 117.965 7.045 10.942 1.00 0.00 C ATOM 941 CE2 PHE A 57 118.897 4.857 10.254 1.00 0.00 C ATOM 942 CZ PHE A 57 119.036 6.273 10.393 1.00 0.00 C ATOM 0 H PHE A 57 116.614 2.203 12.618 1.00 0.00 H new ATOM 0 HA PHE A 57 115.359 4.699 13.791 1.00 0.00 H new ATOM 0 HB2 PHE A 57 115.176 3.430 11.014 1.00 0.00 H new ATOM 0 HB3 PHE A 57 114.506 4.977 11.494 1.00 0.00 H new ATOM 0 HD1 PHE A 57 115.949 6.983 11.769 1.00 0.00 H new ATOM 0 HD2 PHE A 57 117.584 3.143 10.559 1.00 0.00 H new ATOM 0 HE1 PHE A 57 118.068 8.115 11.046 1.00 0.00 H new ATOM 0 HE2 PHE A 57 119.705 4.274 9.839 1.00 0.00 H new ATOM 0 HZ PHE A 57 119.949 6.759 10.084 1.00 0.00 H new ATOM 952 N LYS A 58 112.934 3.668 13.417 1.00 0.00 N ATOM 953 CA LYS A 58 111.659 2.967 13.771 1.00 0.00 C ATOM 954 C LYS A 58 110.992 2.415 12.508 1.00 0.00 C ATOM 955 O LYS A 58 110.373 3.152 11.761 1.00 0.00 O ATOM 956 CB LYS A 58 110.772 4.027 14.429 1.00 0.00 C ATOM 957 CG LYS A 58 111.396 4.482 15.751 1.00 0.00 C ATOM 958 CD LYS A 58 111.274 3.365 16.790 1.00 0.00 C ATOM 959 CE LYS A 58 111.746 3.878 18.152 1.00 0.00 C ATOM 960 NZ LYS A 58 111.122 2.962 19.146 1.00 0.00 N ATOM 0 H LYS A 58 112.827 4.655 13.182 1.00 0.00 H new ATOM 0 HA LYS A 58 111.832 2.122 14.438 1.00 0.00 H new ATOM 0 HB2 LYS A 58 110.653 4.880 13.761 1.00 0.00 H new ATOM 0 HB3 LYS A 58 109.776 3.621 14.608 1.00 0.00 H new ATOM 0 HG2 LYS A 58 112.445 4.739 15.600 1.00 0.00 H new ATOM 0 HG3 LYS A 58 110.896 5.382 16.110 1.00 0.00 H new ATOM 0 HD2 LYS A 58 110.240 3.027 16.856 1.00 0.00 H new ATOM 0 HD3 LYS A 58 111.872 2.505 16.487 1.00 0.00 H new ATOM 0 HE2 LYS A 58 112.833 3.859 18.226 1.00 0.00 H new ATOM 0 HE3 LYS A 58 111.434 4.909 18.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 111.400 3.250 20.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 110.087 3.006 19.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 111.443 1.989 18.970 1.00 0.00 H new ATOM 974 N TYR A 59 111.119 1.126 12.278 1.00 0.00 N ATOM 975 CA TYR A 59 110.512 0.488 11.070 1.00 0.00 C ATOM 976 C TYR A 59 109.335 -0.414 11.469 1.00 0.00 C ATOM 977 O TYR A 59 109.028 -0.550 12.639 1.00 0.00 O ATOM 978 CB TYR A 59 111.659 -0.312 10.427 1.00 0.00 C ATOM 979 CG TYR A 59 112.135 -1.512 11.224 1.00 0.00 C ATOM 980 CD1 TYR A 59 113.132 -1.359 12.236 1.00 0.00 C ATOM 981 CD2 TYR A 59 111.579 -2.802 10.961 1.00 0.00 C ATOM 982 CE1 TYR A 59 113.572 -2.494 12.986 1.00 0.00 C ATOM 983 CE2 TYR A 59 112.019 -3.937 11.709 1.00 0.00 C ATOM 984 CZ TYR A 59 113.016 -3.783 12.722 1.00 0.00 C ATOM 985 OH TYR A 59 113.440 -4.879 13.445 1.00 0.00 O ATOM 0 H TYR A 59 111.625 0.484 12.887 1.00 0.00 H new ATOM 0 HA TYR A 59 110.099 1.217 10.373 1.00 0.00 H new ATOM 0 HB2 TYR A 59 111.336 -0.654 9.444 1.00 0.00 H new ATOM 0 HB3 TYR A 59 112.504 0.358 10.269 1.00 0.00 H new ATOM 0 HD1 TYR A 59 113.554 -0.385 12.435 1.00 0.00 H new ATOM 0 HD2 TYR A 59 110.826 -2.919 10.196 1.00 0.00 H new ATOM 0 HE1 TYR A 59 114.324 -2.377 13.752 1.00 0.00 H new ATOM 0 HE2 TYR A 59 111.598 -4.911 11.509 1.00 0.00 H new ATOM 0 HH TYR A 59 114.417 -4.862 13.522 1.00 0.00 H new ATOM 995 N ILE A 60 108.690 -1.018 10.497 1.00 0.00 N ATOM 996 CA ILE A 60 107.608 -2.012 10.784 1.00 0.00 C ATOM 997 C ILE A 60 108.104 -3.399 10.355 1.00 0.00 C ATOM 998 O ILE A 60 108.600 -3.561 9.254 1.00 0.00 O ATOM 999 CB ILE A 60 106.390 -1.566 9.950 1.00 0.00 C ATOM 1000 CG1 ILE A 60 105.952 -0.152 10.355 1.00 0.00 C ATOM 1001 CG2 ILE A 60 105.210 -2.518 10.181 1.00 0.00 C ATOM 1002 CD1 ILE A 60 105.002 0.415 9.298 1.00 0.00 C ATOM 0 H ILE A 60 108.871 -0.861 9.505 1.00 0.00 H new ATOM 0 HA ILE A 60 107.341 -2.063 11.840 1.00 0.00 H new ATOM 0 HB ILE A 60 106.681 -1.579 8.900 1.00 0.00 H new ATOM 0 HG12 ILE A 60 105.458 -0.178 11.326 1.00 0.00 H new ATOM 0 HG13 ILE A 60 106.824 0.494 10.458 1.00 0.00 H new ATOM 0 HG21 ILE A 60 104.357 -2.191 9.586 1.00 0.00 H new ATOM 0 HG22 ILE A 60 105.494 -3.528 9.884 1.00 0.00 H new ATOM 0 HG23 ILE A 60 104.939 -2.513 11.237 1.00 0.00 H new ATOM 0 HD11 ILE A 60 104.693 1.419 9.588 1.00 0.00 H new ATOM 0 HD12 ILE A 60 105.512 0.456 8.335 1.00 0.00 H new ATOM 0 HD13 ILE A 60 104.124 -0.226 9.217 1.00 0.00 H new ATOM 1014 N GLU A 61 107.973 -4.379 11.219 1.00 0.00 N ATOM 1015 CA GLU A 61 108.438 -5.761 10.896 1.00 0.00 C ATOM 1016 C GLU A 61 107.238 -6.670 10.612 1.00 0.00 C ATOM 1017 O GLU A 61 106.215 -6.561 11.264 1.00 0.00 O ATOM 1018 CB GLU A 61 109.174 -6.231 12.152 1.00 0.00 C ATOM 1019 CG GLU A 61 109.914 -7.537 11.854 1.00 0.00 C ATOM 1020 CD GLU A 61 110.542 -8.074 13.141 1.00 0.00 C ATOM 1021 OE1 GLU A 61 111.494 -7.469 13.608 1.00 0.00 O ATOM 1022 OE2 GLU A 61 110.062 -9.078 13.638 1.00 0.00 O ATOM 0 H GLU A 61 107.558 -4.275 12.145 1.00 0.00 H new ATOM 0 HA GLU A 61 109.075 -5.787 10.012 1.00 0.00 H new ATOM 0 HB2 GLU A 61 109.880 -5.468 12.479 1.00 0.00 H new ATOM 0 HB3 GLU A 61 108.465 -6.380 12.967 1.00 0.00 H new ATOM 0 HG2 GLU A 61 109.224 -8.272 11.440 1.00 0.00 H new ATOM 0 HG3 GLU A 61 110.686 -7.367 11.104 1.00 0.00 H new ATOM 1029 N THR A 62 107.367 -7.555 9.650 1.00 0.00 N ATOM 1030 CA THR A 62 106.265 -8.517 9.331 1.00 0.00 C ATOM 1031 C THR A 62 106.732 -9.959 9.553 1.00 0.00 C ATOM 1032 O THR A 62 107.814 -10.333 9.138 1.00 0.00 O ATOM 1033 CB THR A 62 105.937 -8.272 7.857 1.00 0.00 C ATOM 1034 OG1 THR A 62 107.130 -8.339 7.090 1.00 0.00 O ATOM 1035 CG2 THR A 62 105.301 -6.889 7.702 1.00 0.00 C ATOM 0 H THR A 62 108.198 -7.652 9.067 1.00 0.00 H new ATOM 0 HA THR A 62 105.394 -8.371 9.969 1.00 0.00 H new ATOM 0 HB THR A 62 105.240 -9.032 7.505 1.00 0.00 H new ATOM 0 HG1 THR A 62 107.647 -7.516 7.216 1.00 0.00 H new ATOM 0 HG21 THR A 62 105.066 -6.712 6.652 1.00 0.00 H new ATOM 0 HG22 THR A 62 104.385 -6.841 8.292 1.00 0.00 H new ATOM 0 HG23 THR A 62 105.998 -6.127 8.052 1.00 0.00 H new ATOM 1043 N GLU A 63 105.907 -10.755 10.195 1.00 0.00 N ATOM 1044 CA GLU A 63 106.331 -12.116 10.664 1.00 0.00 C ATOM 1045 C GLU A 63 106.388 -13.120 9.503 1.00 0.00 C ATOM 1046 O GLU A 63 105.983 -12.817 8.396 1.00 0.00 O ATOM 1047 CB GLU A 63 105.308 -12.556 11.726 1.00 0.00 C ATOM 1048 CG GLU A 63 103.885 -12.608 11.150 1.00 0.00 C ATOM 1049 CD GLU A 63 103.001 -13.471 12.052 1.00 0.00 C ATOM 1050 OE1 GLU A 63 103.211 -14.672 12.082 1.00 0.00 O ATOM 1051 OE2 GLU A 63 102.128 -12.915 12.700 1.00 0.00 O ATOM 0 H GLU A 63 104.941 -10.515 10.417 1.00 0.00 H new ATOM 0 HA GLU A 63 107.337 -12.080 11.082 1.00 0.00 H new ATOM 0 HB2 GLU A 63 105.582 -13.538 12.111 1.00 0.00 H new ATOM 0 HB3 GLU A 63 105.336 -11.864 12.568 1.00 0.00 H new ATOM 0 HG2 GLU A 63 103.474 -11.601 11.076 1.00 0.00 H new ATOM 0 HG3 GLU A 63 103.904 -13.019 10.141 1.00 0.00 H new ATOM 1058 N ASP A 64 106.890 -14.309 9.769 1.00 0.00 N ATOM 1059 CA ASP A 64 107.030 -15.356 8.699 1.00 0.00 C ATOM 1060 C ASP A 64 105.638 -15.810 8.246 1.00 0.00 C ATOM 1061 O ASP A 64 104.749 -15.976 9.062 1.00 0.00 O ATOM 1062 CB ASP A 64 107.787 -16.535 9.335 1.00 0.00 C ATOM 1063 CG ASP A 64 109.175 -16.091 9.803 1.00 0.00 C ATOM 1064 OD1 ASP A 64 109.913 -15.559 8.990 1.00 0.00 O ATOM 1065 OD2 ASP A 64 109.478 -16.289 10.968 1.00 0.00 O ATOM 0 H ASP A 64 107.212 -14.601 10.692 1.00 0.00 H new ATOM 0 HA ASP A 64 107.564 -14.972 7.830 1.00 0.00 H new ATOM 0 HB2 ASP A 64 107.220 -16.926 10.180 1.00 0.00 H new ATOM 0 HB3 ASP A 64 107.882 -17.346 8.613 1.00 0.00 H new ATOM 1070 N PHE A 65 105.455 -16.012 6.959 1.00 0.00 N ATOM 1071 CA PHE A 65 104.098 -16.328 6.413 1.00 0.00 C ATOM 1072 C PHE A 65 104.188 -17.418 5.339 1.00 0.00 C ATOM 1073 O PHE A 65 105.267 -17.736 4.871 1.00 0.00 O ATOM 1074 CB PHE A 65 103.584 -15.011 5.821 1.00 0.00 C ATOM 1075 CG PHE A 65 104.450 -14.441 4.720 1.00 0.00 C ATOM 1076 CD1 PHE A 65 104.207 -14.804 3.360 1.00 0.00 C ATOM 1077 CD2 PHE A 65 105.512 -13.538 5.040 1.00 0.00 C ATOM 1078 CE1 PHE A 65 105.025 -14.267 2.318 1.00 0.00 C ATOM 1079 CE2 PHE A 65 106.330 -13.000 3.998 1.00 0.00 C ATOM 1080 CZ PHE A 65 106.086 -13.363 2.638 1.00 0.00 C ATOM 0 H PHE A 65 106.197 -15.970 6.260 1.00 0.00 H new ATOM 0 HA PHE A 65 103.427 -16.711 7.182 1.00 0.00 H new ATOM 0 HB2 PHE A 65 102.579 -15.170 5.430 1.00 0.00 H new ATOM 0 HB3 PHE A 65 103.502 -14.275 6.621 1.00 0.00 H new ATOM 0 HD1 PHE A 65 103.404 -15.485 3.119 1.00 0.00 H new ATOM 0 HD2 PHE A 65 105.696 -13.263 6.068 1.00 0.00 H new ATOM 0 HE1 PHE A 65 104.842 -14.544 1.290 1.00 0.00 H new ATOM 0 HE2 PHE A 65 107.133 -12.319 4.239 1.00 0.00 H new ATOM 0 HZ PHE A 65 106.703 -12.955 1.851 1.00 0.00 H new ATOM 1090 N GLU A 66 103.064 -17.980 4.957 1.00 0.00 N ATOM 1091 CA GLU A 66 103.044 -19.030 3.892 1.00 0.00 C ATOM 1092 C GLU A 66 102.097 -18.629 2.758 1.00 0.00 C ATOM 1093 O GLU A 66 101.112 -17.947 2.978 1.00 0.00 O ATOM 1094 CB GLU A 66 102.539 -20.298 4.589 1.00 0.00 C ATOM 1095 CG GLU A 66 103.721 -21.064 5.193 1.00 0.00 C ATOM 1096 CD GLU A 66 103.221 -22.280 5.982 1.00 0.00 C ATOM 1097 OE1 GLU A 66 102.187 -22.176 6.622 1.00 0.00 O ATOM 1098 OE2 GLU A 66 103.891 -23.299 5.937 1.00 0.00 O ATOM 0 H GLU A 66 102.149 -17.751 5.345 1.00 0.00 H new ATOM 0 HA GLU A 66 104.027 -19.174 3.444 1.00 0.00 H new ATOM 0 HB2 GLU A 66 101.827 -20.035 5.371 1.00 0.00 H new ATOM 0 HB3 GLU A 66 102.010 -20.930 3.876 1.00 0.00 H new ATOM 0 HG2 GLU A 66 104.396 -21.389 4.401 1.00 0.00 H new ATOM 0 HG3 GLU A 66 104.292 -20.407 5.849 1.00 0.00 H new ATOM 1105 N PHE A 67 102.404 -19.052 1.554 1.00 0.00 N ATOM 1106 CA PHE A 67 101.506 -18.812 0.383 1.00 0.00 C ATOM 1107 C PHE A 67 101.640 -19.976 -0.602 1.00 0.00 C ATOM 1108 O PHE A 67 102.736 -20.410 -0.902 1.00 0.00 O ATOM 1109 CB PHE A 67 102.009 -17.505 -0.239 1.00 0.00 C ATOM 1110 CG PHE A 67 101.220 -17.064 -1.450 1.00 0.00 C ATOM 1111 CD1 PHE A 67 101.611 -17.501 -2.754 1.00 0.00 C ATOM 1112 CD2 PHE A 67 100.082 -16.212 -1.294 1.00 0.00 C ATOM 1113 CE1 PHE A 67 100.864 -17.086 -3.901 1.00 0.00 C ATOM 1114 CE2 PHE A 67 99.336 -15.797 -2.440 1.00 0.00 C ATOM 1115 CZ PHE A 67 99.728 -16.235 -3.744 1.00 0.00 C ATOM 0 H PHE A 67 103.258 -19.564 1.332 1.00 0.00 H new ATOM 0 HA PHE A 67 100.454 -18.742 0.659 1.00 0.00 H new ATOM 0 HB2 PHE A 67 101.972 -16.717 0.514 1.00 0.00 H new ATOM 0 HB3 PHE A 67 103.054 -17.627 -0.522 1.00 0.00 H new ATOM 0 HD1 PHE A 67 102.470 -18.144 -2.873 1.00 0.00 H new ATOM 0 HD2 PHE A 67 99.786 -15.882 -0.309 1.00 0.00 H new ATOM 0 HE1 PHE A 67 101.159 -17.416 -4.886 1.00 0.00 H new ATOM 0 HE2 PHE A 67 98.477 -15.153 -2.322 1.00 0.00 H new ATOM 0 HZ PHE A 67 99.164 -15.922 -4.610 1.00 0.00 H new ATOM 1125 N ASN A 68 100.532 -20.487 -1.100 1.00 0.00 N ATOM 1126 CA ASN A 68 100.537 -21.625 -2.087 1.00 0.00 C ATOM 1127 C ASN A 68 101.379 -22.816 -1.595 1.00 0.00 C ATOM 1128 O ASN A 68 101.992 -23.513 -2.384 1.00 0.00 O ATOM 1129 CB ASN A 68 101.111 -21.051 -3.389 1.00 0.00 C ATOM 1130 CG ASN A 68 100.081 -20.125 -4.041 1.00 0.00 C ATOM 1131 OD1 ASN A 68 99.372 -19.409 -3.361 1.00 0.00 O ATOM 1132 ND2 ASN A 68 99.968 -20.108 -5.341 1.00 0.00 N ATOM 0 H ASN A 68 99.599 -20.153 -0.857 1.00 0.00 H new ATOM 0 HA ASN A 68 99.529 -22.016 -2.226 1.00 0.00 H new ATOM 0 HB2 ASN A 68 102.029 -20.501 -3.182 1.00 0.00 H new ATOM 0 HB3 ASN A 68 101.371 -21.860 -4.071 1.00 0.00 H new ATOM 0 HD21 ASN A 68 99.285 -19.494 -5.786 1.00 0.00 H new ATOM 0 HD22 ASN A 68 100.562 -20.708 -5.912 1.00 0.00 H new ATOM 1139 N GLY A 69 101.401 -23.038 -0.301 1.00 0.00 N ATOM 1140 CA GLY A 69 102.117 -24.220 0.275 1.00 0.00 C ATOM 1141 C GLY A 69 103.636 -23.995 0.341 1.00 0.00 C ATOM 1142 O GLY A 69 104.381 -24.948 0.489 1.00 0.00 O ATOM 0 H GLY A 69 100.946 -22.441 0.389 1.00 0.00 H new ATOM 0 HA2 GLY A 69 101.736 -24.422 1.276 1.00 0.00 H new ATOM 0 HA3 GLY A 69 101.907 -25.102 -0.330 1.00 0.00 H new ATOM 1146 N LYS A 70 104.098 -22.766 0.234 1.00 0.00 N ATOM 1147 CA LYS A 70 105.564 -22.477 0.307 1.00 0.00 C ATOM 1148 C LYS A 70 105.839 -21.488 1.443 1.00 0.00 C ATOM 1149 O LYS A 70 105.067 -20.571 1.659 1.00 0.00 O ATOM 1150 CB LYS A 70 105.914 -21.853 -1.045 1.00 0.00 C ATOM 1151 CG LYS A 70 105.783 -22.907 -2.146 1.00 0.00 C ATOM 1152 CD LYS A 70 106.056 -22.264 -3.507 1.00 0.00 C ATOM 1153 CE LYS A 70 107.552 -21.973 -3.644 1.00 0.00 C ATOM 1154 NZ LYS A 70 107.742 -21.601 -5.074 1.00 0.00 N ATOM 0 H LYS A 70 103.510 -21.944 0.098 1.00 0.00 H new ATOM 0 HA LYS A 70 106.157 -23.370 0.505 1.00 0.00 H new ATOM 0 HB2 LYS A 70 105.251 -21.013 -1.251 1.00 0.00 H new ATOM 0 HB3 LYS A 70 106.930 -21.460 -1.023 1.00 0.00 H new ATOM 0 HG2 LYS A 70 106.486 -23.721 -1.970 1.00 0.00 H new ATOM 0 HG3 LYS A 70 104.783 -23.341 -2.131 1.00 0.00 H new ATOM 0 HD2 LYS A 70 105.729 -22.928 -4.307 1.00 0.00 H new ATOM 0 HD3 LYS A 70 105.485 -21.341 -3.606 1.00 0.00 H new ATOM 0 HE2 LYS A 70 107.859 -21.164 -2.981 1.00 0.00 H new ATOM 0 HE3 LYS A 70 108.150 -22.845 -3.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 108.745 -21.387 -5.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 107.448 -22.393 -5.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 107.166 -20.763 -5.294 1.00 0.00 H new ATOM 1168 N ARG A 71 106.927 -21.674 2.155 1.00 0.00 N ATOM 1169 CA ARG A 71 107.242 -20.801 3.329 1.00 0.00 C ATOM 1170 C ARG A 71 108.142 -19.637 2.905 1.00 0.00 C ATOM 1171 O ARG A 71 109.131 -19.836 2.223 1.00 0.00 O ATOM 1172 CB ARG A 71 107.967 -21.709 4.326 1.00 0.00 C ATOM 1173 CG ARG A 71 106.989 -22.755 4.865 1.00 0.00 C ATOM 1174 CD ARG A 71 107.701 -23.653 5.883 1.00 0.00 C ATOM 1175 NE ARG A 71 106.698 -24.694 6.281 1.00 0.00 N ATOM 1176 CZ ARG A 71 107.045 -25.883 6.735 1.00 0.00 C ATOM 1177 NH1 ARG A 71 108.294 -26.250 6.904 1.00 0.00 N ATOM 1178 NH2 ARG A 71 106.101 -26.731 7.041 1.00 0.00 N ATOM 0 H ARG A 71 107.617 -22.402 1.969 1.00 0.00 H new ATOM 0 HA ARG A 71 106.344 -20.361 3.762 1.00 0.00 H new ATOM 0 HB2 ARG A 71 108.811 -22.200 3.841 1.00 0.00 H new ATOM 0 HB3 ARG A 71 108.372 -21.117 5.147 1.00 0.00 H new ATOM 0 HG2 ARG A 71 106.137 -22.263 5.334 1.00 0.00 H new ATOM 0 HG3 ARG A 71 106.598 -23.358 4.045 1.00 0.00 H new ATOM 0 HD2 ARG A 71 108.588 -24.112 5.447 1.00 0.00 H new ATOM 0 HD3 ARG A 71 108.032 -23.078 6.748 1.00 0.00 H new ATOM 0 HE ARG A 71 105.706 -24.474 6.197 1.00 0.00 H new ATOM 0 HH11 ARG A 71 109.050 -25.603 6.681 1.00 0.00 H new ATOM 0 HH12 ARG A 71 108.508 -27.182 7.258 1.00 0.00 H new ATOM 0 HH21 ARG A 71 105.122 -26.468 6.927 1.00 0.00 H new ATOM 0 HH22 ARG A 71 106.342 -27.657 7.394 1.00 0.00 H new ATOM 1192 N PHE A 72 107.796 -18.436 3.310 1.00 0.00 N ATOM 1193 CA PHE A 72 108.620 -17.235 2.980 1.00 0.00 C ATOM 1194 C PHE A 72 109.034 -16.517 4.267 1.00 0.00 C ATOM 1195 O PHE A 72 108.289 -16.501 5.233 1.00 0.00 O ATOM 1196 CB PHE A 72 107.704 -16.349 2.133 1.00 0.00 C ATOM 1197 CG PHE A 72 107.307 -16.983 0.821 1.00 0.00 C ATOM 1198 CD1 PHE A 72 106.187 -17.870 0.765 1.00 0.00 C ATOM 1199 CD2 PHE A 72 108.052 -16.697 -0.364 1.00 0.00 C ATOM 1200 CE1 PHE A 72 105.814 -18.471 -0.476 1.00 0.00 C ATOM 1201 CE2 PHE A 72 107.677 -17.298 -1.607 1.00 0.00 C ATOM 1202 CZ PHE A 72 106.559 -18.185 -1.663 1.00 0.00 C ATOM 0 H PHE A 72 106.963 -18.238 3.864 1.00 0.00 H new ATOM 0 HA PHE A 72 109.538 -17.489 2.450 1.00 0.00 H new ATOM 0 HB2 PHE A 72 106.805 -16.118 2.704 1.00 0.00 H new ATOM 0 HB3 PHE A 72 108.208 -15.403 1.934 1.00 0.00 H new ATOM 0 HD1 PHE A 72 105.623 -18.086 1.661 1.00 0.00 H new ATOM 0 HD2 PHE A 72 108.898 -16.027 -0.321 1.00 0.00 H new ATOM 0 HE1 PHE A 72 104.969 -19.142 -0.518 1.00 0.00 H new ATOM 0 HE2 PHE A 72 108.239 -17.081 -2.503 1.00 0.00 H new ATOM 0 HZ PHE A 72 106.276 -18.639 -2.601 1.00 0.00 H new ATOM 1212 N PHE A 73 110.204 -15.922 4.270 1.00 0.00 N ATOM 1213 CA PHE A 73 110.807 -15.414 5.543 1.00 0.00 C ATOM 1214 C PHE A 73 110.318 -13.992 5.837 1.00 0.00 C ATOM 1215 O PHE A 73 109.937 -13.266 4.936 1.00 0.00 O ATOM 1216 CB PHE A 73 112.321 -15.425 5.322 1.00 0.00 C ATOM 1217 CG PHE A 73 112.879 -16.804 5.057 1.00 0.00 C ATOM 1218 CD1 PHE A 73 113.320 -17.617 6.146 1.00 0.00 C ATOM 1219 CD2 PHE A 73 112.968 -17.293 3.718 1.00 0.00 C ATOM 1220 CE1 PHE A 73 113.849 -18.922 5.896 1.00 0.00 C ATOM 1221 CE2 PHE A 73 113.497 -18.598 3.467 1.00 0.00 C ATOM 1222 CZ PHE A 73 113.938 -19.412 4.556 1.00 0.00 C ATOM 0 H PHE A 73 110.771 -15.766 3.437 1.00 0.00 H new ATOM 0 HA PHE A 73 110.523 -16.031 6.395 1.00 0.00 H new ATOM 0 HB2 PHE A 73 112.563 -14.776 4.481 1.00 0.00 H new ATOM 0 HB3 PHE A 73 112.812 -15.005 6.200 1.00 0.00 H new ATOM 0 HD1 PHE A 73 113.254 -17.246 7.158 1.00 0.00 H new ATOM 0 HD2 PHE A 73 112.636 -16.677 2.895 1.00 0.00 H new ATOM 0 HE1 PHE A 73 114.181 -19.537 6.719 1.00 0.00 H new ATOM 0 HE2 PHE A 73 113.563 -18.968 2.455 1.00 0.00 H new ATOM 0 HZ PHE A 73 114.338 -20.397 4.367 1.00 0.00 H new ATOM 1232 N GLY A 74 110.333 -13.607 7.094 1.00 0.00 N ATOM 1233 CA GLY A 74 109.817 -12.267 7.508 1.00 0.00 C ATOM 1234 C GLY A 74 110.720 -11.163 6.953 1.00 0.00 C ATOM 1235 O GLY A 74 111.856 -11.411 6.585 1.00 0.00 O ATOM 0 H GLY A 74 110.688 -14.178 7.861 1.00 0.00 H new ATOM 0 HA2 GLY A 74 108.798 -12.132 7.144 1.00 0.00 H new ATOM 0 HA3 GLY A 74 109.778 -12.204 8.595 1.00 0.00 H new ATOM 1239 N VAL A 75 110.212 -9.954 6.899 1.00 0.00 N ATOM 1240 CA VAL A 75 110.965 -8.826 6.261 1.00 0.00 C ATOM 1241 C VAL A 75 110.799 -7.542 7.080 1.00 0.00 C ATOM 1242 O VAL A 75 109.846 -7.402 7.823 1.00 0.00 O ATOM 1243 CB VAL A 75 110.391 -8.659 4.842 1.00 0.00 C ATOM 1244 CG1 VAL A 75 110.661 -9.926 4.026 1.00 0.00 C ATOM 1245 CG2 VAL A 75 108.878 -8.399 4.876 1.00 0.00 C ATOM 0 H VAL A 75 109.298 -9.698 7.274 1.00 0.00 H new ATOM 0 HA VAL A 75 112.034 -9.037 6.219 1.00 0.00 H new ATOM 0 HB VAL A 75 110.880 -7.800 4.382 1.00 0.00 H new ATOM 0 HG11 VAL A 75 110.254 -9.806 3.022 1.00 0.00 H new ATOM 0 HG12 VAL A 75 111.736 -10.097 3.964 1.00 0.00 H new ATOM 0 HG13 VAL A 75 110.186 -10.779 4.510 1.00 0.00 H new ATOM 0 HG21 VAL A 75 108.505 -8.286 3.858 1.00 0.00 H new ATOM 0 HG22 VAL A 75 108.375 -9.239 5.355 1.00 0.00 H new ATOM 0 HG23 VAL A 75 108.678 -7.487 5.439 1.00 0.00 H new ATOM 1255 N LYS A 76 111.724 -6.620 6.940 1.00 0.00 N ATOM 1256 CA LYS A 76 111.621 -5.303 7.642 1.00 0.00 C ATOM 1257 C LYS A 76 111.478 -4.181 6.610 1.00 0.00 C ATOM 1258 O LYS A 76 112.173 -4.178 5.608 1.00 0.00 O ATOM 1259 CB LYS A 76 112.935 -5.151 8.415 1.00 0.00 C ATOM 1260 CG LYS A 76 113.041 -6.233 9.494 1.00 0.00 C ATOM 1261 CD LYS A 76 114.223 -5.925 10.415 1.00 0.00 C ATOM 1262 CE LYS A 76 115.537 -6.184 9.673 1.00 0.00 C ATOM 1263 NZ LYS A 76 116.606 -5.837 10.650 1.00 0.00 N ATOM 0 H LYS A 76 112.557 -6.728 6.361 1.00 0.00 H new ATOM 0 HA LYS A 76 110.757 -5.253 8.304 1.00 0.00 H new ATOM 0 HB2 LYS A 76 113.779 -5.226 7.730 1.00 0.00 H new ATOM 0 HB3 LYS A 76 112.984 -4.163 8.874 1.00 0.00 H new ATOM 0 HG2 LYS A 76 112.118 -6.276 10.072 1.00 0.00 H new ATOM 0 HG3 LYS A 76 113.173 -7.211 9.031 1.00 0.00 H new ATOM 0 HD2 LYS A 76 114.179 -4.887 10.744 1.00 0.00 H new ATOM 0 HD3 LYS A 76 114.171 -6.546 11.309 1.00 0.00 H new ATOM 0 HE2 LYS A 76 115.614 -7.224 9.357 1.00 0.00 H new ATOM 0 HE3 LYS A 76 115.610 -5.572 8.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 117.406 -5.401 10.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 116.231 -5.167 11.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 116.929 -6.700 11.133 1.00 0.00 H new ATOM 1277 N VAL A 77 110.592 -3.243 6.854 1.00 0.00 N ATOM 1278 CA VAL A 77 110.329 -2.151 5.861 1.00 0.00 C ATOM 1279 C VAL A 77 110.291 -0.801 6.590 1.00 0.00 C ATOM 1280 O VAL A 77 109.758 -0.702 7.680 1.00 0.00 O ATOM 1281 CB VAL A 77 108.967 -2.482 5.220 1.00 0.00 C ATOM 1282 CG1 VAL A 77 108.604 -1.437 4.157 1.00 0.00 C ATOM 1283 CG2 VAL A 77 109.015 -3.855 4.538 1.00 0.00 C ATOM 0 H VAL A 77 110.035 -3.187 7.707 1.00 0.00 H new ATOM 0 HA VAL A 77 111.104 -2.084 5.098 1.00 0.00 H new ATOM 0 HB VAL A 77 108.220 -2.483 6.014 1.00 0.00 H new ATOM 0 HG11 VAL A 77 107.639 -1.687 3.715 1.00 0.00 H new ATOM 0 HG12 VAL A 77 108.547 -0.452 4.620 1.00 0.00 H new ATOM 0 HG13 VAL A 77 109.368 -1.429 3.379 1.00 0.00 H new ATOM 0 HG21 VAL A 77 108.045 -4.073 4.091 1.00 0.00 H new ATOM 0 HG22 VAL A 77 109.780 -3.849 3.761 1.00 0.00 H new ATOM 0 HG23 VAL A 77 109.254 -4.620 5.277 1.00 0.00 H new ATOM 1293 N LEU A 78 110.854 0.224 5.987 1.00 0.00 N ATOM 1294 CA LEU A 78 110.822 1.592 6.594 1.00 0.00 C ATOM 1295 C LEU A 78 110.507 2.644 5.511 1.00 0.00 C ATOM 1296 O LEU A 78 111.204 2.680 4.515 1.00 0.00 O ATOM 1297 CB LEU A 78 112.235 1.783 7.153 1.00 0.00 C ATOM 1298 CG LEU A 78 112.349 3.111 7.909 1.00 0.00 C ATOM 1299 CD1 LEU A 78 111.515 3.064 9.192 1.00 0.00 C ATOM 1300 CD2 LEU A 78 113.815 3.346 8.278 1.00 0.00 C ATOM 0 H LEU A 78 111.338 0.167 5.091 1.00 0.00 H new ATOM 0 HA LEU A 78 110.057 1.703 7.362 1.00 0.00 H new ATOM 0 HB2 LEU A 78 112.481 0.957 7.821 1.00 0.00 H new ATOM 0 HB3 LEU A 78 112.959 1.760 6.338 1.00 0.00 H new ATOM 0 HG LEU A 78 111.981 3.917 7.274 1.00 0.00 H new ATOM 0 HD11 LEU A 78 111.605 4.014 9.719 1.00 0.00 H new ATOM 0 HD12 LEU A 78 110.469 2.886 8.940 1.00 0.00 H new ATOM 0 HD13 LEU A 78 111.876 2.258 9.831 1.00 0.00 H new ATOM 0 HD21 LEU A 78 113.908 4.289 8.817 1.00 0.00 H new ATOM 0 HD22 LEU A 78 114.166 2.531 8.910 1.00 0.00 H new ATOM 0 HD23 LEU A 78 114.417 3.386 7.370 1.00 0.00 H new ATOM 1312 N PRO A 79 109.486 3.468 5.710 1.00 0.00 N ATOM 1313 CA PRO A 79 109.160 4.549 4.720 1.00 0.00 C ATOM 1314 C PRO A 79 110.298 5.572 4.614 1.00 0.00 C ATOM 1315 O PRO A 79 110.998 5.826 5.578 1.00 0.00 O ATOM 1316 CB PRO A 79 107.906 5.203 5.309 1.00 0.00 C ATOM 1317 CG PRO A 79 107.328 4.142 6.179 1.00 0.00 C ATOM 1318 CD PRO A 79 108.516 3.501 6.826 1.00 0.00 C ATOM 0 HA PRO A 79 109.015 4.162 3.711 1.00 0.00 H new ATOM 0 HB2 PRO A 79 108.152 6.098 5.880 1.00 0.00 H new ATOM 0 HB3 PRO A 79 107.208 5.505 4.528 1.00 0.00 H new ATOM 0 HG2 PRO A 79 106.650 4.563 6.922 1.00 0.00 H new ATOM 0 HG3 PRO A 79 106.755 3.420 5.597 1.00 0.00 H new ATOM 0 HD2 PRO A 79 108.885 4.082 7.671 1.00 0.00 H new ATOM 0 HD3 PRO A 79 108.289 2.503 7.200 1.00 0.00 H new ATOM 1326 N ILE A 80 110.475 6.150 3.446 1.00 0.00 N ATOM 1327 CA ILE A 80 111.437 7.288 3.275 1.00 0.00 C ATOM 1328 C ILE A 80 110.868 8.328 2.301 1.00 0.00 C ATOM 1329 O ILE A 80 109.867 8.087 1.650 1.00 0.00 O ATOM 1330 CB ILE A 80 112.743 6.683 2.726 1.00 0.00 C ATOM 1331 CG1 ILE A 80 112.501 5.956 1.391 1.00 0.00 C ATOM 1332 CG2 ILE A 80 113.327 5.704 3.749 1.00 0.00 C ATOM 1333 CD1 ILE A 80 113.839 5.592 0.739 1.00 0.00 C ATOM 0 H ILE A 80 109.986 5.877 2.593 1.00 0.00 H new ATOM 0 HA ILE A 80 111.614 7.799 4.221 1.00 0.00 H new ATOM 0 HB ILE A 80 113.448 7.495 2.549 1.00 0.00 H new ATOM 0 HG12 ILE A 80 111.913 5.054 1.561 1.00 0.00 H new ATOM 0 HG13 ILE A 80 111.922 6.592 0.721 1.00 0.00 H new ATOM 0 HG21 ILE A 80 114.251 5.277 3.358 1.00 0.00 H new ATOM 0 HG22 ILE A 80 113.536 6.232 4.679 1.00 0.00 H new ATOM 0 HG23 ILE A 80 112.610 4.905 3.938 1.00 0.00 H new ATOM 0 HD11 ILE A 80 113.656 5.078 -0.205 1.00 0.00 H new ATOM 0 HD12 ILE A 80 114.412 6.500 0.552 1.00 0.00 H new ATOM 0 HD13 ILE A 80 114.402 4.938 1.405 1.00 0.00 H new ATOM 1345 N LYS A 81 111.506 9.470 2.210 1.00 0.00 N ATOM 1346 CA LYS A 81 111.212 10.434 1.105 1.00 0.00 C ATOM 1347 C LYS A 81 112.449 10.573 0.215 1.00 0.00 C ATOM 1348 O LYS A 81 113.544 10.761 0.712 1.00 0.00 O ATOM 1349 CB LYS A 81 110.891 11.760 1.797 1.00 0.00 C ATOM 1350 CG LYS A 81 109.588 11.632 2.590 1.00 0.00 C ATOM 1351 CD LYS A 81 108.403 11.563 1.624 1.00 0.00 C ATOM 1352 CE LYS A 81 107.122 11.976 2.354 1.00 0.00 C ATOM 1353 NZ LYS A 81 106.673 10.749 3.069 1.00 0.00 N ATOM 0 H LYS A 81 112.227 9.778 2.863 1.00 0.00 H new ATOM 0 HA LYS A 81 110.386 10.109 0.472 1.00 0.00 H new ATOM 0 HB2 LYS A 81 111.707 12.039 2.464 1.00 0.00 H new ATOM 0 HB3 LYS A 81 110.799 12.554 1.056 1.00 0.00 H new ATOM 0 HG2 LYS A 81 109.616 10.737 3.212 1.00 0.00 H new ATOM 0 HG3 LYS A 81 109.474 12.483 3.261 1.00 0.00 H new ATOM 0 HD2 LYS A 81 108.576 12.220 0.772 1.00 0.00 H new ATOM 0 HD3 LYS A 81 108.300 10.552 1.231 1.00 0.00 H new ATOM 0 HE2 LYS A 81 107.311 12.792 3.051 1.00 0.00 H new ATOM 0 HE3 LYS A 81 106.363 12.324 1.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 106.167 11.018 3.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 106.038 10.201 2.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 107.500 10.169 3.317 1.00 0.00 H new ATOM 1367 N ILE A 82 112.276 10.480 -1.083 1.00 0.00 N ATOM 1368 CA ILE A 82 113.440 10.502 -2.024 1.00 0.00 C ATOM 1369 C ILE A 82 113.481 11.866 -2.725 1.00 0.00 C ATOM 1370 O ILE A 82 112.513 12.266 -3.348 1.00 0.00 O ATOM 1371 CB ILE A 82 113.198 9.356 -3.026 1.00 0.00 C ATOM 1372 CG1 ILE A 82 113.123 8.009 -2.293 1.00 0.00 C ATOM 1373 CG2 ILE A 82 114.346 9.282 -4.041 1.00 0.00 C ATOM 1374 CD1 ILE A 82 112.425 6.977 -3.184 1.00 0.00 C ATOM 0 H ILE A 82 111.366 10.389 -1.535 1.00 0.00 H new ATOM 0 HA ILE A 82 114.397 10.364 -1.520 1.00 0.00 H new ATOM 0 HB ILE A 82 112.257 9.556 -3.538 1.00 0.00 H new ATOM 0 HG12 ILE A 82 114.126 7.666 -2.039 1.00 0.00 H new ATOM 0 HG13 ILE A 82 112.578 8.123 -1.356 1.00 0.00 H new ATOM 0 HG21 ILE A 82 114.160 8.468 -4.742 1.00 0.00 H new ATOM 0 HG22 ILE A 82 114.410 10.223 -4.587 1.00 0.00 H new ATOM 0 HG23 ILE A 82 115.284 9.102 -3.516 1.00 0.00 H new ATOM 0 HD11 ILE A 82 112.373 6.022 -2.662 1.00 0.00 H new ATOM 0 HD12 ILE A 82 111.416 7.319 -3.416 1.00 0.00 H new ATOM 0 HD13 ILE A 82 112.988 6.855 -4.109 1.00 0.00 H new ATOM 1386 N LEU A 83 114.590 12.560 -2.619 1.00 0.00 N ATOM 1387 CA LEU A 83 114.713 13.920 -3.228 1.00 0.00 C ATOM 1388 C LEU A 83 115.642 13.873 -4.445 1.00 0.00 C ATOM 1389 O LEU A 83 116.815 13.567 -4.320 1.00 0.00 O ATOM 1390 CB LEU A 83 115.318 14.800 -2.130 1.00 0.00 C ATOM 1391 CG LEU A 83 114.338 14.933 -0.961 1.00 0.00 C ATOM 1392 CD1 LEU A 83 115.049 15.581 0.230 1.00 0.00 C ATOM 1393 CD2 LEU A 83 113.154 15.808 -1.379 1.00 0.00 C ATOM 0 H LEU A 83 115.424 12.236 -2.130 1.00 0.00 H new ATOM 0 HA LEU A 83 113.752 14.302 -3.573 1.00 0.00 H new ATOM 0 HB2 LEU A 83 116.255 14.366 -1.781 1.00 0.00 H new ATOM 0 HB3 LEU A 83 115.553 15.786 -2.532 1.00 0.00 H new ATOM 0 HG LEU A 83 113.978 13.944 -0.679 1.00 0.00 H new ATOM 0 HD11 LEU A 83 114.352 15.676 1.062 1.00 0.00 H new ATOM 0 HD12 LEU A 83 115.892 14.960 0.532 1.00 0.00 H new ATOM 0 HD13 LEU A 83 115.410 16.569 -0.055 1.00 0.00 H new ATOM 0 HD21 LEU A 83 112.458 15.901 -0.545 1.00 0.00 H new ATOM 0 HD22 LEU A 83 113.515 16.797 -1.663 1.00 0.00 H new ATOM 0 HD23 LEU A 83 112.645 15.350 -2.227 1.00 0.00 H new ATOM 1405 N ILE A 84 115.114 14.174 -5.611 1.00 0.00 N ATOM 1406 CA ILE A 84 115.951 14.234 -6.851 1.00 0.00 C ATOM 1407 C ILE A 84 115.661 15.562 -7.561 1.00 0.00 C ATOM 1408 O ILE A 84 114.527 15.843 -7.903 1.00 0.00 O ATOM 1409 CB ILE A 84 115.524 13.029 -7.712 1.00 0.00 C ATOM 1410 CG1 ILE A 84 115.767 11.716 -6.955 1.00 0.00 C ATOM 1411 CG2 ILE A 84 116.336 12.990 -9.014 1.00 0.00 C ATOM 1412 CD1 ILE A 84 115.026 10.573 -7.652 1.00 0.00 C ATOM 0 H ILE A 84 114.126 14.383 -5.755 1.00 0.00 H new ATOM 0 HA ILE A 84 117.021 14.188 -6.649 1.00 0.00 H new ATOM 0 HB ILE A 84 114.463 13.138 -7.936 1.00 0.00 H new ATOM 0 HG12 ILE A 84 116.835 11.500 -6.916 1.00 0.00 H new ATOM 0 HG13 ILE A 84 115.423 11.810 -5.925 1.00 0.00 H new ATOM 0 HG21 ILE A 84 116.024 12.134 -9.612 1.00 0.00 H new ATOM 0 HG22 ILE A 84 116.165 13.908 -9.577 1.00 0.00 H new ATOM 0 HG23 ILE A 84 117.397 12.901 -8.779 1.00 0.00 H new ATOM 0 HD11 ILE A 84 115.201 9.643 -7.112 1.00 0.00 H new ATOM 0 HD12 ILE A 84 113.958 10.788 -7.667 1.00 0.00 H new ATOM 0 HD13 ILE A 84 115.391 10.473 -8.674 1.00 0.00 H new ATOM 1424 N GLY A 85 116.676 16.369 -7.774 1.00 0.00 N ATOM 1425 CA GLY A 85 116.486 17.705 -8.426 1.00 0.00 C ATOM 1426 C GLY A 85 115.619 18.603 -7.537 1.00 0.00 C ATOM 1427 O GLY A 85 115.978 18.890 -6.409 1.00 0.00 O ATOM 0 H GLY A 85 117.640 16.155 -7.520 1.00 0.00 H new ATOM 0 HA2 GLY A 85 117.454 18.176 -8.599 1.00 0.00 H new ATOM 0 HA3 GLY A 85 116.014 17.580 -9.401 1.00 0.00 H new ATOM 1431 N ASN A 86 114.489 19.040 -8.047 1.00 0.00 N ATOM 1432 CA ASN A 86 113.529 19.847 -7.231 1.00 0.00 C ATOM 1433 C ASN A 86 112.237 19.070 -6.935 1.00 0.00 C ATOM 1434 O ASN A 86 111.244 19.669 -6.561 1.00 0.00 O ATOM 1435 CB ASN A 86 113.222 21.074 -8.091 1.00 0.00 C ATOM 1436 CG ASN A 86 114.468 21.957 -8.188 1.00 0.00 C ATOM 1437 OD1 ASN A 86 114.907 22.292 -9.269 1.00 0.00 O ATOM 1438 ND2 ASN A 86 115.059 22.351 -7.093 1.00 0.00 N ATOM 0 H ASN A 86 114.190 18.868 -9.007 1.00 0.00 H new ATOM 0 HA ASN A 86 113.953 20.105 -6.261 1.00 0.00 H new ATOM 0 HB2 ASN A 86 112.906 20.763 -9.087 1.00 0.00 H new ATOM 0 HB3 ASN A 86 112.397 21.638 -7.656 1.00 0.00 H new ATOM 0 HD21 ASN A 86 115.890 22.940 -7.146 1.00 0.00 H new ATOM 0 HD22 ASN A 86 114.690 22.069 -6.185 1.00 0.00 H new ATOM 1445 N LYS A 87 112.237 17.761 -7.094 1.00 0.00 N ATOM 1446 CA LYS A 87 110.985 16.959 -6.920 1.00 0.00 C ATOM 1447 C LYS A 87 111.156 15.937 -5.792 1.00 0.00 C ATOM 1448 O LYS A 87 112.225 15.378 -5.621 1.00 0.00 O ATOM 1449 CB LYS A 87 110.781 16.245 -8.258 1.00 0.00 C ATOM 1450 CG LYS A 87 110.445 17.271 -9.343 1.00 0.00 C ATOM 1451 CD LYS A 87 110.135 16.544 -10.652 1.00 0.00 C ATOM 1452 CE LYS A 87 109.908 17.571 -11.765 1.00 0.00 C ATOM 1453 NZ LYS A 87 109.042 16.875 -12.758 1.00 0.00 N ATOM 0 H LYS A 87 113.062 17.213 -7.339 1.00 0.00 H new ATOM 0 HA LYS A 87 110.133 17.585 -6.654 1.00 0.00 H new ATOM 0 HB2 LYS A 87 111.683 15.696 -8.530 1.00 0.00 H new ATOM 0 HB3 LYS A 87 109.976 15.515 -8.173 1.00 0.00 H new ATOM 0 HG2 LYS A 87 109.589 17.873 -9.037 1.00 0.00 H new ATOM 0 HG3 LYS A 87 111.282 17.955 -9.484 1.00 0.00 H new ATOM 0 HD2 LYS A 87 110.959 15.881 -10.916 1.00 0.00 H new ATOM 0 HD3 LYS A 87 109.250 15.919 -10.533 1.00 0.00 H new ATOM 0 HE2 LYS A 87 109.425 18.470 -11.381 1.00 0.00 H new ATOM 0 HE3 LYS A 87 110.851 17.883 -12.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 108.842 17.515 -13.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 109.530 16.027 -13.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 108.149 16.596 -12.304 1.00 0.00 H new ATOM 1467 N LYS A 88 110.110 15.699 -5.034 1.00 0.00 N ATOM 1468 CA LYS A 88 110.159 14.684 -3.933 1.00 0.00 C ATOM 1469 C LYS A 88 109.064 13.629 -4.133 1.00 0.00 C ATOM 1470 O LYS A 88 107.911 13.962 -4.342 1.00 0.00 O ATOM 1471 CB LYS A 88 109.967 15.468 -2.622 1.00 0.00 C ATOM 1472 CG LYS A 88 108.627 16.215 -2.593 1.00 0.00 C ATOM 1473 CD LYS A 88 108.516 17.006 -1.288 1.00 0.00 C ATOM 1474 CE LYS A 88 107.085 17.525 -1.125 1.00 0.00 C ATOM 1475 NZ LYS A 88 107.038 18.781 -1.925 1.00 0.00 N ATOM 0 H LYS A 88 109.212 16.172 -5.134 1.00 0.00 H new ATOM 0 HA LYS A 88 111.105 14.143 -3.918 1.00 0.00 H new ATOM 0 HB2 LYS A 88 110.018 14.781 -1.777 1.00 0.00 H new ATOM 0 HB3 LYS A 88 110.783 16.181 -2.503 1.00 0.00 H new ATOM 0 HG2 LYS A 88 108.555 16.889 -3.447 1.00 0.00 H new ATOM 0 HG3 LYS A 88 107.802 15.508 -2.674 1.00 0.00 H new ATOM 0 HD2 LYS A 88 108.783 16.372 -0.442 1.00 0.00 H new ATOM 0 HD3 LYS A 88 109.218 17.840 -1.295 1.00 0.00 H new ATOM 0 HE2 LYS A 88 106.358 16.798 -1.488 1.00 0.00 H new ATOM 0 HE3 LYS A 88 106.851 17.715 -0.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 106.087 19.197 -1.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 107.736 19.456 -1.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 107.258 18.568 -2.919 1.00 0.00 H new ATOM 1489 N ILE A 89 109.430 12.369 -4.070 1.00 0.00 N ATOM 1490 CA ILE A 89 108.439 11.259 -4.242 1.00 0.00 C ATOM 1491 C ILE A 89 108.523 10.326 -3.026 1.00 0.00 C ATOM 1492 O ILE A 89 109.595 10.103 -2.495 1.00 0.00 O ATOM 1493 CB ILE A 89 108.838 10.532 -5.541 1.00 0.00 C ATOM 1494 CG1 ILE A 89 108.787 11.499 -6.732 1.00 0.00 C ATOM 1495 CG2 ILE A 89 107.873 9.374 -5.824 1.00 0.00 C ATOM 1496 CD1 ILE A 89 109.523 10.885 -7.926 1.00 0.00 C ATOM 0 H ILE A 89 110.388 12.060 -3.904 1.00 0.00 H new ATOM 0 HA ILE A 89 107.411 11.616 -4.310 1.00 0.00 H new ATOM 0 HB ILE A 89 109.851 10.151 -5.412 1.00 0.00 H new ATOM 0 HG12 ILE A 89 107.751 11.708 -6.999 1.00 0.00 H new ATOM 0 HG13 ILE A 89 109.244 12.450 -6.460 1.00 0.00 H new ATOM 0 HG21 ILE A 89 108.168 8.871 -6.745 1.00 0.00 H new ATOM 0 HG22 ILE A 89 107.903 8.665 -4.997 1.00 0.00 H new ATOM 0 HG23 ILE A 89 106.860 9.762 -5.932 1.00 0.00 H new ATOM 0 HD11 ILE A 89 109.485 11.574 -8.770 1.00 0.00 H new ATOM 0 HD12 ILE A 89 110.562 10.699 -7.656 1.00 0.00 H new ATOM 0 HD13 ILE A 89 109.046 9.945 -8.203 1.00 0.00 H new ATOM 1508 N ASP A 90 107.400 9.794 -2.595 1.00 0.00 N ATOM 1509 CA ASP A 90 107.394 8.838 -1.439 1.00 0.00 C ATOM 1510 C ASP A 90 107.956 7.483 -1.879 1.00 0.00 C ATOM 1511 O ASP A 90 107.636 7.001 -2.951 1.00 0.00 O ATOM 1512 CB ASP A 90 105.929 8.690 -1.012 1.00 0.00 C ATOM 1513 CG ASP A 90 105.412 10.026 -0.475 1.00 0.00 C ATOM 1514 OD1 ASP A 90 104.901 10.802 -1.265 1.00 0.00 O ATOM 1515 OD2 ASP A 90 105.535 10.249 0.718 1.00 0.00 O ATOM 0 H ASP A 90 106.482 9.983 -2.998 1.00 0.00 H new ATOM 0 HA ASP A 90 108.011 9.201 -0.617 1.00 0.00 H new ATOM 0 HB2 ASP A 90 105.324 8.369 -1.860 1.00 0.00 H new ATOM 0 HB3 ASP A 90 105.839 7.920 -0.246 1.00 0.00 H new ATOM 1520 N GLY A 91 108.785 6.879 -1.057 1.00 0.00 N ATOM 1521 CA GLY A 91 109.353 5.536 -1.379 1.00 0.00 C ATOM 1522 C GLY A 91 109.573 4.758 -0.081 1.00 0.00 C ATOM 1523 O GLY A 91 109.060 5.134 0.959 1.00 0.00 O ATOM 0 H GLY A 91 109.094 7.268 -0.166 1.00 0.00 H new ATOM 0 HA2 GLY A 91 108.675 4.989 -2.034 1.00 0.00 H new ATOM 0 HA3 GLY A 91 110.296 5.646 -1.915 1.00 0.00 H new ATOM 1527 N ALA A 92 110.331 3.686 -0.140 1.00 0.00 N ATOM 1528 CA ALA A 92 110.593 2.857 1.077 1.00 0.00 C ATOM 1529 C ALA A 92 111.852 2.009 0.881 1.00 0.00 C ATOM 1530 O ALA A 92 112.242 1.731 -0.237 1.00 0.00 O ATOM 1531 CB ALA A 92 109.358 1.966 1.223 1.00 0.00 C ATOM 0 H ALA A 92 110.783 3.349 -0.990 1.00 0.00 H new ATOM 0 HA ALA A 92 110.761 3.467 1.964 1.00 0.00 H new ATOM 0 HB1 ALA A 92 109.473 1.325 2.097 1.00 0.00 H new ATOM 0 HB2 ALA A 92 108.472 2.589 1.344 1.00 0.00 H new ATOM 0 HB3 ALA A 92 109.248 1.348 0.332 1.00 0.00 H new ATOM 1537 N ILE A 93 112.477 1.605 1.965 1.00 0.00 N ATOM 1538 CA ILE A 93 113.686 0.726 1.882 1.00 0.00 C ATOM 1539 C ILE A 93 113.300 -0.675 2.371 1.00 0.00 C ATOM 1540 O ILE A 93 112.533 -0.810 3.309 1.00 0.00 O ATOM 1541 CB ILE A 93 114.746 1.356 2.808 1.00 0.00 C ATOM 1542 CG1 ILE A 93 115.065 2.793 2.374 1.00 0.00 C ATOM 1543 CG2 ILE A 93 116.046 0.543 2.755 1.00 0.00 C ATOM 1544 CD1 ILE A 93 115.823 3.511 3.494 1.00 0.00 C ATOM 0 H ILE A 93 112.195 1.851 2.914 1.00 0.00 H new ATOM 0 HA ILE A 93 114.073 0.641 0.867 1.00 0.00 H new ATOM 0 HB ILE A 93 114.341 1.358 3.820 1.00 0.00 H new ATOM 0 HG12 ILE A 93 115.664 2.784 1.463 1.00 0.00 H new ATOM 0 HG13 ILE A 93 114.143 3.327 2.144 1.00 0.00 H new ATOM 0 HG21 ILE A 93 116.787 0.998 3.413 1.00 0.00 H new ATOM 0 HG22 ILE A 93 115.850 -0.479 3.081 1.00 0.00 H new ATOM 0 HG23 ILE A 93 116.426 0.531 1.734 1.00 0.00 H new ATOM 0 HD11 ILE A 93 116.049 4.531 3.184 1.00 0.00 H new ATOM 0 HD12 ILE A 93 115.208 3.533 4.394 1.00 0.00 H new ATOM 0 HD13 ILE A 93 116.752 2.981 3.702 1.00 0.00 H new ATOM 1556 N VAL A 94 113.830 -1.699 1.739 1.00 0.00 N ATOM 1557 CA VAL A 94 113.442 -3.105 2.080 1.00 0.00 C ATOM 1558 C VAL A 94 114.700 -3.900 2.455 1.00 0.00 C ATOM 1559 O VAL A 94 115.686 -3.877 1.740 1.00 0.00 O ATOM 1560 CB VAL A 94 112.773 -3.676 0.813 1.00 0.00 C ATOM 1561 CG1 VAL A 94 112.307 -5.117 1.055 1.00 0.00 C ATOM 1562 CG2 VAL A 94 111.546 -2.838 0.432 1.00 0.00 C ATOM 0 H VAL A 94 114.522 -1.617 0.994 1.00 0.00 H new ATOM 0 HA VAL A 94 112.761 -3.158 2.930 1.00 0.00 H new ATOM 0 HB VAL A 94 113.509 -3.651 0.010 1.00 0.00 H new ATOM 0 HG11 VAL A 94 111.837 -5.504 0.151 1.00 0.00 H new ATOM 0 HG12 VAL A 94 113.165 -5.738 1.313 1.00 0.00 H new ATOM 0 HG13 VAL A 94 111.587 -5.134 1.873 1.00 0.00 H new ATOM 0 HG21 VAL A 94 111.085 -3.254 -0.464 1.00 0.00 H new ATOM 0 HG22 VAL A 94 110.826 -2.853 1.251 1.00 0.00 H new ATOM 0 HG23 VAL A 94 111.853 -1.810 0.238 1.00 0.00 H new ATOM 1572 N VAL A 95 114.655 -4.595 3.569 1.00 0.00 N ATOM 1573 CA VAL A 95 115.792 -5.478 3.983 1.00 0.00 C ATOM 1574 C VAL A 95 115.212 -6.742 4.651 1.00 0.00 C ATOM 1575 O VAL A 95 114.296 -6.616 5.441 1.00 0.00 O ATOM 1576 CB VAL A 95 116.627 -4.649 4.978 1.00 0.00 C ATOM 1577 CG1 VAL A 95 117.832 -5.459 5.472 1.00 0.00 C ATOM 1578 CG2 VAL A 95 117.153 -3.378 4.300 1.00 0.00 C ATOM 0 H VAL A 95 113.867 -4.587 4.217 1.00 0.00 H new ATOM 0 HA VAL A 95 116.411 -5.800 3.146 1.00 0.00 H new ATOM 0 HB VAL A 95 115.983 -4.389 5.818 1.00 0.00 H new ATOM 0 HG11 VAL A 95 118.411 -4.859 6.174 1.00 0.00 H new ATOM 0 HG12 VAL A 95 117.483 -6.363 5.970 1.00 0.00 H new ATOM 0 HG13 VAL A 95 118.460 -5.731 4.624 1.00 0.00 H new ATOM 0 HG21 VAL A 95 117.741 -2.802 5.014 1.00 0.00 H new ATOM 0 HG22 VAL A 95 117.779 -3.651 3.451 1.00 0.00 H new ATOM 0 HG23 VAL A 95 116.313 -2.777 3.953 1.00 0.00 H new ATOM 1588 N PRO A 96 115.738 -7.919 4.335 1.00 0.00 N ATOM 1589 CA PRO A 96 115.252 -9.184 4.985 1.00 0.00 C ATOM 1590 C PRO A 96 115.376 -9.127 6.515 1.00 0.00 C ATOM 1591 O PRO A 96 116.209 -8.413 7.043 1.00 0.00 O ATOM 1592 CB PRO A 96 116.188 -10.252 4.414 1.00 0.00 C ATOM 1593 CG PRO A 96 116.607 -9.685 3.104 1.00 0.00 C ATOM 1594 CD PRO A 96 116.806 -8.222 3.360 1.00 0.00 C ATOM 0 HA PRO A 96 114.197 -9.372 4.787 1.00 0.00 H new ATOM 0 HB2 PRO A 96 117.043 -10.427 5.067 1.00 0.00 H new ATOM 0 HB3 PRO A 96 115.679 -11.208 4.293 1.00 0.00 H new ATOM 0 HG2 PRO A 96 117.525 -10.152 2.748 1.00 0.00 H new ATOM 0 HG3 PRO A 96 115.847 -9.852 2.340 1.00 0.00 H new ATOM 0 HD2 PRO A 96 117.796 -8.012 3.765 1.00 0.00 H new ATOM 0 HD3 PRO A 96 116.702 -7.633 2.449 1.00 0.00 H new ATOM 1602 N LYS A 97 114.548 -9.876 7.212 1.00 0.00 N ATOM 1603 CA LYS A 97 114.574 -9.871 8.714 1.00 0.00 C ATOM 1604 C LYS A 97 115.904 -10.429 9.236 1.00 0.00 C ATOM 1605 O LYS A 97 116.399 -9.985 10.256 1.00 0.00 O ATOM 1606 CB LYS A 97 113.411 -10.763 9.169 1.00 0.00 C ATOM 1607 CG LYS A 97 113.199 -10.607 10.676 1.00 0.00 C ATOM 1608 CD LYS A 97 112.107 -11.571 11.141 1.00 0.00 C ATOM 1609 CE LYS A 97 111.828 -11.351 12.629 1.00 0.00 C ATOM 1610 NZ LYS A 97 110.457 -11.890 12.847 1.00 0.00 N ATOM 0 H LYS A 97 113.850 -10.495 6.800 1.00 0.00 H new ATOM 0 HA LYS A 97 114.476 -8.857 9.102 1.00 0.00 H new ATOM 0 HB2 LYS A 97 112.501 -10.491 8.634 1.00 0.00 H new ATOM 0 HB3 LYS A 97 113.623 -11.805 8.928 1.00 0.00 H new ATOM 0 HG2 LYS A 97 114.129 -10.810 11.208 1.00 0.00 H new ATOM 0 HG3 LYS A 97 112.916 -9.581 10.910 1.00 0.00 H new ATOM 0 HD2 LYS A 97 111.197 -11.412 10.563 1.00 0.00 H new ATOM 0 HD3 LYS A 97 112.419 -12.601 10.968 1.00 0.00 H new ATOM 0 HE2 LYS A 97 112.559 -11.870 13.249 1.00 0.00 H new ATOM 0 HE3 LYS A 97 111.883 -10.294 12.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 109.826 -11.121 13.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 110.101 -12.302 11.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 110.486 -12.624 13.583 1.00 0.00 H new ATOM 1624 N LYS A 98 116.469 -11.392 8.542 1.00 0.00 N ATOM 1625 CA LYS A 98 117.722 -12.057 9.025 1.00 0.00 C ATOM 1626 C LYS A 98 118.955 -11.279 8.554 1.00 0.00 C ATOM 1627 O LYS A 98 119.208 -11.177 7.367 1.00 0.00 O ATOM 1628 CB LYS A 98 117.711 -13.460 8.413 1.00 0.00 C ATOM 1629 CG LYS A 98 116.561 -14.271 9.012 1.00 0.00 C ATOM 1630 CD LYS A 98 116.622 -15.708 8.490 1.00 0.00 C ATOM 1631 CE LYS A 98 115.415 -16.494 9.008 1.00 0.00 C ATOM 1632 NZ LYS A 98 115.789 -17.926 8.841 1.00 0.00 N ATOM 0 H LYS A 98 116.112 -11.747 7.655 1.00 0.00 H new ATOM 0 HA LYS A 98 117.763 -12.094 10.114 1.00 0.00 H new ATOM 0 HB2 LYS A 98 117.599 -13.395 7.331 1.00 0.00 H new ATOM 0 HB3 LYS A 98 118.661 -13.959 8.605 1.00 0.00 H new ATOM 0 HG2 LYS A 98 116.626 -14.265 10.100 1.00 0.00 H new ATOM 0 HG3 LYS A 98 115.606 -13.817 8.748 1.00 0.00 H new ATOM 0 HD2 LYS A 98 116.629 -15.710 7.400 1.00 0.00 H new ATOM 0 HD3 LYS A 98 117.546 -16.185 8.816 1.00 0.00 H new ATOM 0 HE2 LYS A 98 115.209 -16.259 10.052 1.00 0.00 H new ATOM 0 HE3 LYS A 98 114.515 -16.253 8.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 115.303 -18.317 8.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 116.818 -18.003 8.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 115.508 -18.459 9.688 1.00 0.00 H new ATOM 1646 N THR A 99 119.710 -10.738 9.483 1.00 0.00 N ATOM 1647 CA THR A 99 120.971 -10.012 9.137 1.00 0.00 C ATOM 1648 C THR A 99 122.116 -10.500 10.029 1.00 0.00 C ATOM 1649 O THR A 99 121.878 -11.057 11.087 1.00 0.00 O ATOM 1650 CB THR A 99 120.683 -8.529 9.398 1.00 0.00 C ATOM 1651 OG1 THR A 99 120.247 -8.354 10.741 1.00 0.00 O ATOM 1652 CG2 THR A 99 119.608 -8.028 8.429 1.00 0.00 C ATOM 0 H THR A 99 119.500 -10.771 10.481 1.00 0.00 H new ATOM 0 HA THR A 99 121.269 -10.184 8.103 1.00 0.00 H new ATOM 0 HB THR A 99 121.596 -7.954 9.241 1.00 0.00 H new ATOM 0 HG1 THR A 99 120.065 -7.405 10.905 1.00 0.00 H new ATOM 0 HG21 THR A 99 119.409 -6.974 8.620 1.00 0.00 H new ATOM 0 HG22 THR A 99 119.957 -8.151 7.404 1.00 0.00 H new ATOM 0 HG23 THR A 99 118.693 -8.602 8.572 1.00 0.00 H new ATOM 1660 N TYR A 100 123.341 -10.289 9.605 1.00 0.00 N ATOM 1661 CA TYR A 100 124.525 -10.732 10.405 1.00 0.00 C ATOM 1662 C TYR A 100 125.481 -9.557 10.634 1.00 0.00 C ATOM 1663 O TYR A 100 125.914 -9.321 11.747 1.00 0.00 O ATOM 1664 CB TYR A 100 125.195 -11.812 9.555 1.00 0.00 C ATOM 1665 CG TYR A 100 126.187 -12.653 10.322 1.00 0.00 C ATOM 1666 CD1 TYR A 100 125.731 -13.757 11.109 1.00 0.00 C ATOM 1667 CD2 TYR A 100 127.582 -12.347 10.263 1.00 0.00 C ATOM 1668 CE1 TYR A 100 126.669 -14.553 11.835 1.00 0.00 C ATOM 1669 CE2 TYR A 100 128.520 -13.143 10.989 1.00 0.00 C ATOM 1670 CZ TYR A 100 128.064 -14.247 11.775 1.00 0.00 C ATOM 1671 OH TYR A 100 128.970 -15.015 12.477 1.00 0.00 O ATOM 0 H TYR A 100 123.571 -9.823 8.728 1.00 0.00 H new ATOM 0 HA TYR A 100 124.242 -11.105 11.389 1.00 0.00 H new ATOM 0 HB2 TYR A 100 124.427 -12.462 9.136 1.00 0.00 H new ATOM 0 HB3 TYR A 100 125.704 -11.339 8.716 1.00 0.00 H new ATOM 0 HD1 TYR A 100 124.677 -13.989 11.154 1.00 0.00 H new ATOM 0 HD2 TYR A 100 127.927 -11.513 9.669 1.00 0.00 H new ATOM 0 HE1 TYR A 100 126.324 -15.386 12.429 1.00 0.00 H new ATOM 0 HE2 TYR A 100 129.574 -12.911 10.944 1.00 0.00 H new ATOM 0 HH TYR A 100 129.876 -14.672 12.326 1.00 0.00 H new ATOM 1681 N HIS A 101 125.802 -8.832 9.587 1.00 0.00 N ATOM 1682 CA HIS A 101 126.728 -7.665 9.704 1.00 0.00 C ATOM 1683 C HIS A 101 126.101 -6.424 9.061 1.00 0.00 C ATOM 1684 O HIS A 101 125.033 -6.502 8.479 1.00 0.00 O ATOM 1685 CB HIS A 101 127.989 -8.079 8.945 1.00 0.00 C ATOM 1686 CG HIS A 101 128.815 -9.107 9.669 1.00 0.00 C ATOM 1687 ND1 HIS A 101 129.779 -9.868 9.024 1.00 0.00 N ATOM 1688 CD2 HIS A 101 128.838 -9.510 10.982 1.00 0.00 C ATOM 1689 CE1 HIS A 101 130.333 -10.682 9.939 1.00 0.00 C ATOM 1690 NE2 HIS A 101 129.797 -10.505 11.149 1.00 0.00 N ATOM 0 H HIS A 101 125.455 -9.005 8.644 1.00 0.00 H new ATOM 0 HA HIS A 101 126.941 -7.413 10.743 1.00 0.00 H new ATOM 0 HB2 HIS A 101 127.703 -8.475 7.970 1.00 0.00 H new ATOM 0 HB3 HIS A 101 128.601 -7.195 8.763 1.00 0.00 H new ATOM 0 HD2 HIS A 101 128.208 -9.115 11.765 1.00 0.00 H new ATOM 0 HE1 HIS A 101 131.117 -11.393 9.722 1.00 0.00 H new ATOM 0 HE2 HIS A 101 130.038 -10.994 12.011 1.00 0.00 H new ATOM 1698 N SER A 102 126.763 -5.293 9.169 1.00 0.00 N ATOM 1699 CA SER A 102 126.245 -4.031 8.555 1.00 0.00 C ATOM 1700 C SER A 102 126.928 -3.782 7.208 1.00 0.00 C ATOM 1701 O SER A 102 128.066 -4.173 7.010 1.00 0.00 O ATOM 1702 CB SER A 102 126.603 -2.927 9.551 1.00 0.00 C ATOM 1703 OG SER A 102 128.015 -2.783 9.603 1.00 0.00 O ATOM 0 H SER A 102 127.650 -5.193 9.663 1.00 0.00 H new ATOM 0 HA SER A 102 125.173 -4.074 8.365 1.00 0.00 H new ATOM 0 HB2 SER A 102 126.141 -1.987 9.251 1.00 0.00 H new ATOM 0 HB3 SER A 102 126.214 -3.173 10.539 1.00 0.00 H new ATOM 0 HG SER A 102 128.289 -2.037 9.029 1.00 0.00 H new ATOM 1709 N SER A 103 126.237 -3.140 6.294 1.00 0.00 N ATOM 1710 CA SER A 103 126.797 -2.889 4.931 1.00 0.00 C ATOM 1711 C SER A 103 126.532 -1.443 4.504 1.00 0.00 C ATOM 1712 O SER A 103 125.800 -0.726 5.165 1.00 0.00 O ATOM 1713 CB SER A 103 126.056 -3.862 4.014 1.00 0.00 C ATOM 1714 OG SER A 103 126.311 -5.193 4.440 1.00 0.00 O ATOM 0 H SER A 103 125.296 -2.775 6.440 1.00 0.00 H new ATOM 0 HA SER A 103 127.877 -3.036 4.896 1.00 0.00 H new ATOM 0 HB2 SER A 103 124.985 -3.659 4.038 1.00 0.00 H new ATOM 0 HB3 SER A 103 126.383 -3.729 2.983 1.00 0.00 H new ATOM 0 HG SER A 103 125.836 -5.820 3.855 1.00 0.00 H new ATOM 1720 N GLU A 104 127.127 -1.023 3.409 1.00 0.00 N ATOM 1721 CA GLU A 104 126.892 0.354 2.874 1.00 0.00 C ATOM 1722 C GLU A 104 126.025 0.310 1.610 1.00 0.00 C ATOM 1723 O GLU A 104 126.121 1.192 0.777 1.00 0.00 O ATOM 1724 CB GLU A 104 128.290 0.892 2.543 1.00 0.00 C ATOM 1725 CG GLU A 104 128.883 1.596 3.765 1.00 0.00 C ATOM 1726 CD GLU A 104 130.339 1.972 3.482 1.00 0.00 C ATOM 1727 OE1 GLU A 104 131.173 1.081 3.491 1.00 0.00 O ATOM 1728 OE2 GLU A 104 130.595 3.143 3.260 1.00 0.00 O ATOM 0 H GLU A 104 127.774 -1.587 2.858 1.00 0.00 H new ATOM 0 HA GLU A 104 126.364 0.983 3.591 1.00 0.00 H new ATOM 0 HB2 GLU A 104 128.940 0.073 2.234 1.00 0.00 H new ATOM 0 HB3 GLU A 104 128.232 1.587 1.705 1.00 0.00 H new ATOM 0 HG2 GLU A 104 128.305 2.490 3.999 1.00 0.00 H new ATOM 0 HG3 GLU A 104 128.828 0.943 4.636 1.00 0.00 H new ATOM 1735 N ILE A 105 125.191 -0.696 1.467 1.00 0.00 N ATOM 1736 CA ILE A 105 124.312 -0.810 0.257 1.00 0.00 C ATOM 1737 C ILE A 105 122.850 -0.900 0.708 1.00 0.00 C ATOM 1738 O ILE A 105 122.509 -1.722 1.540 1.00 0.00 O ATOM 1739 CB ILE A 105 124.750 -2.100 -0.469 1.00 0.00 C ATOM 1740 CG1 ILE A 105 126.256 -2.077 -0.816 1.00 0.00 C ATOM 1741 CG2 ILE A 105 123.936 -2.290 -1.759 1.00 0.00 C ATOM 1742 CD1 ILE A 105 126.624 -0.879 -1.705 1.00 0.00 C ATOM 0 H ILE A 105 125.081 -1.450 2.145 1.00 0.00 H new ATOM 0 HA ILE A 105 124.400 0.051 -0.406 1.00 0.00 H new ATOM 0 HB ILE A 105 124.566 -2.932 0.210 1.00 0.00 H new ATOM 0 HG12 ILE A 105 126.839 -2.038 0.104 1.00 0.00 H new ATOM 0 HG13 ILE A 105 126.525 -3.002 -1.325 1.00 0.00 H new ATOM 0 HG21 ILE A 105 124.256 -3.204 -2.260 1.00 0.00 H new ATOM 0 HG22 ILE A 105 122.877 -2.363 -1.513 1.00 0.00 H new ATOM 0 HG23 ILE A 105 124.097 -1.438 -2.420 1.00 0.00 H new ATOM 0 HD11 ILE A 105 127.692 -0.903 -1.924 1.00 0.00 H new ATOM 0 HD12 ILE A 105 126.061 -0.931 -2.637 1.00 0.00 H new ATOM 0 HD13 ILE A 105 126.381 0.048 -1.186 1.00 0.00 H new ATOM 1754 N ILE A 106 121.999 -0.060 0.163 1.00 0.00 N ATOM 1755 CA ILE A 106 120.536 -0.113 0.486 1.00 0.00 C ATOM 1756 C ILE A 106 119.713 -0.210 -0.803 1.00 0.00 C ATOM 1757 O ILE A 106 120.063 0.392 -1.805 1.00 0.00 O ATOM 1758 CB ILE A 106 120.210 1.178 1.259 1.00 0.00 C ATOM 1759 CG1 ILE A 106 120.582 2.429 0.447 1.00 0.00 C ATOM 1760 CG2 ILE A 106 120.981 1.192 2.581 1.00 0.00 C ATOM 1761 CD1 ILE A 106 119.940 3.663 1.083 1.00 0.00 C ATOM 0 H ILE A 106 122.261 0.669 -0.500 1.00 0.00 H new ATOM 0 HA ILE A 106 120.290 -0.989 1.086 1.00 0.00 H new ATOM 0 HB ILE A 106 119.136 1.195 1.446 1.00 0.00 H new ATOM 0 HG12 ILE A 106 121.665 2.546 0.415 1.00 0.00 H new ATOM 0 HG13 ILE A 106 120.243 2.320 -0.583 1.00 0.00 H new ATOM 0 HG21 ILE A 106 120.750 2.106 3.127 1.00 0.00 H new ATOM 0 HG22 ILE A 106 120.692 0.328 3.180 1.00 0.00 H new ATOM 0 HG23 ILE A 106 122.051 1.151 2.378 1.00 0.00 H new ATOM 0 HD11 ILE A 106 120.205 4.549 0.506 1.00 0.00 H new ATOM 0 HD12 ILE A 106 118.856 3.546 1.091 1.00 0.00 H new ATOM 0 HD13 ILE A 106 120.301 3.775 2.105 1.00 0.00 H new ATOM 1773 N GLU A 107 118.634 -0.962 -0.775 1.00 0.00 N ATOM 1774 CA GLU A 107 117.749 -1.086 -1.974 1.00 0.00 C ATOM 1775 C GLU A 107 116.392 -0.436 -1.690 1.00 0.00 C ATOM 1776 O GLU A 107 115.786 -0.688 -0.663 1.00 0.00 O ATOM 1777 CB GLU A 107 117.579 -2.590 -2.210 1.00 0.00 C ATOM 1778 CG GLU A 107 118.738 -3.128 -3.061 1.00 0.00 C ATOM 1779 CD GLU A 107 119.859 -3.655 -2.159 1.00 0.00 C ATOM 1780 OE1 GLU A 107 120.381 -2.877 -1.376 1.00 0.00 O ATOM 1781 OE2 GLU A 107 120.176 -4.828 -2.266 1.00 0.00 O ATOM 0 H GLU A 107 118.329 -1.499 0.037 1.00 0.00 H new ATOM 0 HA GLU A 107 118.173 -0.589 -2.846 1.00 0.00 H new ATOM 0 HB2 GLU A 107 117.546 -3.114 -1.255 1.00 0.00 H new ATOM 0 HB3 GLU A 107 116.630 -2.782 -2.712 1.00 0.00 H new ATOM 0 HG2 GLU A 107 118.380 -3.926 -3.712 1.00 0.00 H new ATOM 0 HG3 GLU A 107 119.122 -2.338 -3.706 1.00 0.00 H new ATOM 1788 N ILE A 108 115.926 0.388 -2.598 1.00 0.00 N ATOM 1789 CA ILE A 108 114.667 1.168 -2.369 1.00 0.00 C ATOM 1790 C ILE A 108 113.610 0.747 -3.400 1.00 0.00 C ATOM 1791 O ILE A 108 113.939 0.341 -4.498 1.00 0.00 O ATOM 1792 CB ILE A 108 115.071 2.647 -2.541 1.00 0.00 C ATOM 1793 CG1 ILE A 108 116.107 3.034 -1.479 1.00 0.00 C ATOM 1794 CG2 ILE A 108 113.853 3.568 -2.382 1.00 0.00 C ATOM 1795 CD1 ILE A 108 116.772 4.356 -1.867 1.00 0.00 C ATOM 0 H ILE A 108 116.371 0.556 -3.501 1.00 0.00 H new ATOM 0 HA ILE A 108 114.232 0.995 -1.385 1.00 0.00 H new ATOM 0 HB ILE A 108 115.489 2.764 -3.541 1.00 0.00 H new ATOM 0 HG12 ILE A 108 115.626 3.129 -0.505 1.00 0.00 H new ATOM 0 HG13 ILE A 108 116.859 2.250 -1.388 1.00 0.00 H new ATOM 0 HG21 ILE A 108 114.163 4.606 -2.507 1.00 0.00 H new ATOM 0 HG22 ILE A 108 113.107 3.318 -3.136 1.00 0.00 H new ATOM 0 HG23 ILE A 108 113.423 3.435 -1.389 1.00 0.00 H new ATOM 0 HD11 ILE A 108 117.508 4.629 -1.111 1.00 0.00 H new ATOM 0 HD12 ILE A 108 117.267 4.245 -2.832 1.00 0.00 H new ATOM 0 HD13 ILE A 108 116.015 5.138 -1.936 1.00 0.00 H new ATOM 1807 N ILE A 109 112.353 0.845 -3.036 1.00 0.00 N ATOM 1808 CA ILE A 109 111.239 0.689 -4.024 1.00 0.00 C ATOM 1809 C ILE A 109 110.464 2.008 -4.137 1.00 0.00 C ATOM 1810 O ILE A 109 110.454 2.795 -3.206 1.00 0.00 O ATOM 1811 CB ILE A 109 110.338 -0.446 -3.505 1.00 0.00 C ATOM 1812 CG1 ILE A 109 109.817 -0.150 -2.090 1.00 0.00 C ATOM 1813 CG2 ILE A 109 111.129 -1.757 -3.483 1.00 0.00 C ATOM 1814 CD1 ILE A 109 108.531 -0.942 -1.842 1.00 0.00 C ATOM 0 H ILE A 109 112.048 1.030 -2.080 1.00 0.00 H new ATOM 0 HA ILE A 109 111.612 0.445 -5.019 1.00 0.00 H new ATOM 0 HB ILE A 109 109.483 -0.529 -4.176 1.00 0.00 H new ATOM 0 HG12 ILE A 109 110.571 -0.419 -1.350 1.00 0.00 H new ATOM 0 HG13 ILE A 109 109.627 0.917 -1.977 1.00 0.00 H new ATOM 0 HG21 ILE A 109 110.491 -2.561 -3.115 1.00 0.00 H new ATOM 0 HG22 ILE A 109 111.467 -1.995 -4.491 1.00 0.00 H new ATOM 0 HG23 ILE A 109 111.992 -1.650 -2.826 1.00 0.00 H new ATOM 0 HD11 ILE A 109 108.162 -0.732 -0.838 1.00 0.00 H new ATOM 0 HD12 ILE A 109 107.778 -0.651 -2.574 1.00 0.00 H new ATOM 0 HD13 ILE A 109 108.736 -2.008 -1.937 1.00 0.00 H new ATOM 1826 N ALA A 110 109.826 2.239 -5.262 1.00 0.00 N ATOM 1827 CA ALA A 110 109.119 3.534 -5.499 1.00 0.00 C ATOM 1828 C ALA A 110 107.824 3.297 -6.296 1.00 0.00 C ATOM 1829 O ALA A 110 107.655 2.225 -6.844 1.00 0.00 O ATOM 1830 CB ALA A 110 110.101 4.393 -6.298 1.00 0.00 C ATOM 0 H ALA A 110 109.766 1.575 -6.034 1.00 0.00 H new ATOM 0 HA ALA A 110 108.830 4.019 -4.567 1.00 0.00 H new ATOM 0 HB1 ALA A 110 109.648 5.362 -6.509 1.00 0.00 H new ATOM 0 HB2 ALA A 110 111.013 4.537 -5.719 1.00 0.00 H new ATOM 0 HB3 ALA A 110 110.342 3.893 -7.236 1.00 0.00 H new ATOM 1836 N PRO A 111 106.942 4.286 -6.347 1.00 0.00 N ATOM 1837 CA PRO A 111 105.684 4.162 -7.156 1.00 0.00 C ATOM 1838 C PRO A 111 105.991 3.929 -8.643 1.00 0.00 C ATOM 1839 O PRO A 111 105.240 3.261 -9.331 1.00 0.00 O ATOM 1840 CB PRO A 111 105.001 5.517 -6.954 1.00 0.00 C ATOM 1841 CG PRO A 111 105.542 5.994 -5.652 1.00 0.00 C ATOM 1842 CD PRO A 111 106.987 5.602 -5.674 1.00 0.00 C ATOM 0 HA PRO A 111 105.070 3.316 -6.848 1.00 0.00 H new ATOM 0 HB2 PRO A 111 105.236 6.209 -7.763 1.00 0.00 H new ATOM 0 HB3 PRO A 111 103.916 5.418 -6.925 1.00 0.00 H new ATOM 0 HG2 PRO A 111 105.426 7.073 -5.546 1.00 0.00 H new ATOM 0 HG3 PRO A 111 105.020 5.533 -4.814 1.00 0.00 H new ATOM 0 HD2 PRO A 111 107.596 6.320 -6.224 1.00 0.00 H new ATOM 0 HD3 PRO A 111 107.405 5.532 -4.670 1.00 0.00 H new ATOM 1850 N MET A 112 107.085 4.477 -9.125 1.00 0.00 N ATOM 1851 CA MET A 112 107.450 4.337 -10.569 1.00 0.00 C ATOM 1852 C MET A 112 108.974 4.231 -10.736 1.00 0.00 C ATOM 1853 O MET A 112 109.716 4.498 -9.808 1.00 0.00 O ATOM 1854 CB MET A 112 106.834 5.553 -11.303 1.00 0.00 C ATOM 1855 CG MET A 112 107.623 6.869 -11.145 1.00 0.00 C ATOM 1856 SD MET A 112 107.497 7.521 -9.460 1.00 0.00 S ATOM 1857 CE MET A 112 105.803 8.147 -9.584 1.00 0.00 C ATOM 0 H MET A 112 107.746 5.021 -8.570 1.00 0.00 H new ATOM 0 HA MET A 112 107.054 3.419 -11.003 1.00 0.00 H new ATOM 0 HB2 MET A 112 106.755 5.318 -12.364 1.00 0.00 H new ATOM 0 HB3 MET A 112 105.820 5.707 -10.935 1.00 0.00 H new ATOM 0 HG2 MET A 112 108.671 6.698 -11.393 1.00 0.00 H new ATOM 0 HG3 MET A 112 107.245 7.608 -11.851 1.00 0.00 H new ATOM 0 HE1 MET A 112 105.580 8.768 -8.716 1.00 0.00 H new ATOM 0 HE2 MET A 112 105.700 8.742 -10.492 1.00 0.00 H new ATOM 0 HE3 MET A 112 105.107 7.309 -9.619 1.00 0.00 H new ATOM 1867 N LYS A 113 109.426 3.845 -11.910 1.00 0.00 N ATOM 1868 CA LYS A 113 110.897 3.686 -12.155 1.00 0.00 C ATOM 1869 C LYS A 113 111.574 5.060 -12.188 1.00 0.00 C ATOM 1870 O LYS A 113 111.459 5.790 -13.157 1.00 0.00 O ATOM 1871 CB LYS A 113 111.038 2.985 -13.510 1.00 0.00 C ATOM 1872 CG LYS A 113 112.483 2.522 -13.696 1.00 0.00 C ATOM 1873 CD LYS A 113 112.564 1.554 -14.879 1.00 0.00 C ATOM 1874 CE LYS A 113 112.394 2.327 -16.188 1.00 0.00 C ATOM 1875 NZ LYS A 113 112.331 1.280 -17.247 1.00 0.00 N ATOM 0 H LYS A 113 108.834 3.632 -12.713 1.00 0.00 H new ATOM 0 HA LYS A 113 111.373 3.106 -11.365 1.00 0.00 H new ATOM 0 HB2 LYS A 113 110.362 2.132 -13.562 1.00 0.00 H new ATOM 0 HB3 LYS A 113 110.756 3.665 -14.314 1.00 0.00 H new ATOM 0 HG2 LYS A 113 113.131 3.381 -13.871 1.00 0.00 H new ATOM 0 HG3 LYS A 113 112.839 2.034 -12.789 1.00 0.00 H new ATOM 0 HD2 LYS A 113 113.523 1.036 -14.873 1.00 0.00 H new ATOM 0 HD3 LYS A 113 111.790 0.792 -14.792 1.00 0.00 H new ATOM 0 HE2 LYS A 113 111.487 2.931 -16.175 1.00 0.00 H new ATOM 0 HE3 LYS A 113 113.228 3.008 -16.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 112.215 1.733 -18.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 113.211 0.725 -17.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 111.523 0.650 -17.065 1.00 0.00 H new ATOM 1889 N LEU A 114 112.279 5.406 -11.131 1.00 0.00 N ATOM 1890 CA LEU A 114 112.928 6.760 -11.033 1.00 0.00 C ATOM 1891 C LEU A 114 113.923 6.989 -12.176 1.00 0.00 C ATOM 1892 O LEU A 114 114.078 8.104 -12.642 1.00 0.00 O ATOM 1893 CB LEU A 114 113.669 6.785 -9.690 1.00 0.00 C ATOM 1894 CG LEU A 114 112.662 6.701 -8.541 1.00 0.00 C ATOM 1895 CD1 LEU A 114 113.406 6.438 -7.231 1.00 0.00 C ATOM 1896 CD2 LEU A 114 111.897 8.023 -8.432 1.00 0.00 C ATOM 0 H LEU A 114 112.434 4.802 -10.324 1.00 0.00 H new ATOM 0 HA LEU A 114 112.177 7.547 -11.102 1.00 0.00 H new ATOM 0 HB2 LEU A 114 114.368 5.951 -9.635 1.00 0.00 H new ATOM 0 HB3 LEU A 114 114.256 7.699 -9.605 1.00 0.00 H new ATOM 0 HG LEU A 114 111.960 5.889 -8.733 1.00 0.00 H new ATOM 0 HD11 LEU A 114 112.690 6.378 -6.412 1.00 0.00 H new ATOM 0 HD12 LEU A 114 113.952 5.498 -7.305 1.00 0.00 H new ATOM 0 HD13 LEU A 114 114.107 7.251 -7.041 1.00 0.00 H new ATOM 0 HD21 LEU A 114 111.180 7.962 -7.613 1.00 0.00 H new ATOM 0 HD22 LEU A 114 112.599 8.835 -8.240 1.00 0.00 H new ATOM 0 HD23 LEU A 114 111.367 8.215 -9.365 1.00 0.00 H new ATOM 1908 N ARG A 115 114.585 5.944 -12.625 1.00 0.00 N ATOM 1909 CA ARG A 115 115.661 6.098 -13.663 1.00 0.00 C ATOM 1910 C ARG A 115 115.084 6.648 -14.971 1.00 0.00 C ATOM 1911 O ARG A 115 115.740 7.413 -15.655 1.00 0.00 O ATOM 1912 CB ARG A 115 116.249 4.705 -13.902 1.00 0.00 C ATOM 1913 CG ARG A 115 116.949 4.217 -12.633 1.00 0.00 C ATOM 1914 CD ARG A 115 117.655 2.887 -12.918 1.00 0.00 C ATOM 1915 NE ARG A 115 118.149 2.391 -11.591 1.00 0.00 N ATOM 1916 CZ ARG A 115 118.374 1.115 -11.345 1.00 0.00 C ATOM 1917 NH1 ARG A 115 118.209 0.171 -12.243 1.00 0.00 N ATOM 1918 NH2 ARG A 115 118.791 0.774 -10.156 1.00 0.00 N ATOM 0 H ARG A 115 114.425 4.986 -12.315 1.00 0.00 H new ATOM 0 HA ARG A 115 116.422 6.799 -13.320 1.00 0.00 H new ATOM 0 HB2 ARG A 115 115.458 4.009 -14.183 1.00 0.00 H new ATOM 0 HB3 ARG A 115 116.957 4.736 -14.731 1.00 0.00 H new ATOM 0 HG2 ARG A 115 117.672 4.960 -12.295 1.00 0.00 H new ATOM 0 HG3 ARG A 115 116.223 4.091 -11.830 1.00 0.00 H new ATOM 0 HD2 ARG A 115 116.970 2.171 -13.372 1.00 0.00 H new ATOM 0 HD3 ARG A 115 118.481 3.025 -13.616 1.00 0.00 H new ATOM 0 HE ARG A 115 118.318 3.069 -10.848 1.00 0.00 H new ATOM 0 HH11 ARG A 115 117.893 0.411 -13.183 1.00 0.00 H new ATOM 0 HH12 ARG A 115 118.397 -0.802 -12.001 1.00 0.00 H new ATOM 0 HH21 ARG A 115 118.936 1.488 -9.442 1.00 0.00 H new ATOM 0 HH22 ARG A 115 118.972 -0.206 -9.941 1.00 0.00 H new ATOM 1932 N GLU A 116 113.875 6.262 -15.306 1.00 0.00 N ATOM 1933 CA GLU A 116 113.228 6.771 -16.556 1.00 0.00 C ATOM 1934 C GLU A 116 112.703 8.187 -16.310 1.00 0.00 C ATOM 1935 O GLU A 116 112.949 9.083 -17.098 1.00 0.00 O ATOM 1936 CB GLU A 116 112.081 5.807 -16.875 1.00 0.00 C ATOM 1937 CG GLU A 116 111.501 6.135 -18.253 1.00 0.00 C ATOM 1938 CD GLU A 116 110.272 5.264 -18.516 1.00 0.00 C ATOM 1939 OE1 GLU A 116 109.454 5.137 -17.618 1.00 0.00 O ATOM 1940 OE2 GLU A 116 110.167 4.738 -19.612 1.00 0.00 O ATOM 0 H GLU A 116 113.306 5.612 -14.763 1.00 0.00 H new ATOM 0 HA GLU A 116 113.927 6.818 -17.391 1.00 0.00 H new ATOM 0 HB2 GLU A 116 112.442 4.779 -16.857 1.00 0.00 H new ATOM 0 HB3 GLU A 116 111.304 5.886 -16.114 1.00 0.00 H new ATOM 0 HG2 GLU A 116 111.229 7.189 -18.302 1.00 0.00 H new ATOM 0 HG3 GLU A 116 112.252 5.964 -19.024 1.00 0.00 H new ATOM 1947 N GLN A 117 112.002 8.390 -15.216 1.00 0.00 N ATOM 1948 CA GLN A 117 111.315 9.704 -14.970 1.00 0.00 C ATOM 1949 C GLN A 117 112.331 10.848 -14.867 1.00 0.00 C ATOM 1950 O GLN A 117 112.045 11.960 -15.272 1.00 0.00 O ATOM 1951 CB GLN A 117 110.553 9.553 -13.647 1.00 0.00 C ATOM 1952 CG GLN A 117 109.451 8.503 -13.802 1.00 0.00 C ATOM 1953 CD GLN A 117 108.325 9.063 -14.675 1.00 0.00 C ATOM 1954 OE1 GLN A 117 107.810 10.131 -14.410 1.00 0.00 O ATOM 1955 NE2 GLN A 117 107.921 8.384 -15.714 1.00 0.00 N ATOM 0 H GLN A 117 111.875 7.698 -14.478 1.00 0.00 H new ATOM 0 HA GLN A 117 110.645 9.948 -15.794 1.00 0.00 H new ATOM 0 HB2 GLN A 117 111.239 9.259 -12.853 1.00 0.00 H new ATOM 0 HB3 GLN A 117 110.119 10.509 -13.355 1.00 0.00 H new ATOM 0 HG2 GLN A 117 109.858 7.598 -14.253 1.00 0.00 H new ATOM 0 HG3 GLN A 117 109.061 8.224 -12.823 1.00 0.00 H new ATOM 0 HE21 GLN A 117 108.353 7.487 -15.937 1.00 0.00 H new ATOM 0 HE22 GLN A 117 107.173 8.750 -16.303 1.00 0.00 H new ATOM 1964 N PHE A 118 113.501 10.574 -14.333 1.00 0.00 N ATOM 1965 CA PHE A 118 114.535 11.641 -14.155 1.00 0.00 C ATOM 1966 C PHE A 118 115.712 11.489 -15.133 1.00 0.00 C ATOM 1967 O PHE A 118 116.704 12.182 -14.994 1.00 0.00 O ATOM 1968 CB PHE A 118 115.020 11.471 -12.715 1.00 0.00 C ATOM 1969 CG PHE A 118 113.993 11.869 -11.682 1.00 0.00 C ATOM 1970 CD1 PHE A 118 113.862 13.240 -11.298 1.00 0.00 C ATOM 1971 CD2 PHE A 118 113.153 10.876 -11.088 1.00 0.00 C ATOM 1972 CE1 PHE A 118 112.889 13.618 -10.320 1.00 0.00 C ATOM 1973 CE2 PHE A 118 112.182 11.254 -10.111 1.00 0.00 C ATOM 1974 CZ PHE A 118 112.050 12.625 -9.727 1.00 0.00 C ATOM 0 H PHE A 118 113.783 9.648 -14.011 1.00 0.00 H new ATOM 0 HA PHE A 118 114.117 12.627 -14.355 1.00 0.00 H new ATOM 0 HB2 PHE A 118 115.300 10.430 -12.555 1.00 0.00 H new ATOM 0 HB3 PHE A 118 115.920 12.069 -12.570 1.00 0.00 H new ATOM 0 HD1 PHE A 118 114.497 13.990 -11.746 1.00 0.00 H new ATOM 0 HD2 PHE A 118 113.253 9.840 -11.378 1.00 0.00 H new ATOM 0 HE1 PHE A 118 112.789 14.653 -10.030 1.00 0.00 H new ATOM 0 HE2 PHE A 118 111.547 10.504 -9.662 1.00 0.00 H new ATOM 0 HZ PHE A 118 111.316 12.910 -8.988 1.00 0.00 H new ATOM 1984 N ASN A 119 115.628 10.606 -16.115 1.00 0.00 N ATOM 1985 CA ASN A 119 116.743 10.397 -17.108 1.00 0.00 C ATOM 1986 C ASN A 119 118.095 10.150 -16.409 1.00 0.00 C ATOM 1987 O ASN A 119 119.108 10.721 -16.779 1.00 0.00 O ATOM 1988 CB ASN A 119 116.782 11.669 -17.967 1.00 0.00 C ATOM 1989 CG ASN A 119 115.492 11.778 -18.783 1.00 0.00 C ATOM 1990 OD1 ASN A 119 114.818 12.788 -18.743 1.00 0.00 O ATOM 1991 ND2 ASN A 119 115.119 10.774 -19.528 1.00 0.00 N ATOM 0 H ASN A 119 114.815 10.010 -16.271 1.00 0.00 H new ATOM 0 HA ASN A 119 116.564 9.510 -17.715 1.00 0.00 H new ATOM 0 HB2 ASN A 119 116.897 12.546 -17.330 1.00 0.00 H new ATOM 0 HB3 ASN A 119 117.644 11.644 -18.633 1.00 0.00 H new ATOM 0 HD21 ASN A 119 114.262 10.837 -20.077 1.00 0.00 H new ATOM 0 HD22 ASN A 119 115.685 9.926 -19.562 1.00 0.00 H new ATOM 1998 N LEU A 120 118.104 9.298 -15.409 1.00 0.00 N ATOM 1999 CA LEU A 120 119.312 9.136 -14.539 1.00 0.00 C ATOM 2000 C LEU A 120 120.220 8.020 -15.064 1.00 0.00 C ATOM 2001 O LEU A 120 119.746 6.975 -15.474 1.00 0.00 O ATOM 2002 CB LEU A 120 118.777 8.778 -13.151 1.00 0.00 C ATOM 2003 CG LEU A 120 118.108 10.003 -12.524 1.00 0.00 C ATOM 2004 CD1 LEU A 120 117.324 9.574 -11.282 1.00 0.00 C ATOM 2005 CD2 LEU A 120 119.179 11.018 -12.119 1.00 0.00 C ATOM 0 H LEU A 120 117.316 8.702 -15.157 1.00 0.00 H new ATOM 0 HA LEU A 120 119.912 10.046 -14.521 1.00 0.00 H new ATOM 0 HB2 LEU A 120 118.061 7.960 -13.227 1.00 0.00 H new ATOM 0 HB3 LEU A 120 119.592 8.431 -12.515 1.00 0.00 H new ATOM 0 HG LEU A 120 117.430 10.456 -13.247 1.00 0.00 H new ATOM 0 HD11 LEU A 120 116.847 10.446 -10.834 1.00 0.00 H new ATOM 0 HD12 LEU A 120 116.562 8.848 -11.566 1.00 0.00 H new ATOM 0 HD13 LEU A 120 118.004 9.122 -10.560 1.00 0.00 H new ATOM 0 HD21 LEU A 120 118.703 11.891 -11.672 1.00 0.00 H new ATOM 0 HD22 LEU A 120 119.856 10.564 -11.395 1.00 0.00 H new ATOM 0 HD23 LEU A 120 119.743 11.324 -13.001 1.00 0.00 H new ATOM 2017 N LYS A 121 121.513 8.249 -15.048 1.00 0.00 N ATOM 2018 CA LYS A 121 122.496 7.205 -15.472 1.00 0.00 C ATOM 2019 C LYS A 121 123.357 6.787 -14.277 1.00 0.00 C ATOM 2020 O LYS A 121 123.448 7.504 -13.298 1.00 0.00 O ATOM 2021 CB LYS A 121 123.360 7.880 -16.539 1.00 0.00 C ATOM 2022 CG LYS A 121 122.516 8.162 -17.784 1.00 0.00 C ATOM 2023 CD LYS A 121 123.408 8.740 -18.886 1.00 0.00 C ATOM 2024 CE LYS A 121 122.547 9.122 -20.092 1.00 0.00 C ATOM 2025 NZ LYS A 121 122.375 7.854 -20.856 1.00 0.00 N ATOM 0 H LYS A 121 121.933 9.131 -14.754 1.00 0.00 H new ATOM 0 HA LYS A 121 122.009 6.307 -15.852 1.00 0.00 H new ATOM 0 HB2 LYS A 121 123.774 8.810 -16.150 1.00 0.00 H new ATOM 0 HB3 LYS A 121 124.203 7.239 -16.797 1.00 0.00 H new ATOM 0 HG2 LYS A 121 122.041 7.244 -18.130 1.00 0.00 H new ATOM 0 HG3 LYS A 121 121.717 8.863 -17.543 1.00 0.00 H new ATOM 0 HD2 LYS A 121 123.942 9.615 -18.515 1.00 0.00 H new ATOM 0 HD3 LYS A 121 124.161 8.009 -19.180 1.00 0.00 H new ATOM 0 HE2 LYS A 121 121.585 9.528 -19.778 1.00 0.00 H new ATOM 0 HE3 LYS A 121 123.033 9.886 -20.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 121.852 8.046 -21.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 123.309 7.459 -21.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 121.844 7.171 -20.279 1.00 0.00 H new ATOM 2039 N ASP A 122 123.989 5.634 -14.357 1.00 0.00 N ATOM 2040 CA ASP A 122 124.848 5.129 -13.226 1.00 0.00 C ATOM 2041 C ASP A 122 125.940 6.144 -12.852 1.00 0.00 C ATOM 2042 O ASP A 122 126.551 6.743 -13.720 1.00 0.00 O ATOM 2043 CB ASP A 122 125.500 3.836 -13.731 1.00 0.00 C ATOM 2044 CG ASP A 122 124.422 2.774 -13.968 1.00 0.00 C ATOM 2045 OD1 ASP A 122 123.556 2.636 -13.120 1.00 0.00 O ATOM 2046 OD2 ASP A 122 124.483 2.117 -14.994 1.00 0.00 O ATOM 0 H ASP A 122 123.947 5.014 -15.166 1.00 0.00 H new ATOM 0 HA ASP A 122 124.244 4.966 -12.333 1.00 0.00 H new ATOM 0 HB2 ASP A 122 126.044 4.029 -14.656 1.00 0.00 H new ATOM 0 HB3 ASP A 122 126.226 3.475 -13.003 1.00 0.00 H new ATOM 2051 N GLY A 123 126.174 6.327 -11.573 1.00 0.00 N ATOM 2052 CA GLY A 123 127.185 7.324 -11.104 1.00 0.00 C ATOM 2053 C GLY A 123 126.510 8.621 -10.642 1.00 0.00 C ATOM 2054 O GLY A 123 127.087 9.353 -9.856 1.00 0.00 O ATOM 0 H GLY A 123 125.700 5.820 -10.826 1.00 0.00 H new ATOM 0 HA2 GLY A 123 127.765 6.900 -10.284 1.00 0.00 H new ATOM 0 HA3 GLY A 123 127.886 7.542 -11.910 1.00 0.00 H new ATOM 2058 N ASP A 124 125.312 8.914 -11.113 1.00 0.00 N ATOM 2059 CA ASP A 124 124.606 10.175 -10.693 1.00 0.00 C ATOM 2060 C ASP A 124 124.274 10.119 -9.198 1.00 0.00 C ATOM 2061 O ASP A 124 124.108 9.046 -8.646 1.00 0.00 O ATOM 2062 CB ASP A 124 123.322 10.262 -11.529 1.00 0.00 C ATOM 2063 CG ASP A 124 123.604 10.981 -12.852 1.00 0.00 C ATOM 2064 OD1 ASP A 124 124.328 11.963 -12.833 1.00 0.00 O ATOM 2065 OD2 ASP A 124 123.088 10.536 -13.863 1.00 0.00 O ATOM 0 H ASP A 124 124.794 8.332 -11.771 1.00 0.00 H new ATOM 0 HA ASP A 124 125.233 11.052 -10.856 1.00 0.00 H new ATOM 0 HB2 ASP A 124 122.938 9.261 -11.725 1.00 0.00 H new ATOM 0 HB3 ASP A 124 122.552 10.796 -10.973 1.00 0.00 H new ATOM 2070 N VAL A 125 124.180 11.260 -8.558 1.00 0.00 N ATOM 2071 CA VAL A 125 123.995 11.300 -7.071 1.00 0.00 C ATOM 2072 C VAL A 125 122.588 11.820 -6.746 1.00 0.00 C ATOM 2073 O VAL A 125 122.142 12.805 -7.307 1.00 0.00 O ATOM 2074 CB VAL A 125 125.084 12.249 -6.532 1.00 0.00 C ATOM 2075 CG1 VAL A 125 125.009 12.338 -5.003 1.00 0.00 C ATOM 2076 CG2 VAL A 125 126.479 11.731 -6.909 1.00 0.00 C ATOM 0 H VAL A 125 124.224 12.175 -9.007 1.00 0.00 H new ATOM 0 HA VAL A 125 124.087 10.315 -6.614 1.00 0.00 H new ATOM 0 HB VAL A 125 124.915 13.231 -6.973 1.00 0.00 H new ATOM 0 HG11 VAL A 125 125.785 13.012 -4.639 1.00 0.00 H new ATOM 0 HG12 VAL A 125 124.031 12.718 -4.708 1.00 0.00 H new ATOM 0 HG13 VAL A 125 125.158 11.348 -4.573 1.00 0.00 H new ATOM 0 HG21 VAL A 125 127.237 12.412 -6.521 1.00 0.00 H new ATOM 0 HG22 VAL A 125 126.628 10.740 -6.480 1.00 0.00 H new ATOM 0 HG23 VAL A 125 126.564 11.673 -7.994 1.00 0.00 H new ATOM 2086 N ILE A 126 121.904 11.155 -5.843 1.00 0.00 N ATOM 2087 CA ILE A 126 120.572 11.638 -5.358 1.00 0.00 C ATOM 2088 C ILE A 126 120.561 11.663 -3.826 1.00 0.00 C ATOM 2089 O ILE A 126 121.382 11.019 -3.196 1.00 0.00 O ATOM 2090 CB ILE A 126 119.519 10.659 -5.910 1.00 0.00 C ATOM 2091 CG1 ILE A 126 119.807 9.215 -5.469 1.00 0.00 C ATOM 2092 CG2 ILE A 126 119.512 10.722 -7.440 1.00 0.00 C ATOM 2093 CD1 ILE A 126 118.575 8.346 -5.730 1.00 0.00 C ATOM 0 H ILE A 126 122.219 10.284 -5.416 1.00 0.00 H new ATOM 0 HA ILE A 126 120.358 12.651 -5.700 1.00 0.00 H new ATOM 0 HB ILE A 126 118.547 10.953 -5.513 1.00 0.00 H new ATOM 0 HG12 ILE A 126 120.665 8.821 -6.014 1.00 0.00 H new ATOM 0 HG13 ILE A 126 120.064 9.191 -4.410 1.00 0.00 H new ATOM 0 HG21 ILE A 126 118.766 10.029 -7.829 1.00 0.00 H new ATOM 0 HG22 ILE A 126 119.269 11.735 -7.761 1.00 0.00 H new ATOM 0 HG23 ILE A 126 120.496 10.447 -7.820 1.00 0.00 H new ATOM 0 HD11 ILE A 126 118.779 7.322 -5.417 1.00 0.00 H new ATOM 0 HD12 ILE A 126 117.728 8.736 -5.165 1.00 0.00 H new ATOM 0 HD13 ILE A 126 118.339 8.360 -6.794 1.00 0.00 H new ATOM 2105 N LYS A 127 119.643 12.396 -3.239 1.00 0.00 N ATOM 2106 CA LYS A 127 119.620 12.556 -1.752 1.00 0.00 C ATOM 2107 C LYS A 127 118.419 11.816 -1.159 1.00 0.00 C ATOM 2108 O LYS A 127 117.333 11.863 -1.708 1.00 0.00 O ATOM 2109 CB LYS A 127 119.488 14.063 -1.516 1.00 0.00 C ATOM 2110 CG LYS A 127 120.767 14.768 -1.971 1.00 0.00 C ATOM 2111 CD LYS A 127 120.675 16.259 -1.636 1.00 0.00 C ATOM 2112 CE LYS A 127 121.896 16.987 -2.202 1.00 0.00 C ATOM 2113 NZ LYS A 127 121.558 17.250 -3.629 1.00 0.00 N ATOM 0 H LYS A 127 118.903 12.894 -3.733 1.00 0.00 H new ATOM 0 HA LYS A 127 120.513 12.145 -1.280 1.00 0.00 H new ATOM 0 HB2 LYS A 127 118.631 14.453 -2.065 1.00 0.00 H new ATOM 0 HB3 LYS A 127 119.308 14.261 -0.459 1.00 0.00 H new ATOM 0 HG2 LYS A 127 121.633 14.326 -1.478 1.00 0.00 H new ATOM 0 HG3 LYS A 127 120.907 14.633 -3.044 1.00 0.00 H new ATOM 0 HD2 LYS A 127 119.761 16.681 -2.054 1.00 0.00 H new ATOM 0 HD3 LYS A 127 120.625 16.397 -0.556 1.00 0.00 H new ATOM 0 HE2 LYS A 127 122.087 17.915 -1.664 1.00 0.00 H new ATOM 0 HE3 LYS A 127 122.795 16.377 -2.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 122.395 17.076 -4.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 120.787 16.618 -3.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 121.256 18.239 -3.738 1.00 0.00 H new ATOM 2127 N ILE A 128 118.615 11.140 -0.050 1.00 0.00 N ATOM 2128 CA ILE A 128 117.484 10.454 0.652 1.00 0.00 C ATOM 2129 C ILE A 128 117.217 11.132 2.002 1.00 0.00 C ATOM 2130 O ILE A 128 118.142 11.479 2.717 1.00 0.00 O ATOM 2131 CB ILE A 128 117.899 8.982 0.829 1.00 0.00 C ATOM 2132 CG1 ILE A 128 119.225 8.855 1.596 1.00 0.00 C ATOM 2133 CG2 ILE A 128 118.051 8.331 -0.548 1.00 0.00 C ATOM 2134 CD1 ILE A 128 119.438 7.399 2.018 1.00 0.00 C ATOM 0 H ILE A 128 119.523 11.034 0.403 1.00 0.00 H new ATOM 0 HA ILE A 128 116.558 10.515 0.080 1.00 0.00 H new ATOM 0 HB ILE A 128 117.123 8.480 1.407 1.00 0.00 H new ATOM 0 HG12 ILE A 128 120.052 9.187 0.969 1.00 0.00 H new ATOM 0 HG13 ILE A 128 119.212 9.500 2.474 1.00 0.00 H new ATOM 0 HG21 ILE A 128 118.345 7.288 -0.427 1.00 0.00 H new ATOM 0 HG22 ILE A 128 117.101 8.381 -1.081 1.00 0.00 H new ATOM 0 HG23 ILE A 128 118.815 8.860 -1.118 1.00 0.00 H new ATOM 0 HD11 ILE A 128 120.379 7.312 2.562 1.00 0.00 H new ATOM 0 HD12 ILE A 128 118.617 7.083 2.661 1.00 0.00 H new ATOM 0 HD13 ILE A 128 119.470 6.765 1.132 1.00 0.00 H new ATOM 2146 N LEU A 129 115.961 11.319 2.337 1.00 0.00 N ATOM 2147 CA LEU A 129 115.590 12.005 3.612 1.00 0.00 C ATOM 2148 C LEU A 129 115.005 10.994 4.602 1.00 0.00 C ATOM 2149 O LEU A 129 114.098 10.252 4.269 1.00 0.00 O ATOM 2150 CB LEU A 129 114.537 13.041 3.210 1.00 0.00 C ATOM 2151 CG LEU A 129 114.278 14.000 4.377 1.00 0.00 C ATOM 2152 CD1 LEU A 129 113.762 15.338 3.838 1.00 0.00 C ATOM 2153 CD2 LEU A 129 113.232 13.397 5.319 1.00 0.00 C ATOM 0 H LEU A 129 115.167 11.020 1.770 1.00 0.00 H new ATOM 0 HA LEU A 129 116.447 12.467 4.102 1.00 0.00 H new ATOM 0 HB2 LEU A 129 114.877 13.599 2.338 1.00 0.00 H new ATOM 0 HB3 LEU A 129 113.611 12.540 2.927 1.00 0.00 H new ATOM 0 HG LEU A 129 115.208 14.160 4.922 1.00 0.00 H new ATOM 0 HD11 LEU A 129 113.578 16.019 4.669 1.00 0.00 H new ATOM 0 HD12 LEU A 129 114.506 15.773 3.171 1.00 0.00 H new ATOM 0 HD13 LEU A 129 112.834 15.176 3.290 1.00 0.00 H new ATOM 0 HD21 LEU A 129 113.051 14.082 6.147 1.00 0.00 H new ATOM 0 HD22 LEU A 129 112.303 13.233 4.774 1.00 0.00 H new ATOM 0 HD23 LEU A 129 113.597 12.446 5.707 1.00 0.00 H new ATOM 2165 N ILE A 130 115.524 10.973 5.808 1.00 0.00 N ATOM 2166 CA ILE A 130 115.050 10.000 6.844 1.00 0.00 C ATOM 2167 C ILE A 130 114.426 10.781 8.009 1.00 0.00 C ATOM 2168 O ILE A 130 114.943 11.809 8.409 1.00 0.00 O ATOM 2169 CB ILE A 130 116.302 9.226 7.301 1.00 0.00 C ATOM 2170 CG1 ILE A 130 116.966 8.506 6.116 1.00 0.00 C ATOM 2171 CG2 ILE A 130 115.919 8.171 8.348 1.00 0.00 C ATOM 2172 CD1 ILE A 130 118.441 8.261 6.435 1.00 0.00 C ATOM 0 H ILE A 130 116.266 11.598 6.122 1.00 0.00 H new ATOM 0 HA ILE A 130 114.294 9.313 6.463 1.00 0.00 H new ATOM 0 HB ILE A 130 116.998 9.948 7.727 1.00 0.00 H new ATOM 0 HG12 ILE A 130 116.462 7.559 5.922 1.00 0.00 H new ATOM 0 HG13 ILE A 130 116.873 9.107 5.212 1.00 0.00 H new ATOM 0 HG21 ILE A 130 116.812 7.631 8.663 1.00 0.00 H new ATOM 0 HG22 ILE A 130 115.468 8.661 9.211 1.00 0.00 H new ATOM 0 HG23 ILE A 130 115.205 7.471 7.915 1.00 0.00 H new ATOM 0 HD11 ILE A 130 118.915 7.750 5.596 1.00 0.00 H new ATOM 0 HD12 ILE A 130 118.939 9.215 6.607 1.00 0.00 H new ATOM 0 HD13 ILE A 130 118.522 7.643 7.329 1.00 0.00 H new ATOM 2184 N LYS A 131 113.331 10.289 8.544 1.00 0.00 N ATOM 2185 CA LYS A 131 112.630 10.998 9.661 1.00 0.00 C ATOM 2186 C LYS A 131 113.162 10.512 11.012 1.00 0.00 C ATOM 2187 O LYS A 131 113.574 9.373 11.140 1.00 0.00 O ATOM 2188 CB LYS A 131 111.148 10.642 9.513 1.00 0.00 C ATOM 2189 CG LYS A 131 110.598 11.236 8.214 1.00 0.00 C ATOM 2190 CD LYS A 131 109.110 10.906 8.090 1.00 0.00 C ATOM 2191 CE LYS A 131 108.683 11.017 6.625 1.00 0.00 C ATOM 2192 NZ LYS A 131 109.063 9.712 6.016 1.00 0.00 N ATOM 0 H LYS A 131 112.890 9.417 8.250 1.00 0.00 H new ATOM 0 HA LYS A 131 112.790 12.075 9.619 1.00 0.00 H new ATOM 0 HB2 LYS A 131 111.024 9.559 9.510 1.00 0.00 H new ATOM 0 HB3 LYS A 131 110.586 11.025 10.365 1.00 0.00 H new ATOM 0 HG2 LYS A 131 110.743 12.316 8.206 1.00 0.00 H new ATOM 0 HG3 LYS A 131 111.143 10.835 7.359 1.00 0.00 H new ATOM 0 HD2 LYS A 131 108.918 9.899 8.461 1.00 0.00 H new ATOM 0 HD3 LYS A 131 108.523 11.589 8.704 1.00 0.00 H new ATOM 0 HE2 LYS A 131 107.611 11.197 6.538 1.00 0.00 H new ATOM 0 HE3 LYS A 131 109.186 11.846 6.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 109.659 9.879 5.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 109.591 9.146 6.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 108.204 9.198 5.732 1.00 0.00 H new ATOM 2206 N GLY A 132 113.151 11.373 12.005 1.00 0.00 N ATOM 2207 CA GLY A 132 113.642 10.993 13.365 1.00 0.00 C ATOM 2208 C GLY A 132 113.014 11.919 14.411 1.00 0.00 C ATOM 2209 O GLY A 132 112.307 12.850 14.069 1.00 0.00 O ATOM 0 H GLY A 132 112.818 12.334 11.927 1.00 0.00 H new ATOM 0 HA2 GLY A 132 113.384 9.956 13.580 1.00 0.00 H new ATOM 0 HA3 GLY A 132 114.729 11.066 13.405 1.00 0.00 H new ATOM 2213 N ASP A 133 113.272 11.661 15.673 1.00 0.00 N ATOM 2214 CA ASP A 133 112.710 12.509 16.773 1.00 0.00 C ATOM 2215 C ASP A 133 113.830 13.285 17.477 1.00 0.00 C ATOM 2216 O ASP A 133 113.633 14.414 17.891 1.00 0.00 O ATOM 2217 CB ASP A 133 112.006 11.538 17.737 1.00 0.00 C ATOM 2218 CG ASP A 133 112.976 10.485 18.291 1.00 0.00 C ATOM 2219 OD1 ASP A 133 113.530 9.742 17.498 1.00 0.00 O ATOM 2220 OD2 ASP A 133 113.147 10.443 19.499 1.00 0.00 O ATOM 0 H ASP A 133 113.856 10.888 15.991 1.00 0.00 H new ATOM 0 HA ASP A 133 112.011 13.255 16.394 1.00 0.00 H new ATOM 0 HB2 ASP A 133 111.567 12.099 18.562 1.00 0.00 H new ATOM 0 HB3 ASP A 133 111.186 11.041 17.218 1.00 0.00 H new ATOM 2225 N LYS A 134 114.990 12.681 17.607 1.00 0.00 N ATOM 2226 CA LYS A 134 116.146 13.356 18.271 1.00 0.00 C ATOM 2227 C LYS A 134 117.466 12.774 17.756 1.00 0.00 C ATOM 2228 O LYS A 134 118.283 13.488 17.201 1.00 0.00 O ATOM 2229 CB LYS A 134 115.975 13.061 19.762 1.00 0.00 C ATOM 2230 CG LYS A 134 116.920 13.951 20.572 1.00 0.00 C ATOM 2231 CD LYS A 134 116.989 13.446 22.014 1.00 0.00 C ATOM 2232 CE LYS A 134 115.683 13.780 22.736 1.00 0.00 C ATOM 2233 NZ LYS A 134 115.607 12.810 23.864 1.00 0.00 N ATOM 0 H LYS A 134 115.184 11.736 17.275 1.00 0.00 H new ATOM 0 HA LYS A 134 116.171 14.427 18.068 1.00 0.00 H new ATOM 0 HB2 LYS A 134 114.943 13.241 20.063 1.00 0.00 H new ATOM 0 HB3 LYS A 134 116.187 12.011 19.962 1.00 0.00 H new ATOM 0 HG2 LYS A 134 117.914 13.944 20.126 1.00 0.00 H new ATOM 0 HG3 LYS A 134 116.569 14.983 20.554 1.00 0.00 H new ATOM 0 HD2 LYS A 134 117.158 12.369 22.025 1.00 0.00 H new ATOM 0 HD3 LYS A 134 117.831 13.906 22.532 1.00 0.00 H new ATOM 0 HE2 LYS A 134 115.684 14.808 23.099 1.00 0.00 H new ATOM 0 HE3 LYS A 134 114.826 13.678 22.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 114.736 12.977 24.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 115.600 11.840 23.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 116.432 12.935 24.485 1.00 0.00 H new ATOM 2247 N ASP A 135 117.667 11.488 17.939 1.00 0.00 N ATOM 2248 CA ASP A 135 118.926 10.825 17.477 1.00 0.00 C ATOM 2249 C ASP A 135 118.684 10.061 16.169 1.00 0.00 C ATOM 2250 O ASP A 135 119.315 9.049 15.919 1.00 0.00 O ATOM 2251 CB ASP A 135 119.300 9.860 18.605 1.00 0.00 C ATOM 2252 CG ASP A 135 119.711 10.653 19.848 1.00 0.00 C ATOM 2253 OD1 ASP A 135 120.458 11.607 19.700 1.00 0.00 O ATOM 2254 OD2 ASP A 135 119.270 10.293 20.927 1.00 0.00 O ATOM 0 H ASP A 135 117.002 10.864 18.395 1.00 0.00 H new ATOM 0 HA ASP A 135 119.719 11.545 17.274 1.00 0.00 H new ATOM 0 HB2 ASP A 135 118.455 9.213 18.838 1.00 0.00 H new ATOM 0 HB3 ASP A 135 120.118 9.214 18.287 1.00 0.00 H new ATOM 2259 N GLU A 136 117.781 10.545 15.345 1.00 0.00 N ATOM 2260 CA GLU A 136 117.461 9.859 14.055 1.00 0.00 C ATOM 2261 C GLU A 136 117.231 10.892 12.950 1.00 0.00 C ATOM 2262 O GLU A 136 117.459 10.561 11.799 1.00 0.00 O ATOM 2263 CB GLU A 136 116.176 9.074 14.331 1.00 0.00 C ATOM 2264 CG GLU A 136 116.472 7.936 15.311 1.00 0.00 C ATOM 2265 CD GLU A 136 115.212 7.091 15.513 1.00 0.00 C ATOM 2266 OE1 GLU A 136 114.562 6.783 14.527 1.00 0.00 O ATOM 2267 OE2 GLU A 136 114.919 6.764 16.651 1.00 0.00 O ATOM 2268 OXT GLU A 136 116.829 11.998 13.275 1.00 0.00 O ATOM 0 H GLU A 136 117.247 11.397 15.517 1.00 0.00 H new ATOM 0 HA GLU A 136 118.271 9.211 13.720 1.00 0.00 H new ATOM 0 HB2 GLU A 136 115.415 9.736 14.745 1.00 0.00 H new ATOM 0 HB3 GLU A 136 115.776 8.672 13.400 1.00 0.00 H new ATOM 0 HG2 GLU A 136 117.281 7.314 14.928 1.00 0.00 H new ATOM 0 HG3 GLU A 136 116.806 8.342 16.266 1.00 0.00 H new TER 2275 GLU A 136